PFRMAT TS TARGET T0380 AUTHOR 5370-1100-4902 METHOD The SAM-T06 hand predictions use methods similar to SAM_T04 in CASP6 and METHOD the SAM-T02 method in CASP5. METHOD METHOD We start with a fully automated method (implemented as the SAM_T06 server): METHOD METHOD Use the SAM-T2K and SAM-T04 methods for finding homologs of the METHOD target and aligning them. The hand method also uses the METHOD experimental new SAM-T06 alignment method, which we hope is both METHOD more sensitive and lass prone to contamination by unrelated sequences. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignments. METHOD METHOD We currently use 10 local-structure alphabets: METHOD DSSP METHOD STRIDE METHOD STR2 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 BYS a discretization of Ramachandran plots, due to Bystroff 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 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 O_NOTOR2 an alphabet for predicting characteristics of hydrogen METHOD bonds from the carbonyl oxygen METHOD N_NOTOR2 an alphabet for predicting characteristics of hydrogen METHOD bonds from the amide nitrogen METHOD We hope to add more networks for other alphabets over the summer. METHOD METHOD We make 2-track HMMs with each alphabet (1.0 amino acid + 0.3 METHOD local structure) and use them to score a template library of about METHOD 8000 (t06), 10000 (t04), or 15000 (t2k) templates. METHOD The template libraries are expanded weekly, but old template HMMs METHOD are not rebuilt. METHOD 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 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 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 methods (mainly using the SAM hmmscore METHOD program, but a few alignments were made with Bob Edgar's MUSCLE METHOD profile-profile aligner). 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. The contact prediction method METHOD is expected to evolve over the summer, as new features are METHOD selected and new networks trained. METHOD METHOD Then the "undertaker" program (named because it optimizes burial) METHOD is used to try to combine the alignments and the fragments into a METHOD consistent 3D model. No single alignment or parent template was METHOD used as a frozen core, though in many cases one had much more METHOD influence than the others. The alignment scores were not passed METHOD to undertaker, but were used only to pick the set of alignments METHOD and fragments that undertaker would see. Helix and strand METHOD constraints generated from the secondary-structure predictions are METHOD passed to undertaker to use in the cost function, as are the METHOD residue-residue contact prediction. METHOD METHOD One important change in this server over previous methods is that METHOD sheet constraints are extracted from the top few alignments and METHOD passed to undertaker. 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 METHOD New this year, we are also occasionally using ProteinShop to METHOD manipulate proteins by hand, to produce starting points for undertaker METHOD optimization. We expect this to be most useful in new-fold all-alpha METHOD proteins, where undertaker often gets trapped in poor local minima by METHOD extending helices too far. METHOD METHOD Another new trick is to optimize models with gromacs to knock them out METHOD of a local minimum. The gromacs optimization does terrible things to METHOD the model (messing up sidechains and peptide planes), but is good at METHOD removing clashes. The resulting models are only a small distance from METHOD the pre-optimization models, but score much worse with the undertaker METHOD cost functions, so undertaker can move them more freely than models it METHOD has optimized itself. METHOD METHOD METHOD Target T0380 was a fairly easy comparative modeling target. METHOD BLAST found an excellent hit to 2fhqA, and our HMMs found several more templates. METHOD METHOD The only difficulty was in deciding whether to believe the METHOD secondary-structure prediction for the C-terminus, which the neural METHOD nets believed should be helical, but which all the top alignments had METHOD as a strand. For the most part, we believe the alignments more than METHOD the neural net predictions, but we did include one model with a METHOD C-terminal helix. METHOD METHOD Model 1 is try4-opt2, the top-scoring model with several of the METHOD undertaker cost functions. It was optimized by undertaker from METHOD try3-opt2, in turn from try2-opt2, in turn from try1-opt2, which was METHOD automatically generated by undertaker from alignments and fragments. METHOD METHOD Model 2 is try5-opt2.gromacs0.repack-nonPC is the model that rosetta METHOD likes best of all the ones we had it repack sidechains for. It was METHOD created from try5-opt2 by reoptimizing with gromacs (to remove small METHOD clashes) and repacking the sidechains with rosetta. try5-opt2 was METHOD optimized by undertaker from try1-opt2.gromacs0.repack-nonPC. METHOD METHOD Model 3 is try9-opt2, optimized by undertaker from a chimera of METHOD try4-opt2 and try8-opt2 (M1-E124 from try4-opt2, W125-Y145 from METHOD try8-opt2). try8-opt2 was optimized by undertaker from a chimera of try4-opt2 and METHOD try6-opt2, with M1-I19 from try4-opt2 and V20-Y145 from try6-opt2. METHOD try6-opt2 was optimized by undertaker from alignments, but using a METHOD cost function that had too high a weight on clashes and breaks for METHOD optimization from alignments, so the try6 and try8 models were not METHOD very good. They were only kept because they had the C-terminal METHOD helix. Pating the C-terminal helix onto try4 resulting in a plausible METHOD model, though not as likely as the C-terminal strand models. METHOD METHOD Model 4 is try3-opt2, an earlier stage in the optimization process. METHOD METHOD Model 5 is sidechain replacement by SCWRL on an alignment to 2fhqA. METHOD METHOD REMARK 6 REMARK 6 T0380 model 3 Tue Aug 1 15:48:57 2006 MODEL 3 PARENT 2fhq_A 1dnl_A 1g79_A 1nrg_A 1rfe_A REMARK 7 REMARK 7 ALLPARENTS 2fhq_A 1dnl_A 1g79_A 1nrg_A 1rfe_A 1t9m_A 1ty9_A REMARK 7 ALLPARENTS 2a2j_A 2fg9_A 2asf_A 2aq6_A 1vl7_A 1w9a_A 2fur_A REMARK 7 ALLPARENTS 1ci0_A 2arz_A 1xxo_A 1w3o_A 1flm_A 1xhn_A 1axj ATOM 1 N MET 1 19.464 -2.199 -10.125 1.00 0.00 ATOM 2 CA MET 1 18.798 -2.509 -8.832 1.00 0.00 ATOM 3 CB MET 1 19.735 -3.118 -7.822 1.00 0.00 ATOM 4 CG MET 1 20.809 -2.261 -7.218 1.00 0.00 ATOM 5 SD MET 1 21.968 -3.110 -6.144 1.00 0.00 ATOM 6 CE MET 1 20.879 -4.174 -5.195 1.00 0.00 ATOM 7 O MET 1 18.993 -0.166 -8.410 1.00 0.00 ATOM 8 C MET 1 18.476 -1.230 -8.079 1.00 0.00 ATOM 9 N ILE 2 17.594 -1.337 -7.091 1.00 0.00 ATOM 10 CA ILE 2 17.196 -0.183 -6.292 1.00 0.00 ATOM 11 CB ILE 2 15.701 -0.310 -5.904 1.00 0.00 ATOM 12 CG1 ILE 2 14.794 -0.568 -7.119 1.00 0.00 ATOM 13 CG2 ILE 2 15.245 0.932 -5.137 1.00 0.00 ATOM 14 CD1 ILE 2 13.365 -0.864 -6.759 1.00 0.00 ATOM 15 O ILE 2 18.117 -0.891 -4.189 1.00 0.00 ATOM 16 C ILE 2 18.190 -0.115 -5.141 1.00 0.00 ATOM 17 N ASP 3 19.113 0.840 -5.240 1.00 0.00 ATOM 18 CA ASP 3 20.168 0.973 -4.247 1.00 0.00 ATOM 19 CB ASP 3 21.149 2.049 -4.681 1.00 0.00 ATOM 20 CG ASP 3 21.831 1.696 -5.991 1.00 0.00 ATOM 21 OD1 ASP 3 22.526 0.663 -6.035 1.00 0.00 ATOM 22 OD2 ASP 3 21.670 2.452 -6.978 1.00 0.00 ATOM 23 O ASP 3 18.465 1.693 -2.707 1.00 0.00 ATOM 24 C ASP 3 19.643 1.382 -2.873 1.00 0.00 ATOM 25 N GLU 4 20.532 1.312 -1.888 1.00 0.00 ATOM 26 CA GLU 4 20.230 1.629 -0.497 1.00 0.00 ATOM 27 CB GLU 4 21.488 1.423 0.338 1.00 0.00 ATOM 28 CG GLU 4 21.265 1.493 1.828 1.00 0.00 ATOM 29 CD GLU 4 22.537 1.216 2.606 1.00 0.00 ATOM 30 OE1 GLU 4 23.320 0.339 2.170 1.00 0.00 ATOM 31 OE2 GLU 4 22.756 1.874 3.649 1.00 0.00 ATOM 32 O GLU 4 18.683 3.232 0.394 1.00 0.00 ATOM 33 C GLU 4 19.694 3.040 -0.283 1.00 0.00 ATOM 34 N LYS 5 20.351 4.021 -0.886 1.00 0.00 ATOM 35 CA LYS 5 19.943 5.408 -0.741 1.00 0.00 ATOM 36 CB LYS 5 21.017 6.322 -1.328 1.00 0.00 ATOM 37 CG LYS 5 22.196 6.589 -0.399 1.00 0.00 ATOM 38 CD LYS 5 22.666 5.324 0.320 1.00 0.00 ATOM 39 CE LYS 5 22.270 5.345 1.797 1.00 0.00 ATOM 40 NZ LYS 5 23.397 4.948 2.697 1.00 0.00 ATOM 41 O LYS 5 17.758 6.388 -0.827 1.00 0.00 ATOM 42 C LYS 5 18.600 5.702 -1.398 1.00 0.00 ATOM 43 N PHE 6 18.395 5.137 -2.578 1.00 0.00 ATOM 44 CA PHE 6 17.132 5.359 -3.296 1.00 0.00 ATOM 45 CB PHE 6 17.121 4.829 -4.697 1.00 0.00 ATOM 46 CG PHE 6 18.039 5.599 -5.543 1.00 0.00 ATOM 47 CD1 PHE 6 19.325 5.176 -5.827 1.00 0.00 ATOM 48 CD2 PHE 6 17.656 6.827 -5.970 1.00 0.00 ATOM 49 CE1 PHE 6 20.179 6.020 -6.533 1.00 0.00 ATOM 50 CE2 PHE 6 18.499 7.633 -6.657 1.00 0.00 ATOM 51 CZ PHE 6 19.753 7.228 -6.946 1.00 0.00 ATOM 52 O PHE 6 14.856 5.242 -2.541 1.00 0.00 ATOM 53 C PHE 6 15.947 4.684 -2.598 1.00 0.00 ATOM 54 N LEU 7 16.172 3.490 -2.062 1.00 0.00 ATOM 55 CA LEU 7 15.103 2.765 -1.374 1.00 0.00 ATOM 56 CB LEU 7 15.522 1.368 -0.997 1.00 0.00 ATOM 57 CG LEU 7 15.622 0.369 -2.152 1.00 0.00 ATOM 58 CD1 LEU 7 16.237 -0.932 -1.653 1.00 0.00 ATOM 59 CD2 LEU 7 14.238 0.114 -2.734 1.00 0.00 ATOM 60 O LEU 7 13.506 3.704 0.186 1.00 0.00 ATOM 61 C LEU 7 14.693 3.558 -0.129 1.00 0.00 ATOM 62 N ILE 8 15.686 4.098 0.558 1.00 0.00 ATOM 63 CA ILE 8 15.443 4.891 1.763 1.00 0.00 ATOM 64 CB ILE 8 16.847 5.095 2.523 1.00 0.00 ATOM 65 CG1 ILE 8 17.457 3.744 2.939 1.00 0.00 ATOM 66 CG2 ILE 8 16.677 6.119 3.672 1.00 0.00 ATOM 67 CD1 ILE 8 16.541 2.839 3.725 1.00 0.00 ATOM 68 O ILE 8 13.830 6.629 2.102 1.00 0.00 ATOM 69 C ILE 8 14.760 6.200 1.419 1.00 0.00 ATOM 70 N GLU 9 15.215 6.879 0.358 1.00 0.00 ATOM 71 CA GLU 9 14.614 8.136 -0.059 1.00 0.00 ATOM 72 CB GLU 9 15.477 8.740 -1.201 1.00 0.00 ATOM 73 CG GLU 9 16.911 9.048 -0.801 1.00 0.00 ATOM 74 CD GLU 9 17.776 9.470 -1.977 1.00 0.00 ATOM 75 OE1 GLU 9 17.879 8.686 -2.944 1.00 0.00 ATOM 76 OE2 GLU 9 18.353 10.578 -1.928 1.00 0.00 ATOM 77 O GLU 9 12.300 8.758 -0.140 1.00 0.00 ATOM 78 C GLU 9 13.147 7.907 -0.406 1.00 0.00 ATOM 79 N SER 10 12.835 6.721 -0.969 1.00 0.00 ATOM 80 CA SER 10 11.451 6.402 -1.294 1.00 0.00 ATOM 81 CB SER 10 11.328 5.244 -2.190 1.00 0.00 ATOM 82 OG SER 10 11.893 4.070 -1.641 1.00 0.00 ATOM 83 O SER 10 9.495 6.739 0.075 1.00 0.00 ATOM 84 C SER 10 10.611 6.220 -0.025 1.00 0.00 ATOM 85 N ASN 11 11.205 5.581 0.984 1.00 0.00 ATOM 86 CA ASN 11 10.531 5.437 2.284 1.00 0.00 ATOM 87 CB ASN 11 11.379 4.586 3.232 1.00 0.00 ATOM 88 CG ASN 11 11.341 3.112 2.882 1.00 0.00 ATOM 89 ND2 ASN 11 12.332 2.366 3.361 1.00 0.00 ATOM 90 OD1 ASN 11 10.435 2.651 2.188 1.00 0.00 ATOM 91 O ASN 11 9.237 7.026 3.565 1.00 0.00 ATOM 92 C ASN 11 10.297 6.797 2.971 1.00 0.00 ATOM 93 N GLU 12 11.266 7.706 2.925 1.00 0.00 ATOM 94 CA GLU 12 11.081 9.047 3.466 1.00 0.00 ATOM 95 CB GLU 12 12.305 9.930 3.226 1.00 0.00 ATOM 96 CG GLU 12 12.120 11.410 3.567 1.00 0.00 ATOM 97 CD GLU 12 13.205 12.349 3.011 1.00 0.00 ATOM 98 OE1 GLU 12 13.647 12.212 1.830 1.00 0.00 ATOM 99 OE2 GLU 12 13.592 13.276 3.767 1.00 0.00 ATOM 100 O GLU 12 9.065 10.358 3.562 1.00 0.00 ATOM 101 C GLU 12 9.873 9.760 2.851 1.00 0.00 ATOM 102 N LEU 13 9.772 9.709 1.522 1.00 0.00 ATOM 103 CA LEU 13 8.639 10.317 0.824 1.00 0.00 ATOM 104 CB LEU 13 8.762 10.030 -0.673 1.00 0.00 ATOM 105 CG LEU 13 9.895 10.745 -1.409 1.00 0.00 ATOM 106 CD1 LEU 13 10.020 10.229 -2.835 1.00 0.00 ATOM 107 CD2 LEU 13 9.632 12.244 -1.470 1.00 0.00 ATOM 108 O LEU 13 6.357 10.415 1.559 1.00 0.00 ATOM 109 C LEU 13 7.329 9.717 1.306 1.00 0.00 ATOM 110 N VAL 14 7.307 8.403 1.420 1.00 0.00 ATOM 111 CA VAL 14 6.105 7.717 1.860 1.00 0.00 ATOM 112 CB VAL 14 6.361 6.168 1.935 1.00 0.00 ATOM 113 CG1 VAL 14 5.277 5.489 2.762 1.00 0.00 ATOM 114 CG2 VAL 14 6.390 5.571 0.538 1.00 0.00 ATOM 115 O VAL 14 4.455 8.347 3.525 1.00 0.00 ATOM 116 C VAL 14 5.670 8.146 3.270 1.00 0.00 ATOM 117 N GLU 15 6.661 8.337 4.170 1.00 0.00 ATOM 118 CA GLU 15 6.396 8.768 5.551 1.00 0.00 ATOM 119 CB GLU 15 7.704 8.941 6.326 1.00 0.00 ATOM 120 CG GLU 15 8.401 7.632 6.663 1.00 0.00 ATOM 121 CD GLU 15 9.755 7.844 7.312 1.00 0.00 ATOM 122 OE1 GLU 15 10.178 9.014 7.436 1.00 0.00 ATOM 123 OE2 GLU 15 10.395 6.844 7.697 1.00 0.00 ATOM 124 O GLU 15 4.927 10.408 6.508 1.00 0.00 ATOM 125 C GLU 15 5.648 10.101 5.557 1.00 0.00 ATOM 126 N SER 16 5.846 10.908 4.477 1.00 0.00 ATOM 127 CA SER 16 5.205 12.216 4.361 1.00 0.00 ATOM 128 CB SER 16 6.034 13.138 3.466 1.00 0.00 ATOM 129 OG SER 16 7.301 13.406 4.044 1.00 0.00 ATOM 130 O SER 16 3.037 13.075 3.833 1.00 0.00 ATOM 131 C SER 16 3.816 12.123 3.743 1.00 0.00 ATOM 132 N SER 17 3.500 10.981 3.124 1.00 0.00 ATOM 133 CA SER 17 2.213 10.802 2.452 1.00 0.00 ATOM 134 CB SER 17 2.391 9.979 1.174 1.00 0.00 ATOM 135 OG SER 17 3.192 10.670 0.230 1.00 0.00 ATOM 136 O SER 17 1.558 9.039 3.941 1.00 0.00 ATOM 137 C SER 17 1.227 10.080 3.361 1.00 0.00 ATOM 138 N LYS 18 0.013 10.607 3.470 1.00 0.00 ATOM 139 CA LYS 18 -1.036 9.885 4.191 1.00 0.00 ATOM 140 CB LYS 18 -1.831 10.837 5.085 1.00 0.00 ATOM 141 CG LYS 18 -1.019 11.449 6.216 1.00 0.00 ATOM 142 CD LYS 18 -1.863 12.398 7.051 1.00 0.00 ATOM 143 CE LYS 18 -1.053 13.004 8.186 1.00 0.00 ATOM 144 NZ LYS 18 -1.885 13.875 9.060 1.00 0.00 ATOM 145 O LYS 18 -2.820 8.382 3.596 1.00 0.00 ATOM 146 C LYS 18 -1.990 9.205 3.208 1.00 0.00 ATOM 147 N ILE 19 -1.837 9.545 1.926 1.00 0.00 ATOM 148 CA ILE 19 -2.668 9.016 0.858 1.00 0.00 ATOM 149 CB ILE 19 -3.476 10.149 0.215 1.00 0.00 ATOM 150 CG1 ILE 19 -4.380 10.772 1.279 1.00 0.00 ATOM 151 CG2 ILE 19 -4.313 9.593 -0.924 1.00 0.00 ATOM 152 CD1 ILE 19 -5.354 9.804 1.901 1.00 0.00 ATOM 153 O ILE 19 -0.820 9.005 -0.676 1.00 0.00 ATOM 154 C ILE 19 -1.838 8.431 -0.287 1.00 0.00 ATOM 155 N VAL 20 -2.225 7.290 -0.785 1.00 0.00 ATOM 156 CA VAL 20 -1.549 6.621 -1.904 1.00 0.00 ATOM 157 CB VAL 20 -0.861 5.315 -1.464 1.00 0.00 ATOM 158 CG1 VAL 20 0.205 5.602 -0.418 1.00 0.00 ATOM 159 CG2 VAL 20 -1.876 4.353 -0.864 1.00 0.00 ATOM 160 O VAL 20 -3.790 6.570 -2.687 1.00 0.00 ATOM 161 C VAL 20 -2.619 6.360 -2.953 1.00 0.00 ATOM 162 N MET 21 -2.220 5.957 -4.153 1.00 0.00 ATOM 163 CA MET 21 -3.189 5.497 -5.150 1.00 0.00 ATOM 164 CB MET 21 -3.148 6.394 -6.415 1.00 0.00 ATOM 165 CG MET 21 -3.026 7.894 -6.274 1.00 0.00 ATOM 166 SD MET 21 -4.512 8.738 -5.680 1.00 0.00 ATOM 167 CE MET 21 -5.538 8.759 -7.148 1.00 0.00 ATOM 168 O MET 21 -1.798 3.625 -5.790 1.00 0.00 ATOM 169 C MET 21 -2.928 4.020 -5.439 1.00 0.00 ATOM 170 N VAL 22 -3.943 3.190 -5.318 1.00 0.00 ATOM 171 CA VAL 22 -3.850 1.752 -5.391 1.00 0.00 ATOM 172 CB VAL 22 -4.472 1.111 -4.165 1.00 0.00 ATOM 173 CG1 VAL 22 -4.445 -0.400 -4.334 1.00 0.00 ATOM 174 CG2 VAL 22 -3.687 1.522 -2.923 1.00 0.00 ATOM 175 O VAL 22 -5.753 1.697 -6.757 1.00 0.00 ATOM 176 C VAL 22 -4.630 1.218 -6.653 1.00 0.00 ATOM 177 N GLY 23 -3.988 0.406 -7.424 1.00 0.00 ATOM 178 CA GLY 23 -4.662 -0.121 -8.591 1.00 0.00 ATOM 179 O GLY 23 -3.746 -2.317 -8.235 1.00 0.00 ATOM 180 C GLY 23 -4.714 -1.637 -8.534 1.00 0.00 ATOM 181 N THR 24 -5.884 -2.120 -8.925 1.00 0.00 ATOM 182 CA THR 24 -6.221 -3.526 -9.054 1.00 0.00 ATOM 183 CB THR 24 -7.525 -3.798 -8.304 1.00 0.00 ATOM 184 CG2 THR 24 -7.305 -3.911 -6.827 1.00 0.00 ATOM 185 OG1 THR 24 -8.475 -2.768 -8.524 1.00 0.00 ATOM 186 O THR 24 -7.313 -2.924 -11.082 1.00 0.00 ATOM 187 C THR 24 -6.724 -3.805 -10.463 1.00 0.00 ATOM 188 N ASN 25 -6.502 -4.977 -10.964 1.00 0.00 ATOM 189 CA ASN 25 -7.074 -5.276 -12.293 1.00 0.00 ATOM 190 CB ASN 25 -6.086 -6.188 -13.024 1.00 0.00 ATOM 191 CG ASN 25 -4.741 -5.526 -13.254 1.00 0.00 ATOM 192 ND2 ASN 25 -3.700 -6.073 -12.639 1.00 0.00 ATOM 193 OD1 ASN 25 -4.642 -4.534 -13.979 1.00 0.00 ATOM 194 O ASN 25 -8.500 -6.977 -11.343 1.00 0.00 ATOM 195 C ASN 25 -8.421 -5.985 -12.091 1.00 0.00 ATOM 196 N GLY 26 -9.469 -5.495 -12.747 1.00 0.00 ATOM 197 CA GLY 26 -10.764 -6.155 -12.606 1.00 0.00 ATOM 198 O GLY 26 -9.918 -7.727 -14.236 1.00 0.00 ATOM 199 C GLY 26 -10.854 -7.406 -13.493 1.00 0.00 ATOM 200 N GLU 27 -11.952 -8.141 -13.372 1.00 0.00 ATOM 201 CA GLU 27 -12.058 -9.389 -14.111 1.00 0.00 ATOM 202 CB GLU 27 -13.315 -10.162 -13.739 1.00 0.00 ATOM 203 CG GLU 27 -14.560 -9.321 -13.649 1.00 0.00 ATOM 204 CD GLU 27 -15.759 -10.121 -13.155 1.00 0.00 ATOM 205 OE1 GLU 27 -15.743 -11.371 -13.266 1.00 0.00 ATOM 206 OE2 GLU 27 -16.713 -9.496 -12.658 1.00 0.00 ATOM 207 O GLU 27 -11.643 -10.088 -16.354 1.00 0.00 ATOM 208 C GLU 27 -12.008 -9.180 -15.623 1.00 0.00 ATOM 209 N ASN 28 -12.373 -7.985 -16.082 1.00 0.00 ATOM 210 CA ASN 28 -12.330 -7.683 -17.514 1.00 0.00 ATOM 211 CB ASN 28 -13.358 -6.605 -17.831 1.00 0.00 ATOM 212 CG ASN 28 -14.770 -7.122 -17.713 1.00 0.00 ATOM 213 ND2 ASN 28 -15.448 -6.757 -16.634 1.00 0.00 ATOM 214 OD1 ASN 28 -15.245 -7.853 -18.581 1.00 0.00 ATOM 215 O ASN 28 -10.810 -6.866 -19.211 1.00 0.00 ATOM 216 C ASN 28 -10.947 -7.237 -18.028 1.00 0.00 ATOM 217 N GLY 29 -9.931 -7.167 -17.149 1.00 0.00 ATOM 218 CA GLY 29 -8.605 -6.724 -17.573 1.00 0.00 ATOM 219 O GLY 29 -7.290 -4.759 -17.930 1.00 0.00 ATOM 220 C GLY 29 -8.329 -5.226 -17.474 1.00 0.00 ATOM 221 N TYR 30 -9.253 -4.477 -16.874 1.00 0.00 ATOM 222 CA TYR 30 -9.105 -3.013 -16.710 1.00 0.00 ATOM 223 CB TYR 30 -10.473 -2.325 -16.698 1.00 0.00 ATOM 224 CG TYR 30 -11.159 -2.305 -18.046 1.00 0.00 ATOM 225 CD1 TYR 30 -12.072 -3.293 -18.392 1.00 0.00 ATOM 226 CD2 TYR 30 -10.890 -1.300 -18.965 1.00 0.00 ATOM 227 CE1 TYR 30 -12.705 -3.283 -19.620 1.00 0.00 ATOM 228 CE2 TYR 30 -11.513 -1.275 -20.198 1.00 0.00 ATOM 229 CZ TYR 30 -12.428 -2.277 -20.521 1.00 0.00 ATOM 230 OH TYR 30 -13.055 -2.264 -21.746 1.00 0.00 ATOM 231 O TYR 30 -8.902 -3.097 -14.349 1.00 0.00 ATOM 232 C TYR 30 -8.448 -2.662 -15.401 1.00 0.00 ATOM 233 N PRO 31 -7.351 -1.876 -15.456 1.00 0.00 ATOM 234 CA PRO 31 -6.754 -1.425 -14.197 1.00 0.00 ATOM 235 CB PRO 31 -5.470 -0.752 -14.645 1.00 0.00 ATOM 236 CG PRO 31 -5.754 -0.312 -16.049 1.00 0.00 ATOM 237 CD PRO 31 -6.507 -1.487 -16.615 1.00 0.00 ATOM 238 O PRO 31 -8.268 0.440 -14.278 1.00 0.00 ATOM 239 C PRO 31 -7.675 -0.381 -13.574 1.00 0.00 ATOM 240 N ASN 32 -7.880 -0.470 -12.247 1.00 0.00 ATOM 241 CA ASN 32 -8.620 0.516 -11.474 1.00 0.00 ATOM 242 CB ASN 32 -10.002 -0.094 -11.102 1.00 0.00 ATOM 243 CG ASN 32 -10.826 -0.513 -12.303 1.00 0.00 ATOM 244 ND2 ASN 32 -11.157 -1.798 -12.374 1.00 0.00 ATOM 245 OD1 ASN 32 -11.161 0.307 -13.158 1.00 0.00 ATOM 246 O ASN 32 -7.150 0.499 -9.612 1.00 0.00 ATOM 247 C ASN 32 -7.680 1.181 -10.485 1.00 0.00 ATOM 248 N ILE 33 -7.459 2.505 -10.626 1.00 0.00 ATOM 249 CA ILE 33 -6.615 3.246 -9.701 1.00 0.00 ATOM 250 CB ILE 33 -5.704 4.205 -10.473 1.00 0.00 ATOM 251 CG1 ILE 33 -4.880 3.416 -11.491 1.00 0.00 ATOM 252 CG2 ILE 33 -4.822 4.951 -9.488 1.00 0.00 ATOM 253 CD1 ILE 33 -4.055 2.316 -10.901 1.00 0.00 ATOM 254 O ILE 33 -8.184 4.999 -9.272 1.00 0.00 ATOM 255 C ILE 33 -7.470 4.114 -8.798 1.00 0.00 ATOM 256 N LYS 34 -7.451 3.875 -7.464 1.00 0.00 ATOM 257 CA LYS 34 -8.231 4.648 -6.515 1.00 0.00 ATOM 258 CB LYS 34 -8.864 3.736 -5.586 1.00 0.00 ATOM 259 CG LYS 34 -10.224 3.474 -6.163 1.00 0.00 ATOM 260 CD LYS 34 -10.936 4.684 -6.549 1.00 0.00 ATOM 261 CE LYS 34 -12.393 4.286 -6.963 1.00 0.00 ATOM 262 NZ LYS 34 -12.389 3.540 -8.232 1.00 0.00 ATOM 263 O LYS 34 -6.422 4.547 -4.944 1.00 0.00 ATOM 264 C LYS 34 -7.360 5.208 -5.380 1.00 0.00 ATOM 265 N ALA 35 -7.643 6.443 -4.928 1.00 0.00 ATOM 266 CA ALA 35 -6.936 6.968 -3.764 1.00 0.00 ATOM 267 CB ALA 35 -7.333 8.411 -3.521 1.00 0.00 ATOM 268 O ALA 35 -8.457 5.863 -2.297 1.00 0.00 ATOM 269 C ALA 35 -7.318 6.180 -2.516 1.00 0.00 ATOM 270 N MET 36 -6.361 6.011 -1.647 1.00 0.00 ATOM 271 CA MET 36 -6.572 5.327 -0.366 1.00 0.00 ATOM 272 CB MET 36 -6.072 3.905 -0.626 1.00 0.00 ATOM 273 CG MET 36 -6.859 3.154 -1.687 1.00 0.00 ATOM 274 SD MET 36 -8.533 2.747 -1.154 1.00 0.00 ATOM 275 CE MET 36 -8.205 1.454 0.038 1.00 0.00 ATOM 276 O MET 36 -4.627 6.259 0.647 1.00 0.00 ATOM 277 C MET 36 -5.787 5.878 0.801 1.00 0.00 ATOM 278 N MET 37 -6.383 5.876 1.994 1.00 0.00 ATOM 279 CA MET 37 -5.611 6.279 3.160 1.00 0.00 ATOM 280 CB MET 37 -6.550 6.737 4.301 1.00 0.00 ATOM 281 CG MET 37 -7.345 5.570 4.838 1.00 0.00 ATOM 282 SD MET 37 -8.456 6.071 6.204 1.00 0.00 ATOM 283 CE MET 37 -7.237 6.251 7.532 1.00 0.00 ATOM 284 O MET 37 -4.945 4.029 3.531 1.00 0.00 ATOM 285 C MET 37 -4.598 5.206 3.498 1.00 0.00 ATOM 286 N ARG 38 -3.360 5.628 3.719 1.00 0.00 ATOM 287 CA ARG 38 -2.271 4.759 4.129 1.00 0.00 ATOM 288 CB ARG 38 -1.022 5.058 3.869 1.00 0.00 ATOM 289 CG ARG 38 -0.420 6.447 3.714 1.00 0.00 ATOM 290 CD ARG 38 1.096 6.384 3.853 1.00 0.00 ATOM 291 NE ARG 38 1.469 5.790 5.135 1.00 0.00 ATOM 292 CZ ARG 38 1.214 6.339 6.317 1.00 0.00 ATOM 293 NH1 ARG 38 0.590 7.510 6.392 1.00 0.00 ATOM 294 NH2 ARG 38 1.559 5.711 7.434 1.00 0.00 ATOM 295 O ARG 38 -2.158 5.445 6.425 1.00 0.00 ATOM 296 C ARG 38 -2.395 4.521 5.630 1.00 0.00 ATOM 297 N LEU 39 -2.739 3.301 6.037 1.00 0.00 ATOM 298 CA LEU 39 -2.935 3.094 7.467 1.00 0.00 ATOM 299 CB LEU 39 -3.907 1.941 7.696 1.00 0.00 ATOM 300 CG LEU 39 -5.356 2.208 7.259 1.00 0.00 ATOM 301 CD1 LEU 39 -6.117 0.873 7.179 1.00 0.00 ATOM 302 CD2 LEU 39 -6.022 3.150 8.216 1.00 0.00 ATOM 303 O LEU 39 -1.322 3.394 9.232 1.00 0.00 ATOM 304 C LEU 39 -1.593 2.837 8.167 1.00 0.00 ATOM 305 N LYS 40 -0.732 2.070 7.513 1.00 0.00 ATOM 306 CA LYS 40 0.618 1.815 7.997 1.00 0.00 ATOM 307 CB LYS 40 0.526 0.757 9.121 1.00 0.00 ATOM 308 CG LYS 40 -0.228 1.241 10.358 1.00 0.00 ATOM 309 CD LYS 40 -0.532 0.109 11.331 1.00 0.00 ATOM 310 CE LYS 40 0.730 -0.510 11.910 1.00 0.00 ATOM 311 NZ LYS 40 0.389 -1.629 12.837 1.00 0.00 ATOM 312 O LYS 40 1.049 0.957 5.819 1.00 0.00 ATOM 313 C LYS 40 1.523 1.390 6.844 1.00 0.00 ATOM 314 N HIS 41 2.829 1.514 7.036 1.00 0.00 ATOM 315 CA HIS 41 3.812 1.034 6.069 1.00 0.00 ATOM 316 CB HIS 41 4.154 2.136 5.064 1.00 0.00 ATOM 317 CG HIS 41 4.838 3.320 5.676 1.00 0.00 ATOM 318 CD2 HIS 41 6.219 3.750 5.843 1.00 0.00 ATOM 319 ND1 HIS 41 4.147 4.352 6.273 1.00 0.00 ATOM 320 CE1 HIS 41 5.025 5.263 6.726 1.00 0.00 ATOM 321 NE2 HIS 41 6.271 4.909 6.474 1.00 0.00 ATOM 322 O HIS 41 5.555 1.284 7.699 1.00 0.00 ATOM 323 C HIS 41 5.122 0.637 6.741 1.00 0.00 ATOM 324 N ASP 42 5.729 -0.432 6.239 1.00 0.00 ATOM 325 CA ASP 42 7.045 -0.882 6.685 1.00 0.00 ATOM 326 CB ASP 42 6.974 -2.265 7.297 1.00 0.00 ATOM 327 CG ASP 42 8.215 -2.706 8.074 1.00 0.00 ATOM 328 OD1 ASP 42 9.140 -1.884 8.218 1.00 0.00 ATOM 329 OD2 ASP 42 8.225 -3.834 8.586 1.00 0.00 ATOM 330 O ASP 42 7.822 -1.532 4.509 1.00 0.00 ATOM 331 C ASP 42 7.854 -0.729 5.434 1.00 0.00 ATOM 332 N GLY 43 8.545 0.425 5.323 1.00 0.00 ATOM 333 CA GLY 43 9.346 0.706 4.179 1.00 0.00 ATOM 334 O GLY 43 7.559 1.447 2.827 1.00 0.00 ATOM 335 C GLY 43 8.518 0.690 2.918 1.00 0.00 ATOM 336 N LEU 44 8.865 -0.169 1.956 1.00 0.00 ATOM 337 CA LEU 44 8.255 -0.241 0.662 1.00 0.00 ATOM 338 CB LEU 44 9.299 -0.605 -0.368 1.00 0.00 ATOM 339 CG LEU 44 10.325 0.524 -0.545 1.00 0.00 ATOM 340 CD1 LEU 44 11.357 0.130 -1.580 1.00 0.00 ATOM 341 CD2 LEU 44 9.713 1.821 -0.916 1.00 0.00 ATOM 342 O LEU 44 6.557 -1.488 -0.505 1.00 0.00 ATOM 343 C LEU 44 7.067 -1.214 0.576 1.00 0.00 ATOM 344 N LYS 45 8.072 -2.215 1.601 1.00 0.00 ATOM 345 CA LYS 45 7.835 -3.635 1.375 1.00 0.00 ATOM 346 CB LYS 45 8.748 -4.464 2.254 1.00 0.00 ATOM 347 CG LYS 45 10.222 -4.387 1.867 1.00 0.00 ATOM 348 CD LYS 45 11.077 -5.120 2.906 1.00 0.00 ATOM 349 CE LYS 45 12.550 -5.012 2.580 1.00 0.00 ATOM 350 NZ LYS 45 13.388 -5.598 3.669 1.00 0.00 ATOM 351 O LYS 45 5.802 -4.769 0.845 1.00 0.00 ATOM 352 C LYS 45 6.383 -4.014 1.609 1.00 0.00 ATOM 353 N LYS 46 5.800 -3.509 2.689 1.00 0.00 ATOM 354 CA LYS 46 4.430 -3.861 3.033 1.00 0.00 ATOM 355 CB LYS 46 4.429 -4.748 4.282 1.00 0.00 ATOM 356 CG LYS 46 5.101 -6.097 4.084 1.00 0.00 ATOM 357 CD LYS 46 5.030 -6.937 5.349 1.00 0.00 ATOM 358 CE LYS 46 5.771 -8.253 5.179 1.00 0.00 ATOM 359 NZ LYS 46 5.717 -9.084 6.413 1.00 0.00 ATOM 360 O LYS 46 4.066 -1.787 4.192 1.00 0.00 ATOM 361 C LYS 46 3.643 -2.594 3.364 1.00 0.00 ATOM 362 N PHE 47 2.523 -2.461 2.725 1.00 0.00 ATOM 363 CA PHE 47 1.669 -1.295 2.939 1.00 0.00 ATOM 364 CB PHE 47 1.587 -0.416 1.688 1.00 0.00 ATOM 365 CG PHE 47 2.824 0.337 1.340 1.00 0.00 ATOM 366 CD1 PHE 47 3.624 -0.091 0.292 1.00 0.00 ATOM 367 CD2 PHE 47 3.129 1.536 1.976 1.00 0.00 ATOM 368 CE1 PHE 47 4.704 0.668 -0.135 1.00 0.00 ATOM 369 CE2 PHE 47 4.210 2.306 1.556 1.00 0.00 ATOM 370 CZ PHE 47 4.997 1.870 0.497 1.00 0.00 ATOM 371 O PHE 47 -0.313 -2.589 2.619 1.00 0.00 ATOM 372 C PHE 47 0.274 -1.757 3.311 1.00 0.00 ATOM 373 N TRP 48 -0.280 -1.145 4.390 1.00 0.00 ATOM 374 CA TRP 48 -1.594 -1.540 4.891 1.00 0.00 ATOM 375 CB TRP 48 -1.418 -1.911 6.336 1.00 0.00 ATOM 376 CG TRP 48 -0.618 -3.115 6.685 1.00 0.00 ATOM 377 CD1 TRP 48 0.670 -3.154 7.116 1.00 0.00 ATOM 378 CD2 TRP 48 -1.078 -4.475 6.649 1.00 0.00 ATOM 379 CE2 TRP 48 -0.019 -5.280 7.093 1.00 0.00 ATOM 380 CE3 TRP 48 -2.264 -5.095 6.313 1.00 0.00 ATOM 381 NE1 TRP 48 1.049 -4.449 7.353 1.00 0.00 ATOM 382 CZ2 TRP 48 -0.113 -6.660 7.203 1.00 0.00 ATOM 383 CZ3 TRP 48 -2.377 -6.458 6.443 1.00 0.00 ATOM 384 CH2 TRP 48 -1.306 -7.224 6.887 1.00 0.00 ATOM 385 O TRP 48 -2.468 0.663 5.004 1.00 0.00 ATOM 386 C TRP 48 -2.660 -0.497 4.651 1.00 0.00 ATOM 387 N LEU 49 -3.788 -0.926 4.096 1.00 0.00 ATOM 388 CA LEU 49 -4.965 -0.085 3.905 1.00 0.00 ATOM 389 CB LEU 49 -5.236 0.051 2.414 1.00 0.00 ATOM 390 CG LEU 49 -4.042 0.532 1.572 1.00 0.00 ATOM 391 CD1 LEU 49 -4.476 0.617 0.109 1.00 0.00 ATOM 392 CD2 LEU 49 -3.522 1.863 2.082 1.00 0.00 ATOM 393 O LEU 49 -6.185 -1.915 4.870 1.00 0.00 ATOM 394 C LEU 49 -6.222 -0.761 4.480 1.00 0.00 ATOM 395 N SER 50 -7.325 -0.033 4.545 1.00 0.00 ATOM 396 CA SER 50 -8.570 -0.648 4.977 1.00 0.00 ATOM 397 CB SER 50 -9.048 -0.043 6.300 1.00 0.00 ATOM 398 OG SER 50 -9.342 1.336 6.152 1.00 0.00 ATOM 399 O SER 50 -9.794 0.711 3.457 1.00 0.00 ATOM 400 C SER 50 -9.725 -0.367 4.033 1.00 0.00 ATOM 401 N THR 51 -10.624 -1.303 3.891 1.00 0.00 ATOM 402 CA THR 51 -11.734 -1.147 2.932 1.00 0.00 ATOM 403 CB THR 51 -11.406 -1.747 1.557 1.00 0.00 ATOM 404 CG2 THR 51 -10.088 -1.203 1.031 1.00 0.00 ATOM 405 OG1 THR 51 -11.336 -3.171 1.655 1.00 0.00 ATOM 406 O THR 51 -12.822 -2.505 4.604 1.00 0.00 ATOM 407 C THR 51 -12.924 -1.896 3.534 1.00 0.00 ATOM 408 N ASN 52 -14.004 -1.971 2.658 1.00 0.00 ATOM 409 CA ASN 52 -15.163 -2.780 3.006 1.00 0.00 ATOM 410 CB ASN 52 -16.451 -2.331 2.313 1.00 0.00 ATOM 411 CG ASN 52 -16.834 -0.886 2.477 1.00 0.00 ATOM 412 ND2 ASN 52 -16.317 -0.004 1.620 1.00 0.00 ATOM 413 OD1 ASN 52 -17.647 -0.550 3.340 1.00 0.00 ATOM 414 O ASN 52 -14.491 -4.426 1.378 1.00 0.00 ATOM 415 C ASN 52 -15.052 -4.197 2.457 1.00 0.00 ATOM 416 N THR 53 -15.614 -5.155 3.171 1.00 0.00 ATOM 417 CA THR 53 -15.587 -6.544 2.729 1.00 0.00 ATOM 418 CB THR 53 -16.294 -7.471 3.736 1.00 0.00 ATOM 419 CG2 THR 53 -16.309 -8.901 3.223 1.00 0.00 ATOM 420 OG1 THR 53 -15.608 -7.435 4.994 1.00 0.00 ATOM 421 O THR 53 -15.735 -7.480 0.538 1.00 0.00 ATOM 422 C THR 53 -16.189 -6.663 1.335 1.00 0.00 ATOM 423 N SER 54 -17.221 -5.862 1.048 1.00 0.00 ATOM 424 CA SER 54 -17.873 -5.874 -0.275 1.00 0.00 ATOM 425 CB SER 54 -19.380 -5.717 -0.069 1.00 0.00 ATOM 426 OG SER 54 -19.690 -4.472 0.529 1.00 0.00 ATOM 427 O SER 54 -18.194 -4.581 -2.248 1.00 0.00 ATOM 428 C SER 54 -17.476 -4.842 -1.301 1.00 0.00 ATOM 429 N THR 55 -16.298 -4.150 -1.022 1.00 0.00 ATOM 430 CA THR 55 -15.868 -3.048 -1.892 1.00 0.00 ATOM 431 CB THR 55 -14.506 -2.537 -1.469 1.00 0.00 ATOM 432 CG2 THR 55 -14.199 -1.260 -2.250 1.00 0.00 ATOM 433 OG1 THR 55 -14.544 -2.229 -0.069 1.00 0.00 ATOM 434 O THR 55 -15.104 -4.819 -3.316 1.00 0.00 ATOM 435 C THR 55 -15.453 -3.640 -3.243 1.00 0.00 ATOM 436 N ARG 56 -15.465 -2.816 -4.296 1.00 0.00 ATOM 437 CA ARG 56 -14.959 -3.234 -5.605 1.00 0.00 ATOM 438 CB ARG 56 -15.199 -2.067 -6.615 1.00 0.00 ATOM 439 CG ARG 56 -16.671 -1.749 -6.904 1.00 0.00 ATOM 440 CD ARG 56 -16.795 -0.563 -7.861 1.00 0.00 ATOM 441 NE ARG 56 -16.086 -0.845 -9.101 1.00 0.00 ATOM 442 CZ ARG 56 -16.566 -1.594 -10.088 1.00 0.00 ATOM 443 NH1 ARG 56 -17.780 -2.122 -9.994 1.00 0.00 ATOM 444 NH2 ARG 56 -15.805 -1.870 -11.136 1.00 0.00 ATOM 445 O ARG 56 -13.082 -4.586 -6.239 1.00 0.00 ATOM 446 C ARG 56 -13.488 -3.666 -5.544 1.00 0.00 ATOM 447 N MET 57 -12.689 -2.992 -4.718 1.00 0.00 ATOM 448 CA MET 57 -11.297 -3.389 -4.510 1.00 0.00 ATOM 449 CB MET 57 -10.617 -2.447 -3.514 1.00 0.00 ATOM 450 CG MET 57 -10.377 -1.046 -4.051 1.00 0.00 ATOM 451 SD MET 57 -9.696 0.069 -2.806 1.00 0.00 ATOM 452 CE MET 57 -8.062 -0.630 -2.581 1.00 0.00 ATOM 453 O MET 57 -10.382 -5.606 -4.430 1.00 0.00 ATOM 454 C MET 57 -11.192 -4.807 -3.961 1.00 0.00 ATOM 455 N VAL 58 -12.029 -5.124 -2.954 1.00 0.00 ATOM 456 CA VAL 58 -12.020 -6.448 -2.352 1.00 0.00 ATOM 457 CB VAL 58 -12.918 -6.495 -1.104 1.00 0.00 ATOM 458 CG1 VAL 58 -12.986 -7.922 -0.562 1.00 0.00 ATOM 459 CG2 VAL 58 -12.367 -5.550 -0.040 1.00 0.00 ATOM 460 O VAL 58 -11.867 -8.575 -3.435 1.00 0.00 ATOM 461 C VAL 58 -12.437 -7.483 -3.383 1.00 0.00 ATOM 462 N GLU 59 -13.456 -7.164 -4.199 1.00 0.00 ATOM 463 CA GLU 59 -13.930 -8.104 -5.212 1.00 0.00 ATOM 464 CB GLU 59 -15.182 -7.537 -5.932 1.00 0.00 ATOM 465 CG GLU 59 -16.399 -7.285 -5.047 1.00 0.00 ATOM 466 CD GLU 59 -17.593 -6.742 -5.827 1.00 0.00 ATOM 467 OE1 GLU 59 -17.381 -5.956 -6.778 1.00 0.00 ATOM 468 OE2 GLU 59 -18.743 -7.085 -5.479 1.00 0.00 ATOM 469 O GLU 59 -12.628 -9.546 -6.626 1.00 0.00 ATOM 470 C GLU 59 -12.849 -8.396 -6.259 1.00 0.00 ATOM 471 N ARG 60 -12.178 -7.345 -6.755 1.00 0.00 ATOM 472 CA ARG 60 -11.151 -7.487 -7.774 1.00 0.00 ATOM 473 CB ARG 60 -10.564 -6.120 -8.126 1.00 0.00 ATOM 474 CG ARG 60 -11.548 -5.206 -8.820 1.00 0.00 ATOM 475 CD ARG 60 -11.106 -3.778 -8.754 1.00 0.00 ATOM 476 NE ARG 60 -12.053 -2.836 -9.303 1.00 0.00 ATOM 477 CZ ARG 60 -12.037 -1.512 -9.146 1.00 0.00 ATOM 478 NH1 ARG 60 -11.081 -0.967 -8.430 1.00 0.00 ATOM 479 NH2 ARG 60 -12.981 -0.749 -9.706 1.00 0.00 ATOM 480 O ARG 60 -9.512 -9.254 -7.959 1.00 0.00 ATOM 481 C ARG 60 -10.017 -8.379 -7.252 1.00 0.00 ATOM 482 N LEU 61 -9.552 -8.076 -6.039 1.00 0.00 ATOM 483 CA LEU 61 -8.429 -8.756 -5.430 1.00 0.00 ATOM 484 CB LEU 61 -8.079 -8.152 -4.085 1.00 0.00 ATOM 485 CG LEU 61 -7.805 -6.666 -4.190 1.00 0.00 ATOM 486 CD1 LEU 61 -7.484 -6.148 -2.828 1.00 0.00 ATOM 487 CD2 LEU 61 -6.652 -6.408 -5.141 1.00 0.00 ATOM 488 O LEU 61 -7.871 -11.071 -5.236 1.00 0.00 ATOM 489 C LEU 61 -8.749 -10.206 -5.150 1.00 0.00 ATOM 490 N LYS 62 -10.007 -10.492 -4.765 1.00 0.00 ATOM 491 CA LYS 62 -10.369 -11.900 -4.497 1.00 0.00 ATOM 492 CB LYS 62 -11.854 -11.946 -4.126 1.00 0.00 ATOM 493 CG LYS 62 -12.363 -13.337 -3.787 1.00 0.00 ATOM 494 CD LYS 62 -13.818 -13.300 -3.347 1.00 0.00 ATOM 495 CE LYS 62 -14.325 -14.689 -2.988 1.00 0.00 ATOM 496 NZ LYS 62 -15.747 -14.667 -2.554 1.00 0.00 ATOM 497 O LYS 62 -10.011 -14.034 -5.531 1.00 0.00 ATOM 498 C LYS 62 -10.093 -12.816 -5.683 1.00 0.00 ATOM 499 N LYS 63 -9.987 -12.185 -6.931 1.00 0.00 ATOM 500 CA LYS 63 -9.736 -12.964 -8.139 1.00 0.00 ATOM 501 CB LYS 63 -10.840 -12.717 -9.169 1.00 0.00 ATOM 502 CG LYS 63 -12.226 -13.128 -8.704 1.00 0.00 ATOM 503 CD LYS 63 -13.267 -12.883 -9.786 1.00 0.00 ATOM 504 CE LYS 63 -14.653 -13.304 -9.321 1.00 0.00 ATOM 505 NZ LYS 63 -15.698 -12.978 -10.333 1.00 0.00 ATOM 506 O LYS 63 -7.797 -13.585 -9.407 1.00 0.00 ATOM 507 C LYS 63 -8.376 -12.692 -8.794 1.00 0.00 ATOM 508 N ASN 64 -7.850 -11.471 -8.645 1.00 0.00 ATOM 509 CA ASN 64 -6.549 -11.139 -9.191 1.00 0.00 ATOM 510 CB ASN 64 -6.753 -10.271 -10.434 1.00 0.00 ATOM 511 CG ASN 64 -5.460 -10.002 -11.176 1.00 0.00 ATOM 512 ND2 ASN 64 -5.573 -9.609 -12.441 1.00 0.00 ATOM 513 OD1 ASN 64 -4.372 -10.145 -10.618 1.00 0.00 ATOM 514 O ASN 64 -6.006 -9.207 -7.950 1.00 0.00 ATOM 515 C ASN 64 -5.724 -10.365 -8.177 1.00 0.00 ATOM 516 N ASN 65 -4.703 -11.000 -7.568 1.00 0.00 ATOM 517 CA ASN 65 -3.909 -10.319 -6.549 1.00 0.00 ATOM 518 CB ASN 65 -3.036 -11.324 -5.794 1.00 0.00 ATOM 519 CG ASN 65 -3.841 -12.214 -4.867 1.00 0.00 ATOM 520 ND2 ASN 65 -3.257 -13.341 -4.477 1.00 0.00 ATOM 521 OD1 ASN 65 -4.971 -11.890 -4.509 1.00 0.00 ATOM 522 O ASN 65 -2.559 -8.371 -6.257 1.00 0.00 ATOM 523 C ASN 65 -3.003 -9.193 -7.056 1.00 0.00 ATOM 524 N LYS 66 -2.708 -9.170 -8.357 1.00 0.00 ATOM 525 CA LYS 66 -1.748 -8.219 -8.886 1.00 0.00 ATOM 526 CB LYS 66 -1.534 -8.471 -10.378 1.00 0.00 ATOM 527 CG LYS 66 -0.441 -7.614 -11.001 1.00 0.00 ATOM 528 CD LYS 66 -0.219 -7.978 -12.460 1.00 0.00 ATOM 529 CE LYS 66 0.885 -7.136 -13.077 1.00 0.00 ATOM 530 NZ LYS 66 1.115 -7.483 -14.507 1.00 0.00 ATOM 531 O LYS 66 -3.328 -6.409 -9.037 1.00 0.00 ATOM 532 C LYS 66 -2.192 -6.771 -8.698 1.00 0.00 ATOM 533 N ILE 67 -1.271 -5.973 -8.157 1.00 0.00 ATOM 534 CA ILE 67 -1.559 -4.595 -7.754 1.00 0.00 ATOM 535 CB ILE 67 -1.613 -4.470 -6.222 1.00 0.00 ATOM 536 CG1 ILE 67 -2.735 -5.361 -5.679 1.00 0.00 ATOM 537 CG2 ILE 67 -1.844 -3.020 -5.822 1.00 0.00 ATOM 538 CD1 ILE 67 -4.109 -5.039 -6.235 1.00 0.00 ATOM 539 O ILE 67 0.738 -3.986 -8.197 1.00 0.00 ATOM 540 C ILE 67 -0.439 -3.610 -8.063 1.00 0.00 ATOM 541 N CYS 68 -0.824 -2.333 -8.173 1.00 0.00 ATOM 542 CA CYS 68 0.102 -1.233 -8.348 1.00 0.00 ATOM 543 CB CYS 68 0.037 -0.677 -9.743 1.00 0.00 ATOM 544 SG CYS 68 -1.476 0.191 -10.122 1.00 0.00 ATOM 545 O CYS 68 -1.356 -0.090 -6.823 1.00 0.00 ATOM 546 C CYS 68 -0.216 -0.191 -7.286 1.00 0.00 ATOM 547 N LEU 69 0.793 0.555 -6.872 1.00 0.00 ATOM 548 CA LEU 69 0.627 1.547 -5.813 1.00 0.00 ATOM 549 CB LEU 69 0.919 0.980 -4.422 1.00 0.00 ATOM 550 CG LEU 69 0.839 1.967 -3.256 1.00 0.00 ATOM 551 CD1 LEU 69 -0.589 2.457 -3.064 1.00 0.00 ATOM 552 CD2 LEU 69 1.295 1.309 -1.964 1.00 0.00 ATOM 553 O LEU 69 2.817 2.438 -6.260 1.00 0.00 ATOM 554 C LEU 69 1.619 2.678 -6.077 1.00 0.00 ATOM 555 N TYR 70 1.139 3.903 -6.098 1.00 0.00 ATOM 556 CA TYR 70 1.997 5.062 -6.331 1.00 0.00 ATOM 557 CB TYR 70 1.880 5.587 -7.753 1.00 0.00 ATOM 558 CG TYR 70 0.590 6.278 -8.139 1.00 0.00 ATOM 559 CD1 TYR 70 0.451 7.659 -7.991 1.00 0.00 ATOM 560 CD2 TYR 70 -0.459 5.566 -8.722 1.00 0.00 ATOM 561 CE1 TYR 70 -0.722 8.318 -8.380 1.00 0.00 ATOM 562 CE2 TYR 70 -1.642 6.213 -9.128 1.00 0.00 ATOM 563 CZ TYR 70 -1.763 7.591 -8.950 1.00 0.00 ATOM 564 OH TYR 70 -2.914 8.240 -9.355 1.00 0.00 ATOM 565 O TYR 70 0.674 6.161 -4.630 1.00 0.00 ATOM 566 C TYR 70 1.733 6.137 -5.288 1.00 0.00 ATOM 567 N PHE 71 2.726 6.990 -5.105 1.00 0.00 ATOM 568 CA PHE 71 2.624 8.087 -4.168 1.00 0.00 ATOM 569 CB PHE 71 3.074 7.693 -2.759 1.00 0.00 ATOM 570 CG PHE 71 4.536 7.379 -2.619 1.00 0.00 ATOM 571 CD1 PHE 71 4.987 6.063 -2.716 1.00 0.00 ATOM 572 CD2 PHE 71 5.454 8.384 -2.313 1.00 0.00 ATOM 573 CE1 PHE 71 6.339 5.747 -2.503 1.00 0.00 ATOM 574 CE2 PHE 71 6.809 8.078 -2.101 1.00 0.00 ATOM 575 CZ PHE 71 7.247 6.759 -2.195 1.00 0.00 ATOM 576 O PHE 71 4.439 8.927 -5.524 1.00 0.00 ATOM 577 C PHE 71 3.562 9.184 -4.679 1.00 0.00 ATOM 578 N VAL 72 3.313 10.400 -4.225 1.00 0.00 ATOM 579 CA VAL 72 3.983 11.580 -4.799 1.00 0.00 ATOM 580 CB VAL 72 3.079 12.304 -5.832 1.00 0.00 ATOM 581 CG1 VAL 72 3.853 13.428 -6.511 1.00 0.00 ATOM 582 CG2 VAL 72 2.565 11.342 -6.915 1.00 0.00 ATOM 583 O VAL 72 3.472 12.889 -2.837 1.00 0.00 ATOM 584 C VAL 72 4.305 12.597 -3.699 1.00 0.00 ATOM 585 N ASP 73 5.534 13.107 -3.715 1.00 0.00 ATOM 586 CA ASP 73 5.919 14.187 -2.814 1.00 0.00 ATOM 587 CB ASP 73 6.687 13.638 -1.612 1.00 0.00 ATOM 588 CG ASP 73 6.895 14.678 -0.529 1.00 0.00 ATOM 589 OD1 ASP 73 6.221 15.729 -0.577 1.00 0.00 ATOM 590 OD2 ASP 73 7.733 14.444 0.369 1.00 0.00 ATOM 591 O ASP 73 7.889 14.656 -4.103 1.00 0.00 ATOM 592 C ASP 73 6.769 15.029 -3.758 1.00 0.00 ATOM 593 N ASP 74 6.103 16.238 -4.071 1.00 0.00 ATOM 594 CA ASP 74 6.828 17.195 -4.914 1.00 0.00 ATOM 595 CB ASP 74 7.859 17.974 -4.089 1.00 0.00 ATOM 596 CG ASP 74 8.572 19.019 -4.891 1.00 0.00 ATOM 597 OD1 ASP 74 8.014 19.481 -5.914 1.00 0.00 ATOM 598 OD2 ASP 74 9.687 19.420 -4.498 1.00 0.00 ATOM 599 O ASP 74 8.702 16.190 -6.022 1.00 0.00 ATOM 600 C ASP 74 7.493 16.418 -6.046 1.00 0.00 ATOM 601 N ASN 75 6.660 15.907 -6.973 1.00 0.00 ATOM 602 CA ASN 75 7.161 15.126 -8.101 1.00 0.00 ATOM 603 CB ASN 75 6.030 14.778 -9.023 1.00 0.00 ATOM 604 CG ASN 75 6.429 13.737 -10.053 1.00 0.00 ATOM 605 ND2 ASN 75 6.827 12.549 -9.645 1.00 0.00 ATOM 606 OD1 ASN 75 6.348 14.134 -11.237 1.00 0.00 ATOM 607 O ASN 75 9.085 15.270 -9.507 1.00 0.00 ATOM 608 C ASN 75 8.202 15.882 -8.907 1.00 0.00 ATOM 609 N LYS 76 8.107 17.207 -8.925 1.00 0.00 ATOM 610 CA LYS 76 9.086 18.003 -9.650 1.00 0.00 ATOM 611 CB LYS 76 8.787 19.471 -9.584 1.00 0.00 ATOM 612 CG LYS 76 7.426 19.852 -10.126 1.00 0.00 ATOM 613 CD LYS 76 7.184 21.343 -9.968 1.00 0.00 ATOM 614 CE LYS 76 5.824 21.753 -10.497 1.00 0.00 ATOM 615 NZ LYS 76 5.580 23.201 -10.286 1.00 0.00 ATOM 616 O LYS 76 11.473 17.825 -9.887 1.00 0.00 ATOM 617 C LYS 76 10.492 17.700 -9.149 1.00 0.00 ATOM 618 N PHE 77 10.584 17.330 -7.875 1.00 0.00 ATOM 619 CA PHE 77 11.874 17.009 -7.271 1.00 0.00 ATOM 620 CB PHE 77 12.292 18.125 -6.279 1.00 0.00 ATOM 621 CG PHE 77 13.673 17.927 -5.704 1.00 0.00 ATOM 622 CD1 PHE 77 14.783 17.869 -6.545 1.00 0.00 ATOM 623 CD2 PHE 77 13.865 17.799 -4.326 1.00 0.00 ATOM 624 CE1 PHE 77 16.052 17.694 -6.034 1.00 0.00 ATOM 625 CE2 PHE 77 15.141 17.619 -3.804 1.00 0.00 ATOM 626 CZ PHE 77 16.238 17.569 -4.653 1.00 0.00 ATOM 627 O PHE 77 12.827 14.880 -6.733 1.00 0.00 ATOM 628 C PHE 77 11.797 15.533 -6.911 1.00 0.00 ATOM 629 N ALA 78 10.368 14.666 -6.839 1.00 0.00 ATOM 630 CA ALA 78 10.191 13.260 -6.496 1.00 0.00 ATOM 631 CB ALA 78 10.254 13.083 -4.960 1.00 0.00 ATOM 632 O ALA 78 7.830 13.126 -6.882 1.00 0.00 ATOM 633 C ALA 78 8.902 12.524 -6.820 1.00 0.00 ATOM 634 N GLY 79 9.014 11.194 -7.019 1.00 0.00 ATOM 635 CA GLY 79 7.839 10.407 -7.341 1.00 0.00 ATOM 636 O GLY 79 9.443 8.634 -7.562 1.00 0.00 ATOM 637 C GLY 79 8.285 8.954 -7.284 1.00 0.00 ATOM 638 N LEU 80 7.360 8.075 -6.925 1.00 0.00 ATOM 639 CA LEU 80 7.642 6.650 -6.843 1.00 0.00 ATOM 640 CB LEU 80 7.852 6.277 -5.362 1.00 0.00 ATOM 641 CG LEU 80 8.349 4.849 -5.211 1.00 0.00 ATOM 642 CD1 LEU 80 8.945 4.662 -3.813 1.00 0.00 ATOM 643 CD2 LEU 80 7.291 3.848 -5.457 1.00 0.00 ATOM 644 O LEU 80 5.293 6.151 -6.808 1.00 0.00 ATOM 645 C LEU 80 6.415 5.834 -7.245 1.00 0.00 ATOM 646 N MET 81 6.613 4.818 -8.057 1.00 0.00 ATOM 647 CA MET 81 5.504 3.948 -8.465 1.00 0.00 ATOM 648 CB MET 81 5.247 4.050 -9.963 1.00 0.00 ATOM 649 CG MET 81 4.234 3.019 -10.484 1.00 0.00 ATOM 650 SD MET 81 2.525 3.317 -9.789 1.00 0.00 ATOM 651 CE MET 81 1.977 4.560 -11.025 1.00 0.00 ATOM 652 O MET 81 7.143 2.226 -8.606 1.00 0.00 ATOM 653 C MET 81 6.015 2.541 -8.217 1.00 0.00 ATOM 654 N LEU 82 5.260 1.725 -7.511 1.00 0.00 ATOM 655 CA LEU 82 5.634 0.355 -7.182 1.00 0.00 ATOM 656 CB LEU 82 5.520 0.115 -5.656 1.00 0.00 ATOM 657 CG LEU 82 6.487 0.944 -4.771 1.00 0.00 ATOM 658 CD1 LEU 82 6.026 0.940 -3.311 1.00 0.00 ATOM 659 CD2 LEU 82 7.882 0.399 -4.913 1.00 0.00 ATOM 660 O LEU 82 3.520 -0.364 -8.013 1.00 0.00 ATOM 661 C LEU 82 4.728 -0.621 -7.862 1.00 0.00 ATOM 662 N VAL 83 5.273 -1.784 -8.166 1.00 0.00 ATOM 663 CA VAL 83 4.470 -2.885 -8.646 1.00 0.00 ATOM 664 CB VAL 83 4.936 -3.377 -10.028 1.00 0.00 ATOM 665 CG1 VAL 83 4.127 -4.590 -10.464 1.00 0.00 ATOM 666 CG2 VAL 83 4.762 -2.285 -11.072 1.00 0.00 ATOM 667 O VAL 83 5.562 -4.409 -7.161 1.00 0.00 ATOM 668 C VAL 83 4.509 -4.068 -7.696 1.00 0.00 ATOM 669 N GLY 84 3.373 -4.780 -7.332 1.00 0.00 ATOM 670 CA GLY 84 3.415 -5.901 -6.418 1.00 0.00 ATOM 671 O GLY 84 1.337 -6.681 -7.327 1.00 0.00 ATOM 672 C GLY 84 2.099 -6.634 -6.355 1.00 0.00 ATOM 673 N THR 85 1.827 -7.220 -5.194 1.00 0.00 ATOM 674 CA THR 85 0.595 -7.946 -5.020 1.00 0.00 ATOM 675 CB THR 85 0.832 -9.464 -4.907 1.00 0.00 ATOM 676 CG2 THR 85 1.536 -9.984 -6.152 1.00 0.00 ATOM 677 OG1 THR 85 1.651 -9.740 -3.764 1.00 0.00 ATOM 678 O THR 85 0.550 -7.379 -2.735 1.00 0.00 ATOM 679 C THR 85 -0.115 -7.508 -3.755 1.00 0.00 ATOM 680 N ILE 86 -1.453 -7.603 -3.793 1.00 0.00 ATOM 681 CA ILE 86 -2.279 -7.368 -2.605 1.00 0.00 ATOM 682 CB ILE 86 -3.301 -6.227 -2.877 1.00 0.00 ATOM 683 CG1 ILE 86 -2.787 -4.911 -2.285 1.00 0.00 ATOM 684 CG2 ILE 86 -4.697 -6.561 -2.339 1.00 0.00 ATOM 685 CD1 ILE 86 -3.289 -3.667 -3.007 1.00 0.00 ATOM 686 O ILE 86 -3.561 -9.364 -2.960 1.00 0.00 ATOM 687 C ILE 86 -3.039 -8.601 -2.135 1.00 0.00 ATOM 688 N GLU 87 -3.135 -8.755 -0.815 1.00 0.00 ATOM 689 CA GLU 87 -3.981 -9.790 -0.199 1.00 0.00 ATOM 690 CB GLU 87 -3.126 -10.693 0.688 1.00 0.00 ATOM 691 CG GLU 87 -3.978 -11.641 1.540 1.00 0.00 ATOM 692 CD GLU 87 -3.215 -12.312 2.675 1.00 0.00 ATOM 693 OE1 GLU 87 -2.785 -11.617 3.623 1.00 0.00 ATOM 694 OE2 GLU 87 -3.056 -13.542 2.627 1.00 0.00 ATOM 695 O GLU 87 -4.639 -8.264 1.525 1.00 0.00 ATOM 696 C GLU 87 -4.969 -9.196 0.795 1.00 0.00 ATOM 697 N ILE 88 -6.163 -9.734 0.793 1.00 0.00 ATOM 698 CA ILE 88 -7.198 -9.288 1.715 1.00 0.00 ATOM 699 CB ILE 88 -8.555 -9.648 1.082 1.00 0.00 ATOM 700 CG1 ILE 88 -8.696 -8.980 -0.287 1.00 0.00 ATOM 701 CG2 ILE 88 -9.699 -9.183 1.969 1.00 0.00 ATOM 702 CD1 ILE 88 -9.895 -9.457 -1.078 1.00 0.00 ATOM 703 O ILE 88 -7.125 -11.185 3.179 1.00 0.00 ATOM 704 C ILE 88 -7.057 -9.952 3.083 1.00 0.00 ATOM 705 N LEU 89 -6.939 -9.155 4.143 1.00 0.00 ATOM 706 CA LEU 89 -6.718 -9.746 5.450 1.00 0.00 ATOM 707 CB LEU 89 -5.478 -9.143 6.114 1.00 0.00 ATOM 708 CG LEU 89 -5.129 -9.676 7.504 1.00 0.00 ATOM 709 CD1 LEU 89 -4.708 -11.136 7.431 1.00 0.00 ATOM 710 CD2 LEU 89 -3.982 -8.882 8.111 1.00 0.00 ATOM 711 O LEU 89 -8.486 -8.444 6.436 1.00 0.00 ATOM 712 C LEU 89 -7.900 -9.522 6.392 1.00 0.00 ATOM 713 N HIS 90 -8.277 -10.579 7.107 1.00 0.00 ATOM 714 CA HIS 90 -9.419 -10.499 8.011 1.00 0.00 ATOM 715 CB HIS 90 -10.601 -11.081 6.841 1.00 0.00 ATOM 716 CG HIS 90 -10.344 -12.563 6.832 1.00 0.00 ATOM 717 CD2 HIS 90 -10.648 -13.539 7.716 1.00 0.00 ATOM 718 ND1 HIS 90 -9.625 -13.149 5.810 1.00 0.00 ATOM 719 CE1 HIS 90 -9.500 -14.444 6.055 1.00 0.00 ATOM 720 NE2 HIS 90 -10.099 -14.701 7.200 1.00 0.00 ATOM 721 O HIS 90 -9.746 -11.213 10.284 1.00 0.00 ATOM 722 C HIS 90 -8.934 -10.885 9.415 1.00 0.00 ATOM 723 N ASP 91 -7.608 -10.946 9.634 1.00 0.00 ATOM 724 CA ASP 91 -7.082 -11.382 10.930 1.00 0.00 ATOM 725 CB ASP 91 -5.556 -11.311 10.841 1.00 0.00 ATOM 726 CG ASP 91 -4.875 -11.717 12.134 1.00 0.00 ATOM 727 OD1 ASP 91 -5.590 -11.951 13.130 1.00 0.00 ATOM 728 OD2 ASP 91 -3.629 -11.797 12.148 1.00 0.00 ATOM 729 O ASP 91 -7.505 -9.165 11.778 1.00 0.00 ATOM 730 C ASP 91 -7.604 -10.378 11.976 1.00 0.00 ATOM 731 N ARG 92 -8.278 -10.890 13.010 1.00 0.00 ATOM 732 CA ARG 92 -8.857 -10.053 14.081 1.00 0.00 ATOM 733 CB ARG 92 -9.594 -10.993 15.093 1.00 0.00 ATOM 734 CG ARG 92 -10.887 -11.614 14.568 1.00 0.00 ATOM 735 CD ARG 92 -11.708 -12.239 15.696 1.00 0.00 ATOM 736 NE ARG 92 -11.057 -13.401 16.295 1.00 0.00 ATOM 737 CZ ARG 92 -11.078 -14.626 15.779 1.00 0.00 ATOM 738 NH1 ARG 92 -11.725 -14.865 14.644 1.00 0.00 ATOM 739 NH2 ARG 92 -10.449 -15.615 16.401 1.00 0.00 ATOM 740 O ARG 92 -8.005 -8.052 15.097 1.00 0.00 ATOM 741 C ARG 92 -7.789 -9.219 14.782 1.00 0.00 ATOM 742 N ALA 93 -6.603 -9.802 14.998 1.00 0.00 ATOM 743 CA ALA 93 -5.498 -9.119 15.655 1.00 0.00 ATOM 744 CB ALA 93 -4.338 -10.085 15.848 1.00 0.00 ATOM 745 O ALA 93 -4.895 -6.793 15.405 1.00 0.00 ATOM 746 C ALA 93 -5.042 -7.895 14.852 1.00 0.00 ATOM 747 N SER 94 -4.818 -8.066 13.539 1.00 0.00 ATOM 748 CA SER 94 -4.392 -6.932 12.737 1.00 0.00 ATOM 749 CB SER 94 -3.935 -7.438 11.334 1.00 0.00 ATOM 750 OG SER 94 -2.728 -8.180 11.461 1.00 0.00 ATOM 751 O SER 94 -5.201 -4.686 12.554 1.00 0.00 ATOM 752 C SER 94 -5.489 -5.880 12.603 1.00 0.00 ATOM 753 N LYS 95 -6.772 -6.335 12.475 1.00 0.00 ATOM 754 CA LYS 95 -7.894 -5.409 12.356 1.00 0.00 ATOM 755 CB LYS 95 -9.198 -6.209 12.344 1.00 0.00 ATOM 756 CG LYS 95 -9.476 -6.922 11.030 1.00 0.00 ATOM 757 CD LYS 95 -10.793 -7.674 11.079 1.00 0.00 ATOM 758 CE LYS 95 -11.069 -8.391 9.767 1.00 0.00 ATOM 759 NZ LYS 95 -12.336 -9.174 9.816 1.00 0.00 ATOM 760 O LYS 95 -7.896 -3.232 13.389 1.00 0.00 ATOM 761 C LYS 95 -7.887 -4.456 13.548 1.00 0.00 ATOM 762 N GLU 96 -7.729 -5.020 14.743 1.00 0.00 ATOM 763 CA GLU 96 -7.707 -4.254 15.972 1.00 0.00 ATOM 764 CB GLU 96 -7.669 -5.169 17.184 1.00 0.00 ATOM 765 CG GLU 96 -8.821 -6.154 17.252 1.00 0.00 ATOM 766 CD GLU 96 -8.779 -7.012 18.502 1.00 0.00 ATOM 767 OE1 GLU 96 -7.741 -7.661 18.743 1.00 0.00 ATOM 768 OE2 GLU 96 -9.786 -7.039 19.239 1.00 0.00 ATOM 769 O GLU 96 -6.526 -2.214 16.369 1.00 0.00 ATOM 770 C GLU 96 -6.449 -3.416 16.071 1.00 0.00 ATOM 771 N MET 97 -5.266 -3.980 15.817 1.00 0.00 ATOM 772 CA MET 97 -4.030 -3.193 15.895 1.00 0.00 ATOM 773 CB MET 97 -2.810 -4.089 15.574 1.00 0.00 ATOM 774 CG MET 97 -2.660 -5.321 16.444 1.00 0.00 ATOM 775 SD MET 97 -0.989 -6.013 16.352 1.00 0.00 ATOM 776 CE MET 97 -0.747 -6.169 14.577 1.00 0.00 ATOM 777 O MET 97 -3.442 -0.936 15.257 1.00 0.00 ATOM 778 C MET 97 -4.004 -1.993 14.931 1.00 0.00 ATOM 779 N LEU 98 -4.582 -2.166 13.749 1.00 0.00 ATOM 780 CA LEU 98 -4.508 -1.122 12.721 1.00 0.00 ATOM 781 CB LEU 98 -4.280 -2.131 11.314 1.00 0.00 ATOM 782 CG LEU 98 -3.416 -1.764 10.100 1.00 0.00 ATOM 783 CD1 LEU 98 -3.005 -3.026 9.354 1.00 0.00 ATOM 784 CD2 LEU 98 -4.185 -0.814 9.184 1.00 0.00 ATOM 785 O LEU 98 -5.782 0.712 11.809 1.00 0.00 ATOM 786 C LEU 98 -5.705 -0.171 12.679 1.00 0.00 ATOM 787 N TRP 99 -6.654 -0.400 13.590 1.00 0.00 ATOM 788 CA TRP 99 -7.841 0.432 13.695 1.00 0.00 ATOM 789 CB TRP 99 -8.742 -0.067 14.826 1.00 0.00 ATOM 790 CG TRP 99 -10.032 0.687 14.939 1.00 0.00 ATOM 791 CD1 TRP 99 -10.346 1.647 15.858 1.00 0.00 ATOM 792 CD2 TRP 99 -11.186 0.541 14.099 1.00 0.00 ATOM 793 CE2 TRP 99 -12.159 1.448 14.571 1.00 0.00 ATOM 794 CE3 TRP 99 -11.492 -0.261 12.998 1.00 0.00 ATOM 795 NE1 TRP 99 -11.619 2.111 15.644 1.00 0.00 ATOM 796 CZ2 TRP 99 -13.416 1.568 13.977 1.00 0.00 ATOM 797 CZ3 TRP 99 -12.738 -0.138 12.414 1.00 0.00 ATOM 798 CH2 TRP 99 -13.683 0.768 12.900 1.00 0.00 ATOM 799 O TRP 99 -6.724 2.146 14.974 1.00 0.00 ATOM 800 C TRP 99 -7.489 1.880 14.038 1.00 0.00 ATOM 801 N THR 100 -8.037 2.803 13.249 1.00 0.00 ATOM 802 CA THR 100 -7.878 4.240 13.471 1.00 0.00 ATOM 803 CB THR 100 -7.571 4.986 12.165 1.00 0.00 ATOM 804 CG2 THR 100 -7.419 6.518 12.439 1.00 0.00 ATOM 805 OG1 THR 100 -6.346 4.491 11.594 1.00 0.00 ATOM 806 O THR 100 -10.229 4.233 13.574 1.00 0.00 ATOM 807 C THR 100 -9.206 4.812 13.894 1.00 0.00 ATOM 808 N ASP 101 -9.194 5.899 14.664 1.00 0.00 ATOM 809 CA ASP 101 -10.438 6.529 15.104 1.00 0.00 ATOM 810 CB ASP 101 -10.081 7.804 15.944 1.00 0.00 ATOM 811 CG ASP 101 -9.556 7.498 17.327 1.00 0.00 ATOM 812 OD1 ASP 101 -9.608 6.320 17.741 1.00 0.00 ATOM 813 OD2 ASP 101 -9.099 8.441 18.003 1.00 0.00 ATOM 814 O ASP 101 -12.560 6.760 14.066 1.00 0.00 ATOM 815 C ASP 101 -11.345 6.902 13.961 1.00 0.00 ATOM 816 N GLY 102 -10.760 7.375 12.855 1.00 0.00 ATOM 817 CA GLY 102 -11.567 7.859 11.738 1.00 0.00 ATOM 818 O GLY 102 -13.231 6.945 10.239 1.00 0.00 ATOM 819 C GLY 102 -12.282 6.708 11.010 1.00 0.00 ATOM 820 N CYS 103 -11.907 5.473 11.344 1.00 0.00 ATOM 821 CA CYS 103 -12.615 4.266 10.848 1.00 0.00 ATOM 822 CB CYS 103 -11.912 2.997 11.331 1.00 0.00 ATOM 823 SG CYS 103 -10.254 2.754 10.648 1.00 0.00 ATOM 824 O CYS 103 -14.829 3.367 10.769 1.00 0.00 ATOM 825 C CYS 103 -14.076 4.192 11.299 1.00 0.00 ATOM 826 N GLU 104 -14.412 4.866 12.401 1.00 0.00 ATOM 827 CA GLU 104 -15.773 4.766 12.946 1.00 0.00 ATOM 828 CB GLU 104 -15.795 5.492 14.328 1.00 0.00 ATOM 829 CG GLU 104 -17.194 5.547 14.951 1.00 0.00 ATOM 830 CD GLU 104 -17.274 6.326 16.269 1.00 0.00 ATOM 831 OE1 GLU 104 -18.402 6.464 16.796 1.00 0.00 ATOM 832 OE2 GLU 104 -16.235 6.809 16.772 1.00 0.00 ATOM 833 O GLU 104 -17.917 4.677 11.884 1.00 0.00 ATOM 834 C GLU 104 -16.825 5.242 11.953 1.00 0.00 ATOM 835 N ILE 105 -16.494 6.248 11.147 1.00 0.00 ATOM 836 CA ILE 105 -17.411 6.769 10.142 1.00 0.00 ATOM 837 CB ILE 105 -16.853 8.173 9.612 1.00 0.00 ATOM 838 CG1 ILE 105 -16.793 9.209 10.737 1.00 0.00 ATOM 839 CG2 ILE 105 -17.747 8.698 8.484 1.00 0.00 ATOM 840 CD1 ILE 105 -15.925 10.397 10.395 1.00 0.00 ATOM 841 O ILE 105 -18.712 5.751 8.420 1.00 0.00 ATOM 842 C ILE 105 -17.650 5.788 9.040 1.00 0.00 ATOM 843 N TYR 106 -16.656 4.839 8.791 1.00 0.00 ATOM 844 CA TYR 106 -16.910 3.822 7.766 1.00 0.00 ATOM 845 CB TYR 106 -15.549 3.808 6.867 1.00 0.00 ATOM 846 CG TYR 106 -15.037 5.153 6.402 1.00 0.00 ATOM 847 CD1 TYR 106 -15.904 6.114 5.888 1.00 0.00 ATOM 848 CD2 TYR 106 -13.680 5.460 6.467 1.00 0.00 ATOM 849 CE1 TYR 106 -15.433 7.351 5.451 1.00 0.00 ATOM 850 CE2 TYR 106 -13.198 6.689 6.032 1.00 0.00 ATOM 851 CZ TYR 106 -14.078 7.631 5.526 1.00 0.00 ATOM 852 OH TYR 106 -13.603 8.855 5.109 1.00 0.00 ATOM 853 O TYR 106 -18.177 1.829 7.605 1.00 0.00 ATOM 854 C TYR 106 -17.376 2.472 8.261 1.00 0.00 ATOM 855 N TYR 107 -16.852 2.032 9.407 1.00 0.00 ATOM 856 CA TYR 107 -17.204 0.742 9.986 1.00 0.00 ATOM 857 CB TYR 107 -16.073 -0.335 9.653 1.00 0.00 ATOM 858 CG TYR 107 -15.368 -0.072 8.334 1.00 0.00 ATOM 859 CD1 TYR 107 -16.034 -0.253 7.124 1.00 0.00 ATOM 860 CD2 TYR 107 -14.068 0.421 8.311 1.00 0.00 ATOM 861 CE1 TYR 107 -15.416 0.020 5.918 1.00 0.00 ATOM 862 CE2 TYR 107 -13.441 0.688 7.106 1.00 0.00 ATOM 863 CZ TYR 107 -14.117 0.499 5.916 1.00 0.00 ATOM 864 OH TYR 107 -13.489 0.771 4.719 1.00 0.00 ATOM 865 O TYR 107 -17.136 0.872 12.387 1.00 0.00 ATOM 866 C TYR 107 -17.812 0.898 11.370 1.00 0.00 ATOM 867 N PRO 108 -19.150 1.209 11.415 1.00 0.00 ATOM 868 CA PRO 108 -19.842 1.496 12.674 1.00 0.00 ATOM 869 CB PRO 108 -21.289 1.619 12.212 1.00 0.00 ATOM 870 CG PRO 108 -21.165 2.156 10.916 1.00 0.00 ATOM 871 CD PRO 108 -20.038 1.385 10.230 1.00 0.00 ATOM 872 O PRO 108 -20.116 0.697 14.928 1.00 0.00 ATOM 873 C PRO 108 -19.801 0.410 13.762 1.00 0.00 ATOM 874 N LEU 109 -19.394 -0.886 13.393 1.00 0.00 ATOM 875 CA LEU 109 -19.302 -1.984 14.356 1.00 0.00 ATOM 876 CB LEU 109 -19.747 -3.295 13.569 1.00 0.00 ATOM 877 CG LEU 109 -21.098 -3.299 12.840 1.00 0.00 ATOM 878 CD1 LEU 109 -21.315 -4.656 12.168 1.00 0.00 ATOM 879 CD2 LEU 109 -22.216 -3.015 13.829 1.00 0.00 ATOM 880 O LEU 109 -17.827 -2.916 15.987 1.00 0.00 ATOM 881 C LEU 109 -18.015 -2.034 15.150 1.00 0.00 ATOM 882 N GLY 110 -17.172 -1.149 14.863 1.00 0.00 ATOM 883 CA GLY 110 -15.829 -1.136 15.457 1.00 0.00 ATOM 884 O GLY 110 -15.091 -2.646 13.744 1.00 0.00 ATOM 885 C GLY 110 -14.863 -2.115 14.837 1.00 0.00 ATOM 886 N ILE 111 -13.621 -2.394 15.571 1.00 0.00 ATOM 887 CA ILE 111 -12.606 -3.269 15.066 1.00 0.00 ATOM 888 CB ILE 111 -11.433 -3.304 16.061 1.00 0.00 ATOM 889 CG1 ILE 111 -11.877 -3.910 17.392 1.00 0.00 ATOM 890 CG2 ILE 111 -10.913 -1.898 16.321 1.00 0.00 ATOM 891 CD1 ILE 111 -10.743 -4.162 18.358 1.00 0.00 ATOM 892 O ILE 111 -12.431 -5.423 14.019 1.00 0.00 ATOM 893 C ILE 111 -13.087 -4.689 14.758 1.00 0.00 ATOM 894 N ASP 112 -14.235 -5.049 15.354 1.00 0.00 ATOM 895 CA ASP 112 -14.744 -6.396 15.119 1.00 0.00 ATOM 896 CB ASP 112 -15.441 -6.783 16.426 1.00 0.00 ATOM 897 CG ASP 112 -14.500 -6.772 17.612 1.00 0.00 ATOM 898 OD1 ASP 112 -13.408 -7.371 17.511 1.00 0.00 ATOM 899 OD2 ASP 112 -14.853 -6.166 18.645 1.00 0.00 ATOM 900 O ASP 112 -16.559 -7.433 13.942 1.00 0.00 ATOM 901 C ASP 112 -15.868 -6.426 14.095 1.00 0.00 ATOM 902 N ASP 113 -16.063 -5.275 13.308 1.00 0.00 ATOM 903 CA ASP 113 -17.078 -5.225 12.277 1.00 0.00 ATOM 904 CB ASP 113 -17.070 -3.809 11.696 1.00 0.00 ATOM 905 CG ASP 113 -18.166 -3.593 10.669 1.00 0.00 ATOM 906 OD1 ASP 113 -18.880 -4.566 10.351 1.00 0.00 ATOM 907 OD2 ASP 113 -18.309 -2.449 10.188 1.00 0.00 ATOM 908 O ASP 113 -15.654 -6.118 10.556 1.00 0.00 ATOM 909 C ASP 113 -16.751 -6.163 11.111 1.00 0.00 ATOM 910 N PRO 114 -17.673 -7.093 10.786 1.00 0.00 ATOM 911 CA PRO 114 -17.476 -8.044 9.686 1.00 0.00 ATOM 912 CB PRO 114 -18.823 -8.767 9.619 1.00 0.00 ATOM 913 CG PRO 114 -19.295 -8.733 11.028 1.00 0.00 ATOM 914 CD PRO 114 -18.962 -7.326 11.459 1.00 0.00 ATOM 915 O PRO 114 -16.428 -7.811 7.543 1.00 0.00 ATOM 916 C PRO 114 -17.187 -7.323 8.378 1.00 0.00 ATOM 917 N ASP 115 -17.779 -6.149 8.213 1.00 0.00 ATOM 918 CA ASP 115 -17.578 -5.365 6.998 1.00 0.00 ATOM 919 CB ASP 115 -18.556 -4.188 6.968 1.00 0.00 ATOM 920 CG ASP 115 -19.985 -4.630 6.731 1.00 0.00 ATOM 921 OD1 ASP 115 -20.192 -5.790 6.319 1.00 0.00 ATOM 922 OD2 ASP 115 -20.903 -3.812 6.958 1.00 0.00 ATOM 923 O ASP 115 -15.843 -4.232 5.807 1.00 0.00 ATOM 924 C ASP 115 -16.178 -4.777 6.860 1.00 0.00 ATOM 925 N TYR 116 -15.343 -4.839 7.963 1.00 0.00 ATOM 926 CA TYR 116 -14.002 -4.269 7.914 1.00 0.00 ATOM 927 CB TYR 116 -13.721 -3.530 9.247 1.00 0.00 ATOM 928 CG TYR 116 -12.312 -3.022 9.346 1.00 0.00 ATOM 929 CD1 TYR 116 -11.885 -1.938 8.578 1.00 0.00 ATOM 930 CD2 TYR 116 -11.380 -3.664 10.159 1.00 0.00 ATOM 931 CE1 TYR 116 -10.565 -1.512 8.618 1.00 0.00 ATOM 932 CE2 TYR 116 -10.061 -3.243 10.203 1.00 0.00 ATOM 933 CZ TYR 116 -9.658 -2.171 9.432 1.00 0.00 ATOM 934 OH TYR 116 -8.349 -1.757 9.458 1.00 0.00 ATOM 935 O TYR 116 -12.931 -6.430 7.927 1.00 0.00 ATOM 936 C TYR 116 -13.064 -5.323 7.386 1.00 0.00 ATOM 937 N THR 117 -12.212 -4.901 6.418 1.00 0.00 ATOM 938 CA THR 117 -11.162 -5.692 5.887 1.00 0.00 ATOM 939 CB THR 117 -11.429 -6.431 4.560 1.00 0.00 ATOM 940 CG2 THR 117 -12.520 -7.485 4.743 1.00 0.00 ATOM 941 OG1 THR 117 -11.857 -5.489 3.569 1.00 0.00 ATOM 942 O THR 117 -9.988 -3.661 5.381 1.00 0.00 ATOM 943 C THR 117 -9.891 -4.862 5.693 1.00 0.00 ATOM 944 N ALA 118 -8.728 -5.493 5.851 1.00 0.00 ATOM 945 CA ALA 118 -7.454 -4.846 5.545 1.00 0.00 ATOM 946 CB ALA 118 -6.365 -5.277 6.527 1.00 0.00 ATOM 947 O ALA 118 -7.161 -6.390 3.737 1.00 0.00 ATOM 948 C ALA 118 -6.873 -5.291 4.215 1.00 0.00 ATOM 949 N LEU 119 -6.106 -4.407 3.591 1.00 0.00 ATOM 950 CA LEU 119 -5.433 -4.722 2.336 1.00 0.00 ATOM 951 CB LEU 119 -5.838 -3.768 1.210 1.00 0.00 ATOM 952 CG LEU 119 -7.320 -3.764 0.828 1.00 0.00 ATOM 953 CD1 LEU 119 -7.604 -2.684 -0.205 1.00 0.00 ATOM 954 CD2 LEU 119 -7.726 -5.105 0.237 1.00 0.00 ATOM 955 O LEU 119 -3.441 -3.534 2.979 1.00 0.00 ATOM 956 C LEU 119 -3.942 -4.600 2.600 1.00 0.00 ATOM 957 N CYS 120 -3.245 -5.726 2.464 1.00 0.00 ATOM 958 CA CYS 120 -1.798 -5.748 2.638 1.00 0.00 ATOM 959 CB CYS 120 -1.513 -7.104 3.229 1.00 0.00 ATOM 960 SG CYS 120 0.275 -7.218 3.599 1.00 0.00 ATOM 961 O CYS 120 -1.448 -6.682 0.486 1.00 0.00 ATOM 962 C CYS 120 -1.158 -5.758 1.257 1.00 0.00 ATOM 963 N PHE 121 -0.417 -4.701 0.913 1.00 0.00 ATOM 964 CA PHE 121 0.231 -4.592 -0.384 1.00 0.00 ATOM 965 CB PHE 121 -0.176 -3.248 -1.021 1.00 0.00 ATOM 966 CG PHE 121 0.625 -2.876 -2.248 1.00 0.00 ATOM 967 CD1 PHE 121 0.318 -3.417 -3.493 1.00 0.00 ATOM 968 CD2 PHE 121 1.668 -1.953 -2.161 1.00 0.00 ATOM 969 CE1 PHE 121 1.031 -3.038 -4.638 1.00 0.00 ATOM 970 CE2 PHE 121 2.389 -1.569 -3.293 1.00 0.00 ATOM 971 CZ PHE 121 2.068 -2.111 -4.535 1.00 0.00 ATOM 972 O PHE 121 2.342 -4.277 0.631 1.00 0.00 ATOM 973 C PHE 121 1.714 -4.955 -0.201 1.00 0.00 ATOM 974 N THR 122 2.167 -5.947 -0.936 1.00 0.00 ATOM 975 CA THR 122 3.568 -6.370 -0.846 1.00 0.00 ATOM 976 CB THR 122 3.674 -7.880 -0.564 1.00 0.00 ATOM 977 CG2 THR 122 5.134 -8.307 -0.500 1.00 0.00 ATOM 978 OG1 THR 122 3.047 -8.180 0.687 1.00 0.00 ATOM 979 O THR 122 3.870 -6.659 -3.198 1.00 0.00 ATOM 980 C THR 122 4.249 -6.086 -2.165 1.00 0.00 ATOM 981 N ALA 123 5.304 -5.269 -2.106 1.00 0.00 ATOM 982 CA ALA 123 5.948 -4.733 -3.306 1.00 0.00 ATOM 983 CB ALA 123 6.683 -3.444 -2.970 1.00 0.00 ATOM 984 O ALA 123 7.647 -6.390 -3.137 1.00 0.00 ATOM 985 C ALA 123 6.957 -5.709 -3.887 1.00 0.00 ATOM 986 N GLU 124 7.001 -5.774 -5.226 1.00 0.00 ATOM 987 CA GLU 124 7.963 -6.604 -5.974 1.00 0.00 ATOM 988 CB GLU 124 7.344 -7.205 -7.195 1.00 0.00 ATOM 989 CG GLU 124 6.145 -8.058 -6.887 1.00 0.00 ATOM 990 CD GLU 124 6.509 -9.387 -6.261 1.00 0.00 ATOM 991 OE1 GLU 124 7.519 -9.467 -5.536 1.00 0.00 ATOM 992 OE2 GLU 124 5.758 -10.363 -6.491 1.00 0.00 ATOM 993 O GLU 124 10.206 -6.118 -6.654 1.00 0.00 ATOM 994 C GLU 124 9.033 -5.752 -6.648 1.00 0.00 ATOM 995 N TRP 125 8.522 -4.640 -7.307 1.00 0.00 ATOM 996 CA TRP 125 9.329 -3.624 -7.969 1.00 0.00 ATOM 997 CB TRP 125 8.732 -3.285 -9.235 1.00 0.00 ATOM 998 CG TRP 125 9.893 -3.646 -10.100 1.00 0.00 ATOM 999 CD1 TRP 125 10.071 -4.803 -10.827 1.00 0.00 ATOM 1000 CD2 TRP 125 11.081 -2.874 -10.304 1.00 0.00 ATOM 1001 CE2 TRP 125 11.972 -3.674 -11.090 1.00 0.00 ATOM 1002 CE3 TRP 125 11.549 -1.644 -9.811 1.00 0.00 ATOM 1003 NE1 TRP 125 11.303 -4.819 -11.414 1.00 0.00 ATOM 1004 CZ2 TRP 125 13.224 -3.201 -11.525 1.00 0.00 ATOM 1005 CZ3 TRP 125 12.822 -1.177 -10.239 1.00 0.00 ATOM 1006 CH2 TRP 125 13.653 -1.985 -11.035 1.00 0.00 ATOM 1007 O TRP 125 7.821 -1.874 -7.256 1.00 0.00 ATOM 1008 C TRP 125 9.004 -2.248 -7.397 1.00 0.00 ATOM 1009 N GLY 126 10.009 -1.547 -7.058 1.00 0.00 ATOM 1010 CA GLY 126 9.794 -0.132 -6.616 1.00 0.00 ATOM 1011 O GLY 126 11.867 0.662 -7.509 1.00 0.00 ATOM 1012 C GLY 126 10.643 0.797 -7.462 1.00 0.00 ATOM 1013 N ASN 127 9.984 1.713 -8.160 1.00 0.00 ATOM 1014 CA ASN 127 10.665 2.646 -9.039 1.00 0.00 ATOM 1015 CB ASN 127 9.631 2.918 -10.077 1.00 0.00 ATOM 1016 CG ASN 127 10.000 1.941 -11.175 1.00 0.00 ATOM 1017 ND2 ASN 127 8.998 1.412 -11.848 1.00 0.00 ATOM 1018 OD1 ASN 127 11.162 1.651 -11.390 1.00 0.00 ATOM 1019 O ASN 127 9.560 4.526 -8.077 1.00 0.00 ATOM 1020 C ASN 127 10.625 4.044 -8.461 1.00 0.00 ATOM 1021 N TYR 128 11.764 4.747 -8.549 1.00 0.00 ATOM 1022 CA TYR 128 11.851 6.120 -8.079 1.00 0.00 ATOM 1023 CB TYR 128 12.956 6.232 -7.033 1.00 0.00 ATOM 1024 CG TYR 128 13.121 7.627 -6.469 1.00 0.00 ATOM 1025 CD1 TYR 128 12.026 8.325 -5.957 1.00 0.00 ATOM 1026 CD2 TYR 128 14.368 8.247 -6.445 1.00 0.00 ATOM 1027 CE1 TYR 128 12.168 9.610 -5.439 1.00 0.00 ATOM 1028 CE2 TYR 128 14.523 9.534 -5.926 1.00 0.00 ATOM 1029 CZ TYR 128 13.418 10.208 -5.427 1.00 0.00 ATOM 1030 OH TYR 128 13.556 11.483 -4.924 1.00 0.00 ATOM 1031 O TYR 128 13.249 6.868 -9.879 1.00 0.00 ATOM 1032 C TYR 128 12.265 7.090 -9.181 1.00 0.00 ATOM 1033 N TYR 129 11.500 8.158 -9.340 1.00 0.00 ATOM 1034 CA TYR 129 11.711 9.159 -10.366 1.00 0.00 ATOM 1035 CB TYR 129 10.424 9.347 -11.157 1.00 0.00 ATOM 1036 CG TYR 129 9.968 8.137 -11.928 1.00 0.00 ATOM 1037 CD1 TYR 129 10.193 8.052 -13.297 1.00 0.00 ATOM 1038 CD2 TYR 129 9.241 7.131 -11.306 1.00 0.00 ATOM 1039 CE1 TYR 129 9.700 7.000 -14.041 1.00 0.00 ATOM 1040 CE2 TYR 129 8.740 6.053 -12.038 1.00 0.00 ATOM 1041 CZ TYR 129 8.972 6.001 -13.411 1.00 0.00 ATOM 1042 OH TYR 129 8.436 4.987 -14.188 1.00 0.00 ATOM 1043 O TYR 129 11.156 10.901 -8.821 1.00 0.00 ATOM 1044 C TYR 129 11.931 10.523 -9.697 1.00 0.00 ATOM 1045 N ARG 130 13.000 11.173 -10.044 1.00 0.00 ATOM 1046 CA ARG 130 13.349 12.460 -9.436 1.00 0.00 ATOM 1047 CB ARG 130 13.826 12.755 -8.310 1.00 0.00 ATOM 1048 CG ARG 130 14.705 13.988 -8.344 1.00 0.00 ATOM 1049 CD ARG 130 15.798 13.941 -7.305 1.00 0.00 ATOM 1050 NE ARG 130 15.238 14.233 -6.000 1.00 0.00 ATOM 1051 CZ ARG 130 15.918 14.098 -4.852 1.00 0.00 ATOM 1052 NH1 ARG 130 17.198 13.700 -4.861 1.00 0.00 ATOM 1053 NH2 ARG 130 15.308 14.374 -3.679 1.00 0.00 ATOM 1054 O ARG 130 14.765 13.075 -11.279 1.00 0.00 ATOM 1055 C ARG 130 13.848 13.408 -10.524 1.00 0.00 ATOM 1056 N HIS 131 13.213 14.558 -10.628 1.00 0.00 ATOM 1057 CA HIS 131 13.565 15.571 -11.629 1.00 0.00 ATOM 1058 CB HIS 131 12.247 16.529 -11.695 1.00 0.00 ATOM 1059 CG HIS 131 12.433 17.658 -12.675 1.00 0.00 ATOM 1060 CD2 HIS 131 12.644 17.637 -14.008 1.00 0.00 ATOM 1061 ND1 HIS 131 12.503 18.978 -12.274 1.00 0.00 ATOM 1062 CE1 HIS 131 12.723 19.737 -13.334 1.00 0.00 ATOM 1063 NE2 HIS 131 12.809 18.962 -14.397 1.00 0.00 ATOM 1064 O HIS 131 15.570 16.632 -12.379 1.00 0.00 ATOM 1065 C HIS 131 15.020 16.062 -11.459 1.00 0.00 ATOM 1066 N LEU 132 15.575 15.924 -10.242 1.00 0.00 ATOM 1067 CA LEU 132 16.945 16.459 -10.056 1.00 0.00 ATOM 1068 CB LEU 132 17.340 16.216 -8.568 1.00 0.00 ATOM 1069 CG LEU 132 18.701 16.790 -8.115 1.00 0.00 ATOM 1070 CD1 LEU 132 18.717 18.335 -8.203 1.00 0.00 ATOM 1071 CD2 LEU 132 18.895 16.358 -6.643 1.00 0.00 ATOM 1072 O LEU 132 19.079 16.396 -11.154 1.00 0.00 ATOM 1073 C LEU 132 17.993 15.846 -10.972 1.00 0.00 ATOM 1074 N LYS 133 17.671 14.394 -11.518 1.00 0.00 ATOM 1075 CA LYS 133 18.551 13.633 -12.388 1.00 0.00 ATOM 1076 CB LYS 133 19.451 14.751 -13.134 1.00 0.00 ATOM 1077 CG LYS 133 20.465 14.191 -14.135 1.00 0.00 ATOM 1078 CD LYS 133 21.313 15.297 -14.748 1.00 0.00 ATOM 1079 CE LYS 133 20.503 16.184 -15.681 1.00 0.00 ATOM 1080 NZ LYS 133 19.982 15.402 -16.843 1.00 0.00 ATOM 1081 O LYS 133 19.648 11.502 -12.475 1.00 0.00 ATOM 1082 C LYS 133 18.993 12.304 -11.790 1.00 0.00 ATOM 1083 N ASN 134 18.606 12.084 -10.501 1.00 0.00 ATOM 1084 CA ASN 134 18.977 10.852 -9.802 1.00 0.00 ATOM 1085 CB ASN 134 18.609 10.944 -8.338 1.00 0.00 ATOM 1086 CG ASN 134 19.604 11.725 -7.524 1.00 0.00 ATOM 1087 ND2 ASN 134 19.096 12.505 -6.571 1.00 0.00 ATOM 1088 OD1 ASN 134 20.821 11.673 -7.669 1.00 0.00 ATOM 1089 O ASN 134 18.947 8.587 -10.608 1.00 0.00 ATOM 1090 C ASN 134 18.298 9.599 -10.337 1.00 0.00 ATOM 1091 N ILE 135 17.068 9.747 -10.798 1.00 0.00 ATOM 1092 CA ILE 135 16.309 8.620 -11.328 1.00 0.00 ATOM 1093 CB ILE 135 14.793 9.036 -11.520 1.00 0.00 ATOM 1094 CG1 ILE 135 13.984 7.802 -11.923 1.00 0.00 ATOM 1095 CG2 ILE 135 14.684 10.110 -12.587 1.00 0.00 ATOM 1096 CD1 ILE 135 14.013 6.691 -10.890 1.00 0.00 ATOM 1097 O ILE 135 16.729 6.889 -12.892 1.00 0.00 ATOM 1098 C ILE 135 16.832 8.105 -12.651 1.00 0.00 ATOM 1099 N THR 136 17.281 8.976 -13.470 1.00 0.00 ATOM 1100 CA THR 136 17.720 8.506 -14.786 1.00 0.00 ATOM 1101 CB THR 136 18.090 9.646 -15.721 1.00 0.00 ATOM 1102 CG2 THR 136 18.624 9.094 -17.021 1.00 0.00 ATOM 1103 OG1 THR 136 16.925 10.430 -15.974 1.00 0.00 ATOM 1104 O THR 136 18.894 6.463 -15.231 1.00 0.00 ATOM 1105 C THR 136 18.887 7.536 -14.633 1.00 0.00 ATOM 1106 N PHE 137 19.902 7.935 -13.760 1.00 0.00 ATOM 1107 CA PHE 137 21.044 7.069 -13.491 1.00 0.00 ATOM 1108 CB PHE 137 21.897 7.855 -12.427 1.00 0.00 ATOM 1109 CG PHE 137 23.026 7.044 -11.805 1.00 0.00 ATOM 1110 CD1 PHE 137 24.202 6.754 -12.511 1.00 0.00 ATOM 1111 CD2 PHE 137 22.923 6.556 -10.497 1.00 0.00 ATOM 1112 CE1 PHE 137 25.240 6.012 -11.932 1.00 0.00 ATOM 1113 CE2 PHE 137 23.942 5.806 -9.912 1.00 0.00 ATOM 1114 CZ PHE 137 25.116 5.545 -10.623 1.00 0.00 ATOM 1115 O PHE 137 21.068 4.697 -13.197 1.00 0.00 ATOM 1116 C PHE 137 20.571 5.762 -12.864 1.00 0.00 ATOM 1117 N LYS 138 19.618 5.860 -11.941 1.00 0.00 ATOM 1118 CA LYS 138 19.096 4.671 -11.276 1.00 0.00 ATOM 1119 CB LYS 138 18.167 5.068 -10.105 1.00 0.00 ATOM 1120 CG LYS 138 17.617 3.866 -9.310 1.00 0.00 ATOM 1121 CD LYS 138 16.773 4.317 -8.142 1.00 0.00 ATOM 1122 CE LYS 138 16.262 3.130 -7.338 1.00 0.00 ATOM 1123 NZ LYS 138 15.361 3.562 -6.217 1.00 0.00 ATOM 1124 O LYS 138 18.598 2.512 -12.213 1.00 0.00 ATOM 1125 C LYS 138 18.408 3.729 -12.265 1.00 0.00 ATOM 1126 N ILE 139 17.601 4.286 -13.138 1.00 0.00 ATOM 1127 CA ILE 139 16.903 3.478 -14.125 1.00 0.00 ATOM 1128 CB ILE 139 15.927 4.372 -14.983 1.00 0.00 ATOM 1129 CG1 ILE 139 14.856 5.030 -14.108 1.00 0.00 ATOM 1130 CG2 ILE 139 15.272 3.565 -16.110 1.00 0.00 ATOM 1131 CD1 ILE 139 13.964 5.990 -14.851 1.00 0.00 ATOM 1132 O ILE 139 17.634 1.510 -15.292 1.00 0.00 ATOM 1133 C ILE 139 17.894 2.664 -14.952 1.00 0.00 ATOM 1134 N ASP 140 19.006 3.286 -15.324 1.00 0.00 ATOM 1135 CA ASP 140 20.035 2.604 -16.097 1.00 0.00 ATOM 1136 CB ASP 140 21.179 3.511 -16.495 1.00 0.00 ATOM 1137 CG ASP 140 20.744 4.600 -17.455 1.00 0.00 ATOM 1138 OD1 ASP 140 19.609 4.516 -17.981 1.00 0.00 ATOM 1139 OD2 ASP 140 21.547 5.530 -17.683 1.00 0.00 ATOM 1140 O ASP 140 20.757 0.326 -15.833 1.00 0.00 ATOM 1141 C ASP 140 20.558 1.416 -15.292 1.00 0.00 ATOM 1142 N GLU 141 20.786 1.619 -13.997 1.00 0.00 ATOM 1143 CA GLU 141 21.291 0.549 -13.137 1.00 0.00 ATOM 1144 CB GLU 141 21.629 1.116 -11.797 1.00 0.00 ATOM 1145 CG GLU 141 22.270 0.106 -10.862 1.00 0.00 ATOM 1146 CD GLU 141 23.765 -0.005 -11.072 1.00 0.00 ATOM 1147 OE1 GLU 141 24.389 0.900 -11.677 1.00 0.00 ATOM 1148 OE2 GLU 141 24.306 -1.015 -10.602 1.00 0.00 ATOM 1149 O GLU 141 20.580 -1.723 -13.041 1.00 0.00 ATOM 1150 C GLU 141 20.242 -0.535 -12.968 1.00 0.00 ATOM 1151 N ILE 142 18.978 -0.145 -12.787 1.00 0.00 ATOM 1152 CA ILE 142 17.913 -1.150 -12.614 1.00 0.00 ATOM 1153 CB ILE 142 16.614 -0.453 -12.145 1.00 0.00 ATOM 1154 CG1 ILE 142 16.759 0.165 -10.757 1.00 0.00 ATOM 1155 CG2 ILE 142 15.438 -1.430 -12.230 1.00 0.00 ATOM 1156 CD1 ILE 142 15.631 1.079 -10.323 1.00 0.00 ATOM 1157 O ILE 142 17.562 -3.173 -13.878 1.00 0.00 ATOM 1158 C ILE 142 17.716 -1.958 -13.905 1.00 0.00 ATOM 1159 N TYR 143 17.760 -1.279 -15.055 1.00 0.00 ATOM 1160 CA TYR 143 17.619 -1.981 -16.322 1.00 0.00 ATOM 1161 CB TYR 143 17.707 -1.053 -17.487 1.00 0.00 ATOM 1162 CG TYR 143 17.454 -1.727 -18.815 1.00 0.00 ATOM 1163 CD1 TYR 143 18.440 -2.498 -19.429 1.00 0.00 ATOM 1164 CD2 TYR 143 16.211 -1.627 -19.433 1.00 0.00 ATOM 1165 CE1 TYR 143 18.190 -3.157 -20.636 1.00 0.00 ATOM 1166 CE2 TYR 143 15.950 -2.278 -20.633 1.00 0.00 ATOM 1167 CZ TYR 143 16.942 -3.041 -21.228 1.00 0.00 ATOM 1168 OH TYR 143 16.665 -3.697 -22.401 1.00 0.00 ATOM 1169 O TYR 143 18.397 -4.222 -16.736 1.00 0.00 ATOM 1170 C TYR 143 18.694 -3.058 -16.460 1.00 0.00 ATOM 1171 N ASN 144 19.944 -2.638 -16.240 1.00 0.00 ATOM 1172 CA ASN 144 21.059 -3.569 -16.323 1.00 0.00 ATOM 1173 CB ASN 144 22.386 -2.790 -16.170 1.00 0.00 ATOM 1174 CG ASN 144 23.617 -3.665 -16.354 1.00 0.00 ATOM 1175 ND2 ASN 144 24.390 -3.858 -15.288 1.00 0.00 ATOM 1176 OD1 ASN 144 23.865 -4.161 -17.449 1.00 0.00 ATOM 1177 O ASN 144 21.384 -5.778 -15.419 1.00 0.00 ATOM 1178 C ASN 144 20.939 -4.640 -15.238 1.00 0.00 ATOM 1179 N TYR 145 20.406 -4.312 -14.124 1.00 0.00 ATOM 1180 CA TYR 145 20.223 -5.182 -12.962 1.00 0.00 ATOM 1181 CB TYR 145 19.460 -4.449 -11.858 1.00 0.00 ATOM 1182 CG TYR 145 19.275 -5.263 -10.597 1.00 0.00 ATOM 1183 CD1 TYR 145 20.328 -5.452 -9.712 1.00 0.00 ATOM 1184 CD2 TYR 145 18.047 -5.839 -10.297 1.00 0.00 ATOM 1185 CE1 TYR 145 20.167 -6.195 -8.556 1.00 0.00 ATOM 1186 CE2 TYR 145 17.869 -6.587 -9.147 1.00 0.00 ATOM 1187 CZ TYR 145 18.941 -6.760 -8.275 1.00 0.00 ATOM 1188 OH TYR 145 18.780 -7.500 -7.127 1.00 0.00 ATOM 1189 O TYR 145 18.371 -6.356 -13.927 1.00 0.00 ATOM 1190 C TYR 145 19.427 -6.442 -13.313 1.00 0.00 TER END