PFRMAT TS TARGET T0517 AUTHOR SAM-T06-server METHOD The SAM-T06 server uses methods similar to SAM_T04 in CASP6 and METHOD the SAM-T02 method in CASP5. METHOD METHOD We start with a fully automated method: METHOD METHOD Use the SAM-T2K and SAM-T04 methods for finding homologs of the METHOD target and aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignments. Different neural nets are used for the METHOD SAM-T2K alignments and the SAM-T04 alignments. METHOD We currently use 8 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 METHOD We make 2-track HMMs with each alphabet (1.0 amino acid + 0.3 local structure) METHOD and use them to score a template library of 6400 (t04) or 9900 (t2k) templates METHOD We also used a single-track HMM to score not just the template METHOD library, but a non-redundant copy of the entire PDB. METHOD METHOD We also made a few 3-track HMMs (AA, str2, CB_burial_14_7 and METHOD AA, str2, near-backbone-11) for finding and aligning more remote METHOD homologs. METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence (for early targets, only METHOD t2k template library was searched this way). METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we did not have time to METHOD optimize them), and the best templates ranked. Ranking was METHOD separate for predictions from the t2k and t04 multiple alignments. 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. METHOD METHOD Then the "undertaker" program (named because it optimizes burial) METHOD is used to try to combine the alignments and the fragments into METHOD a consistent 3D model. No single alignment or parent template METHOD was used, though in many cases one had much more influence than METHOD the others. The alignment scores were not passed to undertaker, METHOD but were used only to pick the set of alignments and fragments METHOD that undertaker would see. Helix and strand constraints METHOD generated from the secondary-structure predictions are passed to METHOD undertaker to use in the cost function. 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. REMARK 6 REMARK 6 T0517 model 2 Tue May 4 18:13:51 2010 MODEL 2 PARENT N/A ATOM 2 N LYS 4 15.022 7.123 16.375 1.00 0.00 ATOM 3 CA LYS 4 14.364 5.835 16.471 1.00 0.00 ATOM 4 CB LYS 4 13.065 5.954 17.267 1.00 0.00 ATOM 5 CG LYS 4 13.259 6.390 18.711 1.00 0.00 ATOM 6 CD LYS 4 11.980 6.224 19.516 1.00 0.00 ATOM 7 CE LYS 4 12.240 6.382 21.004 1.00 0.00 ATOM 8 NZ LYS 4 13.054 7.592 21.303 1.00 0.00 ATOM 9 O LYS 4 13.787 6.027 14.153 1.00 0.00 ATOM 10 C LYS 4 14.092 5.284 15.078 1.00 0.00 ATOM 11 N LYS 5 14.142 3.973 14.945 1.00 0.00 ATOM 12 CA LYS 5 13.978 3.354 13.636 1.00 0.00 ATOM 13 CB LYS 5 15.340 2.992 13.041 1.00 0.00 ATOM 14 CG LYS 5 15.263 2.341 11.669 1.00 0.00 ATOM 15 CD LYS 5 16.629 2.299 11.001 1.00 0.00 ATOM 16 CE LYS 5 17.599 1.427 11.781 1.00 0.00 ATOM 17 NZ LYS 5 18.850 1.166 11.016 1.00 0.00 ATOM 18 O LYS 5 13.214 1.352 14.640 1.00 0.00 ATOM 19 C LYS 5 13.119 2.138 13.699 1.00 0.00 ATOM 20 N MET 6 12.273 1.999 12.691 1.00 0.00 ATOM 21 CA MET 6 11.421 0.850 12.494 1.00 0.00 ATOM 22 CB MET 6 9.957 1.220 12.742 1.00 0.00 ATOM 23 CG MET 6 8.988 0.060 12.580 1.00 0.00 ATOM 24 SD MET 6 9.227 -1.224 13.822 1.00 0.00 ATOM 25 CE MET 6 8.524 -0.434 15.266 1.00 0.00 ATOM 26 O MET 6 11.552 1.061 10.102 1.00 0.00 ATOM 27 C MET 6 11.628 0.319 11.068 1.00 0.00 ATOM 28 N ASN 7 11.881 -0.981 10.956 1.00 0.00 ATOM 29 CA ASN 7 12.035 -1.621 9.669 1.00 0.00 ATOM 30 CB ASN 7 13.484 -2.063 9.460 1.00 0.00 ATOM 31 CG ASN 7 14.448 -0.894 9.398 1.00 0.00 ATOM 32 ND2 ASN 7 14.978 -0.630 8.210 1.00 0.00 ATOM 33 OD1 ASN 7 14.710 -0.239 10.406 1.00 0.00 ATOM 34 O ASN 7 10.915 -3.555 10.536 1.00 0.00 ATOM 35 C ASN 7 11.069 -2.781 9.593 1.00 0.00 ATOM 36 N LEU 8 10.406 -2.909 8.459 1.00 0.00 ATOM 37 CA LEU 8 9.407 -3.966 8.296 1.00 0.00 ATOM 38 CB LEU 8 7.994 -3.383 8.359 1.00 0.00 ATOM 39 CG LEU 8 6.844 -4.365 8.138 1.00 0.00 ATOM 40 CD1 LEU 8 6.788 -5.391 9.259 1.00 0.00 ATOM 41 CD2 LEU 8 5.518 -3.626 8.029 1.00 0.00 ATOM 42 O LEU 8 9.747 -4.069 5.951 1.00 0.00 ATOM 43 C LEU 8 9.603 -4.701 7.002 1.00 0.00 ATOM 44 N LEU 9 9.627 -6.038 7.095 1.00 0.00 ATOM 45 CA LEU 9 9.656 -6.909 5.923 1.00 0.00 ATOM 46 CB LEU 9 10.488 -8.161 6.208 1.00 0.00 ATOM 47 CG LEU 9 10.598 -9.176 5.068 1.00 0.00 ATOM 48 CD1 LEU 9 11.312 -8.566 3.872 1.00 0.00 ATOM 49 CD2 LEU 9 11.322 -10.431 5.532 1.00 0.00 ATOM 50 O LEU 9 7.480 -7.840 6.448 1.00 0.00 ATOM 51 C LEU 9 8.193 -7.194 5.648 1.00 0.00 ATOM 52 N LEU 10 7.717 -6.634 4.549 1.00 0.00 ATOM 53 CA LEU 10 6.303 -6.777 4.158 1.00 0.00 ATOM 54 CB LEU 10 5.796 -5.491 3.501 1.00 0.00 ATOM 55 CG LEU 10 4.334 -5.492 3.049 1.00 0.00 ATOM 56 CD1 LEU 10 3.403 -5.657 4.238 1.00 0.00 ATOM 57 CD2 LEU 10 4.005 -4.214 2.292 1.00 0.00 ATOM 58 O LEU 10 6.407 -7.835 2.018 1.00 0.00 ATOM 59 C LEU 10 6.236 -7.954 3.240 1.00 0.00 ATOM 60 N PHE 11 6.041 -9.120 3.853 1.00 0.00 ATOM 61 CA PHE 11 5.941 -10.388 3.115 1.00 0.00 ATOM 62 CB PHE 11 6.422 -11.552 3.983 1.00 0.00 ATOM 63 CG PHE 11 6.140 -12.905 3.394 1.00 0.00 ATOM 64 CD1 PHE 11 7.036 -13.496 2.521 1.00 0.00 ATOM 65 CD2 PHE 11 4.978 -13.585 3.713 1.00 0.00 ATOM 66 CE1 PHE 11 6.776 -14.742 1.978 1.00 0.00 ATOM 67 CE2 PHE 11 4.717 -14.829 3.171 1.00 0.00 ATOM 68 CZ PHE 11 5.610 -15.407 2.308 1.00 0.00 ATOM 69 O PHE 11 4.328 -11.236 1.504 1.00 0.00 ATOM 70 C PHE 11 4.537 -10.680 2.632 1.00 0.00 ATOM 71 N SER 12 3.572 -10.369 3.501 1.00 0.00 ATOM 72 CA SER 12 2.150 -10.670 3.215 1.00 0.00 ATOM 73 CB SER 12 1.327 -10.650 4.506 1.00 0.00 ATOM 74 OG SER 12 1.864 -11.544 5.466 1.00 0.00 ATOM 75 O SER 12 1.988 -8.586 2.022 1.00 0.00 ATOM 76 C SER 12 1.522 -9.710 2.216 1.00 0.00 ATOM 77 N GLY 13 0.465 -10.184 1.552 1.00 0.00 ATOM 78 CA GLY 13 -0.219 -9.392 0.551 1.00 0.00 ATOM 79 O GLY 13 -2.380 -8.751 -0.118 1.00 0.00 ATOM 80 C GLY 13 -1.728 -9.278 0.743 1.00 0.00 ATOM 81 N ASP 14 -2.265 -9.743 1.863 1.00 0.00 ATOM 82 CA ASP 14 -3.693 -9.638 2.128 1.00 0.00 ATOM 83 CB ASP 14 -4.153 -10.777 3.041 1.00 0.00 ATOM 84 CG ASP 14 -4.100 -12.129 2.359 1.00 0.00 ATOM 85 OD1 ASP 14 -4.040 -12.163 1.112 1.00 0.00 ATOM 86 OD2 ASP 14 -4.118 -13.155 3.072 1.00 0.00 ATOM 87 O ASP 14 -3.100 -7.689 3.388 1.00 0.00 ATOM 88 C ASP 14 -3.956 -8.270 2.751 1.00 0.00 ATOM 89 N TYR 15 -5.165 -7.764 2.566 1.00 0.00 ATOM 90 CA TYR 15 -5.508 -6.430 3.029 1.00 0.00 ATOM 91 CB TYR 15 -6.924 -6.056 2.588 1.00 0.00 ATOM 92 CG TYR 15 -7.359 -4.676 3.026 1.00 0.00 ATOM 93 CD1 TYR 15 -6.923 -3.545 2.347 1.00 0.00 ATOM 94 CD2 TYR 15 -8.203 -4.510 4.117 1.00 0.00 ATOM 95 CE1 TYR 15 -7.315 -2.279 2.742 1.00 0.00 ATOM 96 CE2 TYR 15 -8.606 -3.251 4.524 1.00 0.00 ATOM 97 CZ TYR 15 -8.154 -2.133 3.826 1.00 0.00 ATOM 98 OH TYR 15 -8.545 -0.874 4.220 1.00 0.00 ATOM 99 O TYR 15 -4.979 -5.241 5.010 1.00 0.00 ATOM 100 C TYR 15 -5.401 -6.288 4.540 1.00 0.00 ATOM 101 N ASP 16 -5.748 -7.334 5.282 1.00 0.00 ATOM 102 CA ASP 16 -5.697 -7.267 6.740 1.00 0.00 ATOM 103 CB ASP 16 -6.383 -8.488 7.356 1.00 0.00 ATOM 104 CG ASP 16 -5.829 -9.796 6.828 1.00 0.00 ATOM 105 OD1 ASP 16 -5.945 -10.041 5.607 1.00 0.00 ATOM 106 OD2 ASP 16 -5.277 -10.578 7.631 1.00 0.00 ATOM 107 O ASP 16 -4.085 -6.716 8.373 1.00 0.00 ATOM 108 C ASP 16 -4.283 -7.169 7.259 1.00 0.00 ATOM 109 N LYS 17 -3.292 -7.563 6.466 1.00 0.00 ATOM 110 CA LYS 17 -1.901 -7.397 6.879 1.00 0.00 ATOM 111 CB LYS 17 -1.065 -8.604 6.445 1.00 0.00 ATOM 112 CG LYS 17 -1.434 -9.899 7.150 1.00 0.00 ATOM 113 CD LYS 17 -0.208 -10.764 7.391 1.00 0.00 ATOM 114 CE LYS 17 -0.587 -12.100 8.009 1.00 0.00 ATOM 115 NZ LYS 17 0.586 -13.010 8.129 1.00 0.00 ATOM 116 O LYS 17 -0.428 -5.498 6.929 1.00 0.00 ATOM 117 C LYS 17 -1.287 -6.116 6.313 1.00 0.00 ATOM 118 N ALA 18 -1.763 -5.678 5.165 1.00 0.00 ATOM 119 CA ALA 18 -1.252 -4.453 4.581 1.00 0.00 ATOM 120 CB ALA 18 -1.693 -4.333 3.129 1.00 0.00 ATOM 121 O ALA 18 -0.996 -2.271 5.481 1.00 0.00 ATOM 122 C ALA 18 -1.726 -3.248 5.387 1.00 0.00 ATOM 123 N LEU 19 -2.933 -3.293 5.967 1.00 0.00 ATOM 124 CA LEU 19 -3.412 -2.169 6.797 1.00 0.00 ATOM 125 CB LEU 19 -4.815 -2.457 7.335 1.00 0.00 ATOM 126 CG LEU 19 -5.423 -1.394 8.252 1.00 0.00 ATOM 127 CD1 LEU 19 -5.573 -0.071 7.514 1.00 0.00 ATOM 128 CD2 LEU 19 -6.768 -1.855 8.793 1.00 0.00 ATOM 129 O LEU 19 -2.135 -0.692 8.151 1.00 0.00 ATOM 130 C LEU 19 -2.490 -1.844 7.975 1.00 0.00 ATOM 131 N ALA 20 -2.146 -2.840 8.809 1.00 0.00 ATOM 132 CA ALA 20 -1.155 -2.657 9.869 1.00 0.00 ATOM 133 CB ALA 20 -0.844 -3.986 10.539 1.00 0.00 ATOM 134 O ALA 20 0.759 -1.212 10.037 1.00 0.00 ATOM 135 C ALA 20 0.140 -2.031 9.346 1.00 0.00 ATOM 136 N SER 21 0.619 -2.469 8.181 1.00 0.00 ATOM 137 CA SER 21 1.843 -1.875 7.584 1.00 0.00 ATOM 138 CB SER 21 2.166 -2.546 6.247 1.00 0.00 ATOM 139 OG SER 21 2.520 -3.906 6.431 1.00 0.00 ATOM 140 O SER 21 2.453 0.410 7.823 1.00 0.00 ATOM 141 C SER 21 1.633 -0.375 7.411 1.00 0.00 ATOM 142 N LEU 22 0.491 0.009 6.845 1.00 0.00 ATOM 143 CA LEU 22 0.168 1.425 6.679 1.00 0.00 ATOM 144 CB LEU 22 -1.147 1.588 5.912 1.00 0.00 ATOM 145 CG LEU 22 -1.508 3.011 5.482 1.00 0.00 ATOM 146 CD1 LEU 22 -2.554 2.989 4.377 1.00 0.00 ATOM 147 CD2 LEU 22 -2.010 3.821 6.667 1.00 0.00 ATOM 148 O LEU 22 0.561 3.320 8.120 1.00 0.00 ATOM 149 C LEU 22 0.062 2.200 8.000 1.00 0.00 ATOM 150 N ILE 23 -0.586 1.590 8.984 1.00 0.00 ATOM 151 CA ILE 23 -0.827 2.226 10.272 1.00 0.00 ATOM 152 CB ILE 23 -1.882 1.461 11.091 1.00 0.00 ATOM 153 CG1 ILE 23 -3.250 1.546 10.410 1.00 0.00 ATOM 154 CG2 ILE 23 -1.928 1.981 12.519 1.00 0.00 ATOM 155 CD1 ILE 23 -4.250 0.530 10.919 1.00 0.00 ATOM 156 O ILE 23 0.761 3.351 11.660 1.00 0.00 ATOM 157 C ILE 23 0.481 2.333 11.055 1.00 0.00 ATOM 158 N ILE 24 1.280 1.286 11.048 1.00 0.00 ATOM 159 CA ILE 24 2.586 1.353 11.711 1.00 0.00 ATOM 160 CB ILE 24 3.306 -0.007 11.681 1.00 0.00 ATOM 161 CG1 ILE 24 2.567 -1.022 12.555 1.00 0.00 ATOM 162 CG2 ILE 24 4.760 0.149 12.099 1.00 0.00 ATOM 163 CD1 ILE 24 3.024 -2.449 12.353 1.00 0.00 ATOM 164 O ILE 24 4.112 3.188 11.747 1.00 0.00 ATOM 165 C ILE 24 3.452 2.420 11.069 1.00 0.00 ATOM 166 N ALA 25 3.495 2.424 9.737 1.00 0.00 ATOM 167 CA ALA 25 4.346 3.371 9.036 1.00 0.00 ATOM 168 CB ALA 25 4.295 3.120 7.536 1.00 0.00 ATOM 169 O ALA 25 4.774 5.633 9.634 1.00 0.00 ATOM 170 C ALA 25 3.945 4.795 9.336 1.00 0.00 ATOM 171 N ASN 26 2.638 5.044 9.264 1.00 0.00 ATOM 172 CA ASN 26 2.068 6.368 9.448 1.00 0.00 ATOM 173 CB ASN 26 0.576 6.360 9.114 1.00 0.00 ATOM 174 CG ASN 26 -0.048 7.741 9.192 1.00 0.00 ATOM 175 ND2 ASN 26 -1.005 7.906 10.097 1.00 0.00 ATOM 176 OD1 ASN 26 0.331 8.645 8.447 1.00 0.00 ATOM 177 O ASN 26 2.740 7.993 11.079 1.00 0.00 ATOM 178 C ASN 26 2.297 6.865 10.862 1.00 0.00 ATOM 179 N ALA 27 2.006 5.997 11.823 1.00 0.00 ATOM 180 CA ALA 27 2.171 6.334 13.247 1.00 0.00 ATOM 181 CB ALA 27 1.569 5.245 14.121 1.00 0.00 ATOM 182 O ALA 27 3.942 7.495 14.272 1.00 0.00 ATOM 183 C ALA 27 3.620 6.541 13.625 1.00 0.00 ATOM 184 N ALA 28 4.504 5.655 13.181 1.00 0.00 ATOM 185 CA ALA 28 5.928 5.793 13.489 1.00 0.00 ATOM 186 CB ALA 28 6.694 4.568 13.013 1.00 0.00 ATOM 187 O ALA 28 7.258 7.790 13.537 1.00 0.00 ATOM 188 C ALA 28 6.521 7.052 12.860 1.00 0.00 ATOM 189 N ARG 29 6.218 7.295 11.583 1.00 0.00 ATOM 190 CA ARG 29 6.733 8.476 10.889 1.00 0.00 ATOM 191 CB ARG 29 6.278 8.481 9.429 1.00 0.00 ATOM 192 CG ARG 29 6.955 7.429 8.564 1.00 0.00 ATOM 193 CD ARG 29 6.694 7.678 7.088 1.00 0.00 ATOM 194 NE ARG 29 5.276 7.575 6.756 1.00 0.00 ATOM 195 CZ ARG 29 4.666 6.442 6.423 1.00 0.00 ATOM 196 NH1 ARG 29 3.371 6.444 6.137 1.00 0.00 ATOM 197 NH2 ARG 29 5.352 5.309 6.376 1.00 0.00 ATOM 198 O ARG 29 7.063 10.653 11.814 1.00 0.00 ATOM 199 C ARG 29 6.269 9.744 11.603 1.00 0.00 ATOM 200 N GLU 30 4.993 9.789 12.001 1.00 0.00 ATOM 201 CA GLU 30 4.466 10.969 12.693 1.00 0.00 ATOM 202 CB GLU 30 2.951 10.850 12.877 1.00 0.00 ATOM 203 CG GLU 30 2.159 10.960 11.584 1.00 0.00 ATOM 204 CD GLU 30 0.667 10.791 11.799 1.00 0.00 ATOM 205 OE1 GLU 30 0.278 10.222 12.840 1.00 0.00 ATOM 206 OE2 GLU 30 -0.111 11.229 10.926 1.00 0.00 ATOM 207 O GLU 30 5.226 12.280 14.553 1.00 0.00 ATOM 208 C GLU 30 5.137 11.177 14.058 1.00 0.00 ATOM 209 N MET 31 5.615 10.094 14.640 1.00 0.00 ATOM 210 CA MET 31 6.315 10.129 15.909 1.00 0.00 ATOM 211 CB MET 31 6.147 8.801 16.652 1.00 0.00 ATOM 212 CG MET 31 4.708 8.472 17.016 1.00 0.00 ATOM 213 SD MET 31 3.946 9.734 18.053 1.00 0.00 ATOM 214 CE MET 31 4.837 9.493 19.589 1.00 0.00 ATOM 215 O MET 31 8.534 10.457 16.793 1.00 0.00 ATOM 216 C MET 31 7.825 10.433 15.783 1.00 0.00 ATOM 217 N GLU 32 8.318 10.652 14.564 1.00 0.00 ATOM 218 CA GLU 32 9.723 10.947 14.380 1.00 0.00 ATOM 219 CB GLU 32 10.287 11.657 15.613 1.00 0.00 ATOM 220 CG GLU 32 9.532 12.917 16.002 1.00 0.00 ATOM 221 CD GLU 32 9.649 14.013 14.961 1.00 0.00 ATOM 222 OE1 GLU 32 10.535 13.909 14.087 1.00 0.00 ATOM 223 OE2 GLU 32 8.855 14.975 15.019 1.00 0.00 ATOM 224 O GLU 32 11.847 9.917 14.070 1.00 0.00 ATOM 225 C GLU 32 10.630 9.767 14.090 1.00 0.00 ATOM 226 N ILE 33 10.069 8.593 13.858 1.00 0.00 ATOM 227 CA ILE 33 10.878 7.429 13.484 1.00 0.00 ATOM 228 CB ILE 33 10.126 6.113 13.748 1.00 0.00 ATOM 229 CG1 ILE 33 9.845 5.948 15.242 1.00 0.00 ATOM 230 CG2 ILE 33 10.904 4.933 13.186 1.00 0.00 ATOM 231 CD1 ILE 33 8.895 4.814 15.565 1.00 0.00 ATOM 232 O ILE 33 10.595 7.959 11.188 1.00 0.00 ATOM 233 C ILE 33 11.323 7.457 12.031 1.00 0.00 ATOM 234 N GLU 34 12.472 6.850 11.746 1.00 0.00 ATOM 235 CA GLU 34 12.917 6.577 10.400 1.00 0.00 ATOM 236 CB GLU 34 14.445 6.560 10.334 1.00 0.00 ATOM 237 CG GLU 34 15.004 5.967 9.050 1.00 0.00 ATOM 238 CD GLU 34 16.486 5.663 9.147 1.00 0.00 ATOM 239 OE1 GLU 34 17.188 6.365 9.904 1.00 0.00 ATOM 240 OE2 GLU 34 16.945 4.724 8.463 1.00 0.00 ATOM 241 O GLU 34 12.260 4.321 10.991 1.00 0.00 ATOM 242 C GLU 34 12.228 5.226 10.137 1.00 0.00 ATOM 243 N VAL 35 11.545 5.075 9.002 1.00 0.00 ATOM 244 CA VAL 35 10.871 3.836 8.701 1.00 0.00 ATOM 245 CB VAL 35 9.344 4.020 8.649 1.00 0.00 ATOM 246 CG1 VAL 35 8.655 2.693 8.371 1.00 0.00 ATOM 247 CG2 VAL 35 8.836 4.627 9.947 1.00 0.00 ATOM 248 O VAL 35 11.466 4.009 6.395 1.00 0.00 ATOM 249 C VAL 35 11.393 3.285 7.381 1.00 0.00 ATOM 250 N THR 36 11.740 1.997 7.387 1.00 0.00 ATOM 251 CA THR 36 12.206 1.315 6.203 1.00 0.00 ATOM 252 CB THR 36 13.647 0.801 6.377 1.00 0.00 ATOM 253 CG2 THR 36 14.113 0.085 5.120 1.00 0.00 ATOM 254 OG1 THR 36 14.524 1.906 6.627 1.00 0.00 ATOM 255 O THR 36 10.990 -0.632 6.796 1.00 0.00 ATOM 256 C THR 36 11.248 0.180 5.926 1.00 0.00 ATOM 257 N ILE 37 10.720 0.130 4.710 1.00 0.00 ATOM 258 CA ILE 37 9.839 -0.971 4.317 1.00 0.00 ATOM 259 CB ILE 37 8.459 -0.458 3.866 1.00 0.00 ATOM 260 CG1 ILE 37 7.818 0.386 4.970 1.00 0.00 ATOM 261 CG2 ILE 37 7.568 -1.617 3.450 1.00 0.00 ATOM 262 CD1 ILE 37 7.588 -0.369 6.260 1.00 0.00 ATOM 263 O ILE 37 11.015 -1.197 2.249 1.00 0.00 ATOM 264 C ILE 37 10.508 -1.764 3.220 1.00 0.00 ATOM 265 N PHE 38 10.491 -3.080 3.378 1.00 0.00 ATOM 266 CA PHE 38 11.047 -3.990 2.383 1.00 0.00 ATOM 267 CB PHE 38 12.225 -4.770 2.970 1.00 0.00 ATOM 268 CG PHE 38 12.916 -5.662 1.978 1.00 0.00 ATOM 269 CD1 PHE 38 13.623 -5.124 0.918 1.00 0.00 ATOM 270 CD2 PHE 38 12.859 -7.039 2.106 1.00 0.00 ATOM 271 CE1 PHE 38 14.259 -5.945 0.004 1.00 0.00 ATOM 272 CE2 PHE 38 13.495 -7.859 1.194 1.00 0.00 ATOM 273 CZ PHE 38 14.193 -7.317 0.147 1.00 0.00 ATOM 274 O PHE 38 9.516 -5.838 2.622 1.00 0.00 ATOM 275 C PHE 38 9.955 -4.934 1.895 1.00 0.00 ATOM 276 N CYS 39 9.499 -4.723 0.656 1.00 0.00 ATOM 277 CA CYS 39 8.434 -5.533 0.100 1.00 0.00 ATOM 278 CB CYS 39 7.579 -4.706 -0.862 1.00 0.00 ATOM 279 SG CYS 39 6.705 -3.325 -0.087 1.00 0.00 ATOM 280 O CYS 39 9.786 -6.608 -1.523 1.00 0.00 ATOM 281 C CYS 39 8.992 -6.735 -0.603 1.00 0.00 ATOM 282 N ALA 40 8.543 -7.904 -0.178 1.00 0.00 ATOM 283 CA ALA 40 9.041 -9.154 -0.691 1.00 0.00 ATOM 284 CB ALA 40 10.090 -9.733 0.246 1.00 0.00 ATOM 285 O ALA 40 6.805 -9.943 -0.325 1.00 0.00 ATOM 286 C ALA 40 7.881 -10.126 -0.879 1.00 0.00 ATOM 287 N PHE 41 8.085 -11.131 -1.699 1.00 0.00 ATOM 288 CA PHE 41 7.038 -12.107 -1.989 1.00 0.00 ATOM 289 CB PHE 41 6.889 -13.095 -0.830 1.00 0.00 ATOM 290 CG PHE 41 7.948 -14.160 -0.801 1.00 0.00 ATOM 291 CD1 PHE 41 9.188 -13.909 -0.239 1.00 0.00 ATOM 292 CD2 PHE 41 7.703 -15.414 -1.336 1.00 0.00 ATOM 293 CE1 PHE 41 10.161 -14.889 -0.212 1.00 0.00 ATOM 294 CE2 PHE 41 8.677 -16.393 -1.309 1.00 0.00 ATOM 295 CZ PHE 41 9.903 -16.136 -0.750 1.00 0.00 ATOM 296 O PHE 41 5.569 -10.696 -3.200 1.00 0.00 ATOM 297 C PHE 41 5.694 -11.475 -2.270 1.00 0.00 ATOM 298 N TRP 42 4.699 -11.781 -1.463 1.00 0.00 ATOM 299 CA TRP 42 3.334 -11.330 -1.733 1.00 0.00 ATOM 300 CB TRP 42 2.343 -12.037 -0.807 1.00 0.00 ATOM 301 CG TRP 42 2.553 -13.518 -0.722 1.00 0.00 ATOM 302 CD1 TRP 42 2.802 -14.247 0.405 1.00 0.00 ATOM 303 CD2 TRP 42 2.533 -14.452 -1.808 1.00 0.00 ATOM 304 CE2 TRP 42 2.777 -15.726 -1.266 1.00 0.00 ATOM 305 CE3 TRP 42 2.333 -14.333 -3.186 1.00 0.00 ATOM 306 NE1 TRP 42 2.938 -15.576 0.090 1.00 0.00 ATOM 307 CZ2 TRP 42 2.826 -16.877 -2.053 1.00 0.00 ATOM 308 CZ3 TRP 42 2.383 -15.476 -3.963 1.00 0.00 ATOM 309 CH2 TRP 42 2.627 -16.732 -3.397 1.00 0.00 ATOM 310 O TRP 42 2.347 -9.203 -2.250 1.00 0.00 ATOM 311 C TRP 42 3.177 -9.833 -1.584 1.00 0.00 ATOM 312 N GLY 43 3.988 -9.270 -0.705 1.00 0.00 ATOM 313 CA GLY 43 3.969 -7.844 -0.466 1.00 0.00 ATOM 314 O GLY 43 4.096 -6.013 -1.967 1.00 0.00 ATOM 315 C GLY 43 4.508 -7.116 -1.669 1.00 0.00 ATOM 316 N LEU 44 5.447 -7.721 -2.373 1.00 0.00 ATOM 317 CA LEU 44 6.001 -7.078 -3.551 1.00 0.00 ATOM 318 CB LEU 44 7.261 -7.810 -4.018 1.00 0.00 ATOM 319 CG LEU 44 8.015 -7.179 -5.191 1.00 0.00 ATOM 320 CD1 LEU 44 8.382 -5.735 -4.878 1.00 0.00 ATOM 321 CD2 LEU 44 9.265 -7.982 -5.521 1.00 0.00 ATOM 322 O LEU 44 4.792 -6.087 -5.378 1.00 0.00 ATOM 323 C LEU 44 4.942 -7.052 -4.638 1.00 0.00 ATOM 324 N LEU 45 4.180 -8.118 -4.723 1.00 0.00 ATOM 325 CA LEU 45 3.074 -8.205 -5.687 1.00 0.00 ATOM 326 CB LEU 45 2.353 -9.548 -5.556 1.00 0.00 ATOM 327 CG LEU 45 1.184 -9.787 -6.514 1.00 0.00 ATOM 328 CD1 LEU 45 1.655 -9.737 -7.959 1.00 0.00 ATOM 329 CD2 LEU 45 0.513 -11.120 -6.222 1.00 0.00 ATOM 330 O LEU 45 1.607 -6.416 -6.392 1.00 0.00 ATOM 331 C LEU 45 2.103 -7.041 -5.467 1.00 0.00 ATOM 332 N LEU 46 1.849 -6.761 -4.196 1.00 0.00 ATOM 333 CA LEU 46 0.933 -5.721 -3.764 1.00 0.00 ATOM 334 CB LEU 46 0.735 -5.777 -2.248 1.00 0.00 ATOM 335 CG LEU 46 -0.252 -4.768 -1.656 1.00 0.00 ATOM 336 CD1 LEU 46 -1.642 -4.967 -2.242 1.00 0.00 ATOM 337 CD2 LEU 46 -0.296 -4.885 -0.140 1.00 0.00 ATOM 338 O LEU 46 0.539 -3.393 -4.165 1.00 0.00 ATOM 339 C LEU 46 1.365 -4.291 -4.142 1.00 0.00 ATOM 340 N LEU 47 2.647 -4.064 -4.410 1.00 0.00 ATOM 341 CA LEU 47 3.099 -2.736 -4.813 1.00 0.00 ATOM 342 CB LEU 47 4.351 -2.335 -4.027 1.00 0.00 ATOM 343 CG LEU 47 4.192 -2.224 -2.510 1.00 0.00 ATOM 344 CD1 LEU 47 5.525 -1.903 -1.853 1.00 0.00 ATOM 345 CD2 LEU 47 3.158 -1.166 -2.155 1.00 0.00 ATOM 346 O LEU 47 4.040 -1.691 -6.771 1.00 0.00 ATOM 347 C LEU 47 3.397 -2.637 -6.318 1.00 0.00 ATOM 348 N ARG 48 2.951 -3.620 -7.094 1.00 0.00 ATOM 349 CA ARG 48 3.070 -3.517 -8.549 1.00 0.00 ATOM 350 CB ARG 48 3.004 -4.904 -9.192 1.00 0.00 ATOM 351 CG ARG 48 3.239 -4.902 -10.694 1.00 0.00 ATOM 352 CD ARG 48 3.272 -6.317 -11.249 1.00 0.00 ATOM 353 NE ARG 48 3.519 -6.335 -12.689 1.00 0.00 ATOM 354 CZ ARG 48 3.564 -7.440 -13.426 1.00 0.00 ATOM 355 NH1 ARG 48 3.795 -7.359 -14.728 1.00 0.00 ATOM 356 NH2 ARG 48 3.378 -8.624 -12.858 1.00 0.00 ATOM 357 O ARG 48 0.879 -2.611 -8.325 1.00 0.00 ATOM 358 C ARG 48 1.931 -2.603 -8.967 1.00 0.00 ATOM 359 N ASP 49 2.159 -1.796 -10.005 1.00 0.00 ATOM 360 CA ASP 49 1.132 -0.900 -10.555 1.00 0.00 ATOM 361 CB ASP 49 1.669 -0.157 -11.780 1.00 0.00 ATOM 362 CG ASP 49 2.697 0.896 -11.418 1.00 0.00 ATOM 363 OD1 ASP 49 2.800 1.239 -10.220 1.00 0.00 ATOM 364 OD2 ASP 49 3.401 1.377 -12.329 1.00 0.00 ATOM 365 O ASP 49 -1.225 -1.195 -10.689 1.00 0.00 ATOM 366 C ASP 49 -0.114 -1.672 -10.915 1.00 0.00 ATOM 367 N PRO 50 0.069 -2.863 -11.482 1.00 0.00 ATOM 368 CA PRO 50 -1.084 -3.694 -11.852 1.00 0.00 ATOM 369 CB PRO 50 -0.455 -4.967 -12.423 1.00 0.00 ATOM 370 CG PRO 50 0.871 -4.526 -12.946 1.00 0.00 ATOM 371 CD PRO 50 1.380 -3.496 -11.977 1.00 0.00 ATOM 372 O PRO 50 -3.185 -3.885 -10.721 1.00 0.00 ATOM 373 C PRO 50 -1.966 -4.005 -10.647 1.00 0.00 ATOM 374 N GLU 51 -1.348 -4.369 -9.527 1.00 0.00 ATOM 375 CA GLU 51 -2.109 -4.718 -8.333 1.00 0.00 ATOM 376 CB GLU 51 -1.200 -5.371 -7.289 1.00 0.00 ATOM 377 CG GLU 51 -1.922 -5.819 -6.029 1.00 0.00 ATOM 378 CD GLU 51 -2.931 -6.919 -6.297 1.00 0.00 ATOM 379 OE1 GLU 51 -2.815 -7.589 -7.344 1.00 0.00 ATOM 380 OE2 GLU 51 -3.837 -7.110 -5.458 1.00 0.00 ATOM 381 O GLU 51 -3.957 -3.555 -7.346 1.00 0.00 ATOM 382 C GLU 51 -2.792 -3.501 -7.735 1.00 0.00 ATOM 383 N LYS 52 -2.062 -2.397 -7.683 1.00 0.00 ATOM 384 CA LYS 52 -2.586 -1.167 -7.100 1.00 0.00 ATOM 385 CB LYS 52 -1.490 -0.103 -7.021 1.00 0.00 ATOM 386 CG LYS 52 -1.943 1.208 -6.401 1.00 0.00 ATOM 387 CD LYS 52 -2.284 1.035 -4.930 1.00 0.00 ATOM 388 CE LYS 52 -2.616 2.369 -4.281 1.00 0.00 ATOM 389 NZ LYS 52 -3.009 2.209 -2.853 1.00 0.00 ATOM 390 O LYS 52 -4.671 -0.075 -7.252 1.00 0.00 ATOM 391 C LYS 52 -3.758 -0.611 -7.860 1.00 0.00 ATOM 392 N ALA 53 -3.738 -0.747 -9.183 1.00 0.00 ATOM 393 CA ALA 53 -4.817 -0.239 -10.029 1.00 0.00 ATOM 394 CB ALA 53 -4.274 0.179 -11.387 1.00 0.00 ATOM 395 O ALA 53 -6.961 -0.879 -10.855 1.00 0.00 ATOM 396 C ALA 53 -5.957 -1.228 -10.249 1.00 0.00 ATOM 397 N SER 54 -5.814 -2.456 -9.765 1.00 0.00 ATOM 398 CA SER 54 -6.847 -3.475 -9.973 1.00 0.00 ATOM 399 CB SER 54 -6.415 -4.808 -9.362 1.00 0.00 ATOM 400 OG SER 54 -7.402 -5.805 -9.562 1.00 0.00 ATOM 401 O SER 54 -8.264 -2.445 -8.337 1.00 0.00 ATOM 402 C SER 54 -8.185 -3.063 -9.391 1.00 0.00 ATOM 403 N GLN 55 -9.242 -3.419 -10.099 1.00 0.00 ATOM 404 CA GLN 55 -10.595 -3.123 -9.673 1.00 0.00 ATOM 405 CB GLN 55 -11.509 -2.934 -10.885 1.00 0.00 ATOM 406 CG GLN 55 -11.112 -1.776 -11.787 1.00 0.00 ATOM 407 CD GLN 55 -11.961 -1.697 -13.041 1.00 0.00 ATOM 408 OE1 GLN 55 -11.716 -0.867 -13.917 1.00 0.00 ATOM 409 NE2 GLN 55 -12.963 -2.563 -13.131 1.00 0.00 ATOM 410 O GLN 55 -12.135 -4.093 -8.120 1.00 0.00 ATOM 411 C GLN 55 -11.106 -4.251 -8.774 1.00 0.00 ATOM 412 N GLU 56 -10.384 -5.377 -8.732 1.00 0.00 ATOM 413 CA GLU 56 -10.801 -6.534 -7.934 1.00 0.00 ATOM 414 CB GLU 56 -9.929 -7.748 -8.254 1.00 0.00 ATOM 415 CG GLU 56 -10.363 -9.026 -7.554 1.00 0.00 ATOM 416 CD GLU 56 -9.511 -10.220 -7.939 1.00 0.00 ATOM 417 OE1 GLU 56 -8.551 -10.038 -8.717 1.00 0.00 ATOM 418 OE2 GLU 56 -9.803 -11.336 -7.462 1.00 0.00 ATOM 419 O GLU 56 -9.777 -5.641 -5.920 1.00 0.00 ATOM 420 C GLU 56 -10.748 -6.245 -6.417 1.00 0.00 ATOM 421 N ASP 57 -11.804 -6.673 -5.684 1.00 0.00 ATOM 422 CA ASP 57 -11.906 -6.394 -4.242 1.00 0.00 ATOM 423 CB ASP 57 -13.210 -6.963 -3.677 1.00 0.00 ATOM 424 CG ASP 57 -13.436 -6.572 -2.229 1.00 0.00 ATOM 425 OD1 ASP 57 -13.944 -5.458 -1.987 1.00 0.00 ATOM 426 OD2 ASP 57 -13.104 -7.382 -1.337 1.00 0.00 ATOM 427 O ASP 57 -10.352 -8.110 -3.673 1.00 0.00 ATOM 428 C ASP 57 -10.725 -6.955 -3.454 1.00 0.00 ATOM 429 N LYS 58 -10.142 -6.150 -2.539 1.00 0.00 ATOM 430 CA LYS 58 -8.967 -6.609 -1.755 1.00 0.00 ATOM 431 CB LYS 58 -8.623 -5.595 -0.662 1.00 0.00 ATOM 432 CG LYS 58 -8.179 -4.240 -1.191 1.00 0.00 ATOM 433 CD LYS 58 -6.824 -4.330 -1.875 1.00 0.00 ATOM 434 CE LYS 58 -6.346 -2.963 -2.335 1.00 0.00 ATOM 435 NZ LYS 58 -5.039 -3.042 -3.045 1.00 0.00 ATOM 436 O LYS 58 -10.326 -8.344 -0.768 1.00 0.00 ATOM 437 C LYS 58 -9.184 -7.988 -1.114 1.00 0.00 ATOM 438 N SER 59 -8.106 -8.751 -0.957 1.00 0.00 ATOM 439 CA SER 59 -8.243 -10.104 -0.427 1.00 0.00 ATOM 440 CB SER 59 -7.310 -11.066 -1.165 1.00 0.00 ATOM 441 OG SER 59 -7.351 -12.360 -0.590 1.00 0.00 ATOM 442 O SER 59 -6.905 -9.726 1.489 1.00 0.00 ATOM 443 C SER 59 -7.954 -10.139 1.071 1.00 0.00 ATOM 444 N LEU 60 -8.918 -10.603 1.859 1.00 0.00 ATOM 445 CA LEU 60 -8.738 -10.810 3.294 1.00 0.00 ATOM 446 CB LEU 60 -10.071 -10.660 4.028 1.00 0.00 ATOM 447 CG LEU 60 -10.759 -9.299 3.911 1.00 0.00 ATOM 448 CD1 LEU 60 -12.109 -9.318 4.610 1.00 0.00 ATOM 449 CD2 LEU 60 -9.880 -8.200 4.489 1.00 0.00 ATOM 450 O LEU 60 -8.318 -13.105 2.665 1.00 0.00 ATOM 451 C LEU 60 -8.130 -12.204 3.488 1.00 0.00 ATOM 452 N TYR 61 -7.406 -12.385 4.580 1.00 0.00 ATOM 453 CA TYR 61 -6.876 -13.693 4.936 1.00 0.00 ATOM 454 CB TYR 61 -6.090 -13.614 6.246 1.00 0.00 ATOM 455 CG TYR 61 -5.485 -14.932 6.677 1.00 0.00 ATOM 456 CD1 TYR 61 -4.680 -15.661 5.812 1.00 0.00 ATOM 457 CD2 TYR 61 -5.720 -15.441 7.948 1.00 0.00 ATOM 458 CE1 TYR 61 -4.121 -16.866 6.197 1.00 0.00 ATOM 459 CE2 TYR 61 -5.170 -16.644 8.350 1.00 0.00 ATOM 460 CZ TYR 61 -4.366 -17.356 7.462 1.00 0.00 ATOM 461 OH TYR 61 -3.812 -18.554 7.847 1.00 0.00 ATOM 462 O TYR 61 -9.028 -14.401 5.742 1.00 0.00 ATOM 463 C TYR 61 -8.065 -14.671 5.035 1.00 0.00 ATOM 464 N GLU 62 -7.981 -15.796 4.329 1.00 0.00 ATOM 465 CA GLU 62 -9.034 -16.800 4.375 1.00 0.00 ATOM 466 CB GLU 62 -8.643 -18.025 3.546 1.00 0.00 ATOM 467 CG GLU 62 -8.557 -17.762 2.051 1.00 0.00 ATOM 468 CD GLU 62 -7.234 -17.143 1.644 1.00 0.00 ATOM 469 OE1 GLU 62 -6.376 -16.939 2.529 1.00 0.00 ATOM 470 OE2 GLU 62 -7.055 -16.864 0.440 1.00 0.00 ATOM 471 O GLU 62 -10.471 -17.680 6.074 1.00 0.00 ATOM 472 C GLU 62 -9.370 -17.248 5.810 1.00 0.00 ATOM 473 N GLN 63 -8.414 -17.141 6.732 1.00 0.00 ATOM 474 CA GLN 63 -8.659 -17.516 8.129 1.00 0.00 ATOM 475 CB GLN 63 -7.357 -17.476 8.931 1.00 0.00 ATOM 476 CG GLN 63 -7.494 -17.970 10.364 1.00 0.00 ATOM 477 CD GLN 63 -7.869 -19.435 10.441 1.00 0.00 ATOM 478 OE1 GLN 63 -7.235 -20.283 9.811 1.00 0.00 ATOM 479 NE2 GLN 63 -8.903 -19.741 11.216 1.00 0.00 ATOM 480 O GLN 63 -10.290 -17.055 9.854 1.00 0.00 ATOM 481 C GLN 63 -9.694 -16.635 8.839 1.00 0.00 ATOM 482 N ALA 64 -9.891 -15.420 8.315 1.00 0.00 ATOM 483 CA ALA 64 -10.824 -14.455 8.902 1.00 0.00 ATOM 484 CB ALA 64 -10.064 -13.295 9.525 1.00 0.00 ATOM 485 O ALA 64 -12.257 -12.763 7.993 1.00 0.00 ATOM 486 C ALA 64 -11.835 -13.910 7.872 1.00 0.00 ATOM 490 N GLY 84 -12.212 -14.711 6.871 1.00 0.00 ATOM 491 CA GLY 84 -13.201 -14.286 5.859 1.00 0.00 ATOM 492 O GLY 84 -14.983 -12.668 6.063 1.00 0.00 ATOM 493 C GLY 84 -14.514 -13.746 6.454 1.00 0.00 ATOM 494 N GLY 85 -15.110 -14.519 7.368 1.00 0.00 ATOM 495 CA GLY 85 -16.387 -14.165 8.001 1.00 0.00 ATOM 496 O GLY 85 -17.402 -12.082 8.602 1.00 0.00 ATOM 497 C GLY 85 -16.380 -12.754 8.587 1.00 0.00 ATOM 498 N ILE 86 -15.215 -12.310 9.049 1.00 0.00 ATOM 499 CA ILE 86 -15.041 -10.981 9.651 1.00 0.00 ATOM 500 CB ILE 86 -13.977 -10.999 10.764 1.00 0.00 ATOM 501 CG1 ILE 86 -14.403 -11.942 11.891 1.00 0.00 ATOM 502 CG2 ILE 86 -13.713 -9.591 11.272 1.00 0.00 ATOM 503 CD1 ILE 86 -15.718 -11.565 12.540 1.00 0.00 ATOM 504 O ILE 86 -14.568 -8.686 9.086 1.00 0.00 ATOM 505 C ILE 86 -14.663 -9.857 8.681 1.00 0.00 ATOM 506 N GLY 87 -14.412 -10.225 7.422 1.00 0.00 ATOM 507 CA GLY 87 -13.974 -9.285 6.381 1.00 0.00 ATOM 508 O GLY 87 -14.438 -6.948 6.305 1.00 0.00 ATOM 509 C GLY 87 -14.877 -8.092 6.148 1.00 0.00 ATOM 510 N LYS 88 -16.139 -8.348 5.780 1.00 0.00 ATOM 511 CA LYS 88 -17.081 -7.248 5.533 1.00 0.00 ATOM 512 CB LYS 88 -18.482 -7.797 5.246 1.00 0.00 ATOM 513 CG LYS 88 -19.519 -6.727 4.951 1.00 0.00 ATOM 514 CD LYS 88 -20.873 -7.342 4.637 1.00 0.00 ATOM 515 CE LYS 88 -21.920 -6.270 4.383 1.00 0.00 ATOM 516 NZ LYS 88 -23.252 -6.859 4.072 1.00 0.00 ATOM 517 O LYS 88 -17.174 -5.025 6.414 1.00 0.00 ATOM 518 C LYS 88 -17.188 -6.231 6.682 1.00 0.00 ATOM 519 N LYS 89 -17.285 -6.709 7.931 1.00 0.00 ATOM 520 CA LYS 89 -17.373 -5.810 9.108 1.00 0.00 ATOM 521 CB LYS 89 -17.296 -6.618 10.405 1.00 0.00 ATOM 522 CG LYS 89 -17.400 -5.776 11.667 1.00 0.00 ATOM 523 CD LYS 89 -17.361 -6.645 12.914 1.00 0.00 ATOM 524 CE LYS 89 -17.544 -5.812 14.172 1.00 0.00 ATOM 525 NZ LYS 89 -16.391 -4.900 14.406 1.00 0.00 ATOM 526 O LYS 89 -16.506 -3.565 9.277 1.00 0.00 ATOM 527 C LYS 89 -16.264 -4.763 9.068 1.00 0.00 ATOM 528 N MET 90 -15.046 -5.237 8.810 1.00 0.00 ATOM 529 CA MET 90 -13.893 -4.376 8.763 1.00 0.00 ATOM 530 CB MET 90 -12.607 -5.203 8.726 1.00 0.00 ATOM 531 CG MET 90 -11.335 -4.380 8.851 1.00 0.00 ATOM 532 SD MET 90 -9.850 -5.335 8.488 1.00 0.00 ATOM 533 CE MET 90 -10.226 -5.938 6.844 1.00 0.00 ATOM 534 O MET 90 -13.747 -2.222 7.710 1.00 0.00 ATOM 535 C MET 90 -13.939 -3.433 7.553 1.00 0.00 ATOM 536 N LEU 91 -14.185 -3.979 6.363 1.00 0.00 ATOM 537 CA LEU 91 -14.193 -3.177 5.139 1.00 0.00 ATOM 538 CB LEU 91 -14.439 -4.066 3.918 1.00 0.00 ATOM 539 CG LEU 91 -14.519 -3.354 2.566 1.00 0.00 ATOM 540 CD1 LEU 91 -13.210 -2.647 2.252 1.00 0.00 ATOM 541 CD2 LEU 91 -14.868 -4.338 1.460 1.00 0.00 ATOM 542 O LEU 91 -14.958 -0.927 4.910 1.00 0.00 ATOM 543 C LEU 91 -15.247 -2.086 5.216 1.00 0.00 ATOM 544 N LEU 92 -16.445 -2.467 5.661 1.00 0.00 ATOM 545 CA LEU 92 -17.555 -1.537 5.815 1.00 0.00 ATOM 546 CB LEU 92 -18.817 -2.279 6.263 1.00 0.00 ATOM 547 CG LEU 92 -20.058 -1.419 6.510 1.00 0.00 ATOM 548 CD1 LEU 92 -20.481 -0.707 5.234 1.00 0.00 ATOM 549 CD2 LEU 92 -21.201 -2.267 7.046 1.00 0.00 ATOM 550 O LEU 92 -17.412 0.755 6.532 1.00 0.00 ATOM 551 C LEU 92 -17.210 -0.422 6.823 1.00 0.00 ATOM 552 N GLU 93 -16.642 -0.786 7.975 1.00 0.00 ATOM 553 CA GLU 93 -16.363 0.196 9.036 1.00 0.00 ATOM 554 CB GLU 93 -15.990 -0.513 10.340 1.00 0.00 ATOM 555 CG GLU 93 -17.139 -1.271 10.985 1.00 0.00 ATOM 556 CD GLU 93 -16.727 -1.978 12.261 1.00 0.00 ATOM 557 OE1 GLU 93 -15.513 -2.017 12.553 1.00 0.00 ATOM 558 OE2 GLU 93 -17.618 -2.492 12.970 1.00 0.00 ATOM 559 O GLU 93 -15.230 2.296 9.185 1.00 0.00 ATOM 560 C GLU 93 -15.256 1.176 8.671 1.00 0.00 ATOM 561 N MET 94 -14.355 0.758 7.782 1.00 0.00 ATOM 562 CA MET 94 -13.258 1.620 7.328 1.00 0.00 ATOM 563 CB MET 94 -12.082 0.773 6.836 1.00 0.00 ATOM 564 CG MET 94 -11.319 0.065 7.944 1.00 0.00 ATOM 565 SD MET 94 -9.959 -0.940 7.320 1.00 0.00 ATOM 566 CE MET 94 -8.876 0.326 6.664 1.00 0.00 ATOM 567 O MET 94 -13.263 3.737 6.232 1.00 0.00 ATOM 568 C MET 94 -13.684 2.581 6.223 1.00 0.00 ATOM 572 N LYS 96 -14.488 2.112 5.269 1.00 0.00 ATOM 573 CA LYS 96 -15.007 3.013 4.245 1.00 0.00 ATOM 574 CB LYS 96 -15.682 2.220 3.126 1.00 0.00 ATOM 575 CG LYS 96 -14.720 1.418 2.266 1.00 0.00 ATOM 576 CD LYS 96 -15.456 0.659 1.172 1.00 0.00 ATOM 577 CE LYS 96 -14.492 -0.125 0.299 1.00 0.00 ATOM 578 NZ LYS 96 -15.203 -0.913 -0.744 1.00 0.00 ATOM 579 O LYS 96 -16.110 5.150 4.466 1.00 0.00 ATOM 580 C LYS 96 -15.993 4.005 4.906 1.00 0.00 ATOM 581 N GLU 97 -16.646 3.573 5.992 1.00 0.00 ATOM 582 CA GLU 97 -17.564 4.417 6.774 1.00 0.00 ATOM 583 CB GLU 97 -18.328 3.573 7.797 1.00 0.00 ATOM 584 CG GLU 97 -19.400 4.338 8.555 1.00 0.00 ATOM 585 CD GLU 97 -20.478 3.429 9.116 1.00 0.00 ATOM 586 OE1 GLU 97 -20.181 2.242 9.366 1.00 0.00 ATOM 587 OE2 GLU 97 -21.617 3.905 9.304 1.00 0.00 ATOM 588 O GLU 97 -17.308 6.664 7.572 1.00 0.00 ATOM 589 C GLU 97 -16.816 5.546 7.483 1.00 0.00 ATOM 590 N GLU 98 -15.627 5.246 7.996 1.00 0.00 ATOM 591 CA GLU 98 -14.783 6.265 8.623 1.00 0.00 ATOM 592 CB GLU 98 -13.872 5.633 9.675 1.00 0.00 ATOM 593 CG GLU 98 -14.611 5.059 10.873 1.00 0.00 ATOM 594 CD GLU 98 -13.678 4.421 11.883 1.00 0.00 ATOM 595 OE1 GLU 98 -12.458 4.371 11.617 1.00 0.00 ATOM 596 OE2 GLU 98 -14.165 3.972 12.942 1.00 0.00 ATOM 597 O GLU 98 -13.226 7.954 7.909 1.00 0.00 ATOM 598 C GLU 98 -13.941 7.009 7.572 1.00 0.00 ATOM 599 N LYS 99 -14.011 6.572 6.312 1.00 0.00 ATOM 600 CA LYS 99 -13.206 7.137 5.225 1.00 0.00 ATOM 601 CB LYS 99 -13.557 8.610 5.007 1.00 0.00 ATOM 602 CG LYS 99 -15.037 8.866 4.762 1.00 0.00 ATOM 603 CD LYS 99 -15.323 10.351 4.621 1.00 0.00 ATOM 604 CE LYS 99 -16.811 10.611 4.441 1.00 0.00 ATOM 605 NZ LYS 99 -17.123 12.067 4.432 1.00 0.00 ATOM 606 O LYS 99 -10.913 7.857 5.373 1.00 0.00 ATOM 607 C LYS 99 -11.738 6.962 5.572 1.00 0.00 ATOM 608 N ALA 100 -11.413 5.786 6.094 1.00 0.00 ATOM 609 CA ALA 100 -10.065 5.517 6.512 1.00 0.00 ATOM 610 CB ALA 100 -10.020 4.280 7.395 1.00 0.00 ATOM 611 O ALA 100 -9.620 4.646 4.330 1.00 0.00 ATOM 612 C ALA 100 -9.213 5.352 5.242 1.00 0.00 ATOM 613 N PRO 101 -8.051 6.038 5.157 1.00 0.00 ATOM 614 CA PRO 101 -7.207 5.906 3.950 1.00 0.00 ATOM 615 CB PRO 101 -6.003 6.804 4.240 1.00 0.00 ATOM 616 CG PRO 101 -6.411 7.602 5.434 1.00 0.00 ATOM 617 CD PRO 101 -7.589 6.886 6.031 1.00 0.00 ATOM 618 O PRO 101 -6.665 3.674 4.595 1.00 0.00 ATOM 619 C PRO 101 -6.746 4.486 3.665 1.00 0.00 ATOM 620 N LYS 102 -6.459 4.187 2.395 1.00 0.00 ATOM 621 CA LYS 102 -5.941 2.878 1.990 1.00 0.00 ATOM 622 CB LYS 102 -6.013 2.720 0.471 1.00 0.00 ATOM 623 CG LYS 102 -7.429 2.659 -0.081 1.00 0.00 ATOM 624 CD LYS 102 -7.427 2.462 -1.587 1.00 0.00 ATOM 625 CE LYS 102 -8.841 2.409 -2.140 1.00 0.00 ATOM 626 NZ LYS 102 -8.854 2.231 -3.617 1.00 0.00 ATOM 627 O LYS 102 -3.822 3.784 2.710 1.00 0.00 ATOM 628 C LYS 102 -4.507 2.766 2.509 1.00 0.00 ATOM 629 N LEU 103 -4.050 1.540 2.708 1.00 0.00 ATOM 630 CA LEU 103 -2.728 1.316 3.234 1.00 0.00 ATOM 631 CB LEU 103 -2.400 -0.178 3.241 1.00 0.00 ATOM 632 CG LEU 103 -1.107 -0.585 3.949 1.00 0.00 ATOM 633 CD1 LEU 103 -1.121 -2.068 4.286 1.00 0.00 ATOM 634 CD2 LEU 103 0.105 -0.250 3.092 1.00 0.00 ATOM 635 O LEU 103 -0.693 2.596 3.114 1.00 0.00 ATOM 636 C LEU 103 -1.618 2.047 2.487 1.00 0.00 ATOM 637 N SER 104 -1.676 2.037 1.165 1.00 0.00 ATOM 638 CA SER 104 -0.625 2.675 0.378 1.00 0.00 ATOM 639 CB SER 104 -0.727 2.256 -1.091 1.00 0.00 ATOM 640 OG SER 104 -1.920 2.745 -1.678 1.00 0.00 ATOM 641 O SER 104 0.369 4.819 0.319 1.00 0.00 ATOM 642 C SER 104 -0.660 4.189 0.469 1.00 0.00 ATOM 643 N ASP 105 -1.840 4.766 0.685 1.00 0.00 ATOM 644 CA ASP 105 -1.973 6.200 0.874 1.00 0.00 ATOM 645 CB ASP 105 -3.445 6.611 0.831 1.00 0.00 ATOM 646 CG ASP 105 -4.036 6.520 -0.562 1.00 0.00 ATOM 647 OD1 ASP 105 -3.258 6.403 -1.531 1.00 0.00 ATOM 648 OD2 ASP 105 -5.279 6.561 -0.685 1.00 0.00 ATOM 649 O ASP 105 -0.684 7.606 2.285 1.00 0.00 ATOM 650 C ASP 105 -1.335 6.586 2.190 1.00 0.00 ATOM 651 N LEU 106 -1.504 5.748 3.209 1.00 0.00 ATOM 652 CA LEU 106 -0.863 5.984 4.495 1.00 0.00 ATOM 653 CB LEU 106 -1.317 4.942 5.520 1.00 0.00 ATOM 654 CG LEU 106 -2.778 5.025 5.968 1.00 0.00 ATOM 655 CD1 LEU 106 -3.140 3.835 6.843 1.00 0.00 ATOM 656 CD2 LEU 106 -3.040 6.326 6.710 1.00 0.00 ATOM 657 O LEU 106 1.361 6.769 4.957 1.00 0.00 ATOM 658 C LEU 106 0.655 5.957 4.341 1.00 0.00 ATOM 659 N LEU 107 1.168 5.051 3.519 1.00 0.00 ATOM 660 CA LEU 107 2.619 4.990 3.314 1.00 0.00 ATOM 661 CB LEU 107 2.999 3.727 2.539 1.00 0.00 ATOM 662 CG LEU 107 2.817 2.399 3.276 1.00 0.00 ATOM 663 CD1 LEU 107 3.050 1.227 2.337 1.00 0.00 ATOM 664 CD2 LEU 107 3.754 2.314 4.471 1.00 0.00 ATOM 665 O LEU 107 4.089 6.910 3.009 1.00 0.00 ATOM 666 C LEU 107 3.118 6.249 2.567 1.00 0.00 ATOM 667 N SER 108 2.431 6.619 1.490 1.00 0.00 ATOM 668 CA SER 108 2.843 7.764 0.715 1.00 0.00 ATOM 669 CB SER 108 1.978 7.899 -0.541 1.00 0.00 ATOM 670 OG SER 108 0.632 8.184 -0.204 1.00 0.00 ATOM 671 O SER 108 3.655 9.886 1.454 1.00 0.00 ATOM 672 C SER 108 2.767 9.039 1.542 1.00 0.00 ATOM 673 N GLY 109 1.716 9.186 2.339 1.00 0.00 ATOM 674 CA GLY 109 1.581 10.373 3.196 1.00 0.00 ATOM 675 O GLY 109 3.242 11.426 4.547 1.00 0.00 ATOM 676 C GLY 109 2.706 10.376 4.221 1.00 0.00 ATOM 677 N ALA 110 3.064 9.199 4.723 1.00 0.00 ATOM 678 CA ALA 110 4.149 9.094 5.704 1.00 0.00 ATOM 679 CB ALA 110 4.277 7.663 6.203 1.00 0.00 ATOM 680 O ALA 110 6.226 10.261 5.746 1.00 0.00 ATOM 681 C ALA 110 5.460 9.569 5.084 1.00 0.00 ATOM 682 N ARG 111 5.704 9.219 3.809 1.00 0.00 ATOM 683 CA ARG 111 6.924 9.664 3.116 1.00 0.00 ATOM 684 CB ARG 111 6.993 9.061 1.711 1.00 0.00 ATOM 685 CG ARG 111 8.264 9.401 0.953 1.00 0.00 ATOM 686 CD ARG 111 8.289 8.735 -0.413 1.00 0.00 ATOM 687 NE ARG 111 9.528 9.009 -1.135 1.00 0.00 ATOM 688 CZ ARG 111 9.735 10.091 -1.879 1.00 0.00 ATOM 689 NH1 ARG 111 10.895 10.256 -2.499 1.00 0.00 ATOM 690 NH2 ARG 111 8.782 11.005 -2.000 1.00 0.00 ATOM 691 O ARG 111 8.061 11.722 3.122 1.00 0.00 ATOM 692 C ARG 111 6.988 11.170 3.037 1.00 0.00 ATOM 693 N LYS 112 5.844 11.822 2.840 1.00 0.00 ATOM 694 CA LYS 112 5.794 13.286 2.753 1.00 0.00 ATOM 695 CB LYS 112 4.449 13.743 2.184 1.00 0.00 ATOM 696 CG LYS 112 4.255 13.421 0.712 1.00 0.00 ATOM 697 CD LYS 112 2.897 13.891 0.216 1.00 0.00 ATOM 698 CE LYS 112 2.705 13.571 -1.257 1.00 0.00 ATOM 699 NZ LYS 112 1.362 13.987 -1.745 1.00 0.00 ATOM 700 O LYS 112 6.684 14.933 4.233 1.00 0.00 ATOM 701 C LYS 112 6.031 13.915 4.126 1.00 0.00 ATOM 702 N LYS 113 5.520 13.285 5.172 1.00 0.00 ATOM 703 CA LYS 113 5.624 13.790 6.546 1.00 0.00 ATOM 704 CB LYS 113 4.514 13.202 7.419 1.00 0.00 ATOM 705 CG LYS 113 3.123 13.717 7.085 1.00 0.00 ATOM 706 CD LYS 113 2.100 13.243 8.106 1.00 0.00 ATOM 707 CE LYS 113 1.842 11.750 7.975 1.00 0.00 ATOM 708 NZ LYS 113 0.747 11.296 8.876 1.00 0.00 ATOM 709 O LYS 113 7.504 14.378 7.907 1.00 0.00 ATOM 710 C LYS 113 6.969 13.510 7.227 1.00 0.00 ATOM 711 N GLU 114 7.497 12.299 7.053 1.00 0.00 ATOM 712 CA GLU 114 8.717 11.900 7.717 1.00 0.00 ATOM 713 CB GLU 114 8.413 10.931 8.861 1.00 0.00 ATOM 714 CG GLU 114 9.637 10.497 9.650 1.00 0.00 ATOM 715 CD GLU 114 10.281 11.646 10.402 1.00 0.00 ATOM 716 OE1 GLU 114 9.653 12.721 10.497 1.00 0.00 ATOM 717 OE2 GLU 114 11.414 11.470 10.898 1.00 0.00 ATOM 718 O GLU 114 9.751 11.530 5.610 1.00 0.00 ATOM 719 C GLU 114 9.727 11.263 6.812 1.00 0.00 ATOM 720 N VAL 115 10.688 7.983 5.356 1.00 0.00 ATOM 721 CA VAL 115 10.214 6.669 5.039 1.00 0.00 ATOM 722 CB VAL 115 8.676 6.626 4.966 1.00 0.00 ATOM 723 CG1 VAL 115 8.202 5.246 4.533 1.00 0.00 ATOM 724 CG2 VAL 115 8.068 7.005 6.308 1.00 0.00 ATOM 725 O VAL 115 10.829 7.026 2.749 1.00 0.00 ATOM 726 C VAL 115 10.851 6.255 3.721 1.00 0.00 ATOM 727 N LYS 116 11.437 5.051 3.703 1.00 0.00 ATOM 728 CA LYS 116 12.042 4.500 2.499 1.00 0.00 ATOM 729 CB LYS 116 13.549 4.320 2.691 1.00 0.00 ATOM 730 CG LYS 116 14.314 5.624 2.851 1.00 0.00 ATOM 731 CD LYS 116 14.408 6.374 1.532 1.00 0.00 ATOM 732 CE LYS 116 15.151 7.690 1.698 1.00 0.00 ATOM 733 NZ LYS 116 14.266 8.764 2.227 1.00 0.00 ATOM 734 O LYS 116 11.134 2.350 3.051 1.00 0.00 ATOM 735 C LYS 116 11.371 3.179 2.164 1.00 0.00 ATOM 736 N PHE 117 11.050 3.022 0.886 1.00 0.00 ATOM 737 CA PHE 117 10.373 1.852 0.375 1.00 0.00 ATOM 738 CB PHE 117 9.075 2.249 -0.332 1.00 0.00 ATOM 739 CG PHE 117 8.045 2.845 0.584 1.00 0.00 ATOM 740 CD1 PHE 117 8.077 4.191 0.902 1.00 0.00 ATOM 741 CD2 PHE 117 7.042 2.060 1.126 1.00 0.00 ATOM 742 CE1 PHE 117 7.127 4.739 1.743 1.00 0.00 ATOM 743 CE2 PHE 117 6.094 2.608 1.968 1.00 0.00 ATOM 744 CZ PHE 117 6.134 3.942 2.278 1.00 0.00 ATOM 745 O PHE 117 11.768 1.701 -1.541 1.00 0.00 ATOM 746 C PHE 117 11.301 1.132 -0.549 1.00 0.00 ATOM 747 N TYR 118 11.584 -0.111 -0.207 1.00 0.00 ATOM 748 CA TYR 118 12.464 -0.976 -0.975 1.00 0.00 ATOM 749 CB TYR 118 13.648 -1.431 -0.120 1.00 0.00 ATOM 750 CG TYR 118 14.557 -0.303 0.318 1.00 0.00 ATOM 751 CD1 TYR 118 14.290 0.417 1.475 1.00 0.00 ATOM 752 CD2 TYR 118 15.677 0.039 -0.430 1.00 0.00 ATOM 753 CE1 TYR 118 15.115 1.449 1.883 1.00 0.00 ATOM 754 CE2 TYR 118 16.512 1.068 -0.038 1.00 0.00 ATOM 755 CZ TYR 118 16.220 1.774 1.128 1.00 0.00 ATOM 756 OH TYR 118 17.043 2.800 1.532 1.00 0.00 ATOM 757 O TYR 118 10.809 -2.685 -0.854 1.00 0.00 ATOM 758 C TYR 118 11.702 -2.183 -1.505 1.00 0.00 ATOM 759 N ALA 119 12.111 -2.640 -2.680 1.00 0.00 ATOM 760 CA ALA 119 11.578 -3.815 -3.316 1.00 0.00 ATOM 761 CB ALA 119 11.100 -3.485 -4.722 1.00 0.00 ATOM 762 O ALA 119 13.813 -4.593 -3.616 1.00 0.00 ATOM 763 C ALA 119 12.666 -4.875 -3.324 1.00 0.00 ATOM 764 N CYS 120 12.278 -6.099 -3.002 1.00 0.00 ATOM 765 CA CYS 120 13.158 -7.251 -2.963 1.00 0.00 ATOM 766 CB CYS 120 12.511 -8.392 -2.173 1.00 0.00 ATOM 767 SG CYS 120 13.382 -9.971 -2.293 1.00 0.00 ATOM 768 O CYS 120 12.680 -8.196 -5.103 1.00 0.00 ATOM 769 C CYS 120 13.537 -7.759 -4.342 1.00 0.00 ATOM 770 N GLN 121 14.825 -7.743 -4.653 1.00 0.00 ATOM 771 CA GLN 121 15.290 -8.162 -5.961 1.00 0.00 ATOM 772 CB GLN 121 16.769 -7.811 -6.140 1.00 0.00 ATOM 773 CG GLN 121 17.311 -8.096 -7.531 1.00 0.00 ATOM 774 CD GLN 121 16.642 -7.255 -8.601 1.00 0.00 ATOM 775 OE1 GLN 121 16.552 -6.033 -8.477 1.00 0.00 ATOM 776 NE2 GLN 121 16.170 -7.908 -9.656 1.00 0.00 ATOM 777 O GLN 121 14.873 -10.028 -7.370 1.00 0.00 ATOM 778 C GLN 121 15.106 -9.652 -6.229 1.00 0.00 ATOM 779 N LEU 122 15.185 -10.502 -5.205 1.00 0.00 ATOM 780 CA LEU 122 15.036 -11.961 -5.403 1.00 0.00 ATOM 781 CB LEU 122 15.420 -12.717 -4.130 1.00 0.00 ATOM 782 CG LEU 122 15.299 -14.242 -4.184 1.00 0.00 ATOM 783 CD1 LEU 122 16.201 -14.814 -5.267 1.00 0.00 ATOM 784 CD2 LEU 122 15.636 -14.856 -2.834 1.00 0.00 ATOM 785 O LEU 122 13.425 -13.106 -6.770 1.00 0.00 ATOM 786 C LEU 122 13.619 -12.360 -5.817 1.00 0.00 ATOM 787 N SER 123 12.641 -11.850 -5.094 1.00 0.00 ATOM 788 CA SER 123 11.247 -12.048 -5.407 1.00 0.00 ATOM 789 CB SER 123 10.360 -11.340 -4.380 1.00 0.00 ATOM 790 OG SER 123 10.492 -11.931 -3.099 1.00 0.00 ATOM 791 O SER 123 10.110 -12.158 -7.514 1.00 0.00 ATOM 792 C SER 123 10.922 -11.551 -6.804 1.00 0.00 ATOM 793 N VAL 124 11.509 -10.424 -7.198 1.00 0.00 ATOM 794 CA VAL 124 11.239 -9.876 -8.533 1.00 0.00 ATOM 795 CB VAL 124 11.967 -8.537 -8.750 1.00 0.00 ATOM 796 CG1 VAL 124 11.847 -8.096 -10.201 1.00 0.00 ATOM 797 CG2 VAL 124 11.411 -7.471 -7.818 1.00 0.00 ATOM 798 O VAL 124 10.969 -10.905 -10.658 1.00 0.00 ATOM 799 C VAL 124 11.632 -10.848 -9.627 1.00 0.00 ATOM 800 N GLU 125 12.712 -11.593 -9.415 1.00 0.00 ATOM 801 CA GLU 125 13.130 -12.632 -10.358 1.00 0.00 ATOM 802 CB GLU 125 14.542 -13.118 -10.028 1.00 0.00 ATOM 803 CG GLU 125 15.628 -12.084 -10.280 1.00 0.00 ATOM 804 CD GLU 125 17.008 -12.586 -9.900 1.00 0.00 ATOM 805 OE1 GLU 125 17.504 -13.519 -10.564 1.00 0.00 ATOM 806 OE2 GLU 125 17.592 -12.043 -8.939 1.00 0.00 ATOM 807 O GLU 125 11.751 -14.291 -11.370 1.00 0.00 ATOM 808 C GLU 125 12.137 -13.794 -10.325 1.00 0.00 ATOM 809 N ILE 126 11.729 -14.227 -9.127 1.00 0.00 ATOM 810 CA ILE 126 10.765 -15.337 -9.002 1.00 0.00 ATOM 811 CB ILE 126 10.511 -15.699 -7.527 1.00 0.00 ATOM 812 CG1 ILE 126 11.765 -16.317 -6.906 1.00 0.00 ATOM 813 CG2 ILE 126 9.306 -16.621 -7.406 1.00 0.00 ATOM 814 CD1 ILE 126 11.701 -16.442 -5.399 1.00 0.00 ATOM 815 O ILE 126 8.797 -15.981 -10.165 1.00 0.00 ATOM 816 C ILE 126 9.433 -15.048 -9.671 1.00 0.00 ATOM 817 N MET 127 8.965 -13.800 -9.632 1.00 0.00 ATOM 818 CA MET 127 7.666 -13.467 -10.219 1.00 0.00 ATOM 819 CB MET 127 6.824 -12.654 -9.234 1.00 0.00 ATOM 820 CG MET 127 6.473 -13.400 -7.955 1.00 0.00 ATOM 821 SD MET 127 5.479 -14.872 -8.260 1.00 0.00 ATOM 822 CE MET 127 3.927 -14.135 -8.765 1.00 0.00 ATOM 823 O MET 127 6.711 -12.259 -12.038 1.00 0.00 ATOM 824 C MET 127 7.734 -12.694 -11.528 1.00 0.00 ATOM 825 N GLY 128 8.931 -12.572 -12.092 1.00 0.00 ATOM 826 CA GLY 128 9.143 -11.878 -13.360 1.00 0.00 ATOM 827 O GLY 128 8.186 -9.944 -14.336 1.00 0.00 ATOM 828 C GLY 128 8.708 -10.432 -13.353 1.00 0.00 ATOM 829 N PHE 129 8.915 -9.748 -12.236 1.00 0.00 ATOM 830 CA PHE 129 8.545 -8.344 -12.091 1.00 0.00 ATOM 831 CB PHE 129 8.021 -8.070 -10.680 1.00 0.00 ATOM 832 CG PHE 129 6.695 -8.712 -10.391 1.00 0.00 ATOM 833 CD1 PHE 129 5.788 -8.952 -11.411 1.00 0.00 ATOM 834 CD2 PHE 129 6.353 -9.077 -9.102 1.00 0.00 ATOM 835 CE1 PHE 129 4.568 -9.543 -11.143 1.00 0.00 ATOM 836 CE2 PHE 129 5.132 -9.668 -8.834 1.00 0.00 ATOM 837 CZ PHE 129 4.241 -9.901 -9.849 1.00 0.00 ATOM 838 O PHE 129 10.867 -7.826 -11.969 1.00 0.00 ATOM 839 C PHE 129 9.763 -7.496 -12.409 1.00 0.00 ATOM 840 N LYS 130 9.570 -6.425 -13.179 1.00 0.00 ATOM 841 CA LYS 130 10.655 -5.505 -13.520 1.00 0.00 ATOM 842 CB LYS 130 10.718 -5.290 -15.033 1.00 0.00 ATOM 843 CG LYS 130 11.108 -6.529 -15.821 1.00 0.00 ATOM 844 CD LYS 130 11.927 -6.166 -17.050 1.00 0.00 ATOM 845 CE LYS 130 11.670 -7.135 -18.192 1.00 0.00 ATOM 846 NZ LYS 130 11.487 -6.431 -19.490 1.00 0.00 ATOM 847 O LYS 130 9.308 -3.936 -12.296 1.00 0.00 ATOM 848 C LYS 130 10.416 -4.190 -12.768 1.00 0.00 ATOM 849 N LYS 131 11.442 -3.349 -12.666 1.00 0.00 ATOM 850 CA LYS 131 11.352 -2.074 -11.963 1.00 0.00 ATOM 851 CB LYS 131 12.668 -1.302 -12.081 1.00 0.00 ATOM 852 CG LYS 131 12.677 0.028 -11.344 1.00 0.00 ATOM 853 CD LYS 131 14.031 0.708 -11.449 1.00 0.00 ATOM 854 CE LYS 131 14.028 2.055 -10.745 1.00 0.00 ATOM 855 NZ LYS 131 15.351 2.733 -10.839 1.00 0.00 ATOM 856 O LYS 131 9.516 -0.500 -11.710 1.00 0.00 ATOM 857 C LYS 131 10.196 -1.191 -12.478 1.00 0.00 ATOM 858 N GLU 132 10.002 -1.201 -13.802 1.00 0.00 ATOM 859 CA GLU 132 8.960 -0.399 -14.446 1.00 0.00 ATOM 860 CB GLU 132 9.056 -0.520 -15.968 1.00 0.00 ATOM 861 CG GLU 132 10.304 0.111 -16.563 1.00 0.00 ATOM 862 CD GLU 132 10.116 1.578 -16.895 1.00 0.00 ATOM 863 OE1 GLU 132 10.782 2.065 -17.830 1.00 0.00 ATOM 864 OE2 GLU 132 9.300 2.239 -16.217 1.00 0.00 ATOM 865 O GLU 132 6.636 0.015 -14.013 1.00 0.00 ATOM 866 C GLU 132 7.558 -0.801 -13.990 1.00 0.00 ATOM 867 N GLU 133 7.417 -2.050 -13.553 1.00 0.00 ATOM 868 CA GLU 133 6.151 -2.572 -13.067 1.00 0.00 ATOM 869 CB GLU 133 6.151 -4.102 -13.109 1.00 0.00 ATOM 870 CG GLU 133 6.251 -4.685 -14.509 1.00 0.00 ATOM 871 CD GLU 133 5.041 -4.358 -15.363 1.00 0.00 ATOM 872 OE1 GLU 133 3.904 -4.514 -14.869 1.00 0.00 ATOM 873 OE2 GLU 133 5.229 -3.944 -16.526 1.00 0.00 ATOM 874 O GLU 133 4.683 -2.239 -11.199 1.00 0.00 ATOM 875 C GLU 133 5.816 -2.110 -11.643 1.00 0.00 ATOM 876 N LEU 134 6.798 -1.560 -10.932 1.00 0.00 ATOM 877 CA LEU 134 6.601 -1.165 -9.539 1.00 0.00 ATOM 878 CB LEU 134 7.915 -1.266 -8.763 1.00 0.00 ATOM 879 CG LEU 134 8.485 -2.673 -8.575 1.00 0.00 ATOM 880 CD1 LEU 134 9.840 -2.617 -7.884 1.00 0.00 ATOM 881 CD2 LEU 134 7.522 -3.542 -7.779 1.00 0.00 ATOM 882 O LEU 134 6.296 1.092 -10.213 1.00 0.00 ATOM 883 C LEU 134 6.047 0.240 -9.375 1.00 0.00 ATOM 884 N PHE 135 5.300 0.465 -8.290 1.00 0.00 ATOM 885 CA PHE 135 4.744 1.785 -7.976 1.00 0.00 ATOM 886 CB PHE 135 3.952 1.736 -6.668 1.00 0.00 ATOM 887 CG PHE 135 3.297 3.038 -6.306 1.00 0.00 ATOM 888 CD1 PHE 135 2.117 3.428 -6.915 1.00 0.00 ATOM 889 CD2 PHE 135 3.860 3.873 -5.357 1.00 0.00 ATOM 890 CE1 PHE 135 1.515 4.627 -6.584 1.00 0.00 ATOM 891 CE2 PHE 135 3.256 5.071 -5.024 1.00 0.00 ATOM 892 CZ PHE 135 2.089 5.449 -5.634 1.00 0.00 ATOM 893 O PHE 135 7.036 2.489 -7.525 1.00 0.00 ATOM 894 C PHE 135 5.887 2.815 -7.890 1.00 0.00 ATOM 895 N PRO 136 5.547 4.062 -8.205 1.00 0.00 ATOM 896 CA PRO 136 6.513 5.158 -8.252 1.00 0.00 ATOM 897 CB PRO 136 5.681 6.366 -8.688 1.00 0.00 ATOM 898 CG PRO 136 4.532 5.777 -9.437 1.00 0.00 ATOM 899 CD PRO 136 4.194 4.490 -8.738 1.00 0.00 ATOM 900 O PRO 136 8.319 5.873 -6.865 1.00 0.00 ATOM 901 C PRO 136 7.180 5.422 -6.912 1.00 0.00 ATOM 902 N GLU 137 6.468 5.118 -5.838 1.00 0.00 ATOM 903 CA GLU 137 6.959 5.403 -4.517 1.00 0.00 ATOM 904 CB GLU 137 5.811 5.389 -3.503 1.00 0.00 ATOM 905 CG GLU 137 4.762 6.461 -3.740 1.00 0.00 ATOM 906 CD GLU 137 5.313 7.863 -3.565 1.00 0.00 ATOM 907 OE1 GLU 137 6.014 8.106 -2.559 1.00 0.00 ATOM 908 OE2 GLU 137 5.046 8.719 -4.434 1.00 0.00 ATOM 909 O GLU 137 8.512 4.582 -2.921 1.00 0.00 ATOM 910 C GLU 137 8.044 4.444 -4.027 1.00 0.00 ATOM 911 N VAL 138 8.423 3.462 -4.845 1.00 0.00 ATOM 912 CA VAL 138 9.516 2.561 -4.486 1.00 0.00 ATOM 913 CB VAL 138 9.464 1.257 -5.305 1.00 0.00 ATOM 914 CG1 VAL 138 10.735 0.447 -5.095 1.00 0.00 ATOM 915 CG2 VAL 138 8.238 0.441 -4.930 1.00 0.00 ATOM 916 O VAL 138 11.022 3.893 -5.788 1.00 0.00 ATOM 917 C VAL 138 10.799 3.336 -4.714 1.00 0.00 ATOM 918 N GLN 139 11.627 3.388 -3.694 1.00 0.00 ATOM 919 CA GLN 139 12.880 4.112 -3.740 1.00 0.00 ATOM 920 CB GLN 139 13.295 4.556 -2.335 1.00 0.00 ATOM 921 CG GLN 139 12.290 5.468 -1.652 1.00 0.00 ATOM 922 CD GLN 139 12.077 6.767 -2.403 1.00 0.00 ATOM 923 OE1 GLN 139 12.989 7.585 -2.520 1.00 0.00 ATOM 924 NE2 GLN 139 10.868 6.961 -2.918 1.00 0.00 ATOM 925 O GLN 139 14.829 3.830 -5.067 1.00 0.00 ATOM 926 C GLN 139 14.003 3.298 -4.359 1.00 0.00 ATOM 927 N ILE 140 15.564 -1.031 -5.404 1.00 0.00 ATOM 928 CA ILE 140 15.454 -2.482 -5.483 1.00 0.00 ATOM 929 CB ILE 140 15.256 -2.955 -6.935 1.00 0.00 ATOM 930 CG1 ILE 140 13.934 -2.422 -7.494 1.00 0.00 ATOM 931 CG2 ILE 140 15.335 -4.470 -7.018 1.00 0.00 ATOM 932 CD1 ILE 140 13.766 -2.646 -8.981 1.00 0.00 ATOM 933 O ILE 140 17.817 -2.595 -5.291 1.00 0.00 ATOM 934 C ILE 140 16.728 -2.983 -4.855 1.00 0.00 ATOM 935 N MET 141 16.602 -3.811 -3.825 1.00 0.00 ATOM 936 CA MET 141 17.747 -4.260 -3.078 1.00 0.00 ATOM 937 CB MET 141 17.974 -3.367 -1.856 1.00 0.00 ATOM 938 CG MET 141 18.343 -1.932 -2.199 1.00 0.00 ATOM 939 SD MET 141 18.650 -0.926 -0.734 1.00 0.00 ATOM 940 CE MET 141 19.006 0.661 -1.483 1.00 0.00 ATOM 941 O MET 141 16.505 -6.300 -2.753 1.00 0.00 ATOM 942 C MET 141 17.579 -5.704 -2.645 1.00 0.00 ATOM 943 N ASP 142 18.672 -6.253 -2.170 1.00 0.00 ATOM 944 CA ASP 142 18.693 -7.596 -1.628 1.00 0.00 ATOM 945 CB ASP 142 19.939 -8.345 -2.102 1.00 0.00 ATOM 946 CG ASP 142 21.221 -7.744 -1.559 1.00 0.00 ATOM 947 OD1 ASP 142 21.149 -6.983 -0.572 1.00 0.00 ATOM 948 OD2 ASP 142 22.298 -8.035 -2.123 1.00 0.00 ATOM 949 O ASP 142 18.651 -6.530 0.550 1.00 0.00 ATOM 950 C ASP 142 18.640 -7.578 -0.107 1.00 0.00 ATOM 951 N VAL 143 18.631 -8.792 0.431 1.00 0.00 ATOM 952 CA VAL 143 18.528 -9.084 1.865 1.00 0.00 ATOM 953 CB VAL 143 18.597 -10.598 2.138 1.00 0.00 ATOM 954 CG1 VAL 143 19.549 -10.888 3.288 1.00 0.00 ATOM 955 CG2 VAL 143 17.212 -11.150 2.436 1.00 0.00 ATOM 956 O VAL 143 19.180 -7.878 3.757 1.00 0.00 ATOM 957 C VAL 143 19.527 -8.451 2.742 1.00 0.00 ATOM 958 N LYS 144 20.788 -8.578 2.408 1.00 0.00 ATOM 959 CA LYS 144 21.795 -7.976 3.254 1.00 0.00 ATOM 960 CB LYS 144 23.196 -8.267 2.711 1.00 0.00 ATOM 961 CG LYS 144 23.625 -9.717 2.848 1.00 0.00 ATOM 962 CD LYS 144 25.020 -9.935 2.286 1.00 0.00 ATOM 963 CE LYS 144 25.456 -11.385 2.433 1.00 0.00 ATOM 964 NZ LYS 144 26.804 -11.622 1.850 1.00 0.00 ATOM 965 O LYS 144 21.965 -5.869 4.420 1.00 0.00 ATOM 966 C LYS 144 21.612 -6.477 3.396 1.00 0.00 ATOM 967 N GLU 145 21.155 -5.865 2.315 1.00 0.00 ATOM 968 CA GLU 145 20.950 -4.435 2.333 1.00 0.00 ATOM 969 CB GLU 145 20.518 -3.938 0.952 1.00 0.00 ATOM 970 CG GLU 145 21.611 -4.006 -0.102 1.00 0.00 ATOM 971 CD GLU 145 22.778 -3.090 0.209 1.00 0.00 ATOM 972 OE1 GLU 145 22.541 -1.890 0.458 1.00 0.00 ATOM 973 OE2 GLU 145 23.931 -3.574 0.202 1.00 0.00 ATOM 974 O GLU 145 20.087 -3.227 4.212 1.00 0.00 ATOM 975 C GLU 145 19.915 -4.122 3.390 1.00 0.00 ATOM 976 N TYR 146 18.850 -4.913 3.417 1.00 0.00 ATOM 977 CA TYR 146 17.821 -4.625 4.386 1.00 0.00 ATOM 978 CB TYR 146 16.541 -5.393 4.054 1.00 0.00 ATOM 979 CG TYR 146 15.396 -5.111 4.999 1.00 0.00 ATOM 980 CD1 TYR 146 14.659 -3.938 4.896 1.00 0.00 ATOM 981 CD2 TYR 146 15.053 -6.020 5.992 1.00 0.00 ATOM 982 CE1 TYR 146 13.609 -3.673 5.757 1.00 0.00 ATOM 983 CE2 TYR 146 14.008 -5.772 6.862 1.00 0.00 ATOM 984 CZ TYR 146 13.285 -4.587 6.736 1.00 0.00 ATOM 985 OH TYR 146 12.242 -4.325 7.594 1.00 0.00 ATOM 986 O TYR 146 17.962 -4.192 6.701 1.00 0.00 ATOM 987 C TYR 146 18.256 -4.958 5.824 1.00 0.00 ATOM 988 N LEU 147 19.011 -6.001 6.042 1.00 0.00 ATOM 989 CA LEU 147 19.548 -6.245 7.332 1.00 0.00 ATOM 990 CB LEU 147 20.386 -7.526 7.330 1.00 0.00 ATOM 991 CG LEU 147 19.660 -8.813 7.726 1.00 0.00 ATOM 992 CD1 LEU 147 18.300 -8.893 7.049 1.00 0.00 ATOM 993 CD2 LEU 147 20.498 -10.032 7.376 1.00 0.00 ATOM 994 O LEU 147 20.405 -4.807 9.032 1.00 0.00 ATOM 995 C LEU 147 20.381 -5.107 7.826 1.00 0.00 ATOM 996 N LYS 148 21.200 -4.552 6.929 1.00 0.00 ATOM 997 CA LYS 148 22.059 -3.456 7.275 1.00 0.00 ATOM 998 CB LYS 148 22.974 -3.101 6.103 1.00 0.00 ATOM 999 CG LYS 148 23.932 -1.956 6.387 1.00 0.00 ATOM 1000 CD LYS 148 24.842 -1.688 5.200 1.00 0.00 ATOM 1001 CE LYS 148 25.779 -0.522 5.473 1.00 0.00 ATOM 1002 NZ LYS 148 26.676 -0.248 4.317 1.00 0.00 ATOM 1003 O LYS 148 21.535 -1.645 8.676 1.00 0.00 ATOM 1004 C LYS 148 21.260 -2.273 7.683 1.00 0.00 ATOM 1005 N ASN 149 20.260 -1.938 6.885 1.00 0.00 ATOM 1006 CA ASN 149 19.384 -0.808 7.236 1.00 0.00 ATOM 1007 CB ASN 149 18.400 -0.520 6.099 1.00 0.00 ATOM 1008 CG ASN 149 19.064 0.138 4.906 1.00 0.00 ATOM 1009 ND2 ASN 149 18.412 0.063 3.752 1.00 0.00 ATOM 1010 OD1 ASN 149 20.150 0.707 5.023 1.00 0.00 ATOM 1011 O ASN 149 18.467 -0.037 9.242 1.00 0.00 ATOM 1012 C ASN 149 18.618 -0.984 8.491 1.00 0.00 ATOM 1013 N ALA 150 18.177 -2.204 8.771 1.00 0.00 ATOM 1014 CA ALA 150 17.418 -2.474 9.985 1.00 0.00 ATOM 1015 CB ALA 150 16.678 -3.798 9.864 1.00 0.00 ATOM 1016 O ALA 150 17.613 -2.397 12.370 1.00 0.00 ATOM 1017 C ALA 150 18.188 -2.520 11.274 1.00 0.00 ATOM 1018 N LEU 151 19.472 -2.785 11.166 1.00 0.00 ATOM 1019 CA LEU 151 20.314 -2.983 12.318 1.00 0.00 ATOM 1020 CB LEU 151 21.775 -3.143 11.893 1.00 0.00 ATOM 1021 CG LEU 151 22.775 -3.450 13.008 1.00 0.00 ATOM 1022 CD1 LEU 151 22.510 -4.824 13.606 1.00 0.00 ATOM 1023 CD2 LEU 151 24.203 -3.368 12.488 1.00 0.00 ATOM 1024 O LEU 151 20.287 -0.717 12.950 1.00 0.00 ATOM 1025 C LEU 151 20.204 -1.851 13.317 1.00 0.00 ATOM 1026 N GLU 152 19.981 -2.194 14.577 1.00 0.00 ATOM 1027 CA GLU 152 19.897 -1.228 15.640 1.00 0.00 ATOM 1028 CB GLU 152 20.816 -0.039 15.358 1.00 0.00 ATOM 1029 CG GLU 152 22.290 -0.402 15.263 1.00 0.00 ATOM 1030 CD GLU 152 23.173 0.806 15.019 1.00 0.00 ATOM 1031 OE1 GLU 152 22.660 1.943 15.099 1.00 0.00 ATOM 1032 OE2 GLU 152 24.377 0.616 14.748 1.00 0.00 ATOM 1033 O GLU 152 18.338 0.001 16.898 1.00 0.00 ATOM 1034 C GLU 152 18.511 -0.687 15.914 1.00 0.00 ATOM 1035 N SER 153 17.522 -0.982 15.082 1.00 0.00 ATOM 1036 CA SER 153 16.161 -0.496 15.357 1.00 0.00 ATOM 1037 CB SER 153 15.651 0.355 14.192 1.00 0.00 ATOM 1038 OG SER 153 15.454 -0.435 13.032 1.00 0.00 ATOM 1039 O SER 153 15.632 -2.814 15.702 1.00 0.00 ATOM 1040 C SER 153 15.208 -1.657 15.616 1.00 0.00 ATOM 1041 N ASP 154 13.921 -1.361 15.701 1.00 0.00 ATOM 1042 CA ASP 154 12.919 -2.383 15.836 1.00 0.00 ATOM 1043 CB ASP 154 11.650 -1.809 16.471 1.00 0.00 ATOM 1044 CG ASP 154 11.843 -1.452 17.933 1.00 0.00 ATOM 1045 OD1 ASP 154 12.815 -1.945 18.542 1.00 0.00 ATOM 1046 OD2 ASP 154 11.021 -0.677 18.468 1.00 0.00 ATOM 1047 O ASP 154 12.557 -2.152 13.503 1.00 0.00 ATOM 1048 C ASP 154 12.675 -2.926 14.460 1.00 0.00 ATOM 1049 N LEU 155 12.597 -4.251 14.342 1.00 0.00 ATOM 1050 CA LEU 155 12.376 -4.918 13.030 1.00 0.00 ATOM 1051 CB LEU 155 13.678 -5.535 12.516 1.00 0.00 ATOM 1052 CG LEU 155 13.637 -6.130 11.108 1.00 0.00 ATOM 1053 CD1 LEU 155 15.031 -6.174 10.501 1.00 0.00 ATOM 1054 CD2 LEU 155 13.026 -7.523 11.130 1.00 0.00 ATOM 1055 O LEU 155 11.299 -6.706 14.123 1.00 0.00 ATOM 1056 C LEU 155 11.313 -5.964 13.144 1.00 0.00 ATOM 1057 N GLN 156 10.384 -5.940 12.191 1.00 0.00 ATOM 1058 CA GLN 156 9.193 -6.827 12.154 1.00 0.00 ATOM 1059 CB GLN 156 7.921 -6.030 12.445 1.00 0.00 ATOM 1060 CG GLN 156 7.883 -5.405 13.832 1.00 0.00 ATOM 1061 CD GLN 156 6.596 -4.648 14.094 1.00 0.00 ATOM 1062 OE1 GLN 156 5.829 -4.370 13.172 1.00 0.00 ATOM 1063 NE2 GLN 156 6.356 -4.313 15.356 1.00 0.00 ATOM 1064 O GLN 156 9.481 -6.948 9.805 1.00 0.00 ATOM 1065 C GLN 156 9.083 -7.515 10.823 1.00 0.00 ATOM 1066 N LEU 157 8.547 -8.733 10.843 1.00 0.00 ATOM 1067 CA LEU 157 8.225 -9.511 9.654 1.00 0.00 ATOM 1068 CB LEU 157 8.982 -10.841 9.662 1.00 0.00 ATOM 1069 CG LEU 157 10.472 -10.774 9.324 1.00 0.00 ATOM 1070 CD1 LEU 157 11.259 -10.161 10.473 1.00 0.00 ATOM 1071 CD2 LEU 157 11.012 -12.158 8.994 1.00 0.00 ATOM 1072 O LEU 157 6.154 -10.276 10.645 1.00 0.00 ATOM 1073 C LEU 157 6.709 -9.682 9.685 1.00 0.00 TER END