PFRMAT TS TARGET T0634 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 T0634 model 5 Wed Jul 14 20:22:50 2010 MODEL 5 PARENT N/A ATOM 2 N LEU 3 -4.276 12.502 1.430 1.00 0.00 ATOM 3 CA LEU 3 -4.569 11.765 0.221 1.00 0.00 ATOM 4 CB LEU 3 -5.490 12.577 -0.692 1.00 0.00 ATOM 5 CG LEU 3 -6.898 12.853 -0.162 1.00 0.00 ATOM 6 CD1 LEU 3 -7.654 13.781 -1.100 1.00 0.00 ATOM 7 CD2 LEU 3 -7.666 11.554 0.028 1.00 0.00 ATOM 8 O LEU 3 -3.145 11.446 -1.672 1.00 0.00 ATOM 9 C LEU 3 -3.246 11.440 -0.452 1.00 0.00 ATOM 10 N LYS 4 -2.231 11.156 0.355 1.00 0.00 ATOM 11 CA LYS 4 -0.921 10.778 -0.154 1.00 0.00 ATOM 12 CB LYS 4 0.170 11.137 0.857 1.00 0.00 ATOM 13 CG LYS 4 1.583 10.878 0.363 1.00 0.00 ATOM 14 CD LYS 4 2.616 11.306 1.392 1.00 0.00 ATOM 15 CE LYS 4 4.030 11.022 0.908 1.00 0.00 ATOM 16 NZ LYS 4 5.052 11.425 1.913 1.00 0.00 ATOM 17 O LYS 4 -1.161 8.455 0.413 1.00 0.00 ATOM 18 C LYS 4 -0.922 9.280 -0.460 1.00 0.00 ATOM 19 N LYS 5 -0.675 8.926 -1.715 1.00 0.00 ATOM 20 CA LYS 5 -0.748 7.532 -2.157 1.00 0.00 ATOM 21 CB LYS 5 -1.810 7.371 -3.247 1.00 0.00 ATOM 22 CG LYS 5 -3.204 7.804 -2.825 1.00 0.00 ATOM 23 CD LYS 5 -3.774 6.871 -1.768 1.00 0.00 ATOM 24 CE LYS 5 -5.166 7.309 -1.338 1.00 0.00 ATOM 25 NZ LYS 5 -5.128 8.560 -0.532 1.00 0.00 ATOM 26 O LYS 5 1.097 7.597 -3.628 1.00 0.00 ATOM 27 C LYS 5 0.598 7.069 -2.657 1.00 0.00 ATOM 28 N ILE 6 1.172 6.067 -2.015 1.00 0.00 ATOM 29 CA ILE 6 2.454 5.505 -2.457 1.00 0.00 ATOM 30 CB ILE 6 3.251 4.919 -1.278 1.00 0.00 ATOM 31 CG1 ILE 6 3.472 5.983 -0.201 1.00 0.00 ATOM 32 CG2 ILE 6 4.563 4.324 -1.765 1.00 0.00 ATOM 33 CD1 ILE 6 4.232 7.196 -0.690 1.00 0.00 ATOM 34 O ILE 6 1.428 3.500 -3.259 1.00 0.00 ATOM 35 C ILE 6 2.161 4.449 -3.517 1.00 0.00 ATOM 36 N LEU 7 2.680 4.666 -4.724 1.00 0.00 ATOM 37 CA LEU 7 2.436 3.774 -5.852 1.00 0.00 ATOM 38 CB LEU 7 2.101 4.579 -7.109 1.00 0.00 ATOM 39 CG LEU 7 1.839 3.771 -8.382 1.00 0.00 ATOM 40 CD1 LEU 7 0.619 2.877 -8.209 1.00 0.00 ATOM 41 CD2 LEU 7 1.651 4.695 -9.576 1.00 0.00 ATOM 42 O LEU 7 4.603 3.281 -6.775 1.00 0.00 ATOM 43 C LEU 7 3.644 2.884 -6.097 1.00 0.00 ATOM 44 N ILE 8 3.599 1.688 -5.534 1.00 0.00 ATOM 45 CA ILE 8 4.727 0.756 -5.597 1.00 0.00 ATOM 46 CB ILE 8 4.918 0.008 -4.265 1.00 0.00 ATOM 47 CG1 ILE 8 5.161 1.001 -3.127 1.00 0.00 ATOM 48 CG2 ILE 8 6.043 -1.008 -4.381 1.00 0.00 ATOM 49 CD1 ILE 8 5.153 0.370 -1.752 1.00 0.00 ATOM 50 O ILE 8 3.847 -1.263 -6.620 1.00 0.00 ATOM 51 C ILE 8 4.488 -0.222 -6.752 1.00 0.00 ATOM 52 N ILE 9 5.000 0.158 -7.916 1.00 0.00 ATOM 53 CA ILE 9 4.705 -0.532 -9.156 1.00 0.00 ATOM 54 CB ILE 9 3.445 0.038 -9.833 1.00 0.00 ATOM 55 CG1 ILE 9 3.088 -0.785 -11.073 1.00 0.00 ATOM 56 CG2 ILE 9 3.638 1.509 -10.167 1.00 0.00 ATOM 57 CD1 ILE 9 1.703 -0.502 -11.616 1.00 0.00 ATOM 58 O ILE 9 6.386 0.744 -10.295 1.00 0.00 ATOM 59 C ILE 9 5.952 -0.383 -10.007 1.00 0.00 ATOM 60 N ASP 10 6.542 -1.502 -10.414 1.00 0.00 ATOM 61 CA ASP 10 7.760 -1.452 -11.229 1.00 0.00 ATOM 62 CB ASP 10 8.585 -2.726 -11.036 1.00 0.00 ATOM 63 CG ASP 10 7.781 -3.985 -11.291 1.00 0.00 ATOM 64 OD1 ASP 10 6.589 -4.014 -10.919 1.00 0.00 ATOM 65 OD2 ASP 10 8.343 -4.944 -11.862 1.00 0.00 ATOM 66 O ASP 10 8.451 -0.916 -13.433 1.00 0.00 ATOM 67 C ASP 10 7.519 -1.265 -12.718 1.00 0.00 ATOM 68 N GLN 11 6.290 -1.485 -13.185 1.00 0.00 ATOM 69 CA GLN 11 5.993 -1.300 -14.611 1.00 0.00 ATOM 70 CB GLN 11 4.791 -2.153 -15.022 1.00 0.00 ATOM 71 CG GLN 11 4.409 -2.021 -16.488 1.00 0.00 ATOM 72 CD GLN 11 5.476 -2.568 -17.418 1.00 0.00 ATOM 73 OE1 GLN 11 5.871 -3.728 -17.311 1.00 0.00 ATOM 74 NE2 GLN 11 5.944 -1.730 -18.336 1.00 0.00 ATOM 75 O GLN 11 4.704 0.717 -14.425 1.00 0.00 ATOM 76 C GLN 11 5.744 0.190 -14.846 1.00 0.00 ATOM 77 N GLN 12 6.692 0.871 -15.485 1.00 0.00 ATOM 78 CA GLN 12 6.618 2.327 -15.612 1.00 0.00 ATOM 79 CB GLN 12 7.816 2.858 -16.401 1.00 0.00 ATOM 80 CG GLN 12 9.140 2.762 -15.659 1.00 0.00 ATOM 81 CD GLN 12 10.317 3.190 -16.512 1.00 0.00 ATOM 82 OE1 GLN 12 10.239 4.176 -17.246 1.00 0.00 ATOM 83 NE2 GLN 12 11.415 2.448 -16.419 1.00 0.00 ATOM 84 O GLN 12 4.798 3.814 -15.790 1.00 0.00 ATOM 85 C GLN 12 5.358 2.853 -16.271 1.00 0.00 ATOM 86 N ASP 13 4.899 2.272 -17.375 1.00 0.00 ATOM 87 CA ASP 13 3.682 2.815 -17.986 1.00 0.00 ATOM 88 CB ASP 13 3.367 2.087 -19.294 1.00 0.00 ATOM 89 CG ASP 13 4.333 2.441 -20.407 1.00 0.00 ATOM 90 OD1 ASP 13 5.067 3.441 -20.260 1.00 0.00 ATOM 91 OD2 ASP 13 4.355 1.720 -21.427 1.00 0.00 ATOM 92 O ASP 13 1.681 3.678 -17.043 1.00 0.00 ATOM 93 C ASP 13 2.484 2.732 -17.065 1.00 0.00 ATOM 94 N PHE 14 2.363 1.644 -16.304 1.00 0.00 ATOM 95 CA PHE 14 1.296 1.503 -15.328 1.00 0.00 ATOM 96 CB PHE 14 1.252 0.073 -14.785 1.00 0.00 ATOM 97 CG PHE 14 0.711 -0.930 -15.763 1.00 0.00 ATOM 98 CD1 PHE 14 0.009 -0.517 -16.882 1.00 0.00 ATOM 99 CD2 PHE 14 0.904 -2.285 -15.564 1.00 0.00 ATOM 100 CE1 PHE 14 -0.488 -1.441 -17.782 1.00 0.00 ATOM 101 CE2 PHE 14 0.405 -3.208 -16.463 1.00 0.00 ATOM 102 CZ PHE 14 -0.288 -2.792 -17.570 1.00 0.00 ATOM 103 O PHE 14 0.488 3.176 -13.767 1.00 0.00 ATOM 104 C PHE 14 1.435 2.489 -14.154 1.00 0.00 ATOM 105 N SER 15 2.645 2.592 -13.609 1.00 0.00 ATOM 106 CA SER 15 2.893 3.508 -12.500 1.00 0.00 ATOM 107 CB SER 15 4.355 3.427 -12.055 1.00 0.00 ATOM 108 OG SER 15 5.226 3.884 -13.074 1.00 0.00 ATOM 109 O SER 15 1.901 5.662 -12.130 1.00 0.00 ATOM 110 C SER 15 2.539 4.947 -12.894 1.00 0.00 ATOM 111 N ARG 16 2.951 5.370 -14.084 1.00 0.00 ATOM 112 CA ARG 16 2.677 6.738 -14.534 1.00 0.00 ATOM 113 CB ARG 16 3.492 7.064 -15.787 1.00 0.00 ATOM 114 CG ARG 16 4.985 7.205 -15.537 1.00 0.00 ATOM 115 CD ARG 16 5.691 7.813 -16.738 1.00 0.00 ATOM 116 NE ARG 16 5.599 6.958 -17.918 1.00 0.00 ATOM 117 CZ ARG 16 6.458 5.985 -18.206 1.00 0.00 ATOM 118 NH1 ARG 16 6.295 5.259 -19.302 1.00 0.00 ATOM 119 NH2 ARG 16 7.480 5.742 -17.396 1.00 0.00 ATOM 120 O ARG 16 0.677 8.044 -14.538 1.00 0.00 ATOM 121 C ARG 16 1.204 6.967 -14.818 1.00 0.00 ATOM 122 N ILE 17 0.528 5.956 -15.359 1.00 0.00 ATOM 123 CA ILE 17 -0.907 6.063 -15.556 1.00 0.00 ATOM 124 CB ILE 17 -1.468 4.835 -16.296 1.00 0.00 ATOM 125 CG1 ILE 17 -0.967 4.810 -17.742 1.00 0.00 ATOM 126 CG2 ILE 17 -2.987 4.816 -16.224 1.00 0.00 ATOM 127 CD1 ILE 17 -1.233 3.503 -18.458 1.00 0.00 ATOM 128 O ILE 17 -2.529 7.093 -14.109 1.00 0.00 ATOM 129 C ILE 17 -1.620 6.239 -14.230 1.00 0.00 ATOM 130 N GLU 18 -1.218 5.445 -13.248 1.00 0.00 ATOM 131 CA GLU 18 -1.844 5.529 -11.931 1.00 0.00 ATOM 132 CB GLU 18 -1.285 4.450 -11.002 1.00 0.00 ATOM 133 CG GLU 18 -1.714 3.037 -11.363 1.00 0.00 ATOM 134 CD GLU 18 -1.079 1.990 -10.469 1.00 0.00 ATOM 135 OE1 GLU 18 0.152 1.798 -10.560 1.00 0.00 ATOM 136 OE2 GLU 18 -1.812 1.361 -9.678 1.00 0.00 ATOM 137 O GLU 18 -2.553 7.545 -10.823 1.00 0.00 ATOM 138 C GLU 18 -1.617 6.927 -11.350 1.00 0.00 ATOM 139 N LEU 19 -0.393 7.445 -11.462 1.00 0.00 ATOM 140 CA LEU 19 -0.118 8.765 -10.902 1.00 0.00 ATOM 141 CB LEU 19 1.358 9.126 -11.082 1.00 0.00 ATOM 142 CG LEU 19 1.840 10.387 -10.361 1.00 0.00 ATOM 143 CD1 LEU 19 3.356 10.390 -10.239 1.00 0.00 ATOM 144 CD2 LEU 19 1.365 11.636 -11.086 1.00 0.00 ATOM 145 O LEU 19 -1.563 10.683 -10.884 1.00 0.00 ATOM 146 C LEU 19 -1.009 9.814 -11.556 1.00 0.00 ATOM 147 N LYS 20 -1.153 9.739 -12.880 1.00 0.00 ATOM 148 CA LYS 20 -1.987 10.687 -13.608 1.00 0.00 ATOM 149 CB LYS 20 -1.942 10.397 -15.109 1.00 0.00 ATOM 150 CG LYS 20 -2.775 11.351 -15.951 1.00 0.00 ATOM 151 CD LYS 20 -2.646 11.037 -17.433 1.00 0.00 ATOM 152 CE LYS 20 -3.505 11.969 -18.271 1.00 0.00 ATOM 153 NZ LYS 20 -3.389 11.672 -19.726 1.00 0.00 ATOM 154 O LYS 20 -4.069 11.698 -12.875 1.00 0.00 ATOM 155 C LYS 20 -3.441 10.655 -13.115 1.00 0.00 ATOM 156 N ASN 21 -4.004 9.453 -13.023 1.00 0.00 ATOM 157 CA ASN 21 -5.394 9.308 -12.562 1.00 0.00 ATOM 158 CB ASN 21 -5.822 7.839 -12.601 1.00 0.00 ATOM 159 CG ASN 21 -6.052 7.338 -14.013 1.00 0.00 ATOM 160 ND2 ASN 21 -6.029 6.021 -14.184 1.00 0.00 ATOM 161 OD1 ASN 21 -6.246 8.126 -14.939 1.00 0.00 ATOM 162 O ASN 21 -6.451 10.649 -10.873 1.00 0.00 ATOM 163 C ASN 21 -5.536 9.893 -11.153 1.00 0.00 ATOM 164 N PHE 22 -4.594 9.575 -10.296 1.00 0.00 ATOM 165 CA PHE 22 -4.645 10.064 -8.921 1.00 0.00 ATOM 166 CB PHE 22 -3.528 9.435 -8.085 1.00 0.00 ATOM 167 CG PHE 22 -3.779 7.998 -7.725 1.00 0.00 ATOM 168 CD1 PHE 22 -5.035 7.440 -7.878 1.00 0.00 ATOM 169 CD2 PHE 22 -2.757 7.207 -7.230 1.00 0.00 ATOM 170 CE1 PHE 22 -5.265 6.119 -7.545 1.00 0.00 ATOM 171 CE2 PHE 22 -2.987 5.885 -6.896 1.00 0.00 ATOM 172 CZ PHE 22 -4.235 5.340 -7.051 1.00 0.00 ATOM 173 O PHE 22 -5.348 12.201 -8.088 1.00 0.00 ATOM 174 C PHE 22 -4.543 11.585 -8.806 1.00 0.00 ATOM 175 N LEU 23 -3.584 12.185 -9.514 1.00 0.00 ATOM 176 CA LEU 23 -3.455 13.646 -9.590 1.00 0.00 ATOM 177 CB LEU 23 -2.363 14.036 -10.587 1.00 0.00 ATOM 178 CG LEU 23 -2.138 15.537 -10.794 1.00 0.00 ATOM 179 CD1 LEU 23 -1.698 16.198 -9.497 1.00 0.00 ATOM 180 CD2 LEU 23 -1.110 15.780 -11.887 1.00 0.00 ATOM 181 O LEU 23 -5.222 15.266 -9.370 1.00 0.00 ATOM 182 C LEU 23 -4.788 14.297 -9.986 1.00 0.00 ATOM 183 N ASP 24 -5.438 13.745 -11.002 1.00 0.00 ATOM 184 CA ASP 24 -6.635 14.379 -11.571 1.00 0.00 ATOM 185 CB ASP 24 -6.922 13.823 -12.968 1.00 0.00 ATOM 186 CG ASP 24 -5.883 14.242 -13.988 1.00 0.00 ATOM 187 OD1 ASP 24 -5.223 15.280 -13.771 1.00 0.00 ATOM 188 OD2 ASP 24 -5.728 13.534 -15.006 1.00 0.00 ATOM 189 O ASP 24 -8.902 14.844 -10.922 1.00 0.00 ATOM 190 C ASP 24 -7.858 14.197 -10.696 1.00 0.00 ATOM 191 N SER 25 -7.741 13.328 -9.702 1.00 0.00 ATOM 192 CA SER 25 -8.826 13.054 -8.776 1.00 0.00 ATOM 193 CB SER 25 -9.107 11.551 -8.709 1.00 0.00 ATOM 194 OG SER 25 -7.969 10.839 -8.254 1.00 0.00 ATOM 195 O SER 25 -9.196 13.132 -6.408 1.00 0.00 ATOM 196 C SER 25 -8.552 13.575 -7.360 1.00 0.00 ATOM 197 N GLU 26 -7.587 14.485 -7.224 1.00 0.00 ATOM 198 CA GLU 26 -7.355 15.147 -5.947 1.00 0.00 ATOM 199 CB GLU 26 -8.674 15.339 -5.194 1.00 0.00 ATOM 200 CG GLU 26 -9.736 16.085 -5.986 1.00 0.00 ATOM 201 CD GLU 26 -9.352 17.524 -6.266 1.00 0.00 ATOM 202 OE1 GLU 26 -8.413 18.026 -5.614 1.00 0.00 ATOM 203 OE2 GLU 26 -9.990 18.149 -7.139 1.00 0.00 ATOM 204 O GLU 26 -6.316 14.849 -3.812 1.00 0.00 ATOM 205 C GLU 26 -6.395 14.475 -4.982 1.00 0.00 ATOM 206 N TYR 27 -5.683 13.456 -5.449 1.00 0.00 ATOM 207 CA TYR 27 -4.706 12.758 -4.607 1.00 0.00 ATOM 208 CB TYR 27 -4.798 11.246 -4.820 1.00 0.00 ATOM 209 CG TYR 27 -6.097 10.639 -4.340 1.00 0.00 ATOM 210 CD1 TYR 27 -7.191 10.537 -5.190 1.00 0.00 ATOM 211 CD2 TYR 27 -6.226 10.169 -3.040 1.00 0.00 ATOM 212 CE1 TYR 27 -8.383 9.983 -4.762 1.00 0.00 ATOM 213 CE2 TYR 27 -7.409 9.612 -2.594 1.00 0.00 ATOM 214 CZ TYR 27 -8.491 9.523 -3.467 1.00 0.00 ATOM 215 OH TYR 27 -9.677 8.970 -3.037 1.00 0.00 ATOM 216 O TYR 27 -3.048 13.896 -5.895 1.00 0.00 ATOM 217 C TYR 27 -3.298 13.229 -4.883 1.00 0.00 ATOM 218 N LEU 28 -2.397 12.866 -3.975 1.00 0.00 ATOM 219 CA LEU 28 -0.976 13.173 -4.128 1.00 0.00 ATOM 220 CB LEU 28 -0.467 13.972 -2.926 1.00 0.00 ATOM 221 CG LEU 28 -1.158 15.310 -2.660 1.00 0.00 ATOM 222 CD1 LEU 28 -0.634 15.940 -1.379 1.00 0.00 ATOM 223 CD2 LEU 28 -0.964 16.258 -3.833 1.00 0.00 ATOM 224 O LEU 28 0.212 11.260 -3.306 1.00 0.00 ATOM 225 C LEU 28 -0.183 11.889 -4.293 1.00 0.00 ATOM 226 N VAL 29 0.040 11.452 -5.523 1.00 0.00 ATOM 227 CA VAL 29 0.727 10.176 -5.742 1.00 0.00 ATOM 228 CB VAL 29 0.384 9.579 -7.119 1.00 0.00 ATOM 229 CG1 VAL 29 0.943 10.451 -8.233 1.00 0.00 ATOM 230 CG2 VAL 29 0.917 8.159 -7.233 1.00 0.00 ATOM 231 O VAL 29 2.800 11.417 -5.911 1.00 0.00 ATOM 232 C VAL 29 2.232 10.345 -5.610 1.00 0.00 ATOM 233 N ILE 30 2.872 9.283 -5.123 1.00 0.00 ATOM 234 CA ILE 30 4.330 9.198 -4.974 1.00 0.00 ATOM 235 CB ILE 30 4.748 9.212 -3.491 1.00 0.00 ATOM 236 CG1 ILE 30 4.235 10.481 -2.806 1.00 0.00 ATOM 237 CG2 ILE 30 6.256 9.067 -3.362 1.00 0.00 ATOM 238 CD1 ILE 30 4.857 11.755 -3.335 1.00 0.00 ATOM 239 O ILE 30 4.313 6.846 -5.406 1.00 0.00 ATOM 240 C ILE 30 4.808 7.926 -5.679 1.00 0.00 ATOM 241 N GLU 31 5.769 8.054 -6.588 1.00 0.00 ATOM 242 CA GLU 31 6.290 6.880 -7.306 1.00 0.00 ATOM 243 CB GLU 31 7.000 7.311 -8.592 1.00 0.00 ATOM 244 CG GLU 31 6.071 7.889 -9.649 1.00 0.00 ATOM 245 CD GLU 31 6.769 8.116 -10.976 1.00 0.00 ATOM 246 OE1 GLU 31 7.439 7.181 -11.462 1.00 0.00 ATOM 247 OE2 GLU 31 6.645 9.229 -11.528 1.00 0.00 ATOM 248 O GLU 31 8.122 6.640 -5.779 1.00 0.00 ATOM 249 C GLU 31 7.242 6.071 -6.440 1.00 0.00 ATOM 250 N SER 32 7.116 4.758 -6.505 1.00 0.00 ATOM 251 CA SER 32 8.136 3.863 -5.983 1.00 0.00 ATOM 252 CB SER 32 7.722 3.317 -4.616 1.00 0.00 ATOM 253 OG SER 32 7.605 4.361 -3.664 1.00 0.00 ATOM 254 O SER 32 7.516 1.819 -7.123 1.00 0.00 ATOM 255 C SER 32 8.350 2.737 -6.999 1.00 0.00 ATOM 256 N LYS 33 9.466 2.790 -7.714 1.00 0.00 ATOM 257 CA LYS 33 9.674 1.860 -8.831 1.00 0.00 ATOM 258 CB LYS 33 10.557 2.500 -9.905 1.00 0.00 ATOM 259 CG LYS 33 9.927 3.699 -10.594 1.00 0.00 ATOM 260 CD LYS 33 10.860 4.290 -11.638 1.00 0.00 ATOM 261 CE LYS 33 10.233 5.493 -12.322 1.00 0.00 ATOM 262 NZ LYS 33 11.148 6.101 -13.325 1.00 0.00 ATOM 263 O LYS 33 10.360 -0.388 -9.259 1.00 0.00 ATOM 264 C LYS 33 10.294 0.524 -8.440 1.00 0.00 ATOM 265 N ASN 34 10.752 0.408 -7.192 1.00 0.00 ATOM 266 CA ASN 34 11.323 -0.842 -6.706 1.00 0.00 ATOM 267 CB ASN 34 12.778 -0.978 -7.160 1.00 0.00 ATOM 268 CG ASN 34 13.653 0.153 -6.658 1.00 0.00 ATOM 269 ND2 ASN 34 14.371 0.796 -7.571 1.00 0.00 ATOM 270 OD1 ASN 34 13.681 0.444 -5.462 1.00 0.00 ATOM 271 O ASN 34 10.680 0.000 -4.563 1.00 0.00 ATOM 272 C ASN 34 11.210 -0.914 -5.192 1.00 0.00 ATOM 273 N GLU 35 11.657 -2.031 -4.626 1.00 0.00 ATOM 274 CA GLU 35 11.458 -2.289 -3.209 1.00 0.00 ATOM 275 CB GLU 35 11.980 -3.677 -2.839 1.00 0.00 ATOM 276 CG GLU 35 11.653 -4.105 -1.419 1.00 0.00 ATOM 277 CD GLU 35 12.629 -3.549 -0.401 1.00 0.00 ATOM 278 OE1 GLU 35 13.786 -3.272 -0.779 1.00 0.00 ATOM 279 OE2 GLU 35 12.237 -3.389 0.774 1.00 0.00 ATOM 280 O GLU 35 11.496 -0.677 -1.428 1.00 0.00 ATOM 281 C GLU 35 12.136 -1.231 -2.329 1.00 0.00 ATOM 282 N LYS 36 13.413 -0.953 -2.582 1.00 0.00 ATOM 283 CA LYS 36 14.141 0.002 -1.741 1.00 0.00 ATOM 284 CB LYS 36 15.622 0.038 -2.127 1.00 0.00 ATOM 285 CG LYS 36 16.393 -1.215 -1.745 1.00 0.00 ATOM 286 CD LYS 36 17.848 -1.120 -2.174 1.00 0.00 ATOM 287 CE LYS 36 18.615 -2.380 -1.807 1.00 0.00 ATOM 288 NZ LYS 36 20.033 -2.319 -2.259 1.00 0.00 ATOM 289 O LYS 36 13.452 2.126 -0.836 1.00 0.00 ATOM 290 C LYS 36 13.542 1.410 -1.842 1.00 0.00 ATOM 291 N GLU 37 13.065 1.783 -3.035 1.00 0.00 ATOM 292 CA GLU 37 12.421 3.084 -3.224 1.00 0.00 ATOM 293 CB GLU 37 12.063 3.296 -4.696 1.00 0.00 ATOM 294 CG GLU 37 11.438 4.649 -4.994 1.00 0.00 ATOM 295 CD GLU 37 11.169 4.853 -6.473 1.00 0.00 ATOM 296 OE1 GLU 37 11.873 4.232 -7.295 1.00 0.00 ATOM 297 OE2 GLU 37 10.253 5.634 -6.806 1.00 0.00 ATOM 298 O GLU 37 10.907 4.240 -1.766 1.00 0.00 ATOM 299 C GLU 37 11.180 3.192 -2.355 1.00 0.00 ATOM 300 N ALA 38 10.428 2.105 -2.260 1.00 0.00 ATOM 301 CA ALA 38 9.217 2.075 -1.444 1.00 0.00 ATOM 302 CB ALA 38 8.418 0.813 -1.728 1.00 0.00 ATOM 303 O ALA 38 8.937 2.937 0.750 1.00 0.00 ATOM 304 C ALA 38 9.543 2.161 0.026 1.00 0.00 ATOM 305 N LEU 39 10.517 1.377 0.469 1.00 0.00 ATOM 306 CA LEU 39 10.930 1.455 1.880 1.00 0.00 ATOM 307 CB LEU 39 12.071 0.473 2.160 1.00 0.00 ATOM 308 CG LEU 39 12.593 0.433 3.598 1.00 0.00 ATOM 309 CD1 LEU 39 11.488 0.031 4.561 1.00 0.00 ATOM 310 CD2 LEU 39 13.770 -0.522 3.714 1.00 0.00 ATOM 311 O LEU 39 11.075 3.364 3.366 1.00 0.00 ATOM 312 C LEU 39 11.358 2.881 2.246 1.00 0.00 ATOM 313 N GLU 40 12.025 3.559 1.311 1.00 0.00 ATOM 314 CA GLU 40 12.555 4.889 1.571 1.00 0.00 ATOM 315 CB GLU 40 13.583 5.274 0.506 1.00 0.00 ATOM 316 CG GLU 40 14.856 4.442 0.543 1.00 0.00 ATOM 317 CD GLU 40 15.844 4.845 -0.535 1.00 0.00 ATOM 318 OE1 GLU 40 15.513 5.736 -1.344 1.00 0.00 ATOM 319 OE2 GLU 40 16.953 4.268 -0.568 1.00 0.00 ATOM 320 O GLU 40 11.757 7.116 1.965 1.00 0.00 ATOM 321 C GLU 40 11.470 5.960 1.629 1.00 0.00 ATOM 322 N GLN 41 10.223 5.591 1.333 1.00 0.00 ATOM 323 CA GLN 41 9.094 6.521 1.461 1.00 0.00 ATOM 324 CB GLN 41 8.157 6.396 0.259 1.00 0.00 ATOM 325 CG GLN 41 8.714 6.988 -1.026 1.00 0.00 ATOM 326 CD GLN 41 8.862 8.495 -0.957 1.00 0.00 ATOM 327 OE1 GLN 41 8.158 9.163 -0.198 1.00 0.00 ATOM 328 NE2 GLN 41 9.778 9.036 -1.752 1.00 0.00 ATOM 329 O GLN 41 7.283 7.003 2.984 1.00 0.00 ATOM 330 C GLN 41 8.285 6.310 2.751 1.00 0.00 ATOM 331 N ILE 42 8.707 5.359 3.583 1.00 0.00 ATOM 332 CA ILE 42 8.015 5.094 4.850 1.00 0.00 ATOM 333 CB ILE 42 8.158 3.621 5.274 1.00 0.00 ATOM 334 CG1 ILE 42 9.632 3.265 5.479 1.00 0.00 ATOM 335 CG2 ILE 42 7.491 2.707 4.256 1.00 0.00 ATOM 336 CD1 ILE 42 9.850 1.912 6.122 1.00 0.00 ATOM 337 O ILE 42 9.200 5.551 6.915 1.00 0.00 ATOM 338 C ILE 42 8.510 5.988 5.982 1.00 0.00 ATOM 339 N ASP 43 8.148 7.264 5.873 1.00 0.00 ATOM 340 CA ASP 43 8.537 8.299 6.825 1.00 0.00 ATOM 341 CB ASP 43 10.030 8.607 6.700 1.00 0.00 ATOM 342 CG ASP 43 10.601 9.237 7.956 1.00 0.00 ATOM 343 OD1 ASP 43 9.830 9.464 8.910 1.00 0.00 ATOM 344 OD2 ASP 43 11.821 9.503 7.984 1.00 0.00 ATOM 345 O ASP 43 6.954 9.591 5.589 1.00 0.00 ATOM 346 C ASP 43 7.691 9.534 6.566 1.00 0.00 ATOM 347 N HIS 44 7.800 10.524 7.453 1.00 0.00 ATOM 348 CA HIS 44 7.034 11.763 7.342 1.00 0.00 ATOM 349 CB HIS 44 7.381 12.711 8.492 1.00 0.00 ATOM 350 CG HIS 44 6.522 13.936 8.545 1.00 0.00 ATOM 351 CD2 HIS 44 5.461 14.423 9.416 1.00 0.00 ATOM 352 ND1 HIS 44 6.624 14.957 7.626 1.00 0.00 ATOM 353 CE1 HIS 44 5.730 15.914 7.933 1.00 0.00 ATOM 354 NE2 HIS 44 5.027 15.599 9.005 1.00 0.00 ATOM 355 O HIS 44 8.443 12.626 5.602 1.00 0.00 ATOM 356 C HIS 44 7.285 12.463 5.994 1.00 0.00 ATOM 357 N HIS 45 6.234 12.867 5.267 1.00 0.00 ATOM 358 CA HIS 45 4.816 12.611 5.582 1.00 0.00 ATOM 359 CB HIS 45 3.921 13.648 4.900 1.00 0.00 ATOM 360 CG HIS 45 2.485 13.571 5.312 1.00 0.00 ATOM 361 CD2 HIS 45 1.594 14.385 6.128 1.00 0.00 ATOM 362 ND1 HIS 45 1.650 12.548 4.918 1.00 0.00 ATOM 363 CE1 HIS 45 0.429 12.752 5.443 1.00 0.00 ATOM 364 NE2 HIS 45 0.388 13.851 6.171 1.00 0.00 ATOM 365 O HIS 45 4.641 10.762 4.043 1.00 0.00 ATOM 366 C HIS 45 4.379 11.199 5.163 1.00 0.00 ATOM 367 N HIS 46 3.730 10.490 6.074 1.00 0.00 ATOM 368 CA HIS 46 3.429 9.075 5.882 1.00 0.00 ATOM 369 CB HIS 46 2.941 8.449 7.191 1.00 0.00 ATOM 370 CG HIS 46 3.995 8.365 8.251 1.00 0.00 ATOM 371 CD2 HIS 46 4.237 9.020 9.528 1.00 0.00 ATOM 372 ND1 HIS 46 5.076 7.515 8.161 1.00 0.00 ATOM 373 CE1 HIS 46 5.842 7.664 9.255 1.00 0.00 ATOM 374 NE2 HIS 46 5.345 8.566 10.080 1.00 0.00 ATOM 375 O HIS 46 1.469 9.736 4.687 1.00 0.00 ATOM 376 C HIS 46 2.388 8.912 4.785 1.00 0.00 ATOM 377 N PRO 47 2.520 7.869 3.954 1.00 0.00 ATOM 378 CA PRO 47 1.460 7.553 2.994 1.00 0.00 ATOM 379 CB PRO 47 1.965 6.294 2.285 1.00 0.00 ATOM 380 CG PRO 47 3.446 6.334 2.464 1.00 0.00 ATOM 381 CD PRO 47 3.687 6.982 3.798 1.00 0.00 ATOM 382 O PRO 47 0.138 6.736 4.825 1.00 0.00 ATOM 383 C PRO 47 0.156 7.306 3.722 1.00 0.00 ATOM 384 N ASP 48 -0.928 7.753 3.111 1.00 0.00 ATOM 385 CA ASP 48 -2.253 7.466 3.610 1.00 0.00 ATOM 386 CB ASP 48 -3.223 8.586 3.232 1.00 0.00 ATOM 387 CG ASP 48 -2.842 9.919 3.846 1.00 0.00 ATOM 388 OD1 ASP 48 -2.451 10.831 3.087 1.00 0.00 ATOM 389 OD2 ASP 48 -2.932 10.051 5.084 1.00 0.00 ATOM 390 O ASP 48 -3.662 5.566 3.735 1.00 0.00 ATOM 391 C ASP 48 -2.789 6.147 3.101 1.00 0.00 ATOM 392 N LEU 49 -2.262 5.682 1.964 1.00 0.00 ATOM 393 CA LEU 49 -2.630 4.398 1.381 1.00 0.00 ATOM 394 CB LEU 49 -3.968 4.508 0.645 1.00 0.00 ATOM 395 CG LEU 49 -4.515 3.215 0.037 1.00 0.00 ATOM 396 CD1 LEU 49 -6.026 3.144 0.197 1.00 0.00 ATOM 397 CD2 LEU 49 -4.133 3.108 -1.431 1.00 0.00 ATOM 398 O LEU 49 -0.845 4.839 -0.144 1.00 0.00 ATOM 399 C LEU 49 -1.503 3.981 0.452 1.00 0.00 ATOM 400 N VAL 50 -1.250 2.674 0.386 1.00 0.00 ATOM 401 CA VAL 50 -0.201 2.125 -0.486 1.00 0.00 ATOM 402 CB VAL 50 0.865 1.363 0.323 1.00 0.00 ATOM 403 CG1 VAL 50 1.908 0.762 -0.605 1.00 0.00 ATOM 404 CG2 VAL 50 1.518 2.282 1.342 1.00 0.00 ATOM 405 O VAL 50 -1.616 0.323 -1.189 1.00 0.00 ATOM 406 C VAL 50 -0.832 1.216 -1.535 1.00 0.00 ATOM 407 N ILE 51 -0.479 1.437 -2.806 1.00 0.00 ATOM 408 CA ILE 51 -0.810 0.535 -3.924 1.00 0.00 ATOM 409 CB ILE 51 -1.264 1.320 -5.168 1.00 0.00 ATOM 410 CG1 ILE 51 -2.457 2.216 -4.827 1.00 0.00 ATOM 411 CG2 ILE 51 -1.579 0.368 -6.312 1.00 0.00 ATOM 412 CD1 ILE 51 -3.658 1.461 -4.301 1.00 0.00 ATOM 413 O ILE 51 1.503 0.288 -4.301 1.00 0.00 ATOM 414 C ILE 51 0.415 -0.295 -4.194 1.00 0.00 ATOM 415 N LEU 52 0.273 -1.621 -4.235 1.00 0.00 ATOM 416 CA LEU 52 1.445 -2.486 -4.169 1.00 0.00 ATOM 417 CB LEU 52 1.608 -3.062 -2.761 1.00 0.00 ATOM 418 CG LEU 52 2.802 -3.993 -2.543 1.00 0.00 ATOM 419 CD1 LEU 52 4.109 -3.263 -2.813 1.00 0.00 ATOM 420 CD2 LEU 52 2.794 -4.556 -1.130 1.00 0.00 ATOM 421 O LEU 52 0.497 -4.465 -5.129 1.00 0.00 ATOM 422 C LEU 52 1.397 -3.630 -5.171 1.00 0.00 ATOM 423 N ASP 53 2.363 -3.673 -6.079 1.00 0.00 ATOM 424 CA ASP 53 2.528 -4.821 -6.973 1.00 0.00 ATOM 425 CB ASP 53 3.466 -4.468 -8.130 1.00 0.00 ATOM 426 CG ASP 53 3.411 -5.485 -9.254 1.00 0.00 ATOM 427 OD1 ASP 53 2.575 -6.409 -9.179 1.00 0.00 ATOM 428 OD2 ASP 53 4.207 -5.357 -10.209 1.00 0.00 ATOM 429 O ASP 53 3.696 -5.930 -5.182 1.00 0.00 ATOM 430 C ASP 53 3.066 -6.051 -6.231 1.00 0.00 ATOM 431 N MET 54 2.809 -7.241 -6.779 1.00 0.00 ATOM 432 CA MET 54 3.236 -8.488 -6.128 1.00 0.00 ATOM 433 CB MET 54 2.552 -9.693 -6.775 1.00 0.00 ATOM 434 CG MET 54 2.771 -11.002 -6.034 1.00 0.00 ATOM 435 SD MET 54 2.133 -10.964 -4.349 1.00 0.00 ATOM 436 CE MET 54 0.371 -11.071 -4.649 1.00 0.00 ATOM 437 O MET 54 5.276 -9.355 -5.232 1.00 0.00 ATOM 438 C MET 54 4.738 -8.734 -6.143 1.00 0.00 ATOM 439 N ASP 55 5.421 -8.229 -7.166 1.00 0.00 ATOM 440 CA ASP 55 6.849 -8.500 -7.291 1.00 0.00 ATOM 441 CB ASP 55 7.087 -9.719 -8.185 1.00 0.00 ATOM 442 CG ASP 55 8.540 -10.150 -8.207 1.00 0.00 ATOM 443 OD1 ASP 55 9.405 -9.343 -7.809 1.00 0.00 ATOM 444 OD2 ASP 55 8.814 -11.297 -8.623 1.00 0.00 ATOM 445 O ASP 55 7.058 -6.645 -8.757 1.00 0.00 ATOM 446 C ASP 55 7.547 -7.282 -7.845 1.00 0.00 ATOM 447 N ILE 56 8.659 -6.927 -7.221 1.00 0.00 ATOM 448 CA ILE 56 9.438 -5.740 -7.585 1.00 0.00 ATOM 449 CB ILE 56 9.259 -4.609 -6.554 1.00 0.00 ATOM 450 CG1 ILE 56 9.773 -5.051 -5.184 1.00 0.00 ATOM 451 CG2 ILE 56 7.806 -4.165 -6.499 1.00 0.00 ATOM 452 CD1 ILE 56 9.820 -3.937 -4.161 1.00 0.00 ATOM 453 O ILE 56 11.324 -7.101 -7.104 1.00 0.00 ATOM 454 C ILE 56 10.899 -6.118 -7.720 1.00 0.00 ATOM 455 N ILE 57 11.689 -5.300 -8.422 1.00 0.00 ATOM 456 CA ILE 57 13.148 -5.394 -8.288 1.00 0.00 ATOM 457 CB ILE 57 13.865 -4.378 -9.195 1.00 0.00 ATOM 458 CG1 ILE 57 13.597 -4.695 -10.668 1.00 0.00 ATOM 459 CG2 ILE 57 15.355 -4.344 -8.885 1.00 0.00 ATOM 460 CD1 ILE 57 14.071 -3.619 -11.621 1.00 0.00 ATOM 461 O ILE 57 12.999 -4.215 -6.204 1.00 0.00 ATOM 462 C ILE 57 13.490 -5.180 -6.818 1.00 0.00 ATOM 463 N GLY 58 14.247 -6.107 -6.253 1.00 0.00 ATOM 464 CA GLY 58 14.751 -5.937 -4.901 1.00 0.00 ATOM 465 O GLY 58 14.398 -6.514 -2.620 1.00 0.00 ATOM 466 C GLY 58 13.916 -6.507 -3.764 1.00 0.00 ATOM 467 N GLU 59 12.688 -6.952 -4.043 1.00 0.00 ATOM 468 CA GLU 59 11.823 -7.448 -2.986 1.00 0.00 ATOM 469 CB GLU 59 11.788 -6.464 -1.815 1.00 0.00 ATOM 470 CG GLU 59 13.124 -6.291 -1.110 1.00 0.00 ATOM 471 CD GLU 59 13.553 -7.538 -0.361 1.00 0.00 ATOM 472 OE1 GLU 59 12.677 -8.370 -0.042 1.00 0.00 ATOM 473 OE2 GLU 59 14.764 -7.683 -0.092 1.00 0.00 ATOM 474 O GLU 59 9.951 -7.095 -4.401 1.00 0.00 ATOM 475 C GLU 59 10.418 -7.709 -3.452 1.00 0.00 ATOM 476 N ASN 60 9.716 -8.590 -2.755 1.00 0.00 ATOM 477 CA ASN 60 8.332 -8.863 -3.130 1.00 0.00 ATOM 478 CB ASN 60 7.988 -10.332 -2.877 1.00 0.00 ATOM 479 CG ASN 60 8.735 -11.272 -3.803 1.00 0.00 ATOM 480 ND2 ASN 60 9.328 -12.315 -3.232 1.00 0.00 ATOM 481 OD1 ASN 60 8.779 -11.062 -5.015 1.00 0.00 ATOM 482 O ASN 60 7.606 -7.357 -1.376 1.00 0.00 ATOM 483 C ASN 60 7.299 -7.980 -2.415 1.00 0.00 ATOM 484 N SER 61 6.068 -7.985 -2.925 1.00 0.00 ATOM 485 CA SER 61 4.962 -7.342 -2.247 1.00 0.00 ATOM 486 CB SER 61 3.685 -7.451 -3.083 1.00 0.00 ATOM 487 OG SER 61 2.596 -6.818 -2.435 1.00 0.00 ATOM 488 O SER 61 4.478 -7.191 0.089 1.00 0.00 ATOM 489 C SER 61 4.716 -7.932 -0.864 1.00 0.00 ATOM 490 N PRO 62 4.744 -9.258 -0.746 1.00 0.00 ATOM 491 CA PRO 62 4.530 -9.905 0.558 1.00 0.00 ATOM 492 CB PRO 62 4.586 -11.402 0.242 1.00 0.00 ATOM 493 CG PRO 62 4.157 -11.499 -1.184 1.00 0.00 ATOM 494 CD PRO 62 4.738 -10.298 -1.878 1.00 0.00 ATOM 495 O PRO 62 5.339 -9.197 2.715 1.00 0.00 ATOM 496 C PRO 62 5.620 -9.496 1.551 1.00 0.00 ATOM 497 N ASN 63 6.858 -9.415 1.085 1.00 0.00 ATOM 498 CA ASN 63 7.958 -8.929 1.919 1.00 0.00 ATOM 499 CB ASN 63 9.283 -9.010 1.158 1.00 0.00 ATOM 500 CG ASN 63 9.788 -10.434 1.018 1.00 0.00 ATOM 501 ND2 ASN 63 10.682 -10.651 0.060 1.00 0.00 ATOM 502 OD1 ASN 63 9.376 -11.323 1.760 1.00 0.00 ATOM 503 O ASN 63 7.894 -7.145 3.548 1.00 0.00 ATOM 504 C ASN 63 7.668 -7.493 2.381 1.00 0.00 ATOM 505 N LEU 64 7.177 -6.652 1.475 1.00 0.00 ATOM 506 CA LEU 64 6.871 -5.286 1.854 1.00 0.00 ATOM 507 CB LEU 64 6.497 -4.458 0.623 1.00 0.00 ATOM 508 CG LEU 64 7.629 -4.165 -0.365 1.00 0.00 ATOM 509 CD1 LEU 64 7.087 -3.499 -1.619 1.00 0.00 ATOM 510 CD2 LEU 64 8.693 -3.293 0.280 1.00 0.00 ATOM 511 O LEU 64 5.857 -4.421 3.823 1.00 0.00 ATOM 512 C LEU 64 5.753 -5.195 2.872 1.00 0.00 ATOM 513 N CYS 65 4.695 -5.989 2.704 1.00 0.00 ATOM 514 CA CYS 65 3.614 -5.984 3.684 1.00 0.00 ATOM 515 CB CYS 65 2.486 -6.919 3.242 1.00 0.00 ATOM 516 SG CYS 65 1.548 -6.333 1.812 1.00 0.00 ATOM 517 O CYS 65 3.793 -5.808 6.068 1.00 0.00 ATOM 518 C CYS 65 4.148 -6.396 5.058 1.00 0.00 ATOM 519 N LEU 66 5.019 -7.400 5.095 1.00 0.00 ATOM 520 CA LEU 66 5.553 -7.865 6.377 1.00 0.00 ATOM 521 CB LEU 66 6.389 -9.130 6.182 1.00 0.00 ATOM 522 CG LEU 66 5.624 -10.395 5.791 1.00 0.00 ATOM 523 CD1 LEU 66 6.586 -11.524 5.454 1.00 0.00 ATOM 524 CD2 LEU 66 4.680 -10.821 6.905 1.00 0.00 ATOM 525 O LEU 66 6.340 -6.582 8.246 1.00 0.00 ATOM 526 C LEU 66 6.384 -6.773 7.032 1.00 0.00 ATOM 527 N LYS 67 7.112 -6.027 6.205 1.00 0.00 ATOM 528 CA LYS 67 7.884 -4.887 6.666 1.00 0.00 ATOM 529 CB LYS 67 8.672 -4.270 5.508 1.00 0.00 ATOM 530 CG LYS 67 9.511 -3.065 5.901 1.00 0.00 ATOM 531 CD LYS 67 10.636 -3.458 6.844 1.00 0.00 ATOM 532 CE LYS 67 11.551 -2.279 7.134 1.00 0.00 ATOM 533 NZ LYS 67 12.622 -2.635 8.106 1.00 0.00 ATOM 534 O LYS 67 7.239 -3.376 8.419 1.00 0.00 ATOM 535 C LYS 67 6.968 -3.843 7.306 1.00 0.00 ATOM 536 N LEU 68 5.873 -3.528 6.632 1.00 0.00 ATOM 537 CA LEU 68 4.906 -2.562 7.133 1.00 0.00 ATOM 538 CB LEU 68 3.758 -2.386 6.136 1.00 0.00 ATOM 539 CG LEU 68 4.119 -1.745 4.794 1.00 0.00 ATOM 540 CD1 LEU 68 2.945 -1.824 3.828 1.00 0.00 ATOM 541 CD2 LEU 68 4.550 -0.300 4.987 1.00 0.00 ATOM 542 O LEU 68 4.161 -2.107 9.343 1.00 0.00 ATOM 543 C LEU 68 4.346 -2.964 8.486 1.00 0.00 ATOM 544 N LYS 69 4.118 -4.267 8.694 1.00 0.00 ATOM 545 CA LYS 69 3.417 -4.721 9.903 1.00 0.00 ATOM 546 CB LYS 69 2.833 -6.120 9.691 1.00 0.00 ATOM 547 CG LYS 69 1.718 -6.177 8.660 1.00 0.00 ATOM 548 CD LYS 69 1.184 -7.592 8.501 1.00 0.00 ATOM 549 CE LYS 69 0.075 -7.650 7.465 1.00 0.00 ATOM 550 NZ LYS 69 -0.440 -9.035 7.280 1.00 0.00 ATOM 551 O LYS 69 3.808 -4.826 12.250 1.00 0.00 ATOM 552 C LYS 69 4.308 -4.735 11.126 1.00 0.00 ATOM 553 N ARG 70 5.618 -4.630 10.913 1.00 0.00 ATOM 554 CA ARG 70 6.582 -4.696 12.022 1.00 0.00 ATOM 555 CB ARG 70 7.983 -5.014 11.496 1.00 0.00 ATOM 556 CG ARG 70 8.185 -6.470 11.110 1.00 0.00 ATOM 557 CD ARG 70 9.591 -6.712 10.586 1.00 0.00 ATOM 558 NE ARG 70 9.736 -8.044 10.001 1.00 0.00 ATOM 559 CZ ARG 70 9.982 -8.273 8.715 1.00 0.00 ATOM 560 NH1 ARG 70 10.099 -9.518 8.274 1.00 0.00 ATOM 561 NH2 ARG 70 10.112 -7.257 7.874 1.00 0.00 ATOM 562 O ARG 70 7.198 -3.449 13.984 1.00 0.00 ATOM 563 C ARG 70 6.662 -3.425 12.863 1.00 0.00 ATOM 564 N SER 71 6.113 -2.333 12.342 1.00 0.00 ATOM 565 CA SER 71 6.215 -1.025 12.994 1.00 0.00 ATOM 566 CB SER 71 7.124 -0.094 12.189 1.00 0.00 ATOM 567 OG SER 71 8.445 -0.603 12.123 1.00 0.00 ATOM 568 O SER 71 4.025 -0.353 12.287 1.00 0.00 ATOM 569 C SER 71 4.862 -0.350 13.192 1.00 0.00 ATOM 570 N LYS 72 4.661 0.248 14.367 1.00 0.00 ATOM 571 CA LYS 72 3.394 0.884 14.706 1.00 0.00 ATOM 572 CB LYS 72 3.432 1.426 16.137 1.00 0.00 ATOM 573 CG LYS 72 3.437 0.348 17.209 1.00 0.00 ATOM 574 CD LYS 72 3.481 0.954 18.602 1.00 0.00 ATOM 575 CE LYS 72 3.473 -0.123 19.674 1.00 0.00 ATOM 576 NZ LYS 72 3.557 0.455 21.043 1.00 0.00 ATOM 577 O LYS 72 1.840 2.218 13.432 1.00 0.00 ATOM 578 C LYS 72 3.019 2.028 13.746 1.00 0.00 ATOM 579 N GLY 73 4.024 2.755 13.261 1.00 0.00 ATOM 580 CA GLY 73 3.793 3.874 12.342 1.00 0.00 ATOM 581 O GLY 73 2.920 4.312 10.147 1.00 0.00 ATOM 582 C GLY 73 3.370 3.470 10.926 1.00 0.00 ATOM 583 N LEU 74 3.517 2.191 10.587 1.00 0.00 ATOM 584 CA LEU 74 3.119 1.761 9.249 1.00 0.00 ATOM 585 CB LEU 74 4.339 1.305 8.447 1.00 0.00 ATOM 586 CG LEU 74 5.417 2.361 8.192 1.00 0.00 ATOM 587 CD1 LEU 74 6.609 1.749 7.472 1.00 0.00 ATOM 588 CD2 LEU 74 4.853 3.523 7.390 1.00 0.00 ATOM 589 O LEU 74 1.479 0.386 8.232 1.00 0.00 ATOM 590 C LEU 74 2.097 0.650 9.251 1.00 0.00 ATOM 591 N LYS 75 1.927 -0.026 10.385 1.00 0.00 ATOM 592 CA LYS 75 1.145 -1.253 10.350 1.00 0.00 ATOM 593 CB LYS 75 1.305 -2.028 11.659 1.00 0.00 ATOM 594 CG LYS 75 0.658 -1.357 12.860 1.00 0.00 ATOM 595 CD LYS 75 0.894 -2.156 14.131 1.00 0.00 ATOM 596 CE LYS 75 0.250 -1.483 15.333 1.00 0.00 ATOM 597 NZ LYS 75 0.511 -2.230 16.594 1.00 0.00 ATOM 598 O LYS 75 -1.042 -1.959 9.749 1.00 0.00 ATOM 599 C LYS 75 -0.336 -1.016 10.094 1.00 0.00 ATOM 600 N ASN 76 -0.789 0.233 10.239 1.00 0.00 ATOM 601 CA ASN 76 -2.197 0.549 10.021 1.00 0.00 ATOM 602 CB ASN 76 -2.743 1.385 11.180 1.00 0.00 ATOM 603 CG ASN 76 -2.808 0.608 12.480 1.00 0.00 ATOM 604 ND2 ASN 76 -2.341 1.224 13.560 1.00 0.00 ATOM 605 OD1 ASN 76 -3.269 -0.532 12.511 1.00 0.00 ATOM 606 O ASN 76 -3.619 1.647 8.434 1.00 0.00 ATOM 607 C ASN 76 -2.472 1.274 8.714 1.00 0.00 ATOM 608 N VAL 77 -1.429 1.472 7.908 1.00 0.00 ATOM 609 CA VAL 77 -1.615 2.086 6.587 1.00 0.00 ATOM 610 CB VAL 77 -0.275 2.551 5.987 1.00 0.00 ATOM 611 CG1 VAL 77 -0.476 3.069 4.571 1.00 0.00 ATOM 612 CG2 VAL 77 0.358 3.621 6.863 1.00 0.00 ATOM 613 O VAL 77 -1.850 -0.037 5.515 1.00 0.00 ATOM 614 C VAL 77 -2.304 1.081 5.667 1.00 0.00 ATOM 615 N PRO 78 -3.417 1.457 5.059 1.00 0.00 ATOM 616 CA PRO 78 -4.101 0.556 4.131 1.00 0.00 ATOM 617 CB PRO 78 -5.354 1.330 3.718 1.00 0.00 ATOM 618 CG PRO 78 -5.422 2.470 4.679 1.00 0.00 ATOM 619 CD PRO 78 -4.036 2.624 5.242 1.00 0.00 ATOM 620 O PRO 78 -2.554 1.051 2.372 1.00 0.00 ATOM 621 C PRO 78 -3.254 0.206 2.907 1.00 0.00 ATOM 622 N LEU 79 -3.330 -1.052 2.503 1.00 0.00 ATOM 623 CA LEU 79 -2.613 -1.558 1.339 1.00 0.00 ATOM 624 CB LEU 79 -1.558 -2.582 1.763 1.00 0.00 ATOM 625 CG LEU 79 -0.622 -3.086 0.663 1.00 0.00 ATOM 626 CD1 LEU 79 0.662 -3.642 1.262 1.00 0.00 ATOM 627 CD2 LEU 79 -1.310 -4.143 -0.187 1.00 0.00 ATOM 628 O LEU 79 -4.429 -3.011 0.711 1.00 0.00 ATOM 629 C LEU 79 -3.584 -2.178 0.342 1.00 0.00 ATOM 630 N ILE 80 -3.467 -1.765 -0.924 1.00 0.00 ATOM 631 CA ILE 80 -4.283 -2.323 -2.008 1.00 0.00 ATOM 632 CB ILE 80 -5.179 -1.248 -2.650 1.00 0.00 ATOM 633 CG1 ILE 80 -6.122 -0.647 -1.606 1.00 0.00 ATOM 634 CG2 ILE 80 -5.938 -1.826 -3.835 1.00 0.00 ATOM 635 CD1 ILE 80 -6.890 0.560 -2.099 1.00 0.00 ATOM 636 O ILE 80 -2.459 -2.264 -3.574 1.00 0.00 ATOM 637 C ILE 80 -3.349 -2.951 -3.030 1.00 0.00 ATOM 638 N LEU 81 -3.499 -4.250 -3.261 1.00 0.00 ATOM 639 CA LEU 81 -2.624 -4.949 -4.217 1.00 0.00 ATOM 640 CB LEU 81 -2.715 -6.463 -4.017 1.00 0.00 ATOM 641 CG LEU 81 -2.207 -7.002 -2.678 1.00 0.00 ATOM 642 CD1 LEU 81 -2.472 -8.494 -2.563 1.00 0.00 ATOM 643 CD2 LEU 81 -0.723 -6.714 -2.510 1.00 0.00 ATOM 644 O LEU 81 -4.151 -4.417 -5.985 1.00 0.00 ATOM 645 C LEU 81 -2.976 -4.594 -5.653 1.00 0.00 ATOM 646 N LEU 82 -1.944 -4.498 -6.486 1.00 0.00 ATOM 647 CA LEU 82 -2.088 -4.323 -7.932 1.00 0.00 ATOM 648 CB LEU 82 -1.173 -3.202 -8.430 1.00 0.00 ATOM 649 CG LEU 82 -1.461 -1.801 -7.888 1.00 0.00 ATOM 650 CD1 LEU 82 -0.316 -0.854 -8.210 1.00 0.00 ATOM 651 CD2 LEU 82 -2.768 -1.264 -8.453 1.00 0.00 ATOM 652 O LEU 82 -0.613 -6.114 -8.508 1.00 0.00 ATOM 653 C LEU 82 -1.767 -5.650 -8.592 1.00 0.00 ATOM 654 N PHE 83 -2.769 -6.287 -9.202 1.00 0.00 ATOM 655 CA PHE 83 -2.639 -7.666 -9.689 1.00 0.00 ATOM 656 CB PHE 83 -3.721 -8.556 -9.073 1.00 0.00 ATOM 657 CG PHE 83 -3.587 -8.734 -7.588 1.00 0.00 ATOM 658 CD1 PHE 83 -4.707 -8.911 -6.794 1.00 0.00 ATOM 659 CD2 PHE 83 -2.341 -8.726 -6.985 1.00 0.00 ATOM 660 CE1 PHE 83 -4.584 -9.074 -5.427 1.00 0.00 ATOM 661 CE2 PHE 83 -2.219 -8.889 -5.618 1.00 0.00 ATOM 662 CZ PHE 83 -3.334 -9.064 -4.839 1.00 0.00 ATOM 663 O PHE 83 -3.651 -7.151 -11.781 1.00 0.00 ATOM 664 C PHE 83 -2.719 -7.709 -11.206 1.00 0.00 ATOM 665 N SER 84 -1.739 -8.334 -11.847 1.00 0.00 ATOM 666 CA SER 84 -1.727 -8.439 -13.304 1.00 0.00 ATOM 667 CB SER 84 -0.315 -8.741 -13.810 1.00 0.00 ATOM 668 OG SER 84 -0.305 -8.942 -15.212 1.00 0.00 ATOM 669 O SER 84 -2.606 -10.655 -13.271 1.00 0.00 ATOM 670 C SER 84 -2.701 -9.516 -13.740 1.00 0.00 ATOM 671 N SER 85 -3.627 -9.157 -14.625 1.00 0.00 ATOM 672 CA SER 85 -4.535 -10.102 -15.268 1.00 0.00 ATOM 673 CB SER 85 -5.333 -9.411 -16.376 1.00 0.00 ATOM 674 OG SER 85 -6.151 -10.336 -17.069 1.00 0.00 ATOM 675 O SER 85 -2.648 -11.125 -16.333 1.00 0.00 ATOM 676 C SER 85 -3.763 -11.290 -15.836 1.00 0.00 ATOM 677 N GLU 86 -4.354 -12.484 -15.750 1.00 0.00 ATOM 678 CA GLU 86 -3.751 -13.691 -16.292 1.00 0.00 ATOM 679 CB GLU 86 -2.730 -13.338 -17.376 1.00 0.00 ATOM 680 CG GLU 86 -3.337 -12.704 -18.617 1.00 0.00 ATOM 681 CD GLU 86 -4.233 -13.658 -19.381 1.00 0.00 ATOM 682 OE1 GLU 86 -4.077 -14.885 -19.210 1.00 0.00 ATOM 683 OE2 GLU 86 -5.094 -13.179 -20.149 1.00 0.00 ATOM 684 O GLU 86 -3.661 -14.889 -14.229 1.00 0.00 ATOM 685 C GLU 86 -3.068 -14.563 -15.260 1.00 0.00 ATOM 686 N HIS 87 -1.818 -14.925 -15.537 1.00 0.00 ATOM 687 CA HIS 87 -1.056 -15.860 -14.702 1.00 0.00 ATOM 688 CB HIS 87 0.348 -16.069 -15.276 1.00 0.00 ATOM 689 CG HIS 87 0.370 -16.866 -16.543 1.00 0.00 ATOM 690 CD2 HIS 87 0.757 -16.611 -17.924 1.00 0.00 ATOM 691 ND1 HIS 87 -0.042 -18.180 -16.603 1.00 0.00 ATOM 692 CE1 HIS 87 0.094 -18.622 -17.865 1.00 0.00 ATOM 693 NE2 HIS 87 0.572 -17.687 -18.662 1.00 0.00 ATOM 694 O HIS 87 -1.116 -16.219 -12.319 1.00 0.00 ATOM 695 C HIS 87 -0.926 -15.416 -13.238 1.00 0.00 ATOM 696 N LYS 88 -0.617 -14.136 -13.026 1.00 0.00 ATOM 697 CA LYS 88 -0.405 -13.633 -11.680 1.00 0.00 ATOM 698 CB LYS 88 0.162 -12.214 -11.722 1.00 0.00 ATOM 699 CG LYS 88 1.610 -12.136 -12.177 1.00 0.00 ATOM 700 CD LYS 88 2.058 -10.695 -12.356 1.00 0.00 ATOM 701 CE LYS 88 2.097 -9.961 -11.026 1.00 0.00 ATOM 702 NZ LYS 88 2.625 -8.576 -11.171 1.00 0.00 ATOM 703 O LYS 88 -1.717 -14.107 -9.730 1.00 0.00 ATOM 704 C LYS 88 -1.704 -13.661 -10.886 1.00 0.00 ATOM 705 N GLU 89 -2.780 -13.182 -11.512 1.00 0.00 ATOM 706 CA GLU 89 -4.113 -13.156 -10.915 1.00 0.00 ATOM 707 CB GLU 89 -5.135 -12.599 -11.908 1.00 0.00 ATOM 708 CG GLU 89 -6.497 -12.310 -11.299 1.00 0.00 ATOM 709 CD GLU 89 -7.431 -11.609 -12.267 1.00 0.00 ATOM 710 OE1 GLU 89 -8.283 -10.821 -11.806 1.00 0.00 ATOM 711 OE2 GLU 89 -7.311 -11.849 -13.487 1.00 0.00 ATOM 712 O GLU 89 -5.164 -14.689 -9.402 1.00 0.00 ATOM 713 C GLU 89 -4.545 -14.549 -10.452 1.00 0.00 ATOM 714 N ALA 90 -4.215 -15.560 -11.245 1.00 0.00 ATOM 715 CA ALA 90 -4.556 -16.942 -10.917 1.00 0.00 ATOM 716 CB ALA 90 -4.304 -17.847 -12.113 1.00 0.00 ATOM 717 O ALA 90 -4.328 -18.160 -8.842 1.00 0.00 ATOM 718 C ALA 90 -3.772 -17.466 -9.703 1.00 0.00 ATOM 719 N ILE 91 -2.490 -17.114 -9.640 1.00 0.00 ATOM 720 CA ILE 91 -1.592 -17.520 -8.563 1.00 0.00 ATOM 721 CB ILE 91 -0.127 -17.179 -8.891 1.00 0.00 ATOM 722 CG1 ILE 91 0.371 -18.033 -10.058 1.00 0.00 ATOM 723 CG2 ILE 91 0.747 -17.341 -7.656 1.00 0.00 ATOM 724 CD1 ILE 91 1.701 -17.580 -10.622 1.00 0.00 ATOM 725 O ILE 91 -1.760 -17.523 -6.160 1.00 0.00 ATOM 726 C ILE 91 -1.946 -16.898 -7.204 1.00 0.00 ATOM 727 N VAL 92 -2.466 -15.674 -7.219 1.00 0.00 ATOM 728 CA VAL 92 -2.686 -14.917 -5.987 1.00 0.00 ATOM 729 CB VAL 92 -2.141 -13.481 -6.103 1.00 0.00 ATOM 730 CG1 VAL 92 -0.698 -13.496 -6.581 1.00 0.00 ATOM 731 CG2 VAL 92 -3.009 -12.656 -7.041 1.00 0.00 ATOM 732 O VAL 92 -4.438 -14.188 -4.514 1.00 0.00 ATOM 733 C VAL 92 -4.150 -14.819 -5.530 1.00 0.00 ATOM 734 N ASN 93 -5.076 -15.428 -6.270 1.00 0.00 ATOM 735 CA ASN 93 -6.485 -15.380 -5.868 1.00 0.00 ATOM 736 CB ASN 93 -7.377 -15.941 -6.978 1.00 0.00 ATOM 737 CG ASN 93 -8.854 -15.768 -6.680 1.00 0.00 ATOM 738 ND2 ASN 93 -9.483 -14.810 -7.351 1.00 0.00 ATOM 739 OD1 ASN 93 -9.420 -16.488 -5.857 1.00 0.00 ATOM 740 O ASN 93 -6.256 -17.279 -4.407 1.00 0.00 ATOM 741 C ASN 93 -6.705 -16.140 -4.559 1.00 0.00 ATOM 742 N GLY 94 -7.372 -15.482 -3.612 1.00 0.00 ATOM 743 CA GLY 94 -7.689 -16.087 -2.326 1.00 0.00 ATOM 744 O GLY 94 -6.620 -16.864 -0.327 1.00 0.00 ATOM 745 C GLY 94 -6.515 -16.203 -1.366 1.00 0.00 ATOM 746 N LEU 95 -5.406 -15.555 -1.717 1.00 0.00 ATOM 747 CA LEU 95 -4.213 -15.486 -0.879 1.00 0.00 ATOM 748 CB LEU 95 -2.976 -15.198 -1.730 1.00 0.00 ATOM 749 CG LEU 95 -1.679 -15.883 -1.293 1.00 0.00 ATOM 750 CD1 LEU 95 -1.754 -17.383 -1.532 1.00 0.00 ATOM 751 CD2 LEU 95 -0.485 -15.289 -2.024 1.00 0.00 ATOM 752 O LEU 95 -4.488 -13.228 -0.139 1.00 0.00 ATOM 753 C LEU 95 -4.404 -14.413 0.185 1.00 0.00 ATOM 754 N HIS 96 -4.484 -14.823 1.450 1.00 0.00 ATOM 755 CA HIS 96 -4.604 -13.863 2.542 1.00 0.00 ATOM 756 CB HIS 96 -5.232 -14.524 3.769 1.00 0.00 ATOM 757 CG HIS 96 -5.521 -13.572 4.887 1.00 0.00 ATOM 758 CD2 HIS 96 -6.722 -13.035 5.510 1.00 0.00 ATOM 759 ND1 HIS 96 -4.527 -12.956 5.618 1.00 0.00 ATOM 760 CE1 HIS 96 -5.092 -12.163 6.545 1.00 0.00 ATOM 761 NE2 HIS 96 -6.409 -12.206 6.487 1.00 0.00 ATOM 762 O HIS 96 -2.302 -14.044 3.175 1.00 0.00 ATOM 763 C HIS 96 -3.232 -13.294 2.872 1.00 0.00 ATOM 764 N SER 97 -3.099 -11.971 2.782 1.00 0.00 ATOM 765 CA SER 97 -1.821 -11.306 3.063 1.00 0.00 ATOM 766 CB SER 97 -1.249 -10.682 1.789 1.00 0.00 ATOM 767 OG SER 97 -2.104 -9.667 1.291 1.00 0.00 ATOM 768 O SER 97 -0.906 -9.696 4.586 1.00 0.00 ATOM 769 C SER 97 -1.925 -10.234 4.130 1.00 0.00 ATOM 770 N GLY 98 -3.152 -9.929 4.529 1.00 0.00 ATOM 771 CA GLY 98 -3.385 -8.790 5.390 1.00 0.00 ATOM 772 O GLY 98 -3.822 -6.469 5.256 1.00 0.00 ATOM 773 C GLY 98 -3.542 -7.490 4.625 1.00 0.00 ATOM 774 N ALA 99 -3.356 -7.520 3.298 1.00 0.00 ATOM 775 CA ALA 99 -3.720 -6.377 2.438 1.00 0.00 ATOM 776 CB ALA 99 -3.300 -6.640 1.001 1.00 0.00 ATOM 777 O ALA 99 -6.005 -7.060 2.799 1.00 0.00 ATOM 778 C ALA 99 -5.214 -6.138 2.538 1.00 0.00 ATOM 779 N ASP 100 -5.607 -4.888 2.338 1.00 0.00 ATOM 780 CA ASP 100 -6.973 -4.468 2.572 1.00 0.00 ATOM 781 CB ASP 100 -7.019 -2.991 2.971 1.00 0.00 ATOM 782 CG ASP 100 -6.236 -2.705 4.236 1.00 0.00 ATOM 783 OD1 ASP 100 -6.796 -2.889 5.336 1.00 0.00 ATOM 784 OD2 ASP 100 -5.061 -2.294 4.127 1.00 0.00 ATOM 785 O ASP 100 -9.078 -4.879 1.514 1.00 0.00 ATOM 786 C ASP 100 -7.884 -4.682 1.371 1.00 0.00 ATOM 787 N ASP 101 -7.311 -4.619 0.172 1.00 0.00 ATOM 788 CA ASP 101 -8.076 -4.862 -1.047 1.00 0.00 ATOM 789 CB ASP 101 -8.984 -3.670 -1.356 1.00 0.00 ATOM 790 CG ASP 101 -10.166 -4.049 -2.227 1.00 0.00 ATOM 791 OD1 ASP 101 -10.274 -5.236 -2.598 1.00 0.00 ATOM 792 OD2 ASP 101 -10.983 -3.157 -2.540 1.00 0.00 ATOM 793 O ASP 101 -5.897 -5.186 -1.999 1.00 0.00 ATOM 794 C ASP 101 -7.109 -5.131 -2.195 1.00 0.00 ATOM 795 N TYR 102 -7.666 -5.329 -3.380 1.00 0.00 ATOM 796 CA TYR 102 -6.860 -5.539 -4.570 1.00 0.00 ATOM 797 CB TYR 102 -6.531 -7.024 -4.739 1.00 0.00 ATOM 798 CG TYR 102 -7.742 -7.893 -4.997 1.00 0.00 ATOM 799 CD1 TYR 102 -8.142 -8.189 -6.294 1.00 0.00 ATOM 800 CD2 TYR 102 -8.479 -8.415 -3.942 1.00 0.00 ATOM 801 CE1 TYR 102 -9.246 -8.985 -6.538 1.00 0.00 ATOM 802 CE2 TYR 102 -9.587 -9.211 -4.167 1.00 0.00 ATOM 803 CZ TYR 102 -9.966 -9.493 -5.478 1.00 0.00 ATOM 804 OH TYR 102 -11.065 -10.284 -5.721 1.00 0.00 ATOM 805 O TYR 102 -8.833 -4.796 -5.709 1.00 0.00 ATOM 806 C TYR 102 -7.617 -4.999 -5.766 1.00 0.00 ATOM 807 N LEU 103 -6.878 -4.761 -6.841 1.00 0.00 ATOM 808 CA LEU 103 -7.462 -4.371 -8.106 1.00 0.00 ATOM 809 CB LEU 103 -7.524 -2.847 -8.222 1.00 0.00 ATOM 810 CG LEU 103 -8.112 -2.289 -9.520 1.00 0.00 ATOM 811 CD1 LEU 103 -9.589 -2.633 -9.633 1.00 0.00 ATOM 812 CD2 LEU 103 -7.911 -0.783 -9.597 1.00 0.00 ATOM 813 O LEU 103 -5.413 -5.021 -9.132 1.00 0.00 ATOM 814 C LEU 103 -6.638 -4.981 -9.224 1.00 0.00 ATOM 815 N THR 104 -7.313 -5.448 -10.271 1.00 0.00 ATOM 816 CA THR 104 -6.641 -6.113 -11.384 1.00 0.00 ATOM 817 CB THR 104 -7.501 -7.252 -11.962 1.00 0.00 ATOM 818 CG2 THR 104 -6.811 -7.883 -13.162 1.00 0.00 ATOM 819 OG1 THR 104 -7.696 -8.262 -10.964 1.00 0.00 ATOM 820 O THR 104 -7.147 -4.289 -12.875 1.00 0.00 ATOM 821 C THR 104 -6.302 -5.110 -12.500 1.00 0.00 ATOM 822 N LYS 105 -5.069 -5.188 -13.003 1.00 0.00 ATOM 823 CA LYS 105 -4.609 -4.403 -14.170 1.00 0.00 ATOM 824 CB LYS 105 -3.124 -4.063 -14.034 1.00 0.00 ATOM 825 CG LYS 105 -2.767 -3.342 -12.746 1.00 0.00 ATOM 826 CD LYS 105 -1.261 -3.271 -12.551 1.00 0.00 ATOM 827 CE LYS 105 -0.739 -4.506 -11.834 1.00 0.00 ATOM 828 NZ LYS 105 0.748 -4.508 -11.746 1.00 0.00 ATOM 829 O LYS 105 -4.612 -6.384 -15.491 1.00 0.00 ATOM 830 C LYS 105 -4.869 -5.176 -15.449 1.00 0.00 ATOM 831 N PRO 106 -5.343 -4.529 -16.515 1.00 0.00 ATOM 832 CA PRO 106 -5.632 -3.091 -16.563 1.00 0.00 ATOM 833 CB PRO 106 -5.674 -2.773 -18.058 1.00 0.00 ATOM 834 CG PRO 106 -6.164 -4.028 -18.695 1.00 0.00 ATOM 835 CD PRO 106 -5.558 -5.158 -17.910 1.00 0.00 ATOM 836 O PRO 106 -7.926 -3.466 -15.959 1.00 0.00 ATOM 837 C PRO 106 -6.961 -2.718 -15.894 1.00 0.00 ATOM 838 N PHE 107 -6.996 -1.551 -15.254 1.00 0.00 ATOM 839 CA PHE 107 -8.252 -1.078 -14.672 1.00 0.00 ATOM 840 CB PHE 107 -8.141 -0.996 -13.149 1.00 0.00 ATOM 841 CG PHE 107 -6.835 -0.435 -12.666 1.00 0.00 ATOM 842 CD1 PHE 107 -6.561 0.917 -12.784 1.00 0.00 ATOM 843 CD2 PHE 107 -5.880 -1.257 -12.093 1.00 0.00 ATOM 844 CE1 PHE 107 -5.358 1.434 -12.340 1.00 0.00 ATOM 845 CE2 PHE 107 -4.678 -0.740 -11.649 1.00 0.00 ATOM 846 CZ PHE 107 -4.415 0.599 -11.770 1.00 0.00 ATOM 847 O PHE 107 -7.801 0.960 -15.800 1.00 0.00 ATOM 848 C PHE 107 -8.644 0.273 -15.237 1.00 0.00 ATOM 849 N ASN 108 -9.909 0.666 -15.086 1.00 0.00 ATOM 850 CA ASN 108 -10.314 1.991 -15.534 1.00 0.00 ATOM 851 CB ASN 108 -11.812 2.015 -15.848 1.00 0.00 ATOM 852 CG ASN 108 -12.164 1.189 -17.070 1.00 0.00 ATOM 853 ND2 ASN 108 -13.178 0.343 -16.937 1.00 0.00 ATOM 854 OD1 ASN 108 -11.531 1.313 -18.118 1.00 0.00 ATOM 855 O ASN 108 -9.883 2.695 -13.288 1.00 0.00 ATOM 856 C ASN 108 -9.958 3.036 -14.483 1.00 0.00 ATOM 857 N ARG 109 -9.755 4.290 -14.900 1.00 0.00 ATOM 858 CA ARG 109 -9.520 5.378 -13.939 1.00 0.00 ATOM 859 CB ARG 109 -9.451 6.726 -14.661 1.00 0.00 ATOM 860 CG ARG 109 -9.176 7.907 -13.745 1.00 0.00 ATOM 861 CD ARG 109 -9.156 9.213 -14.521 1.00 0.00 ATOM 862 NE ARG 109 -10.459 9.525 -15.105 1.00 0.00 ATOM 863 CZ ARG 109 -10.656 10.437 -16.051 1.00 0.00 ATOM 864 NH1 ARG 109 -11.876 10.652 -16.520 1.00 0.00 ATOM 865 NH2 ARG 109 -9.631 11.132 -16.525 1.00 0.00 ATOM 866 O ARG 109 -10.284 5.497 -11.646 1.00 0.00 ATOM 867 C ARG 109 -10.602 5.431 -12.854 1.00 0.00 ATOM 868 N ASN 110 -11.872 5.308 -13.237 1.00 0.00 ATOM 869 CA ASN 110 -12.938 5.355 -12.245 1.00 0.00 ATOM 870 CB ASN 110 -14.306 5.343 -12.929 1.00 0.00 ATOM 871 CG ASN 110 -14.634 6.662 -13.599 1.00 0.00 ATOM 872 ND2 ASN 110 -15.579 6.631 -14.533 1.00 0.00 ATOM 873 OD1 ASN 110 -14.043 7.695 -13.281 1.00 0.00 ATOM 874 O ASN 110 -13.152 4.464 -10.029 1.00 0.00 ATOM 875 C ASN 110 -12.887 4.222 -11.216 1.00 0.00 ATOM 876 N ASP 111 -12.574 2.997 -11.650 1.00 0.00 ATOM 877 CA ASP 111 -12.521 1.859 -10.736 1.00 0.00 ATOM 878 CB ASP 111 -12.365 0.553 -11.516 1.00 0.00 ATOM 879 CG ASP 111 -13.624 0.170 -12.270 1.00 0.00 ATOM 880 OD1 ASP 111 -14.690 0.753 -11.980 1.00 0.00 ATOM 881 OD2 ASP 111 -13.544 -0.712 -13.150 1.00 0.00 ATOM 882 O ASP 111 -11.600 1.671 -8.551 1.00 0.00 ATOM 883 C ASP 111 -11.398 1.974 -9.724 1.00 0.00 ATOM 884 N LEU 112 -10.231 2.428 -10.177 1.00 0.00 ATOM 885 CA LEU 112 -9.116 2.678 -9.274 1.00 0.00 ATOM 886 CB LEU 112 -7.908 3.208 -10.048 1.00 0.00 ATOM 887 CG LEU 112 -6.692 3.610 -9.212 1.00 0.00 ATOM 888 CD1 LEU 112 -6.069 2.391 -8.549 1.00 0.00 ATOM 889 CD2 LEU 112 -5.662 4.327 -10.072 1.00 0.00 ATOM 890 O LEU 112 -9.331 3.403 -6.986 1.00 0.00 ATOM 891 C LEU 112 -9.532 3.662 -8.187 1.00 0.00 ATOM 892 N LEU 113 -10.079 4.795 -8.607 1.00 0.00 ATOM 893 CA LEU 113 -10.434 5.828 -7.634 1.00 0.00 ATOM 894 CB LEU 113 -10.925 7.091 -8.347 1.00 0.00 ATOM 895 CG LEU 113 -11.317 8.266 -7.451 1.00 0.00 ATOM 896 CD1 LEU 113 -10.131 8.726 -6.617 1.00 0.00 ATOM 897 CD2 LEU 113 -11.858 9.419 -8.282 1.00 0.00 ATOM 898 O LEU 113 -11.407 5.551 -5.461 1.00 0.00 ATOM 899 C LEU 113 -11.503 5.314 -6.667 1.00 0.00 ATOM 900 N SER 114 -12.521 4.616 -7.181 1.00 0.00 ATOM 901 CA SER 114 -13.586 4.130 -6.309 1.00 0.00 ATOM 902 CB SER 114 -14.699 3.481 -7.134 1.00 0.00 ATOM 903 OG SER 114 -14.236 2.313 -7.788 1.00 0.00 ATOM 904 O SER 114 -13.442 3.159 -4.127 1.00 0.00 ATOM 905 C SER 114 -13.035 3.134 -5.287 1.00 0.00 ATOM 906 N ARG 115 -12.110 2.266 -5.695 1.00 0.00 ATOM 907 CA ARG 115 -11.575 1.263 -4.772 1.00 0.00 ATOM 908 CB ARG 115 -10.718 0.244 -5.526 1.00 0.00 ATOM 909 CG ARG 115 -10.179 -0.878 -4.656 1.00 0.00 ATOM 910 CD ARG 115 -10.868 -2.198 -4.968 1.00 0.00 ATOM 911 NE ARG 115 -11.734 -2.100 -6.139 1.00 0.00 ATOM 912 CZ ARG 115 -11.931 -3.085 -7.008 1.00 0.00 ATOM 913 NH1 ARG 115 -12.738 -2.904 -8.045 1.00 0.00 ATOM 914 NH2 ARG 115 -11.320 -4.250 -6.839 1.00 0.00 ATOM 915 O ARG 115 -10.849 1.556 -2.487 1.00 0.00 ATOM 916 C ARG 115 -10.759 1.935 -3.670 1.00 0.00 ATOM 917 N ILE 116 -9.958 2.932 -4.051 1.00 0.00 ATOM 918 CA ILE 116 -9.128 3.658 -3.078 1.00 0.00 ATOM 919 CB ILE 116 -8.174 4.644 -3.775 1.00 0.00 ATOM 920 CG1 ILE 116 -7.042 3.888 -4.475 1.00 0.00 ATOM 921 CG2 ILE 116 -7.641 5.664 -2.781 1.00 0.00 ATOM 922 CD1 ILE 116 -6.157 4.766 -5.332 1.00 0.00 ATOM 923 O ILE 116 -9.844 4.321 -0.861 1.00 0.00 ATOM 924 C ILE 116 -10.042 4.394 -2.076 1.00 0.00 ATOM 925 N GLU 117 -11.078 5.062 -2.584 1.00 0.00 ATOM 926 CA GLU 117 -11.978 5.794 -1.705 1.00 0.00 ATOM 927 CB GLU 117 -12.994 6.592 -2.523 1.00 0.00 ATOM 928 CG GLU 117 -12.400 7.775 -3.270 1.00 0.00 ATOM 929 CD GLU 117 -13.421 8.494 -4.130 1.00 0.00 ATOM 930 OE1 GLU 117 -14.539 7.964 -4.294 1.00 0.00 ATOM 931 OE2 GLU 117 -13.101 9.589 -4.640 1.00 0.00 ATOM 932 O GLU 117 -12.880 5.195 0.409 1.00 0.00 ATOM 933 C GLU 117 -12.703 4.864 -0.747 1.00 0.00 ATOM 934 N ILE 118 -13.099 3.694 -1.230 1.00 0.00 ATOM 935 CA ILE 118 -13.800 2.743 -0.379 1.00 0.00 ATOM 936 CB ILE 118 -14.323 1.542 -1.187 1.00 0.00 ATOM 937 CG1 ILE 118 -15.442 1.982 -2.134 1.00 0.00 ATOM 938 CG2 ILE 118 -14.774 0.428 -0.255 1.00 0.00 ATOM 939 CD1 ILE 118 -15.821 0.937 -3.160 1.00 0.00 ATOM 940 O ILE 118 -13.357 2.149 1.894 1.00 0.00 ATOM 941 C ILE 118 -12.912 2.248 0.754 1.00 0.00 ATOM 942 N HIS 119 -11.656 1.972 0.435 1.00 0.00 ATOM 943 CA HIS 119 -10.732 1.528 1.461 1.00 0.00 ATOM 944 CB HIS 119 -9.415 1.067 0.834 1.00 0.00 ATOM 945 CG HIS 119 -8.437 0.511 1.822 1.00 0.00 ATOM 946 CD2 HIS 119 -7.035 0.744 2.137 1.00 0.00 ATOM 947 ND1 HIS 119 -8.773 -0.466 2.733 1.00 0.00 ATOM 948 CE1 HIS 119 -7.693 -0.758 3.480 1.00 0.00 ATOM 949 NE2 HIS 119 -6.647 -0.037 3.128 1.00 0.00 ATOM 950 O HIS 119 -10.415 2.379 3.696 1.00 0.00 ATOM 951 C HIS 119 -10.464 2.634 2.490 1.00 0.00 ATOM 952 N LEU 120 -10.304 3.870 2.004 1.00 0.00 ATOM 953 CA LEU 120 -10.039 4.985 2.911 1.00 0.00 ATOM 954 CB LEU 120 -9.728 6.257 2.120 1.00 0.00 ATOM 955 CG LEU 120 -8.408 6.267 1.346 1.00 0.00 ATOM 956 CD1 LEU 120 -8.304 7.512 0.478 1.00 0.00 ATOM 957 CD2 LEU 120 -7.225 6.187 2.298 1.00 0.00 ATOM 958 O LEU 120 -10.875 5.789 4.992 1.00 0.00 ATOM 959 C LEU 120 -11.152 5.315 3.892 1.00 0.00 ATOM 960 N ARG 121 -12.406 5.087 3.518 1.00 0.00 ATOM 961 CA ARG 121 -13.498 5.356 4.457 1.00 0.00 ATOM 962 CB ARG 121 -14.753 5.802 3.704 1.00 0.00 ATOM 963 CG ARG 121 -15.309 4.759 2.749 1.00 0.00 ATOM 964 CD ARG 121 -16.576 5.251 2.071 1.00 0.00 ATOM 965 NE ARG 121 -17.212 4.204 1.275 1.00 0.00 ATOM 966 CZ ARG 121 -17.058 4.068 -0.039 1.00 0.00 ATOM 967 NH1 ARG 121 -17.676 3.086 -0.680 1.00 0.00 ATOM 968 NH2 ARG 121 -16.288 4.914 -0.708 1.00 0.00 ATOM 969 O ARG 121 -14.643 4.247 6.234 1.00 0.00 ATOM 970 C ARG 121 -13.837 4.139 5.332 1.00 0.00 TER END