EXPDTA T0348TS609_5-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called T0348TS609_5-scwrl ATOM 1 N MET A 1 -11.927 -16.238 -8.722 1.00 0.00 ATOM 2 CA MET A 1 -11.970 -16.556 -7.278 1.00 0.00 ATOM 3 CB MET A 1 -11.141 -17.807 -6.980 1.00 0.00 ATOM 4 CG MET A 1 -11.218 -18.273 -5.535 1.00 0.00 ATOM 5 SD MET A 1 -12.875 -18.803 -5.062 1.00 0.00 ATOM 6 CE MET A 1 -12.927 -20.440 -5.786 1.00 0.00 ATOM 7 O MET A 1 -12.176 -14.720 -5.805 1.00 0.00 ATOM 8 C MET A 1 -11.425 -15.439 -6.460 1.00 0.00 ATOM 9 N ASP A 2 -10.092 -15.254 -6.497 1.00 0.00 ATOM 10 CA ASP A 2 -9.489 -14.223 -5.711 1.00 0.00 ATOM 11 CB ASP A 2 -7.967 -14.380 -5.698 1.00 0.00 ATOM 12 CG ASP A 2 -7.510 -15.557 -4.859 1.00 0.00 ATOM 13 OD1 ASP A 2 -8.346 -16.120 -4.120 1.00 0.00 ATOM 14 OD2 ASP A 2 -6.317 -15.916 -4.939 1.00 0.00 ATOM 15 O ASP A 2 -10.338 -12.889 -7.480 1.00 0.00 ATOM 16 C ASP A 2 -9.873 -12.926 -6.342 1.00 0.00 ATOM 17 N ALA A 3 -9.721 -11.823 -5.591 1.00 0.00 ATOM 18 CA ALA A 3 -10.072 -10.527 -6.086 1.00 0.00 ATOM 19 CB ALA A 3 -10.119 -9.519 -4.948 1.00 0.00 ATOM 20 O ALA A 3 -7.973 -10.725 -7.173 1.00 0.00 ATOM 21 C ALA A 3 -9.039 -10.118 -7.078 1.00 0.00 ATOM 22 N LYS A 4 -9.355 -9.087 -7.882 1.00 0.00 ATOM 23 CA LYS A 4 -8.385 -8.602 -8.811 1.00 0.00 ATOM 24 CB LYS A 4 -9.035 -7.650 -9.817 1.00 0.00 ATOM 25 CG LYS A 4 -8.091 -7.149 -10.897 1.00 0.00 ATOM 26 CD LYS A 4 -8.822 -6.283 -11.911 1.00 0.00 ATOM 27 CE LYS A 4 -7.881 -5.796 -13.001 1.00 0.00 ATOM 28 NZ LYS A 4 -8.584 -4.948 -14.003 1.00 0.00 ATOM 29 O LYS A 4 -7.687 -7.074 -7.138 1.00 0.00 ATOM 30 C LYS A 4 -7.359 -7.890 -7.998 1.00 0.00 ATOM 31 N PHE A 5 -6.073 -8.190 -8.244 1.00 0.00 ATOM 32 CA PHE A 5 -5.088 -7.543 -7.440 1.00 0.00 ATOM 33 CB PHE A 5 -3.726 -8.219 -7.613 1.00 0.00 ATOM 34 CG PHE A 5 -3.621 -9.554 -6.932 1.00 0.00 ATOM 35 CD1 PHE A 5 -3.896 -10.722 -7.621 1.00 0.00 ATOM 36 CD2 PHE A 5 -3.248 -9.641 -5.602 1.00 0.00 ATOM 37 CE1 PHE A 5 -3.800 -11.950 -6.995 1.00 0.00 ATOM 38 CE2 PHE A 5 -3.151 -10.869 -4.976 1.00 0.00 ATOM 39 CZ PHE A 5 -3.425 -12.021 -5.666 1.00 0.00 ATOM 40 O PHE A 5 -4.566 -5.817 -8.982 1.00 0.00 ATOM 41 C PHE A 5 -4.998 -6.122 -7.870 1.00 0.00 ATOM 42 N LEU A 6 -5.453 -5.216 -6.987 1.00 0.00 ATOM 43 CA LEU A 6 -5.300 -3.813 -7.213 1.00 0.00 ATOM 44 CB LEU A 6 -6.102 -3.014 -6.184 1.00 0.00 ATOM 45 CG LEU A 6 -7.625 -3.096 -6.300 1.00 0.00 ATOM 46 CD1 LEU A 6 -8.292 -2.408 -5.118 1.00 0.00 ATOM 47 CD2 LEU A 6 -8.105 -2.420 -7.576 1.00 0.00 ATOM 48 O LEU A 6 -3.216 -2.836 -7.836 1.00 0.00 ATOM 49 C LEU A 6 -3.836 -3.573 -7.071 1.00 0.00 ATOM 50 N GLU A 7 -3.263 -4.254 -6.064 1.00 0.00 ATOM 51 CA GLU A 7 -1.891 -4.171 -5.661 1.00 0.00 ATOM 52 CB GLU A 7 -1.715 -4.721 -4.244 1.00 0.00 ATOM 53 CG GLU A 7 -2.435 -3.918 -3.173 1.00 0.00 ATOM 54 CD GLU A 7 -2.202 -4.466 -1.779 1.00 0.00 ATOM 55 OE1 GLU A 7 -1.519 -5.504 -1.655 1.00 0.00 ATOM 56 OE2 GLU A 7 -2.703 -3.858 -0.810 1.00 0.00 ATOM 57 O GLU A 7 -1.472 -5.919 -7.223 1.00 0.00 ATOM 58 C GLU A 7 -1.029 -4.964 -6.588 1.00 0.00 ATOM 59 N ILE A 8 0.250 -4.555 -6.694 1.00 0.00 ATOM 60 CA ILE A 8 1.203 -5.296 -7.465 1.00 0.00 ATOM 61 CB ILE A 8 1.898 -4.405 -8.511 1.00 0.00 ATOM 62 CG1 ILE A 8 0.872 -3.837 -9.494 1.00 0.00 ATOM 63 CG2 ILE A 8 2.925 -5.207 -9.296 1.00 0.00 ATOM 64 CD1 ILE A 8 1.430 -2.773 -10.413 1.00 0.00 ATOM 65 O ILE A 8 2.693 -5.089 -5.621 1.00 0.00 ATOM 66 C ILE A 8 2.200 -5.819 -6.480 1.00 0.00 ATOM 67 N LEU A 9 2.525 -7.120 -6.587 1.00 0.00 ATOM 68 CA LEU A 9 3.315 -7.771 -5.581 1.00 0.00 ATOM 69 CB LEU A 9 3.544 -9.239 -5.946 1.00 0.00 ATOM 70 CG LEU A 9 4.389 -10.057 -4.968 1.00 0.00 ATOM 71 CD1 LEU A 9 3.721 -10.119 -3.603 1.00 0.00 ATOM 72 CD2 LEU A 9 4.570 -11.480 -5.474 1.00 0.00 ATOM 73 O LEU A 9 5.081 -6.735 -4.377 1.00 0.00 ATOM 74 C LEU A 9 4.641 -7.082 -5.470 1.00 0.00 ATOM 75 N VAL A 10 5.321 -6.830 -6.594 1.00 0.00 ATOM 76 CA VAL A 10 6.589 -6.176 -6.490 1.00 0.00 ATOM 77 CB VAL A 10 7.738 -7.192 -6.352 1.00 0.00 ATOM 78 CG1 VAL A 10 7.589 -7.995 -5.069 1.00 0.00 ATOM 79 CG2 VAL A 10 7.739 -8.158 -7.527 1.00 0.00 ATOM 80 O VAL A 10 5.864 -5.481 -8.616 1.00 0.00 ATOM 81 C VAL A 10 6.724 -5.398 -7.743 1.00 0.00 ATOM 82 N CYS A 11 7.784 -4.583 -7.858 1.00 0.00 ATOM 83 CA CYS A 11 7.942 -3.875 -9.088 1.00 0.00 ATOM 84 CB CYS A 11 9.012 -2.790 -8.948 1.00 0.00 ATOM 85 SG CYS A 11 8.571 -1.448 -7.819 1.00 0.00 ATOM 86 O CYS A 11 9.297 -5.653 -9.887 1.00 0.00 ATOM 87 C CYS A 11 8.352 -4.891 -10.100 1.00 0.00 ATOM 88 N PRO A 12 7.654 -4.967 -11.190 1.00 0.00 ATOM 89 CA PRO A 12 7.999 -5.897 -12.220 1.00 0.00 ATOM 90 CB PRO A 12 6.893 -5.722 -13.262 1.00 0.00 ATOM 91 CG PRO A 12 5.710 -5.260 -12.478 1.00 0.00 ATOM 92 CD PRO A 12 6.246 -4.333 -11.423 1.00 0.00 ATOM 93 O PRO A 12 10.123 -6.441 -13.065 1.00 0.00 ATOM 94 C PRO A 12 9.343 -5.542 -12.752 1.00 0.00 ATOM 95 N LEU A 13 9.622 -4.231 -12.873 1.00 0.00 ATOM 96 CA LEU A 13 10.889 -3.783 -13.350 1.00 0.00 ATOM 97 CB LEU A 13 10.863 -2.274 -13.604 1.00 0.00 ATOM 98 CG LEU A 13 10.001 -1.799 -14.775 1.00 0.00 ATOM 99 CD1 LEU A 13 9.922 -0.280 -14.804 1.00 0.00 ATOM 100 CD2 LEU A 13 10.584 -2.270 -16.099 1.00 0.00 ATOM 101 O LEU A 13 13.010 -4.554 -12.637 1.00 0.00 ATOM 102 C LEU A 13 11.914 -4.098 -12.315 1.00 0.00 ATOM 103 N CYS A 14 11.585 -3.875 -11.027 1.00 0.00 ATOM 104 CA CYS A 14 12.602 -4.134 -10.055 1.00 0.00 ATOM 105 CB CYS A 14 13.039 -2.834 -9.377 1.00 0.00 ATOM 106 SG CYS A 14 13.683 -1.581 -10.511 1.00 0.00 ATOM 107 O CYS A 14 11.102 -4.779 -8.339 1.00 0.00 ATOM 108 C CYS A 14 12.088 -5.061 -9.017 1.00 0.00 ATOM 109 N LYS A 15 12.783 -6.199 -8.855 1.00 0.00 ATOM 110 CA LYS A 15 12.461 -7.115 -7.808 1.00 0.00 ATOM 111 CB LYS A 15 13.019 -8.505 -8.122 1.00 0.00 ATOM 112 CG LYS A 15 12.399 -9.161 -9.345 1.00 0.00 ATOM 113 CD LYS A 15 12.955 -10.558 -9.563 1.00 0.00 ATOM 114 CE LYS A 15 12.347 -11.208 -10.796 1.00 0.00 ATOM 115 NZ LYS A 15 12.865 -12.588 -11.009 1.00 0.00 ATOM 116 O LYS A 15 13.767 -5.479 -6.744 1.00 0.00 ATOM 117 C LYS A 15 13.109 -6.508 -6.618 1.00 0.00 ATOM 118 N GLY A 16 12.928 -7.087 -5.422 1.00 0.00 ATOM 119 CA GLY A 16 13.567 -6.454 -4.311 1.00 0.00 ATOM 120 O GLY A 16 11.809 -5.315 -3.207 1.00 0.00 ATOM 121 C GLY A 16 12.796 -5.226 -3.939 1.00 0.00 ATOM 122 N PRO A 17 13.225 -4.076 -4.388 1.00 0.00 ATOM 123 CA PRO A 17 12.587 -2.868 -3.941 1.00 0.00 ATOM 124 CB PRO A 17 13.462 -1.753 -4.517 1.00 0.00 ATOM 125 CG PRO A 17 14.113 -2.367 -5.710 1.00 0.00 ATOM 126 CD PRO A 17 14.319 -3.817 -5.372 1.00 0.00 ATOM 127 O PRO A 17 10.798 -2.776 -5.496 1.00 0.00 ATOM 128 C PRO A 17 11.170 -2.580 -4.339 1.00 0.00 ATOM 129 N LEU A 18 10.380 -2.117 -3.347 1.00 0.00 ATOM 130 CA LEU A 18 9.036 -1.639 -3.468 1.00 0.00 ATOM 131 CB LEU A 18 8.183 -2.632 -4.260 1.00 0.00 ATOM 132 CG LEU A 18 6.723 -2.239 -4.490 1.00 0.00 ATOM 133 CD1 LEU A 18 6.630 -1.003 -5.371 1.00 0.00 ATOM 134 CD2 LEU A 18 5.963 -3.367 -5.172 1.00 0.00 ATOM 135 O LEU A 18 8.310 -2.532 -1.398 1.00 0.00 ATOM 136 C LEU A 18 8.593 -1.523 -2.041 1.00 0.00 ATOM 137 N VAL A 19 8.506 -0.291 -1.500 1.00 0.00 ATOM 138 CA VAL A 19 8.208 -0.179 -0.100 1.00 0.00 ATOM 139 CB VAL A 19 9.239 0.704 0.628 1.00 0.00 ATOM 140 CG1 VAL A 19 8.866 0.859 2.094 1.00 0.00 ATOM 141 CG2 VAL A 19 10.624 0.082 0.547 1.00 0.00 ATOM 142 O VAL A 19 6.465 1.314 -0.687 1.00 0.00 ATOM 143 C VAL A 19 6.858 0.431 0.070 1.00 0.00 ATOM 144 N PHE A 20 6.111 -0.057 1.081 1.00 0.00 ATOM 145 CA PHE A 20 4.804 0.451 1.391 1.00 0.00 ATOM 146 CB PHE A 20 3.774 -0.680 1.383 1.00 0.00 ATOM 147 CG PHE A 20 2.383 -0.236 1.738 1.00 0.00 ATOM 148 CD1 PHE A 20 1.610 0.461 0.827 1.00 0.00 ATOM 149 CD2 PHE A 20 1.849 -0.516 2.984 1.00 0.00 ATOM 150 CE1 PHE A 20 0.330 0.870 1.154 1.00 0.00 ATOM 151 CE2 PHE A 20 0.570 -0.108 3.311 1.00 0.00 ATOM 152 CZ PHE A 20 -0.188 0.582 2.403 1.00 0.00 ATOM 153 O PHE A 20 5.348 0.445 3.699 1.00 0.00 ATOM 154 C PHE A 20 4.874 1.067 2.748 1.00 0.00 ATOM 155 N ASP A 21 4.424 2.331 2.867 1.00 0.00 ATOM 156 CA ASP A 21 4.482 2.971 4.146 1.00 0.00 ATOM 157 CB ASP A 21 4.736 4.471 3.984 1.00 0.00 ATOM 158 CG ASP A 21 6.060 4.767 3.306 1.00 0.00 ATOM 159 OD1 ASP A 21 7.079 4.166 3.705 1.00 0.00 ATOM 160 OD2 ASP A 21 6.077 5.601 2.376 1.00 0.00 ATOM 161 O ASP A 21 2.245 2.166 4.302 1.00 0.00 ATOM 162 C ASP A 21 3.175 2.762 4.846 1.00 0.00 ATOM 163 N LYS A 22 3.094 3.239 6.100 1.00 0.00 ATOM 164 CA LYS A 22 1.937 3.045 6.922 1.00 0.00 ATOM 165 CB LYS A 22 2.187 3.579 8.334 1.00 0.00 ATOM 166 CG LYS A 22 1.025 3.371 9.291 1.00 0.00 ATOM 167 CD LYS A 22 1.372 3.846 10.693 1.00 0.00 ATOM 168 CE LYS A 22 0.198 3.669 11.642 1.00 0.00 ATOM 169 NZ LYS A 22 0.505 4.181 13.006 1.00 0.00 ATOM 170 O LYS A 22 -0.317 3.131 6.217 1.00 0.00 ATOM 171 C LYS A 22 0.732 3.753 6.376 1.00 0.00 ATOM 172 N SER A 23 0.824 5.060 6.056 1.00 0.00 ATOM 173 CA SER A 23 -0.400 5.670 5.621 1.00 0.00 ATOM 174 CB SER A 23 -1.246 6.090 6.824 1.00 0.00 ATOM 175 OG SER A 23 -2.430 6.750 6.410 1.00 0.00 ATOM 176 O SER A 23 0.697 7.725 5.153 1.00 0.00 ATOM 177 C SER A 23 -0.125 6.881 4.798 1.00 0.00 ATOM 178 N LYS A 24 -0.835 6.976 3.656 1.00 0.00 ATOM 179 CA LYS A 24 -0.786 8.088 2.756 1.00 0.00 ATOM 180 CB LYS A 24 -1.250 9.366 3.458 1.00 0.00 ATOM 181 CG LYS A 24 -2.708 9.345 3.886 1.00 0.00 ATOM 182 CD LYS A 24 -3.063 10.579 4.698 1.00 0.00 ATOM 183 CE LYS A 24 -4.516 10.548 5.143 1.00 0.00 ATOM 184 NZ LYS A 24 -4.860 11.717 6.000 1.00 0.00 ATOM 185 O LYS A 24 0.948 9.306 1.705 1.00 0.00 ATOM 186 C LYS A 24 0.610 8.274 2.282 1.00 0.00 ATOM 187 N ASP A 25 1.465 7.268 2.508 1.00 0.00 ATOM 188 CA ASP A 25 2.784 7.362 1.976 1.00 0.00 ATOM 189 CB ASP A 25 3.822 7.075 3.063 1.00 0.00 ATOM 190 CG ASP A 25 3.812 8.115 4.166 1.00 0.00 ATOM 191 OD1 ASP A 25 3.921 9.318 3.850 1.00 0.00 ATOM 192 OD2 ASP A 25 3.696 7.726 5.348 1.00 0.00 ATOM 193 O ASP A 25 2.429 5.174 1.153 1.00 0.00 ATOM 194 C ASP A 25 2.770 6.330 0.920 1.00 0.00 ATOM 195 N GLU A 26 3.130 6.727 -0.294 1.00 0.00 ATOM 196 CA GLU A 26 2.955 5.818 -1.363 1.00 0.00 ATOM 197 CB GLU A 26 2.997 6.553 -2.704 1.00 0.00 ATOM 198 CG GLU A 26 1.849 7.528 -2.913 1.00 0.00 ATOM 199 CD GLU A 26 2.101 8.874 -2.264 1.00 0.00 ATOM 200 OE1 GLU A 26 3.222 9.088 -1.758 1.00 0.00 ATOM 201 OE2 GLU A 26 1.177 9.714 -2.260 1.00 0.00 ATOM 202 O GLU A 26 4.969 4.851 -0.560 1.00 0.00 ATOM 203 C GLU A 26 4.030 4.796 -1.354 1.00 0.00 ATOM 204 N LEU A 27 3.834 3.768 -2.200 1.00 0.00 ATOM 205 CA LEU A 27 4.796 2.725 -2.341 1.00 0.00 ATOM 206 CB LEU A 27 4.188 1.532 -3.082 1.00 0.00 ATOM 207 CG LEU A 27 3.447 0.506 -2.222 1.00 0.00 ATOM 208 CD1 LEU A 27 2.344 1.175 -1.418 1.00 0.00 ATOM 209 CD2 LEU A 27 2.816 -0.569 -3.093 1.00 0.00 ATOM 210 O LEU A 27 5.636 4.201 -3.970 1.00 0.00 ATOM 211 C LEU A 27 5.895 3.354 -3.119 1.00 0.00 ATOM 212 N ILE A 28 7.161 2.979 -2.869 1.00 0.00 ATOM 213 CA ILE A 28 8.135 3.673 -3.651 1.00 0.00 ATOM 214 CB ILE A 28 9.510 3.688 -2.957 1.00 0.00 ATOM 215 CG1 ILE A 28 9.396 4.309 -1.563 1.00 0.00 ATOM 216 CG2 ILE A 28 10.506 4.503 -3.767 1.00 0.00 ATOM 217 CD1 ILE A 28 10.653 4.178 -0.732 1.00 0.00 ATOM 218 O ILE A 28 9.147 2.165 -5.214 1.00 0.00 ATOM 219 C ILE A 28 8.238 2.954 -4.961 1.00 0.00 ATOM 220 N CYS A 29 7.259 3.258 -5.837 1.00 0.00 ATOM 221 CA CYS A 29 7.115 2.694 -7.145 1.00 0.00 ATOM 222 CB CYS A 29 6.507 1.293 -7.060 1.00 0.00 ATOM 223 SG CYS A 29 7.540 0.080 -6.205 1.00 0.00 ATOM 224 O CYS A 29 6.600 4.771 -8.163 1.00 0.00 ATOM 225 C CYS A 29 6.206 3.645 -7.863 1.00 0.00 ATOM 226 N LYS A 30 4.959 3.217 -8.165 1.00 0.00 ATOM 227 CA LYS A 30 4.053 4.107 -8.841 1.00 0.00 ATOM 228 CB LYS A 30 2.720 3.408 -9.115 1.00 0.00 ATOM 229 CG LYS A 30 2.797 2.315 -10.169 1.00 0.00 ATOM 230 CD LYS A 30 1.442 1.663 -10.389 1.00 0.00 ATOM 231 CE LYS A 30 1.524 0.554 -11.425 1.00 0.00 ATOM 232 NZ LYS A 30 0.211 -0.118 -11.625 1.00 0.00 ATOM 233 O LYS A 30 3.958 6.438 -8.442 1.00 0.00 ATOM 234 C LYS A 30 3.808 5.309 -7.980 1.00 0.00 ATOM 235 N GLY A 31 3.466 5.099 -6.692 1.00 0.00 ATOM 236 CA GLY A 31 3.234 6.211 -5.809 1.00 0.00 ATOM 237 O GLY A 31 1.875 8.109 -6.221 1.00 0.00 ATOM 238 C GLY A 31 1.931 6.885 -6.117 1.00 0.00 ATOM 239 N ASP A 32 0.838 6.114 -6.268 1.00 0.00 ATOM 240 CA ASP A 32 -0.432 6.731 -6.542 1.00 0.00 ATOM 241 CB ASP A 32 -1.387 5.726 -7.189 1.00 0.00 ATOM 242 CG ASP A 32 -1.012 5.405 -8.622 1.00 0.00 ATOM 243 OD1 ASP A 32 -0.159 6.122 -9.188 1.00 0.00 ATOM 244 OD2 ASP A 32 -1.569 4.436 -9.180 1.00 0.00 ATOM 245 O ASP A 32 -0.969 6.520 -4.235 1.00 0.00 ATOM 246 C ASP A 32 -1.013 7.211 -5.251 1.00 0.00 ATOM 247 N ARG A 33 -1.563 8.440 -5.258 1.00 0.00 ATOM 248 CA ARG A 33 -2.162 8.994 -4.085 1.00 0.00 ATOM 249 CB ARG A 33 -2.385 10.498 -4.257 1.00 0.00 ATOM 250 CG ARG A 33 -1.117 11.285 -4.543 1.00 0.00 ATOM 251 CD ARG A 33 -0.261 11.426 -3.295 1.00 0.00 ATOM 252 NE ARG A 33 0.905 12.276 -3.524 1.00 0.00 ATOM 253 CZ ARG A 33 1.805 12.576 -2.593 1.00 0.00 ATOM 254 NH1 ARG A 33 2.834 13.357 -2.893 1.00 0.00 ATOM 255 NH2 ARG A 33 1.675 12.093 -1.365 1.00 0.00 ATOM 256 O ARG A 33 -3.992 7.671 -4.788 1.00 0.00 ATOM 257 C ARG A 33 -3.466 8.309 -3.879 1.00 0.00 ATOM 258 N LEU A 34 -4.009 8.379 -2.650 1.00 0.00 ATOM 259 CA LEU A 34 -5.231 7.678 -2.426 1.00 0.00 ATOM 260 CB LEU A 34 -5.497 7.531 -0.927 1.00 0.00 ATOM 261 CG LEU A 34 -4.489 6.693 -0.138 1.00 0.00 ATOM 262 CD1 LEU A 34 -4.804 6.732 1.350 1.00 0.00 ATOM 263 CD2 LEU A 34 -4.524 5.242 -0.593 1.00 0.00 ATOM 264 O LEU A 34 -6.497 9.657 -2.832 1.00 0.00 ATOM 265 C LEU A 34 -6.332 8.457 -3.057 1.00 0.00 ATOM 266 N ALA A 35 -7.099 7.746 -3.903 1.00 0.00 ATOM 267 CA ALA A 35 -8.200 8.285 -4.634 1.00 0.00 ATOM 268 CB ALA A 35 -7.722 9.364 -5.593 1.00 0.00 ATOM 269 O ALA A 35 -8.322 5.995 -5.217 1.00 0.00 ATOM 270 C ALA A 35 -8.781 7.127 -5.372 1.00 0.00 ATOM 271 N PHE A 36 -9.828 7.382 -6.176 1.00 0.00 ATOM 272 CA PHE A 36 -10.443 6.348 -6.959 1.00 0.00 ATOM 273 CB PHE A 36 -11.965 6.504 -6.951 1.00 0.00 ATOM 274 CG PHE A 36 -12.592 6.260 -5.608 1.00 0.00 ATOM 275 CD1 PHE A 36 -12.953 7.320 -4.794 1.00 0.00 ATOM 276 CD2 PHE A 36 -12.822 4.972 -5.159 1.00 0.00 ATOM 277 CE1 PHE A 36 -13.530 7.096 -3.559 1.00 0.00 ATOM 278 CE2 PHE A 36 -13.399 4.748 -3.923 1.00 0.00 ATOM 279 CZ PHE A 36 -13.753 5.804 -3.124 1.00 0.00 ATOM 280 O PHE A 36 -9.148 7.432 -8.610 1.00 0.00 ATOM 281 C PHE A 36 -9.907 6.501 -8.337 1.00 0.00 ATOM 282 N PRO A 37 -10.235 5.606 -9.218 1.00 0.00 ATOM 283 CA PRO A 37 -9.702 5.651 -10.544 1.00 0.00 ATOM 284 CB PRO A 37 -10.362 4.464 -11.249 1.00 0.00 ATOM 285 CG PRO A 37 -10.678 3.506 -10.150 1.00 0.00 ATOM 286 CD PRO A 37 -11.082 4.344 -8.969 1.00 0.00 ATOM 287 O PRO A 37 -9.243 7.446 -11.970 1.00 0.00 ATOM 288 C PRO A 37 -10.051 6.942 -11.190 1.00 0.00 ATOM 289 N ILE A 38 -11.229 7.506 -10.888 1.00 0.00 ATOM 290 CA ILE A 38 -11.495 8.772 -11.487 1.00 0.00 ATOM 291 CB ILE A 38 -12.952 9.213 -11.252 1.00 0.00 ATOM 292 CG1 ILE A 38 -13.919 8.241 -11.930 1.00 0.00 ATOM 293 CG2 ILE A 38 -13.186 10.603 -11.822 1.00 0.00 ATOM 294 CD1 ILE A 38 -15.368 8.461 -11.555 1.00 0.00 ATOM 295 O ILE A 38 -10.382 9.675 -9.600 1.00 0.00 ATOM 296 C ILE A 38 -10.538 9.699 -10.821 1.00 0.00 ATOM 297 N LYS A 39 -9.833 10.520 -11.622 1.00 0.00 ATOM 298 CA LYS A 39 -8.825 11.376 -11.081 1.00 0.00 ATOM 299 CB LYS A 39 -8.165 12.196 -12.192 1.00 0.00 ATOM 300 CG LYS A 39 -7.025 13.081 -11.716 1.00 0.00 ATOM 301 CD LYS A 39 -6.313 13.740 -12.886 1.00 0.00 ATOM 302 CE LYS A 39 -5.225 14.688 -12.408 1.00 0.00 ATOM 303 NZ LYS A 39 -4.485 15.303 -13.544 1.00 0.00 ATOM 304 O LYS A 39 -10.114 13.280 -10.460 1.00 0.00 ATOM 305 C LYS A 39 -9.468 12.296 -10.097 1.00 0.00 ATOM 306 N ASP A 40 -9.290 11.974 -8.800 1.00 0.00 ATOM 307 CA ASP A 40 -9.819 12.772 -7.736 1.00 0.00 ATOM 308 CB ASP A 40 -10.092 11.908 -6.503 1.00 0.00 ATOM 309 CG ASP A 40 -11.291 10.998 -6.684 1.00 0.00 ATOM 310 OD1 ASP A 40 -12.057 11.209 -7.647 1.00 0.00 ATOM 311 OD2 ASP A 40 -11.463 10.073 -5.862 1.00 0.00 ATOM 312 O ASP A 40 -7.655 13.741 -7.865 1.00 0.00 ATOM 313 C ASP A 40 -8.799 13.812 -7.419 1.00 0.00 ATOM 314 N GLY A 41 -9.201 14.823 -6.633 1.00 0.00 ATOM 315 CA GLY A 41 -8.250 15.826 -6.278 1.00 0.00 ATOM 316 O GLY A 41 -7.698 14.278 -4.572 1.00 0.00 ATOM 317 C GLY A 41 -7.321 15.199 -5.297 1.00 0.00 ATOM 318 N ILE A 42 -6.065 15.680 -5.254 1.00 0.00 ATOM 319 CA ILE A 42 -5.137 15.160 -4.298 1.00 0.00 ATOM 320 CB ILE A 42 -3.733 14.992 -4.908 1.00 0.00 ATOM 321 CG1 ILE A 42 -3.772 13.996 -6.069 1.00 0.00 ATOM 322 CG2 ILE A 42 -2.756 14.475 -3.863 1.00 0.00 ATOM 323 CD1 ILE A 42 -2.494 13.951 -6.878 1.00 0.00 ATOM 324 O ILE A 42 -4.989 17.354 -3.386 1.00 0.00 ATOM 325 C ILE A 42 -5.099 16.147 -3.182 1.00 0.00 ATOM 326 N PRO A 43 -5.223 15.638 -1.994 1.00 0.00 ATOM 327 CA PRO A 43 -5.222 16.427 -0.798 1.00 0.00 ATOM 328 CB PRO A 43 -5.444 15.406 0.319 1.00 0.00 ATOM 329 CG PRO A 43 -4.968 14.114 -0.256 1.00 0.00 ATOM 330 CD PRO A 43 -5.317 14.154 -1.717 1.00 0.00 ATOM 331 O PRO A 43 -3.769 18.041 0.092 1.00 0.00 ATOM 332 C PRO A 43 -3.903 17.111 -0.700 1.00 0.00 ATOM 333 N MET A 44 -2.907 16.661 -1.482 1.00 0.00 ATOM 334 CA MET A 44 -1.621 17.271 -1.395 1.00 0.00 ATOM 335 CB MET A 44 -0.625 16.554 -2.309 1.00 0.00 ATOM 336 CG MET A 44 0.800 17.070 -2.199 1.00 0.00 ATOM 337 SD MET A 44 1.941 16.202 -3.293 1.00 0.00 ATOM 338 CE MET A 44 1.474 16.888 -4.881 1.00 0.00 ATOM 339 O MET A 44 -2.414 19.011 -2.818 1.00 0.00 ATOM 340 C MET A 44 -1.769 18.695 -1.820 1.00 0.00 ATOM 341 N MET A 45 -1.171 19.597 -1.024 1.00 0.00 ATOM 342 CA MET A 45 -1.172 21.010 -1.259 1.00 0.00 ATOM 343 CB MET A 45 -2.060 21.722 -0.237 1.00 0.00 ATOM 344 CG MET A 45 -3.533 21.360 -0.336 1.00 0.00 ATOM 345 SD MET A 45 -4.557 22.288 0.822 1.00 0.00 ATOM 346 CE MET A 45 -4.625 23.884 0.011 1.00 0.00 ATOM 347 O MET A 45 1.157 20.632 -1.432 1.00 0.00 ATOM 348 C MET A 45 0.255 21.405 -1.114 1.00 0.00 ATOM 349 N LEU A 46 0.515 22.636 -0.646 1.00 0.00 ATOM 350 CA LEU A 46 1.890 22.983 -0.453 1.00 0.00 ATOM 351 CB LEU A 46 2.017 24.439 -0.000 1.00 0.00 ATOM 352 CG LEU A 46 1.591 25.503 -1.014 1.00 0.00 ATOM 353 CD1 LEU A 46 1.645 26.890 -0.392 1.00 0.00 ATOM 354 CD2 LEU A 46 2.511 25.490 -2.225 1.00 0.00 ATOM 355 O LEU A 46 1.603 21.603 1.452 1.00 0.00 ATOM 356 C LEU A 46 2.375 22.041 0.602 1.00 0.00 ATOM 357 N GLU A 47 3.669 21.673 0.554 1.00 0.00 ATOM 358 CA GLU A 47 4.139 20.666 1.455 1.00 0.00 ATOM 359 CB GLU A 47 5.399 19.998 0.902 1.00 0.00 ATOM 360 CG GLU A 47 5.936 18.871 1.769 1.00 0.00 ATOM 361 CD GLU A 47 7.182 18.232 1.188 1.00 0.00 ATOM 362 OE1 GLU A 47 7.653 18.701 0.131 1.00 0.00 ATOM 363 OE2 GLU A 47 7.688 17.262 1.791 1.00 0.00 ATOM 364 O GLU A 47 5.121 22.272 2.932 1.00 0.00 ATOM 365 C GLU A 47 4.475 21.234 2.794 1.00 0.00 ATOM 366 N SER A 48 3.988 20.523 3.821 1.00 0.00 ATOM 367 CA SER A 48 4.242 20.751 5.208 1.00 0.00 ATOM 368 CB SER A 48 3.132 21.606 5.822 1.00 0.00 ATOM 369 OG SER A 48 1.895 20.915 5.820 1.00 0.00 ATOM 370 O SER A 48 4.026 18.445 4.924 1.00 0.00 ATOM 371 C SER A 48 4.259 19.353 5.720 1.00 0.00 ATOM 372 N GLU A 49 4.575 19.102 7.007 1.00 0.00 ATOM 373 CA GLU A 49 4.567 17.712 7.381 1.00 0.00 ATOM 374 CB GLU A 49 5.007 17.546 8.837 1.00 0.00 ATOM 375 CG GLU A 49 5.071 16.102 9.305 1.00 0.00 ATOM 376 CD GLU A 49 5.543 15.975 10.741 1.00 0.00 ATOM 377 OE1 GLU A 49 5.831 17.018 11.365 1.00 0.00 ATOM 378 OE2 GLU A 49 5.623 14.834 11.241 1.00 0.00 ATOM 379 O GLU A 49 2.924 16.242 6.493 1.00 0.00 ATOM 380 C GLU A 49 3.173 17.208 7.210 1.00 0.00 ATOM 381 N ALA A 50 2.202 17.872 7.847 1.00 0.00 ATOM 382 CA ALA A 50 0.874 17.421 7.613 1.00 0.00 ATOM 383 CB ALA A 50 0.658 16.056 8.249 1.00 0.00 ATOM 384 O ALA A 50 0.132 18.826 9.368 1.00 0.00 ATOM 385 C ALA A 50 -0.036 18.417 8.219 1.00 0.00 ATOM 386 N ARG A 51 -1.033 18.841 7.437 1.00 0.00 ATOM 387 CA ARG A 51 -2.010 19.719 7.978 1.00 0.00 ATOM 388 CB ARG A 51 -2.075 21.014 7.166 1.00 0.00 ATOM 389 CG ARG A 51 -3.074 22.029 7.696 1.00 0.00 ATOM 390 CD ARG A 51 -3.053 23.307 6.872 1.00 0.00 ATOM 391 NE ARG A 51 -4.025 24.285 7.354 1.00 0.00 ATOM 392 CZ ARG A 51 -4.144 25.519 6.874 1.00 0.00 ATOM 393 NH1 ARG A 51 -5.058 26.339 7.375 1.00 0.00 ATOM 394 NH2 ARG A 51 -3.350 25.929 5.895 1.00 0.00 ATOM 395 O ARG A 51 -3.589 18.465 6.762 1.00 0.00 ATOM 396 C ARG A 51 -3.238 18.900 7.858 1.00 0.00 ATOM 397 N GLU A 52 -3.917 18.636 8.982 1.00 0.00 ATOM 398 CA GLU A 52 -5.044 17.775 8.840 1.00 0.00 ATOM 399 CB GLU A 52 -5.391 17.121 10.179 1.00 0.00 ATOM 400 CG GLU A 52 -4.308 16.201 10.719 1.00 0.00 ATOM 401 CD GLU A 52 -4.683 15.578 12.049 1.00 0.00 ATOM 402 OE1 GLU A 52 -5.780 15.886 12.561 1.00 0.00 ATOM 403 OE2 GLU A 52 -3.881 14.781 12.579 1.00 0.00 ATOM 404 O GLU A 52 -6.766 19.395 9.102 1.00 0.00 ATOM 405 C GLU A 52 -6.199 18.586 8.370 1.00 0.00 ATOM 406 N LEU A 53 -6.540 18.391 7.086 1.00 0.00 ATOM 407 CA LEU A 53 -7.618 19.090 6.469 1.00 0.00 ATOM 408 CB LEU A 53 -7.665 18.787 4.970 1.00 0.00 ATOM 409 CG LEU A 53 -6.527 19.363 4.126 1.00 0.00 ATOM 410 CD1 LEU A 53 -6.592 18.833 2.702 1.00 0.00 ATOM 411 CD2 LEU A 53 -6.613 20.881 4.072 1.00 0.00 ATOM 412 O LEU A 53 -9.719 19.393 7.549 1.00 0.00 ATOM 413 C LEU A 53 -8.860 18.609 7.145 1.00 0.00 ATOM 414 N ALA A 54 -8.941 17.277 7.314 1.00 0.00 ATOM 415 CA ALA A 54 -10.073 16.597 7.872 1.00 0.00 ATOM 416 CB ALA A 54 -10.077 15.137 7.447 1.00 0.00 ATOM 417 O ALA A 54 -9.018 16.988 9.981 1.00 0.00 ATOM 418 C ALA A 54 -10.029 16.659 9.365 1.00 0.00 ATOM 419 N PRO A 55 -11.160 16.368 9.944 1.00 0.00 ATOM 420 CA PRO A 55 -11.253 16.316 11.374 1.00 0.00 ATOM 421 CB PRO A 55 -12.757 16.381 11.650 1.00 0.00 ATOM 422 CG PRO A 55 -13.382 15.721 10.467 1.00 0.00 ATOM 423 CD PRO A 55 -12.548 16.114 9.280 1.00 0.00 ATOM 424 O PRO A 55 -10.451 14.132 11.039 1.00 0.00 ATOM 425 C PRO A 55 -10.642 15.041 11.845 1.00 0.00 ATOM 426 N GLU A 56 -10.325 14.954 13.146 1.00 0.00 ATOM 427 CA GLU A 56 -9.756 13.762 13.691 1.00 0.00 ATOM 428 CB GLU A 56 -9.404 13.962 15.166 1.00 0.00 ATOM 429 CG GLU A 56 -8.224 14.891 15.403 1.00 0.00 ATOM 430 CD GLU A 56 -7.982 15.163 16.874 1.00 0.00 ATOM 431 OE1 GLU A 56 -8.782 14.685 17.706 1.00 0.00 ATOM 432 OE2 GLU A 56 -6.993 15.853 17.196 1.00 0.00 ATOM 433 O GLU A 56 -10.435 11.538 13.238 1.00 0.00 ATOM 434 C GLU A 56 -10.771 12.679 13.551 1.00 0.00 ATOM 435 N GLU A 57 -12.056 13.020 13.759 1.00 0.00 ATOM 436 CA GLU A 57 -13.066 12.006 13.679 1.00 0.00 ATOM 437 CB GLU A 57 -14.448 12.604 13.947 1.00 0.00 ATOM 438 CG GLU A 57 -15.579 11.589 13.927 1.00 0.00 ATOM 439 CD GLU A 57 -16.928 12.212 14.229 1.00 0.00 ATOM 440 OE1 GLU A 57 -16.976 13.437 14.467 1.00 0.00 ATOM 441 OE2 GLU A 57 -17.936 11.475 14.228 1.00 0.00 ATOM 442 O GLU A 57 -13.038 10.197 12.159 1.00 0.00 ATOM 443 C GLU A 57 -13.036 11.417 12.310 1.00 0.00 ATOM 444 N GLU 58 -12.986 12.267 11.269 1.00 0.00 ATOM 445 CA GLU 58 -12.972 11.739 9.940 1.00 0.00 ENDMDL