EXPDTA T0348TS351_3-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called T0348TS351_3-scwrl ATOM 1 C GLY 16 -2.900 1.521 -0.161 1.00 0.00 ATOM 2 N PRO A 17 -3.118 1.653 -1.452 1.00 0.00 ATOM 3 CA PRO A 17 -2.153 2.315 -2.223 1.00 0.00 ATOM 4 CB PRO A 17 -2.764 2.356 -3.625 1.00 0.00 ATOM 5 CG PRO A 17 -3.733 1.221 -3.644 1.00 0.00 ATOM 6 CD PRO A 17 -4.324 1.156 -2.263 1.00 0.00 ATOM 7 O PRO A 17 -2.740 4.520 -1.491 1.00 0.00 ATOM 8 C PRO A 17 -1.825 3.745 -1.753 1.00 0.00 ATOM 9 N LEU A 18 -0.567 4.148 -1.921 1.00 0.00 ATOM 10 CA LEU A 18 -0.045 5.440 -1.624 1.00 0.00 ATOM 11 CB LEU A 18 1.464 5.365 -1.380 1.00 0.00 ATOM 12 CG LEU A 18 1.915 4.544 -0.171 1.00 0.00 ATOM 13 CD1 LEU A 18 3.432 4.453 -0.119 1.00 0.00 ATOM 14 CD2 LEU A 18 1.432 5.181 1.123 1.00 0.00 ATOM 15 O LEU A 18 -0.191 6.099 -3.968 1.00 0.00 ATOM 16 C LEU A 18 -0.291 6.428 -2.785 1.00 0.00 ATOM 17 N VAL A 19 -0.745 7.598 -2.406 1.00 0.00 ATOM 18 CA VAL A 19 -1.057 8.638 -3.358 1.00 0.00 ATOM 19 CB VAL A 19 -2.501 9.144 -3.188 1.00 0.00 ATOM 20 CG1 VAL A 19 -2.785 10.281 -4.157 1.00 0.00 ATOM 21 CG2 VAL A 19 -3.494 8.024 -3.457 1.00 0.00 ATOM 22 O VAL A 19 0.331 10.158 -2.078 1.00 0.00 ATOM 23 C VAL A 19 -0.102 9.849 -3.174 1.00 0.00 ATOM 24 N PHE A 20 0.290 10.417 -4.314 1.00 0.00 ATOM 25 CA PHE A 20 1.115 11.609 -4.298 1.00 0.00 ATOM 26 CB PHE A 20 2.513 11.300 -4.837 1.00 0.00 ATOM 27 CG PHE A 20 3.423 12.495 -4.882 1.00 0.00 ATOM 28 CD1 PHE A 20 4.053 12.946 -3.736 1.00 0.00 ATOM 29 CD2 PHE A 20 3.648 13.166 -6.071 1.00 0.00 ATOM 30 CE1 PHE A 20 4.890 14.045 -3.777 1.00 0.00 ATOM 31 CE2 PHE A 20 4.485 14.265 -6.112 1.00 0.00 ATOM 32 CZ PHE A 20 5.105 14.705 -4.972 1.00 0.00 ATOM 33 O PHE A 20 -0.014 12.524 -6.252 1.00 0.00 ATOM 34 C PHE A 20 0.543 12.763 -5.161 1.00 0.00 ATOM 35 N ASP A 21 0.575 13.980 -4.614 1.00 0.00 ATOM 36 CA ASP A 21 0.117 15.134 -5.339 1.00 0.00 ATOM 37 CB ASP A 21 -0.974 15.863 -4.552 1.00 0.00 ATOM 38 CG ASP A 21 -1.533 17.057 -5.300 1.00 0.00 ATOM 39 OD1 ASP A 21 -1.005 17.378 -6.386 1.00 0.00 ATOM 40 OD2 ASP A 21 -2.499 17.671 -4.802 1.00 0.00 ATOM 41 O ASP A 21 1.853 16.561 -4.622 1.00 0.00 ATOM 42 C ASP A 21 1.259 16.086 -5.572 1.00 0.00 ATOM 43 N LYS A 22 1.760 16.091 -6.786 1.00 0.00 ATOM 44 CA LYS A 22 2.812 17.009 -7.254 1.00 0.00 ATOM 45 CB LYS A 22 3.352 16.557 -8.612 1.00 0.00 ATOM 46 CG LYS A 22 4.489 17.414 -9.145 1.00 0.00 ATOM 47 CD LYS A 22 5.038 16.856 -10.448 1.00 0.00 ATOM 48 CE LYS A 22 6.158 17.727 -10.993 1.00 0.00 ATOM 49 NZ LYS A 22 6.691 17.204 -12.281 1.00 0.00 ATOM 50 O LYS A 22 3.032 19.368 -7.197 1.00 0.00 ATOM 51 C LYS A 22 2.252 18.448 -7.404 1.00 0.00 ATOM 52 N SER A 23 1.023 18.655 -7.902 1.00 0.00 ATOM 53 CA SER A 23 0.431 19.952 -8.107 1.00 0.00 ATOM 54 CB SER A 23 -1.070 19.820 -8.372 1.00 0.00 ATOM 55 OG SER A 23 -1.671 21.091 -8.544 1.00 0.00 ATOM 56 O SER A 23 1.381 21.821 -6.909 1.00 0.00 ATOM 57 C SER A 23 0.656 20.818 -6.820 1.00 0.00 ATOM 58 N LYS A 24 0.145 20.358 -5.649 1.00 0.00 ATOM 59 CA LYS A 24 0.352 21.012 -4.390 1.00 0.00 ATOM 60 CB LYS A 24 -0.899 20.900 -3.516 1.00 0.00 ATOM 61 CG LYS A 24 -2.126 21.582 -4.098 1.00 0.00 ATOM 62 CD LYS A 24 -3.307 21.499 -3.145 1.00 0.00 ATOM 63 CE LYS A 24 -4.541 22.163 -3.736 1.00 0.00 ATOM 64 NZ LYS A 24 -5.708 22.085 -2.815 1.00 0.00 ATOM 65 O LYS A 24 1.667 20.928 -2.410 1.00 0.00 ATOM 66 C LYS A 24 1.532 20.435 -3.541 1.00 0.00 ATOM 67 N ASP A 25 2.417 19.554 -4.067 1.00 0.00 ATOM 68 CA ASP A 25 3.526 19.005 -3.245 1.00 0.00 ATOM 69 CB ASP A 25 4.571 20.087 -2.964 1.00 0.00 ATOM 70 CG ASP A 25 5.257 20.576 -4.225 1.00 0.00 ATOM 71 OD1 ASP A 25 5.714 19.728 -5.020 1.00 0.00 ATOM 72 OD2 ASP A 25 5.336 21.807 -4.418 1.00 0.00 ATOM 73 O ASP A 25 3.855 18.490 -0.913 1.00 0.00 ATOM 74 C ASP A 25 3.044 18.455 -1.855 1.00 0.00 ATOM 75 N GLU A 26 1.988 17.646 -1.825 1.00 0.00 ATOM 76 CA GLU A 26 1.411 17.059 -0.627 1.00 0.00 ATOM 77 CB GLU A 26 0.018 17.636 -0.365 1.00 0.00 ATOM 78 CG GLU A 26 0.010 19.126 -0.067 1.00 0.00 ATOM 79 CD GLU A 26 -1.385 19.659 0.199 1.00 0.00 ATOM 80 OE1 GLU A 26 -2.350 18.873 0.099 1.00 0.00 ATOM 81 OE2 GLU A 26 -1.512 20.863 0.507 1.00 0.00 ATOM 82 O GLU A 26 0.823 15.081 -1.886 1.00 0.00 ATOM 83 C GLU A 26 1.303 15.523 -0.829 1.00 0.00 ATOM 84 N LEU A 27 1.380 14.783 0.285 1.00 0.00 ATOM 85 CA LEU A 27 1.386 13.323 0.208 1.00 0.00 ATOM 86 CB LEU A 27 2.643 12.757 0.872 1.00 0.00 ATOM 87 CG LEU A 27 2.754 11.231 0.923 1.00 0.00 ATOM 88 CD1 LEU A 27 2.902 10.656 -0.477 1.00 0.00 ATOM 89 CD2 LEU A 27 3.963 10.808 1.742 1.00 0.00 ATOM 90 O LEU A 27 -0.150 13.113 2.116 1.00 0.00 ATOM 91 C LEU A 27 0.104 12.764 0.954 1.00 0.00 ATOM 92 N ILE A 28 -0.607 11.885 0.264 1.00 0.00 ATOM 93 CA ILE A 28 -1.813 11.297 0.823 1.00 0.00 ATOM 94 CB ILE A 28 -3.081 11.953 0.245 1.00 0.00 ATOM 95 CG1 ILE A 28 -3.098 13.450 0.562 1.00 0.00 ATOM 96 CG2 ILE A 28 -4.328 11.320 0.843 1.00 0.00 ATOM 97 CD1 ILE A 28 -4.235 14.200 -0.096 1.00 0.00 ATOM 98 O ILE A 28 -2.396 9.417 -0.541 1.00 0.00 ATOM 99 C ILE A 28 -1.874 9.793 0.509 1.00 0.00 ATOM 100 N CYS A 29 -1.888 9.011 1.562 1.00 0.00 ATOM 101 CA CYS A 29 -2.012 7.539 1.460 1.00 0.00 ATOM 102 CB CYS A 29 -1.284 6.858 2.621 1.00 0.00 ATOM 103 SG CYS A 29 -1.361 5.052 2.595 1.00 0.00 ATOM 104 O CYS A 29 -4.121 7.490 2.504 1.00 0.00 ATOM 105 C CYS A 29 -3.457 7.145 1.501 1.00 0.00 ATOM 106 N LYS A 30 -3.948 6.263 0.602 1.00 0.00 ATOM 107 CA LYS A 30 -5.332 5.922 0.669 1.00 0.00 ATOM 108 CB LYS A 30 -5.917 5.776 -0.737 1.00 0.00 ATOM 109 CG LYS A 30 -7.419 5.545 -0.764 1.00 0.00 ATOM 110 CD LYS A 30 -7.925 5.373 -2.187 1.00 0.00 ATOM 111 CE LYS A 30 -9.439 5.242 -2.222 1.00 0.00 ATOM 112 NZ LYS A 30 -9.957 5.149 -3.615 1.00 0.00 ATOM 113 O LYS A 30 -5.238 3.520 0.853 1.00 0.00 ATOM 114 C LYS A 30 -5.591 4.595 1.407 1.00 0.00 ATOM 115 N GLY A 31 -5.889 4.599 2.704 1.00 0.00 ATOM 116 CA GLY A 31 -6.221 3.353 3.301 1.00 0.00 ATOM 117 O GLY A 31 -8.079 3.477 1.840 1.00 0.00 ATOM 118 C GLY A 31 -7.715 3.143 2.991 1.00 0.00 ATOM 119 N ASP A 32 -8.347 2.182 3.535 1.00 0.00 ATOM 120 CA ASP A 32 -9.742 2.095 3.289 1.00 0.00 ATOM 121 CB ASP A 32 -10.359 0.953 4.099 1.00 0.00 ATOM 122 CG ASP A 32 -9.992 -0.413 3.552 1.00 0.00 ATOM 123 OD1 ASP A 32 -9.425 -0.475 2.441 1.00 0.00 ATOM 124 OD2 ASP A 32 -10.273 -1.421 4.234 1.00 0.00 ATOM 125 O ASP A 32 -10.111 3.780 4.966 1.00 0.00 ATOM 126 C ASP A 32 -10.211 3.531 3.770 1.00 0.00 ATOM 127 N ARG A 33 -10.947 4.262 2.960 1.00 0.00 ATOM 128 CA ARG A 33 -11.289 5.644 3.368 1.00 0.00 ATOM 129 CB ARG A 33 -12.201 5.630 4.596 1.00 0.00 ATOM 130 CG ARG A 33 -13.539 4.945 4.368 1.00 0.00 ATOM 131 CD ARG A 33 -14.432 5.055 5.593 1.00 0.00 ATOM 132 NE ARG A 33 -13.875 4.344 6.741 1.00 0.00 ATOM 133 CZ ARG A 33 -13.948 3.028 6.912 1.00 0.00 ATOM 134 NH1 ARG A 33 -13.412 2.469 7.989 1.00 0.00 ATOM 135 NH2 ARG A 33 -14.556 2.275 6.007 1.00 0.00 ATOM 136 O ARG A 33 -9.643 6.593 4.928 1.00 0.00 ATOM 137 C ARG A 33 -10.059 6.548 3.750 1.00 0.00 ATOM 138 N LEU A 34 -9.350 6.964 2.762 1.00 0.00 ATOM 139 CA LEU A 34 -8.110 7.758 2.838 1.00 0.00 ATOM 140 CB LEU A 34 -7.264 7.552 1.580 1.00 0.00 ATOM 141 CG LEU A 34 -5.929 8.298 1.531 1.00 0.00 ATOM 142 CD1 LEU A 34 -4.987 7.785 2.610 1.00 0.00 ATOM 143 CD2 LEU A 34 -5.255 8.107 0.181 1.00 0.00 ATOM 144 O LEU A 34 -9.142 9.874 2.275 1.00 0.00 ATOM 145 C LEU A 34 -8.315 9.241 2.964 1.00 0.00 ATOM 146 N ALA A 35 -7.868 9.730 4.089 1.00 0.00 ATOM 147 CA ALA A 35 -7.787 11.098 4.450 1.00 0.00 ATOM 148 CB ALA A 35 -9.034 11.520 5.212 1.00 0.00 ATOM 149 O ALA A 35 -6.620 10.985 6.564 1.00 0.00 ATOM 150 C ALA A 35 -6.536 11.250 5.341 1.00 0.00 ATOM 151 N PHE A 36 -5.400 11.784 4.856 1.00 0.00 ATOM 152 CA PHE A 36 -4.196 12.036 5.660 1.00 0.00 ATOM 153 CB PHE A 36 -3.499 10.719 6.008 1.00 0.00 ATOM 154 CG PHE A 36 -2.430 10.858 7.054 1.00 0.00 ATOM 155 CD1 PHE A 36 -2.761 10.958 8.394 1.00 0.00 ATOM 156 CD2 PHE A 36 -1.093 10.888 6.698 1.00 0.00 ATOM 157 CE1 PHE A 36 -1.778 11.085 9.357 1.00 0.00 ATOM 158 CE2 PHE A 36 -0.109 11.015 7.661 1.00 0.00 ATOM 159 CZ PHE A 36 -0.447 11.113 8.985 1.00 0.00 ATOM 160 O PHE A 36 -2.452 12.401 4.038 1.00 0.00 ATOM 161 C PHE A 36 -3.122 12.934 4.946 1.00 0.00 ATOM 162 N PRO A 37 -3.245 14.276 4.962 1.00 0.00 ATOM 163 CA PRO A 37 -2.307 15.191 4.309 1.00 0.00 ATOM 164 CB PRO A 37 -3.085 16.504 4.201 1.00 0.00 ATOM 165 CG PRO A 37 -4.043 16.466 5.344 1.00 0.00 ATOM 166 CD PRO A 37 -4.419 15.022 5.525 1.00 0.00 ATOM 167 O PRO A 37 -0.988 15.157 6.345 1.00 0.00 ATOM 168 C PRO A 37 -0.988 15.383 5.149 1.00 0.00 ATOM 169 N ILE A 38 0.071 15.517 4.385 1.00 0.00 ATOM 170 CA ILE A 38 1.471 15.810 4.773 1.00 0.00 ATOM 171 CB ILE A 38 2.146 14.585 5.417 1.00 0.00 ATOM 172 CG1 ILE A 38 3.457 14.992 6.093 1.00 0.00 ATOM 173 CG2 ILE A 38 2.455 13.532 4.363 1.00 0.00 ATOM 174 CD1 ILE A 38 4.010 13.944 7.034 1.00 0.00 ATOM 175 O ILE A 38 1.689 16.490 2.497 1.00 0.00 ATOM 176 C ILE A 38 2.329 16.227 3.501 1.00 0.00 ATOM 177 N LYS A 39 3.605 16.708 3.587 1.00 0.00 ATOM 178 CA LYS A 39 4.475 17.060 2.480 1.00 0.00 ATOM 179 CB LYS A 39 4.171 18.477 1.990 1.00 0.00 ATOM 180 CG LYS A 39 4.576 19.571 2.964 1.00 0.00 ATOM 181 CD LYS A 39 4.303 20.951 2.389 1.00 0.00 ATOM 182 CE LYS A 39 4.716 22.046 3.360 1.00 0.00 ATOM 183 NZ LYS A 39 4.404 23.403 2.833 1.00 0.00 ATOM 184 O LYS A 39 6.425 17.655 3.807 1.00 0.00 ATOM 185 C LYS A 39 6.014 17.033 2.812 1.00 0.00 ATOM 186 N ASP A 40 6.842 16.440 1.909 1.00 0.00 ATOM 187 CA ASP A 40 8.315 16.390 2.028 1.00 0.00 ATOM 188 CB ASP A 40 8.898 17.804 2.066 1.00 0.00 ATOM 189 CG ASP A 40 8.741 18.534 0.747 1.00 0.00 ATOM 190 OD1 ASP A 40 8.489 17.865 -0.277 1.00 0.00 ATOM 191 OD2 ASP A 40 8.871 19.777 0.736 1.00 0.00 ATOM 192 O ASP A 40 10.065 15.518 3.500 1.00 0.00 ATOM 193 C ASP A 40 8.855 15.664 3.313 1.00 0.00 ATOM 194 N GLY A 41 7.878 15.225 4.143 1.00 0.00 ATOM 195 CA GLY A 41 8.087 14.515 5.411 1.00 0.00 ATOM 196 O GLY A 41 7.295 12.452 6.142 1.00 0.00 ATOM 197 C GLY A 41 7.878 13.026 5.222 1.00 0.00 ATOM 198 N ILE A 42 8.062 12.470 4.002 1.00 0.00 ATOM 199 CA ILE A 42 7.724 11.064 3.790 1.00 0.00 ATOM 200 CB ILE A 42 6.986 10.856 2.455 1.00 0.00 ATOM 201 CG1 ILE A 42 5.762 11.771 2.374 1.00 0.00 ATOM 202 CG2 ILE A 42 6.520 9.414 2.322 1.00 0.00 ATOM 203 CD1 ILE A 42 4.757 11.546 3.483 1.00 0.00 ATOM 204 O ILE A 42 9.902 10.401 3.039 1.00 0.00 ATOM 205 C ILE A 42 8.923 10.155 3.754 1.00 0.00 ATOM 206 N PRO A 43 9.020 9.439 4.961 1.00 0.00 ATOM 207 CA PRO A 43 9.913 8.388 5.209 1.00 0.00 ATOM 208 CB PRO A 43 9.897 8.240 6.732 1.00 0.00 ATOM 209 CG PRO A 43 8.516 8.641 7.131 1.00 0.00 ATOM 210 CD PRO A 43 8.130 9.771 6.218 1.00 0.00 ATOM 211 O PRO A 43 8.346 6.776 4.273 1.00 0.00 ATOM 212 C PRO A 43 9.547 6.994 4.542 1.00 0.00 ATOM 213 N MET A 44 10.451 6.008 4.673 1.00 0.00 ATOM 214 CA MET A 44 10.327 4.642 4.178 1.00 0.00 ATOM 215 CB MET A 44 11.185 4.446 2.926 1.00 0.00 ATOM 216 CG MET A 44 11.040 3.076 2.283 1.00 0.00 ATOM 217 SD MET A 44 12.022 2.905 0.781 1.00 0.00 ATOM 218 CE MET A 44 11.085 3.927 -0.354 1.00 0.00 ATOM 219 O MET A 44 11.973 3.679 5.682 1.00 0.00 ATOM 220 C MET A 44 10.794 3.646 5.258 1.00 0.00 ATOM 221 N MET A 45 9.994 2.596 5.489 1.00 0.00 ATOM 222 CA MET A 45 10.347 1.633 6.534 1.00 0.00 ATOM 223 CB MET A 45 9.428 1.796 7.746 1.00 0.00 ATOM 224 CG MET A 45 9.539 3.148 8.432 1.00 0.00 ATOM 225 SD MET A 45 8.488 3.277 9.891 1.00 0.00 ATOM 226 CE MET A 45 9.396 2.262 11.054 1.00 0.00 ATOM 227 O MET A 45 9.401 -0.161 5.203 1.00 0.00 ATOM 228 C MET A 45 10.229 0.180 6.073 1.00 0.00 ATOM 229 N LEU A 46 10.970 -0.670 6.732 1.00 0.00 ATOM 230 CA LEU A 46 10.978 -2.087 6.442 1.00 0.00 ATOM 231 CB LEU A 46 12.412 -2.590 6.267 1.00 0.00 ATOM 232 CG LEU A 46 12.579 -4.090 6.014 1.00 0.00 ATOM 233 CD1 LEU A 46 11.986 -4.476 4.667 1.00 0.00 ATOM 234 CD2 LEU A 46 14.050 -4.475 6.014 1.00 0.00 ATOM 235 O LEU A 46 10.851 -2.763 8.754 1.00 0.00 ATOM 236 C LEU A 46 10.319 -2.854 7.600 1.00 0.00 ATOM 237 N GLU A 47 9.449 -3.744 7.266 1.00 0.00 ATOM 238 CA GLU A 47 8.838 -4.506 8.288 1.00 0.00 ATOM 239 CB GLU A 47 7.315 -4.383 8.211 1.00 0.00 ATOM 240 CG GLU A 47 6.573 -5.182 9.269 1.00 0.00 ATOM 241 CD GLU A 47 6.938 -4.762 10.679 1.00 0.00 ATOM 242 OE1 GLU A 47 6.695 -3.589 11.031 1.00 0.00 ATOM 243 OE2 GLU A 47 7.467 -5.607 11.432 1.00 0.00 ATOM 244 O GLU A 47 9.063 -6.487 7.066 1.00 0.00 ATOM 245 C GLU A 47 9.173 -5.966 8.198 1.00 0.00 ATOM 246 N SER A 48 10.069 -6.421 9.127 1.00 0.00 ATOM 247 CA SER A 48 10.392 -7.820 9.119 1.00 0.00 ATOM 248 CB SER A 48 10.991 -8.239 10.463 1.00 0.00 ATOM 249 OG SER A 48 12.212 -7.563 10.710 1.00 0.00 ATOM 250 O SER A 48 9.132 -9.698 8.370 1.00 0.00 ATOM 251 C SER A 48 9.042 -8.573 8.854 1.00 0.00 ATOM 252 N GLU A 49 7.872 -8.130 9.385 1.00 0.00 ATOM 253 CA GLU A 49 6.607 -8.721 9.104 1.00 0.00 ATOM 254 CB GLU A 49 5.961 -9.240 10.390 1.00 0.00 ATOM 255 CG GLU A 49 6.748 -10.342 11.080 1.00 0.00 ATOM 256 CD GLU A 49 5.980 -10.982 12.219 1.00 0.00 ATOM 257 OE1 GLU A 49 5.567 -10.249 13.143 1.00 0.00 ATOM 258 OE2 GLU A 49 5.790 -12.216 12.188 1.00 0.00 ATOM 259 O GLU A 49 4.428 -8.421 8.133 1.00 0.00 ATOM 260 C GLU A 49 5.495 -7.825 8.446 1.00 0.00 ATOM 261 N ALA A 50 5.671 -6.549 8.022 1.00 0.00 ATOM 262 CA ALA A 50 4.502 -5.772 7.504 1.00 0.00 ATOM 263 CB ALA A 50 3.334 -5.861 8.475 1.00 0.00 ATOM 264 O ALA A 50 5.441 -3.937 6.287 1.00 0.00 ATOM 265 C ALA A 50 4.787 -4.226 7.285 1.00 0.00 ATOM 266 N ARG A 51 3.840 -3.347 7.733 1.00 0.00 ATOM 267 CA ARG A 51 3.884 -1.853 7.635 1.00 0.00 ATOM 268 CB ARG A 51 5.302 -1.379 7.310 1.00 0.00 ATOM 269 CG ARG A 51 6.327 -1.706 8.383 1.00 0.00 ATOM 270 CD ARG A 51 6.140 -0.830 9.611 1.00 0.00 ATOM 271 NE ARG A 51 7.157 -1.088 10.628 1.00 0.00 ATOM 272 CZ ARG A 51 7.226 -0.454 11.793 1.00 0.00 ATOM 273 NH1 ARG A 51 8.186 -0.755 12.657 1.00 0.00 ATOM 274 NH2 ARG A 51 6.335 0.481 12.093 1.00 0.00 ATOM 275 O ARG A 51 2.774 0.004 6.552 1.00 0.00 ATOM 276 C ARG A 51 2.962 -1.221 6.538 1.00 0.00 ATOM 277 N GLU A 52 2.306 -1.985 5.748 1.00 0.00 ATOM 278 CA GLU A 52 1.280 -1.573 4.773 1.00 0.00 ATOM 279 CB GLU A 52 0.065 -0.983 5.491 1.00 0.00 ATOM 280 CG GLU A 52 -0.692 -1.981 6.352 1.00 0.00 ATOM 281 CD GLU A 52 -1.869 -1.354 7.074 1.00 0.00 ATOM 282 OE1 GLU A 52 -2.099 -0.140 6.891 1.00 0.00 ATOM 283 OE2 GLU A 52 -2.561 -2.076 7.822 1.00 0.00 ATOM 284 O GLU A 52 0.936 0.536 3.674 1.00 0.00 ATOM 285 C GLU A 52 1.628 -0.477 3.675 1.00 0.00 ATOM 286 N LEU A 53 2.255 -0.854 2.583 1.00 0.00 ATOM 287 CA LEU A 53 2.559 -0.027 1.462 1.00 0.00 ATOM 288 CB LEU A 53 3.818 0.799 1.731 1.00 0.00 ATOM 289 CG LEU A 53 3.683 1.927 2.757 1.00 0.00 ATOM 290 CD1 LEU A 53 5.036 2.560 3.040 1.00 0.00 ATOM 291 CD2 LEU A 53 2.748 3.011 2.243 1.00 0.00 ATOM 292 O LEU A 53 3.560 -1.963 0.443 1.00 0.00 ATOM 293 C LEU A 53 2.779 -0.985 0.274 1.00 0.00 ATOM 294 N ALA A 54 2.369 -0.650 -0.983 1.00 0.00 ATOM 295 CA ALA A 54 2.687 -1.617 -2.085 1.00 0.00 ATOM 296 CB ALA A 54 1.901 -1.268 -3.340 1.00 0.00 ATOM 297 O ALA A 54 4.749 -0.519 -2.231 1.00 0.00 ATOM 298 C ALA A 54 4.228 -1.583 -2.441 1.00 0.00 ATOM 299 N PRO A 55 4.959 -2.734 -2.508 1.00 0.00 ATOM 300 CA PRO A 55 6.357 -2.429 -3.005 1.00 0.00 ATOM 301 CB PRO A 55 6.838 -3.756 -3.595 1.00 0.00 ATOM 302 CG PRO A 55 6.162 -4.799 -2.768 1.00 0.00 ATOM 303 CD PRO A 55 4.755 -4.315 -2.556 1.00 0.00 ATOM 304 O PRO A 55 7.482 -0.519 -3.998 1.00 0.00 ATOM 305 C PRO A 55 6.547 -1.307 -4.107 1.00 0.00 ATOM 306 N GLU A 56 5.856 -1.444 -5.279 1.00 0.00 ATOM 307 CA GLU A 56 5.874 -0.468 -6.380 1.00 0.00 ATOM 308 CB GLU A 56 4.849 -0.849 -7.450 1.00 0.00 ATOM 309 CG GLU A 56 4.818 0.094 -8.643 1.00 0.00 ATOM 310 CD GLU A 56 3.821 -0.338 -9.700 1.00 0.00 ATOM 311 OE1 GLU A 56 3.179 -1.393 -9.516 1.00 0.00 ATOM 312 OE2 GLU A 56 3.681 0.380 -10.713 1.00 0.00 ATOM 313 O GLU A 56 6.085 1.906 -6.359 1.00 0.00 ATOM 314 C GLU A 56 5.526 0.946 -5.828 1.00 0.00 ATOM 315 N GLU A 57 4.472 1.025 -5.124 1.00 0.00 ATOM 316 CA GLU A 57 4.023 2.299 -4.427 1.00 0.00 ATOM 317 CB GLU A 57 2.794 2.029 -3.557 1.00 0.00 ATOM 318 CG GLU A 57 1.514 1.799 -4.344 1.00 0.00 ATOM 319 CD GLU A 57 1.106 3.010 -5.159 1.00 0.00 ATOM 320 OE1 GLU A 57 1.071 4.123 -4.593 1.00 0.00 ATOM 321 OE2 GLU A 57 0.822 2.847 -6.364 1.00 0.00 ATOM 322 O GLU A 57 5.282 4.083 -3.451 1.00 0.00 ATOM 323 C GLU A 57 5.184 2.858 -3.501 1.00 0.00 ATOM 324 N GLU A 58 5.799 2.051 -2.632 1.00 0.00 ATOM 325 CA GLU A 58 6.954 2.542 -1.844 1.00 0.00 ATOM 326 CB GLU A 58 7.599 1.393 -1.066 1.00 0.00 ATOM 327 CG GLU A 58 8.780 1.812 -0.206 1.00 0.00 ATOM 328 CD GLU A 58 9.367 0.657 0.581 1.00 0.00 ATOM 329 OE1 GLU A 58 8.828 -0.465 0.480 1.00 0.00 ATOM 330 OE2 GLU A 58 10.366 0.874 1.299 1.00 0.00 ATOM 331 O GLU A 58 8.597 4.167 -2.380 1.00 0.00 ATOM 332 C GLU A 58 8.027 3.163 -2.769 1.00 0.00 ATOM 333 N VAL A 59 8.438 2.495 -3.834 1.00 0.00 ATOM 334 CA VAL A 59 9.382 3.156 -4.745 1.00 0.00 ATOM 335 CB VAL A 59 9.621 2.319 -6.015 1.00 0.00 ATOM 336 CG1 VAL A 59 10.428 3.111 -7.032 1.00 0.00 ATOM 337 CG2 VAL A 59 10.386 1.048 -5.679 1.00 0.00 ATOM 338 O VAL A 59 9.823 5.381 -5.502 1.00 0.00 ATOM 339 C VAL A 59 8.927 4.573 -5.253 1.00 0.00 ATOM 340 N LYS A 60 7.707 4.675 -5.812 1.00 0.00 ATOM 341 CA LYS A 60 7.093 5.895 -6.341 1.00 0.00 ATOM 342 CB LYS A 60 5.684 5.603 -6.862 1.00 0.00 ATOM 343 CG LYS A 60 4.971 6.817 -7.434 1.00 0.00 ATOM 344 CD LYS A 60 3.595 6.449 -7.966 1.00 0.00 ATOM 345 CE LYS A 60 2.874 7.666 -8.522 1.00 0.00 ATOM 346 NZ LYS A 60 1.512 7.326 -9.019 1.00 0.00 ATOM 347 O LYS A 60 7.405 8.123 -5.564 1.00 0.00 ATOM 348 C LYS A 60 6.984 6.992 -5.239 1.00 0.00 ATOM 349 N LEU A 61 6.342 6.765 -4.085 1.00 0.00 ATOM 350 CA LEU A 61 6.369 7.776 -3.075 1.00 0.00 ATOM 351 CB LEU A 61 5.601 7.315 -1.835 1.00 0.00 ATOM 352 CG LEU A 61 4.112 7.663 -1.791 1.00 0.00 ATOM 353 CD1 LEU A 61 3.456 7.387 -3.135 1.00 0.00 ATOM 354 CD2 LEU A 61 3.397 6.834 -0.735 1.00 0.00 ATOM 355 O LEU A 61 8.019 9.293 -2.345 1.00 0.00 ATOM 356 C LEU A 61 7.803 8.103 -2.647 1.00 0.00 ATOM 357 N GLU A 62 8.786 7.308 -3.028 1.00 0.00 ATOM 358 CA GLU A 62 10.087 7.558 -2.550 1.00 0.00 ATOM 359 CB GLU A 62 10.474 6.529 -1.486 1.00 0.00 ATOM 360 CG GLU A 62 9.661 6.625 -0.205 1.00 0.00 ATOM 361 CD GLU A 62 8.314 5.939 -0.317 1.00 0.00 ATOM 362 OE1 GLU A 62 8.271 4.788 -0.800 1.00 0.00 ATOM 363 OE2 GLU A 62 7.301 6.553 0.078 1.00 0.00 ATOM 364 O GLU A 62 10.926 7.619 -4.761 1.00 0.00 ATOM 365 C GLU A 62 11.191 7.513 -3.561 1.00 0.00 ATOM 366 N HIS A 63 12.067 8.291 -3.056 1.00 0.00 ATOM 367 CA HIS A 63 13.382 8.527 -3.421 1.00 0.00 ATOM 368 CB HIS A 63 13.522 9.914 -4.051 1.00 0.00 ATOM 369 CG HIS A 63 12.715 10.095 -5.299 1.00 0.00 ATOM 370 CD2 HIS A 63 11.518 10.838 -5.663 1.00 0.00 ATOM 371 ND1 HIS A 63 13.039 9.483 -6.491 1.00 0.00 ATOM 372 CE1 HIS A 63 12.136 9.833 -7.423 1.00 0.00 ATOM 373 NE2 HIS A 63 11.220 10.647 -6.933 1.00 0.00 ATOM 374 O HIS A 63 14.569 9.394 -1.520 1.00 0.00 ATOM 375 C HIS A 63 14.008 8.381 -1.968 1.00 0.00 ATOM 376 N HIS A 64 13.654 7.354 -1.067 1.00 0.00 ATOM 377 CA HIS A 64 14.068 7.272 0.399 1.00 0.00 ATOM 378 CB HIS A 64 12.866 7.530 1.310 1.00 0.00 ATOM 379 CG HIS A 64 12.279 8.899 1.163 1.00 0.00 ATOM 380 CD2 HIS A 64 11.119 9.464 0.489 1.00 0.00 ATOM 381 ND1 HIS A 64 12.842 10.017 1.739 1.00 0.00 ATOM 382 CE1 HIS A 64 12.095 11.092 1.431 1.00 0.00 ATOM 383 NE2 HIS A 64 11.059 10.767 0.682 1.00 0.00 ATOM 384 O HIS A 64 15.494 5.265 0.366 1.00 0.00 ATOM 385 C HIS A 64 14.700 5.928 1.042 1.00 0.00 ATOM 386 N HIS A 65 14.848 5.972 2.429 1.00 0.00 ATOM 387 CA HIS A 65 15.518 5.017 3.413 1.00 0.00 ATOM 388 CB HIS A 65 14.853 5.111 4.788 1.00 0.00 ATOM 389 CG HIS A 65 15.453 4.199 5.813 1.00 0.00 ATOM 390 CD2 HIS A 65 15.081 2.929 6.417 1.00 0.00 ATOM 391 ND1 HIS A 65 16.648 4.472 6.443 1.00 0.00 ATOM 392 CE1 HIS A 65 16.926 3.478 7.304 1.00 0.00 ATOM 393 NE2 HIS A 65 15.990 2.548 7.294 1.00 0.00 ATOM 394 O HIS A 65 16.646 2.920 3.190 1.00 0.00 ATOM 395 C HIS A 65 15.534 3.465 3.122 1.00 0.00 ATOM 396 N HIS A 66 14.464 2.727 2.894 1.00 0.00 ATOM 397 CA HIS A 66 14.512 1.238 2.748 1.00 0.00 ATOM 398 CB HIS A 66 13.315 0.740 1.935 1.00 0.00 ATOM 399 CG HIS A 66 13.320 -0.737 1.695 1.00 0.00 ATOM 400 CD2 HIS A 66 13.678 -1.608 0.584 1.00 0.00 ATOM 401 ND1 HIS A 66 12.921 -1.648 2.649 1.00 0.00 ATOM 402 CE1 HIS A 66 13.035 -2.889 2.145 1.00 0.00 ATOM 403 NE2 HIS A 66 13.489 -2.873 0.906 1.00 0.00 ATOM 404 O HIS A 66 16.383 -0.229 2.607 1.00 0.00 ATOM 405 C HIS A 66 15.769 0.698 2.036 1.00 0.00 ATOM 406 N HIS A 67 16.114 1.194 0.886 1.00 0.00 ATOM 407 CA HIS A 67 17.263 0.817 0.121 1.00 0.00 ATOM 408 CB HIS A 67 16.909 -0.300 -0.862 1.00 0.00 ATOM 409 CG HIS A 67 15.923 0.109 -1.912 1.00 0.00 ATOM 410 CD2 HIS A 67 16.004 0.561 -3.293 1.00 0.00 ATOM 411 ND1 HIS A 67 14.563 0.121 -1.691 1.00 0.00 ATOM 412 CE1 HIS A 67 13.940 0.530 -2.811 1.00 0.00 ATOM 413 NE2 HIS A 67 14.799 0.796 -3.776 1.00 0.00 ATOM 414 O HIS A 67 16.984 3.076 -0.798 1.00 0.00 ATOM 415 C HIS A 67 17.732 2.083 -0.651 1.00 0.00 ATOM 416 N HIS A 68 18.929 2.038 -1.191 1.00 0.00 ATOM 417 CA HIS A 68 19.493 3.137 -1.967 1.00 0.00 ATOM 418 CB HIS A 68 20.658 2.643 -2.827 1.00 0.00 ATOM 419 CG HIS A 68 21.820 2.133 -2.034 1.00 0.00 ATOM 420 CD2 HIS A 68 22.388 0.822 -1.750 1.00 0.00 ATOM 421 ND1 HIS A 68 22.670 2.965 -1.338 1.00 0.00 ATOM 422 CE1 HIS A 68 23.610 2.221 -0.729 1.00 0.00 ATOM 423 NE2 HIS A 68 23.447 0.935 -0.972 1.00 0.00 ATOM 424 O HIS A 68 17.998 3.115 -3.886 1.00 0.00 ATOM 425 C HIS A 68 18.413 3.740 -2.896 1.00 0.00 ENDMDL