HETATM 1 N FME A 1 -1.727 0.693 0.101 1.00 72.41 N HETATM 2 CN FME A 1 -2.113 -0.117 1.157 1.00 4.14 C HETATM 3 O1 FME A 1 -1.341 -0.611 1.945 1.00 21.03 O HETATM 4 CA FME A 1 -0.321 1.164 0.107 1.00 31.13 C HETATM 5 CB FME A 1 0.005 2.000 1.366 1.00 15.30 C HETATM 6 CG FME A 1 1.142 3.023 1.181 1.00 75.14 C HETATM 7 SD FME A 1 0.846 4.443 2.288 1.00 43.43 S HETATM 8 CE FME A 1 2.127 4.073 3.519 1.00 2.43 C HETATM 9 C FME A 1 0.682 0.054 -0.203 1.00 5.25 C HETATM 10 O FME A 1 1.487 -0.347 0.637 1.00 33.15 O HETATM 11 HCN FME A 1 -3.202 -0.303 1.239 1.00 14.44 H HETATM 12 HA FME A 1 -0.167 1.878 -0.740 1.00 12.20 H HETATM 13 HB2 FME A 1 0.254 1.323 2.216 1.00 14.41 H HETATM 14 HB3 FME A 1 -0.926 2.555 1.644 1.00 3.10 H HETATM 15 HG2 FME A 1 1.169 3.371 0.121 1.00 63.53 H HETATM 16 HG3 FME A 1 2.126 2.560 1.412 1.00 21.14 H HETATM 17 HE1 FME A 1 1.657 3.576 4.397 1.00 12.33 H HETATM 18 HE2 FME A 1 2.618 5.013 3.858 1.00 1.31 H HETATM 19 HE3 FME A 1 2.891 3.390 3.086 1.00 51.22 H ATOM 20 N GLY A 2 0.635 -0.421 -1.443 1.00 61.15 N ATOM 21 CA GLY A 2 1.552 -1.460 -1.875 1.00 74.14 C ATOM 22 C GLY A 2 0.990 -2.294 -3.010 1.00 34.14 C ATOM 23 O GLY A 2 1.629 -2.451 -4.049 1.00 51.14 O ATOM 24 H GLY A 2 -0.028 -0.063 -2.071 1.00 23.33 H ATOM 25 HA2 GLY A 2 2.472 -1.000 -2.202 1.00 40.03 H ATOM 26 HA3 GLY A 2 1.763 -2.109 -1.038 1.00 12.32 H ATOM 27 N ALA A 3 -0.209 -2.832 -2.809 1.00 40.00 N ATOM 28 CA ALA A 3 -0.857 -3.654 -3.823 1.00 62.14 C ATOM 29 C ALA A 3 -1.287 -2.812 -5.020 1.00 34.13 C ATOM 30 O ALA A 3 -1.297 -3.289 -6.155 1.00 21.11 O ATOM 31 CB ALA A 3 -2.054 -4.380 -3.228 1.00 71.55 C ATOM 32 H ALA A 3 -0.669 -2.671 -1.959 1.00 40.31 H ATOM 33 HA ALA A 3 -0.145 -4.396 -4.156 1.00 33.42 H ATOM 34 HB1 ALA A 3 -2.651 -3.682 -2.660 1.00 33.41 H ATOM 35 HB2 ALA A 3 -2.651 -4.801 -4.024 1.00 30.44 H ATOM 36 HB3 ALA A 3 -1.709 -5.171 -2.579 1.00 62.24 H ATOM 37 N ILE A 4 -1.643 -1.559 -4.758 1.00 35.12 N ATOM 38 CA ILE A 4 -2.075 -0.651 -5.814 1.00 24.53 C ATOM 39 C ILE A 4 -0.937 -0.361 -6.787 1.00 54.12 C ATOM 40 O ILE A 4 -1.171 0.008 -7.938 1.00 22.22 O ATOM 41 CB ILE A 4 -2.593 0.679 -5.236 1.00 31.42 C ATOM 42 CG1 ILE A 4 -3.762 0.424 -4.282 1.00 12.20 C ATOM 43 CG2 ILE A 4 -3.013 1.616 -6.358 1.00 44.12 C ATOM 44 CD1 ILE A 4 -3.354 0.373 -2.826 1.00 52.33 C ATOM 45 H ILE A 4 -1.615 -1.237 -3.833 1.00 22.30 H ATOM 46 HA ILE A 4 -2.882 -1.126 -6.352 1.00 34.42 H ATOM 47 HB ILE A 4 -1.788 1.147 -4.690 1.00 70.44 H ATOM 48 HG12 ILE A 4 -4.489 1.213 -4.395 1.00 20.03 H ATOM 49 HG13 ILE A 4 -4.221 -0.521 -4.532 1.00 35.40 H ATOM 50 HG21 ILE A 4 -3.117 1.055 -7.275 1.00 55.22 H ATOM 51 HG22 ILE A 4 -3.957 2.076 -6.109 1.00 31.34 H ATOM 52 HG23 ILE A 4 -2.262 2.381 -6.488 1.00 13.30 H ATOM 53 HD11 ILE A 4 -3.815 -0.481 -2.352 1.00 54.53 H ATOM 54 HD12 ILE A 4 -2.280 0.289 -2.755 1.00 54.44 H ATOM 55 HD13 ILE A 4 -3.678 1.277 -2.330 1.00 41.32 H ATOM 56 N ALA A 5 0.294 -0.531 -6.318 1.00 21.43 N ATOM 57 CA ALA A 5 1.468 -0.291 -7.148 1.00 21.34 C ATOM 58 C ALA A 5 1.367 -1.041 -8.472 1.00 20.14 C ATOM 59 O ALA A 5 1.662 -0.491 -9.533 1.00 13.11 O ATOM 60 CB ALA A 5 2.732 -0.697 -6.404 1.00 70.21 C ATOM 61 H ALA A 5 0.416 -0.827 -5.392 1.00 11.04 H ATOM 62 HA ALA A 5 1.523 0.769 -7.349 1.00 62.12 H ATOM 63 HB1 ALA A 5 3.583 -0.597 -7.062 1.00 3.02 H ATOM 64 HB2 ALA A 5 2.864 -0.059 -5.544 1.00 0.53 H ATOM 65 HB3 ALA A 5 2.645 -1.724 -6.081 1.00 42.22 H ATOM 66 N LYS A 6 0.949 -2.301 -8.403 1.00 3.54 N ATOM 67 CA LYS A 6 0.808 -3.127 -9.596 1.00 5.15 C ATOM 68 C LYS A 6 -0.080 -2.443 -10.630 1.00 4.42 C ATOM 69 O LYS A 6 0.120 -2.599 -11.835 1.00 42.42 O ATOM 70 CB LYS A 6 0.223 -4.493 -9.229 1.00 2.42 C ATOM 71 CG LYS A 6 1.021 -5.231 -8.168 1.00 34.02 C ATOM 72 CD LYS A 6 2.202 -5.971 -8.772 1.00 40.04 C ATOM 73 CE LYS A 6 3.303 -6.196 -7.747 1.00 52.21 C ATOM 74 NZ LYS A 6 4.171 -4.996 -7.594 1.00 5.02 N ATOM 75 H LYS A 6 0.729 -2.684 -7.527 1.00 42.40 H ATOM 76 HA LYS A 6 1.791 -3.268 -10.019 1.00 41.04 H ATOM 77 HB2 LYS A 6 -0.783 -4.353 -8.861 1.00 43.23 H ATOM 78 HB3 LYS A 6 0.190 -5.107 -10.117 1.00 65.01 H ATOM 79 HG2 LYS A 6 1.388 -4.518 -7.445 1.00 42.21 H ATOM 80 HG3 LYS A 6 0.374 -5.944 -7.676 1.00 62.10 H ATOM 81 HD2 LYS A 6 1.866 -6.930 -9.139 1.00 42.41 H ATOM 82 HD3 LYS A 6 2.599 -5.389 -9.592 1.00 52.12 H ATOM 83 HE2 LYS A 6 2.849 -6.425 -6.795 1.00 51.13 H ATOM 84 HE3 LYS A 6 3.909 -7.030 -8.067 1.00 22.42 H ATOM 85 HZ1 LYS A 6 3.595 -4.131 -7.628 1.00 33.13 H ATOM 86 HZ2 LYS A 6 4.872 -4.962 -8.361 1.00 41.34 H ATOM 87 HZ3 LYS A 6 4.672 -5.031 -6.683 1.00 50.11 H ATOM 88 N LEU A 7 -1.059 -1.684 -10.152 1.00 15.52 N ATOM 89 CA LEU A 7 -1.978 -0.973 -11.035 1.00 63.45 C ATOM 90 C LEU A 7 -1.393 0.369 -11.463 1.00 13.12 C ATOM 91 O LEU A 7 -1.563 0.797 -12.605 1.00 33.04 O ATOM 92 CB LEU A 7 -3.323 -0.759 -10.339 1.00 42.35 C ATOM 93 CG LEU A 7 -3.794 -1.890 -9.426 1.00 21.45 C ATOM 94 CD1 LEU A 7 -4.997 -1.449 -8.606 1.00 63.32 C ATOM 95 CD2 LEU A 7 -4.128 -3.131 -10.241 1.00 41.24 C ATOM 96 H LEU A 7 -1.169 -1.598 -9.182 1.00 41.22 H ATOM 97 HA LEU A 7 -2.129 -1.582 -11.914 1.00 73.51 H ATOM 98 HB2 LEU A 7 -3.247 0.138 -9.743 1.00 72.43 H ATOM 99 HB3 LEU A 7 -4.072 -0.617 -11.106 1.00 22.22 H ATOM 100 HG LEU A 7 -2.998 -2.145 -8.739 1.00 12.01 H ATOM 101 HD11 LEU A 7 -5.659 -2.289 -8.458 1.00 42.21 H ATOM 102 HD12 LEU A 7 -5.522 -0.665 -9.131 1.00 44.11 H ATOM 103 HD13 LEU A 7 -4.663 -1.079 -7.648 1.00 30.54 H ATOM 104 HD21 LEU A 7 -4.858 -3.724 -9.711 1.00 23.34 H ATOM 105 HD22 LEU A 7 -3.231 -3.714 -10.393 1.00 32.21 H ATOM 106 HD23 LEU A 7 -4.531 -2.834 -11.198 1.00 74.41 H ATOM 107 N VAL A 8 -0.702 1.029 -10.539 1.00 22.21 N ATOM 108 CA VAL A 8 -0.089 2.321 -10.821 1.00 2.44 C ATOM 109 C VAL A 8 1.111 2.170 -11.749 1.00 21.12 C ATOM 110 O VAL A 8 1.597 3.148 -12.317 1.00 35.32 O ATOM 111 CB VAL A 8 0.363 3.022 -9.526 1.00 10.53 C ATOM 112 CG1 VAL A 8 0.851 4.432 -9.824 1.00 21.12 C ATOM 113 CG2 VAL A 8 -0.769 3.045 -8.510 1.00 11.22 C ATOM 114 H VAL A 8 -0.601 0.636 -9.647 1.00 1.44 H ATOM 115 HA VAL A 8 -0.829 2.944 -11.303 1.00 24.22 H ATOM 116 HB VAL A 8 1.185 2.462 -9.105 1.00 11.21 H ATOM 117 HG11 VAL A 8 0.677 4.660 -10.865 1.00 52.11 H ATOM 118 HG12 VAL A 8 0.316 5.137 -9.205 1.00 0.12 H ATOM 119 HG13 VAL A 8 1.909 4.498 -9.614 1.00 14.21 H ATOM 120 HG21 VAL A 8 -0.634 2.240 -7.803 1.00 60.35 H ATOM 121 HG22 VAL A 8 -0.763 3.989 -7.984 1.00 51.33 H ATOM 122 HG23 VAL A 8 -1.713 2.923 -9.019 1.00 52.44 H ATOM 123 N ALA A 9 1.585 0.937 -11.898 1.00 54.24 N ATOM 124 CA ALA A 9 2.726 0.657 -12.760 1.00 24.21 C ATOM 125 C ALA A 9 2.471 1.137 -14.184 1.00 54.43 C ATOM 126 O ALA A 9 3.407 1.394 -14.942 1.00 34.21 O ATOM 127 CB ALA A 9 3.041 -0.832 -12.752 1.00 11.25 C ATOM 128 H ALA A 9 1.155 0.199 -11.419 1.00 32.30 H ATOM 129 HA ALA A 9 3.582 1.183 -12.361 1.00 62.35 H ATOM 130 HB1 ALA A 9 2.176 -1.379 -12.405 1.00 25.42 H ATOM 131 HB2 ALA A 9 3.293 -1.152 -13.751 1.00 41.14 H ATOM 132 HB3 ALA A 9 3.875 -1.020 -12.092 1.00 13.42 H ATOM 133 N LYS A 10 1.197 1.257 -14.544 1.00 11.05 N ATOM 134 CA LYS A 10 0.817 1.707 -15.877 1.00 53.41 C ATOM 135 C LYS A 10 -0.086 2.935 -15.800 1.00 61.42 C ATOM 136 O LYS A 10 0.139 3.927 -16.493 1.00 54.22 O ATOM 137 CB LYS A 10 0.104 0.584 -16.633 1.00 63.25 C ATOM 138 CG LYS A 10 0.957 -0.659 -16.822 1.00 4.41 C ATOM 139 CD LYS A 10 2.116 -0.401 -17.771 1.00 73.11 C ATOM 140 CE LYS A 10 2.732 -1.701 -18.264 1.00 71.32 C ATOM 141 NZ LYS A 10 1.844 -2.404 -19.232 1.00 44.30 N ATOM 142 H LYS A 10 0.495 1.038 -13.895 1.00 31.31 H ATOM 143 HA LYS A 10 1.719 1.972 -16.408 1.00 32.41 H ATOM 144 HB2 LYS A 10 -0.785 0.305 -16.087 1.00 4.41 H ATOM 145 HB3 LYS A 10 -0.183 0.949 -17.609 1.00 71.11 H ATOM 146 HG2 LYS A 10 1.352 -0.962 -15.864 1.00 21.13 H ATOM 147 HG3 LYS A 10 0.341 -1.449 -17.226 1.00 63.23 H ATOM 148 HD2 LYS A 10 1.756 0.158 -18.622 1.00 15.54 H ATOM 149 HD3 LYS A 10 2.872 0.173 -17.255 1.00 22.35 H ATOM 150 HE2 LYS A 10 3.671 -1.479 -18.746 1.00 64.13 H ATOM 151 HE3 LYS A 10 2.907 -2.346 -17.415 1.00 74.04 H ATOM 152 HZ1 LYS A 10 2.410 -2.809 -20.005 1.00 53.15 H ATOM 153 HZ2 LYS A 10 1.156 -1.737 -19.634 1.00 54.43 H ATOM 154 HZ3 LYS A 10 1.330 -3.171 -18.754 1.00 40.40 H ATOM 155 N PHE A 11 -1.107 2.861 -14.952 1.00 65.43 N ATOM 156 CA PHE A 11 -2.043 3.966 -14.785 1.00 22.04 C ATOM 157 C PHE A 11 -1.315 5.232 -14.342 1.00 54.45 C ATOM 158 O PHE A 11 -1.140 6.166 -15.125 1.00 21.25 O ATOM 159 CB PHE A 11 -3.120 3.599 -13.761 1.00 43.34 C ATOM 160 CG PHE A 11 -3.920 2.386 -14.142 1.00 2.43 C ATOM 161 CD1 PHE A 11 -4.270 2.157 -15.463 1.00 2.34 C ATOM 162 CD2 PHE A 11 -4.322 1.476 -13.178 1.00 73.42 C ATOM 163 CE1 PHE A 11 -5.006 1.042 -15.816 1.00 62.11 C ATOM 164 CE2 PHE A 11 -5.058 0.358 -13.526 1.00 1.42 C ATOM 165 CZ PHE A 11 -5.401 0.142 -14.846 1.00 71.11 C ATOM 166 H PHE A 11 -1.233 2.042 -14.427 1.00 54.43 H ATOM 167 HA PHE A 11 -2.512 4.149 -15.739 1.00 12.34 H ATOM 168 HB2 PHE A 11 -2.650 3.401 -12.810 1.00 24.10 H ATOM 169 HB3 PHE A 11 -3.802 4.429 -13.655 1.00 72.11 H ATOM 170 HD1 PHE A 11 -3.961 2.861 -16.223 1.00 11.54 H ATOM 171 HD2 PHE A 11 -4.056 1.644 -12.145 1.00 63.02 H ATOM 172 HE1 PHE A 11 -5.272 0.876 -16.849 1.00 72.04 H ATOM 173 HE2 PHE A 11 -5.366 -0.344 -12.765 1.00 51.35 H ATOM 174 HZ PHE A 11 -5.975 -0.730 -15.120 1.00 74.41 H ATOM 175 N GLY A 12 -0.895 5.257 -13.081 1.00 64.44 N ATOM 176 CA GLY A 12 -0.192 6.413 -12.556 1.00 21.52 C ATOM 177 C GLY A 12 -0.897 7.026 -11.362 1.00 65.11 C ATOM 178 O GLY A 12 -1.991 6.601 -10.994 1.00 35.03 O ATOM 179 H GLY A 12 -1.063 4.483 -12.503 1.00 43.12 H ATOM 180 HA2 GLY A 12 0.802 6.112 -12.259 1.00 33.10 H ATOM 181 HA3 GLY A 12 -0.114 7.157 -13.335 1.00 33.13 H ATOM 182 N TRP A 13 -0.267 8.026 -10.756 1.00 33.02 N ATOM 183 CA TRP A 13 -0.841 8.698 -9.595 1.00 62.30 C ATOM 184 C TRP A 13 -2.097 9.471 -9.979 1.00 51.44 C ATOM 185 O TRP A 13 -3.159 9.318 -9.375 1.00 5.24 O ATOM 186 CB TRP A 13 0.185 9.644 -8.970 1.00 11.53 C ATOM 187 CG TRP A 13 1.598 9.165 -9.109 1.00 21.03 C ATOM 188 CD1 TRP A 13 2.616 9.794 -9.768 1.00 32.34 C ATOM 189 CD2 TRP A 13 2.148 7.954 -8.578 1.00 44.41 C ATOM 190 NE1 TRP A 13 3.766 9.047 -9.678 1.00 72.14 N ATOM 191 CE2 TRP A 13 3.506 7.914 -8.953 1.00 53.41 C ATOM 192 CE3 TRP A 13 1.628 6.902 -7.821 1.00 33.30 C ATOM 193 CZ2 TRP A 13 4.345 6.862 -8.597 1.00 3.31 C ATOM 194 CZ3 TRP A 13 2.462 5.858 -7.469 1.00 1.14 C ATOM 195 CH2 TRP A 13 3.809 5.845 -7.856 1.00 32.23 C ATOM 196 H TRP A 13 0.604 8.320 -11.096 1.00 54.15 H ATOM 197 HA TRP A 13 -1.106 7.940 -8.872 1.00 44.12 H ATOM 198 HB2 TRP A 13 0.112 10.610 -9.447 1.00 2.21 H ATOM 199 HB3 TRP A 13 -0.030 9.750 -7.916 1.00 42.51 H ATOM 200 HD1 TRP A 13 2.516 10.738 -10.281 1.00 21.04 H ATOM 201 HE1 TRP A 13 4.632 9.288 -10.070 1.00 30.44 H ATOM 202 HE3 TRP A 13 0.592 6.894 -7.513 1.00 64.10 H ATOM 203 HZ2 TRP A 13 5.386 6.838 -8.887 1.00 74.21 H ATOM 204 HZ3 TRP A 13 2.077 5.035 -6.884 1.00 42.40 H ATOM 205 HH2 TRP A 13 4.424 5.009 -7.558 1.00 54.53 H ATOM 206 N PRO A 14 -1.977 10.323 -11.009 1.00 34.12 N ATOM 207 CA PRO A 14 -3.095 11.137 -11.497 1.00 24.21 C ATOM 208 C PRO A 14 -4.164 10.298 -12.188 1.00 13.12 C ATOM 209 O PRO A 14 -5.241 10.796 -12.517 1.00 51.12 O ATOM 210 CB PRO A 14 -2.431 12.087 -12.497 1.00 60.42 C ATOM 211 CG PRO A 14 -1.212 11.363 -12.955 1.00 5.54 C ATOM 212 CD PRO A 14 -0.742 10.556 -11.776 1.00 13.21 C ATOM 213 HA PRO A 14 -3.546 11.709 -10.700 1.00 35.01 H ATOM 214 HB2 PRO A 14 -3.108 12.280 -13.318 1.00 21.35 H ATOM 215 HB3 PRO A 14 -2.179 13.014 -12.005 1.00 44.05 H ATOM 216 HG2 PRO A 14 -1.458 10.713 -13.780 1.00 50.41 H ATOM 217 HG3 PRO A 14 -0.453 12.074 -13.248 1.00 25.40 H ATOM 218 HD2 PRO A 14 -0.311 9.623 -12.106 1.00 22.34 H ATOM 219 HD3 PRO A 14 -0.028 11.119 -11.193 1.00 40.23 H ATOM 220 N PHE A 15 -3.861 9.022 -12.404 1.00 53.53 N ATOM 221 CA PHE A 15 -4.797 8.114 -13.057 1.00 13.41 C ATOM 222 C PHE A 15 -5.447 7.180 -12.040 1.00 51.23 C ATOM 223 O PHE A 15 -6.577 6.729 -12.230 1.00 12.32 O ATOM 224 CB PHE A 15 -4.081 7.296 -14.133 1.00 43.21 C ATOM 225 CG PHE A 15 -4.984 6.850 -15.248 1.00 4.44 C ATOM 226 CD1 PHE A 15 -5.697 5.667 -15.147 1.00 54.02 C ATOM 227 CD2 PHE A 15 -5.119 7.615 -16.395 1.00 61.32 C ATOM 228 CE1 PHE A 15 -6.528 5.254 -16.172 1.00 12.24 C ATOM 229 CE2 PHE A 15 -5.949 7.207 -17.423 1.00 4.11 C ATOM 230 CZ PHE A 15 -6.655 6.026 -17.310 1.00 61.33 C ATOM 231 H PHE A 15 -2.987 8.684 -12.119 1.00 24.12 H ATOM 232 HA PHE A 15 -5.566 8.711 -13.523 1.00 33.03 H ATOM 233 HB2 PHE A 15 -3.292 7.894 -14.565 1.00 14.43 H ATOM 234 HB3 PHE A 15 -3.652 6.416 -13.679 1.00 63.33 H ATOM 235 HD1 PHE A 15 -5.600 5.063 -14.257 1.00 13.10 H ATOM 236 HD2 PHE A 15 -4.567 8.540 -16.484 1.00 65.21 H ATOM 237 HE1 PHE A 15 -7.080 4.330 -16.081 1.00 43.21 H ATOM 238 HE2 PHE A 15 -6.045 7.813 -18.312 1.00 31.04 H ATOM 239 HZ PHE A 15 -7.303 5.705 -18.112 1.00 51.11 H ATOM 240 N ILE A 16 -4.725 6.894 -10.963 1.00 4.15 N ATOM 241 CA ILE A 16 -5.230 6.015 -9.916 1.00 33.50 C ATOM 242 C ILE A 16 -5.994 6.802 -8.857 1.00 53.43 C ATOM 243 O ILE A 16 -6.918 6.285 -8.228 1.00 43.32 O ATOM 244 CB ILE A 16 -4.089 5.235 -9.236 1.00 34.02 C ATOM 245 CG1 ILE A 16 -4.658 4.116 -8.360 1.00 41.25 C ATOM 246 CG2 ILE A 16 -3.225 6.175 -8.409 1.00 14.05 C ATOM 247 CD1 ILE A 16 -4.599 2.751 -9.010 1.00 43.41 C ATOM 248 H ILE A 16 -3.831 7.284 -10.869 1.00 1.24 H ATOM 249 HA ILE A 16 -5.902 5.303 -10.375 1.00 10.24 H ATOM 250 HB ILE A 16 -3.471 4.801 -10.006 1.00 61.32 H ATOM 251 HG12 ILE A 16 -4.099 4.069 -7.439 1.00 61.14 H ATOM 252 HG13 ILE A 16 -5.693 4.334 -8.138 1.00 44.10 H ATOM 253 HG21 ILE A 16 -3.005 7.062 -8.984 1.00 71.24 H ATOM 254 HG22 ILE A 16 -3.755 6.453 -7.510 1.00 13.01 H ATOM 255 HG23 ILE A 16 -2.304 5.679 -8.145 1.00 23.23 H ATOM 256 HD11 ILE A 16 -5.375 2.674 -9.757 1.00 32.43 H ATOM 257 HD12 ILE A 16 -3.635 2.616 -9.476 1.00 64.53 H ATOM 258 HD13 ILE A 16 -4.746 1.989 -8.259 1.00 24.32 H ATOM 259 N LYS A 17 -5.604 8.058 -8.666 1.00 54.23 N ATOM 260 CA LYS A 17 -6.254 8.921 -7.686 1.00 64.32 C ATOM 261 C LYS A 17 -7.687 9.235 -8.103 1.00 3.40 C ATOM 262 O LYS A 17 -8.519 9.602 -7.273 1.00 75.34 O ATOM 263 CB LYS A 17 -5.463 10.220 -7.517 1.00 53.32 C ATOM 264 CG LYS A 17 -5.586 11.165 -8.700 1.00 62.13 C ATOM 265 CD LYS A 17 -4.784 12.437 -8.484 1.00 3.14 C ATOM 266 CE LYS A 17 -5.273 13.564 -9.380 1.00 12.21 C ATOM 267 NZ LYS A 17 -4.354 14.735 -9.351 1.00 4.10 N ATOM 268 H LYS A 17 -4.862 8.414 -9.199 1.00 3.13 H ATOM 269 HA LYS A 17 -6.273 8.396 -6.743 1.00 64.32 H ATOM 270 HB2 LYS A 17 -5.820 10.732 -6.636 1.00 1.43 H ATOM 271 HB3 LYS A 17 -4.419 9.978 -7.384 1.00 62.50 H ATOM 272 HG2 LYS A 17 -5.219 10.668 -9.586 1.00 72.30 H ATOM 273 HG3 LYS A 17 -6.626 11.425 -8.836 1.00 32.35 H ATOM 274 HD2 LYS A 17 -4.882 12.744 -7.453 1.00 33.42 H ATOM 275 HD3 LYS A 17 -3.744 12.239 -8.704 1.00 72.22 H ATOM 276 HE2 LYS A 17 -5.343 13.197 -10.392 1.00 41.13 H ATOM 277 HE3 LYS A 17 -6.251 13.876 -9.042 1.00 45.21 H ATOM 278 HZ1 LYS A 17 -4.306 15.128 -8.389 1.00 53.21 H ATOM 279 HZ2 LYS A 17 -4.695 15.474 -9.998 1.00 71.34 H ATOM 280 HZ3 LYS A 17 -3.398 14.447 -9.644 1.00 34.12 H ATOM 281 N LYS A 18 -7.968 9.089 -9.393 1.00 55.12 N ATOM 282 CA LYS A 18 -9.302 9.355 -9.921 1.00 24.24 C ATOM 283 C LYS A 18 -10.324 8.391 -9.326 1.00 41.32 C ATOM 284 O LYS A 18 -11.503 8.722 -9.199 1.00 50.15 O ATOM 285 CB LYS A 18 -9.302 9.238 -11.446 1.00 65.55 C ATOM 286 CG LYS A 18 -8.587 10.382 -12.144 1.00 54.04 C ATOM 287 CD LYS A 18 -8.911 10.419 -13.629 1.00 22.33 C ATOM 288 CE LYS A 18 -7.912 11.271 -14.396 1.00 3.01 C ATOM 289 NZ LYS A 18 -7.874 12.671 -13.891 1.00 3.35 N ATOM 290 H LYS A 18 -7.262 8.794 -10.006 1.00 50.11 H ATOM 291 HA LYS A 18 -9.572 10.363 -9.646 1.00 34.15 H ATOM 292 HB2 LYS A 18 -8.815 8.314 -11.725 1.00 11.15 H ATOM 293 HB3 LYS A 18 -10.325 9.214 -11.794 1.00 5.23 H ATOM 294 HG2 LYS A 18 -8.897 11.314 -11.696 1.00 52.55 H ATOM 295 HG3 LYS A 18 -7.521 10.258 -12.021 1.00 21.35 H ATOM 296 HD2 LYS A 18 -8.883 9.412 -14.020 1.00 11.45 H ATOM 297 HD3 LYS A 18 -9.901 10.832 -13.762 1.00 62.44 H ATOM 298 HE2 LYS A 18 -6.931 10.833 -14.292 1.00 43.44 H ATOM 299 HE3 LYS A 18 -8.193 11.281 -15.439 1.00 11.04 H ATOM 300 HZ1 LYS A 18 -8.674 12.841 -13.248 1.00 72.24 H ATOM 301 HZ2 LYS A 18 -7.934 13.340 -14.685 1.00 21.42 H ATOM 302 HZ3 LYS A 18 -6.987 12.841 -13.375 1.00 10.34 H ATOM 303 N PHE A 19 -9.864 7.199 -8.962 1.00 32.11 N ATOM 304 CA PHE A 19 -10.739 6.187 -8.380 1.00 40.50 C ATOM 305 C PHE A 19 -10.016 5.407 -7.286 1.00 63.04 C ATOM 306 O PHE A 19 -10.271 4.220 -7.084 1.00 24.50 O ATOM 307 CB PHE A 19 -11.236 5.228 -9.463 1.00 42.14 C ATOM 308 CG PHE A 19 -12.022 5.906 -10.550 1.00 25.54 C ATOM 309 CD1 PHE A 19 -11.375 6.553 -11.590 1.00 24.11 C ATOM 310 CD2 PHE A 19 -13.407 5.895 -10.531 1.00 21.54 C ATOM 311 CE1 PHE A 19 -12.095 7.178 -12.590 1.00 73.31 C ATOM 312 CE2 PHE A 19 -14.133 6.517 -11.528 1.00 40.34 C ATOM 313 CZ PHE A 19 -13.476 7.159 -12.560 1.00 71.20 C ATOM 314 H PHE A 19 -8.914 6.994 -9.088 1.00 62.00 H ATOM 315 HA PHE A 19 -11.586 6.694 -7.944 1.00 1.21 H ATOM 316 HB2 PHE A 19 -10.387 4.743 -9.922 1.00 11.32 H ATOM 317 HB3 PHE A 19 -11.870 4.482 -9.010 1.00 21.44 H ATOM 318 HD1 PHE A 19 -10.295 6.568 -11.616 1.00 21.44 H ATOM 319 HD2 PHE A 19 -13.922 5.392 -9.724 1.00 1.34 H ATOM 320 HE1 PHE A 19 -11.579 7.678 -13.396 1.00 14.32 H ATOM 321 HE2 PHE A 19 -15.212 6.500 -11.502 1.00 14.45 H ATOM 322 HZ PHE A 19 -14.041 7.646 -13.340 1.00 53.51 H ATOM 323 N TYR A 20 -9.112 6.082 -6.585 1.00 15.52 N ATOM 324 CA TYR A 20 -8.350 5.453 -5.514 1.00 25.33 C ATOM 325 C TYR A 20 -9.268 5.008 -4.379 1.00 43.33 C ATOM 326 O TYR A 20 -8.953 4.077 -3.638 1.00 1.44 O ATOM 327 CB TYR A 20 -7.290 6.417 -4.979 1.00 3.32 C ATOM 328 CG TYR A 20 -6.594 5.921 -3.731 1.00 42.35 C ATOM 329 CD1 TYR A 20 -5.592 4.961 -3.806 1.00 12.42 C ATOM 330 CD2 TYR A 20 -6.938 6.414 -2.478 1.00 64.43 C ATOM 331 CE1 TYR A 20 -4.954 4.505 -2.669 1.00 35.13 C ATOM 332 CE2 TYR A 20 -6.304 5.964 -1.336 1.00 32.11 C ATOM 333 CZ TYR A 20 -5.314 5.009 -1.436 1.00 42.32 C ATOM 334 OH TYR A 20 -4.680 4.558 -0.301 1.00 41.21 O ATOM 335 H TYR A 20 -8.954 7.027 -6.793 1.00 25.31 H ATOM 336 HA TYR A 20 -7.857 4.584 -5.924 1.00 64.42 H ATOM 337 HB2 TYR A 20 -6.538 6.572 -5.737 1.00 52.54 H ATOM 338 HB3 TYR A 20 -7.758 7.362 -4.744 1.00 72.03 H ATOM 339 HD1 TYR A 20 -5.313 4.569 -4.773 1.00 21.31 H ATOM 340 HD2 TYR A 20 -7.714 7.161 -2.403 1.00 1.30 H ATOM 341 HE1 TYR A 20 -4.179 3.758 -2.747 1.00 25.30 H ATOM 342 HE2 TYR A 20 -6.585 6.358 -0.370 1.00 53.45 H ATOM 343 HH TYR A 20 -4.806 5.192 0.409 1.00 71.10 H ATOM 344 N LYS A 21 -10.406 5.681 -4.251 1.00 34.13 N ATOM 345 CA LYS A 21 -11.374 5.357 -3.209 1.00 63.41 C ATOM 346 C LYS A 21 -11.977 3.974 -3.438 1.00 2.31 C ATOM 347 O LYS A 21 -12.310 3.268 -2.487 1.00 11.22 O ATOM 348 CB LYS A 21 -12.484 6.409 -3.170 1.00 10.01 C ATOM 349 CG LYS A 21 -13.426 6.256 -1.988 1.00 60.23 C ATOM 350 CD LYS A 21 -14.153 7.555 -1.683 1.00 20.44 C ATOM 351 CE LYS A 21 -15.063 7.967 -2.829 1.00 41.24 C ATOM 352 NZ LYS A 21 -15.638 9.325 -2.620 1.00 62.14 N ATOM 353 H LYS A 21 -10.601 6.413 -4.873 1.00 14.52 H ATOM 354 HA LYS A 21 -10.855 5.358 -2.262 1.00 61.55 H ATOM 355 HB2 LYS A 21 -12.033 7.389 -3.119 1.00 50.14 H ATOM 356 HB3 LYS A 21 -13.065 6.336 -4.078 1.00 61.12 H ATOM 357 HG2 LYS A 21 -14.155 5.493 -2.217 1.00 73.02 H ATOM 358 HG3 LYS A 21 -12.854 5.961 -1.120 1.00 32.22 H ATOM 359 HD2 LYS A 21 -14.751 7.422 -0.793 1.00 73.35 H ATOM 360 HD3 LYS A 21 -13.424 8.334 -1.515 1.00 5.43 H ATOM 361 HE2 LYS A 21 -14.491 7.965 -3.744 1.00 63.04 H ATOM 362 HE3 LYS A 21 -15.869 7.252 -2.907 1.00 43.31 H ATOM 363 HZ1 LYS A 21 -14.998 9.897 -2.033 1.00 45.24 H ATOM 364 HZ2 LYS A 21 -16.558 9.253 -2.141 1.00 42.50 H ATOM 365 HZ3 LYS A 21 -15.771 9.801 -3.535 1.00 14.40 H ATOM 366 N GLN A 22 -12.112 3.595 -4.705 1.00 14.24 N ATOM 367 CA GLN A 22 -12.675 2.297 -5.057 1.00 23.33 C ATOM 368 C GLN A 22 -11.575 1.252 -5.214 1.00 61.04 C ATOM 369 O GLN A 22 -11.699 0.128 -4.728 1.00 32.24 O ATOM 370 CB GLN A 22 -13.484 2.402 -6.350 1.00 70.25 C ATOM 371 CG GLN A 22 -14.523 1.304 -6.509 1.00 32.31 C ATOM 372 CD GLN A 22 -15.904 1.738 -6.060 1.00 14.12 C ATOM 373 OE1 GLN A 22 -16.049 2.680 -5.280 1.00 24.35 O ATOM 374 NE2 GLN A 22 -16.930 1.053 -6.552 1.00 21.34 N ATOM 375 H GLN A 22 -11.828 4.203 -5.418 1.00 73.44 H ATOM 376 HA GLN A 22 -13.331 1.992 -4.256 1.00 72.11 H ATOM 377 HB2 GLN A 22 -13.992 3.354 -6.367 1.00 13.22 H ATOM 378 HB3 GLN A 22 -12.807 2.350 -7.190 1.00 64.20 H ATOM 379 HG2 GLN A 22 -14.573 1.020 -7.550 1.00 30.03 H ATOM 380 HG3 GLN A 22 -14.220 0.451 -5.919 1.00 0.42 H ATOM 381 HE21 GLN A 22 -16.739 0.314 -7.168 1.00 34.25 H ATOM 382 HE22 GLN A 22 -17.834 1.311 -6.278 1.00 4.43 H ATOM 383 N ILE A 23 -10.500 1.630 -5.898 1.00 2.35 N ATOM 384 CA ILE A 23 -9.378 0.726 -6.118 1.00 73.13 C ATOM 385 C ILE A 23 -8.850 0.172 -4.799 1.00 55.41 C ATOM 386 O ILE A 23 -8.884 -1.035 -4.563 1.00 55.12 O ATOM 387 CB ILE A 23 -8.228 1.427 -6.865 1.00 10.23 C ATOM 388 CG1 ILE A 23 -8.708 1.933 -8.227 1.00 12.25 C ATOM 389 CG2 ILE A 23 -7.049 0.480 -7.031 1.00 73.11 C ATOM 390 CD1 ILE A 23 -8.049 3.224 -8.658 1.00 43.24 C ATOM 391 H ILE A 23 -10.460 2.539 -6.261 1.00 3.32 H ATOM 392 HA ILE A 23 -9.728 -0.096 -6.727 1.00 42.41 H ATOM 393 HB ILE A 23 -7.903 2.267 -6.271 1.00 4.53 H ATOM 394 HG12 ILE A 23 -8.497 1.187 -8.976 1.00 31.22 H ATOM 395 HG13 ILE A 23 -9.775 2.103 -8.183 1.00 65.55 H ATOM 396 HG21 ILE A 23 -6.574 0.326 -6.074 1.00 25.23 H ATOM 397 HG22 ILE A 23 -7.400 -0.467 -7.414 1.00 40.41 H ATOM 398 HG23 ILE A 23 -6.338 0.907 -7.722 1.00 12.32 H ATOM 399 HD11 ILE A 23 -7.317 3.016 -9.425 1.00 3.22 H ATOM 400 HD12 ILE A 23 -8.796 3.899 -9.047 1.00 35.22 H ATOM 401 HD13 ILE A 23 -7.560 3.680 -7.809 1.00 65.22 H ATOM 402 N MET A 24 -8.364 1.064 -3.942 1.00 14.02 N ATOM 403 CA MET A 24 -7.832 0.665 -2.644 1.00 72.42 C ATOM 404 C MET A 24 -8.870 -0.121 -1.849 1.00 14.50 C ATOM 405 O MET A 24 -8.524 -0.920 -0.980 1.00 11.13 O ATOM 406 CB MET A 24 -7.388 1.895 -1.850 1.00 73.15 C ATOM 407 CG MET A 24 -6.381 1.581 -0.756 1.00 44.35 C ATOM 408 SD MET A 24 -7.164 1.233 0.830 1.00 64.41 S ATOM 409 CE MET A 24 -6.954 2.804 1.664 1.00 61.14 C ATOM 410 H MET A 24 -8.364 2.013 -4.186 1.00 52.15 H ATOM 411 HA MET A 24 -6.975 0.032 -2.819 1.00 32.45 H ATOM 412 HB2 MET A 24 -6.941 2.605 -2.530 1.00 24.31 H ATOM 413 HB3 MET A 24 -8.256 2.345 -1.392 1.00 1.51 H ATOM 414 HG2 MET A 24 -5.803 0.719 -1.053 1.00 71.44 H ATOM 415 HG3 MET A 24 -5.722 2.429 -0.639 1.00 53.43 H ATOM 416 HE1 MET A 24 -6.438 3.492 1.011 1.00 51.25 H ATOM 417 HE2 MET A 24 -7.922 3.207 1.919 1.00 14.44 H ATOM 418 HE3 MET A 24 -6.374 2.659 2.564 1.00 73.22 H ATOM 419 N GLN A 25 -10.143 0.114 -2.153 1.00 30.53 N ATOM 420 CA GLN A 25 -11.231 -0.572 -1.465 1.00 4.13 C ATOM 421 C GLN A 25 -11.339 -2.021 -1.927 1.00 33.34 C ATOM 422 O GLN A 25 -11.814 -2.885 -1.189 1.00 0.14 O ATOM 423 CB GLN A 25 -12.555 0.154 -1.709 1.00 4.32 C ATOM 424 CG GLN A 25 -12.925 1.131 -0.605 1.00 12.42 C ATOM 425 CD GLN A 25 -13.464 0.438 0.631 1.00 12.41 C ATOM 426 OE1 GLN A 25 -12.866 -0.514 1.134 1.00 54.34 O ATOM 427 NE2 GLN A 25 -14.600 0.914 1.129 1.00 61.42 N ATOM 428 H GLN A 25 -10.355 0.762 -2.855 1.00 53.12 H ATOM 429 HA GLN A 25 -11.014 -0.560 -0.407 1.00 44.44 H ATOM 430 HB2 GLN A 25 -12.485 0.702 -2.637 1.00 34.12 H ATOM 431 HB3 GLN A 25 -13.344 -0.579 -1.791 1.00 3.35 H ATOM 432 HG2 GLN A 25 -12.045 1.693 -0.328 1.00 53.23 H ATOM 433 HG3 GLN A 25 -13.680 1.807 -0.979 1.00 2.52 H ATOM 434 HE21 GLN A 25 -15.021 1.674 0.675 1.00 11.11 H ATOM 435 HE22 GLN A 25 -14.971 0.484 1.927 1.00 52.25 H ATOM 436 N PHE A 26 -10.897 -2.281 -3.152 1.00 61.15 N ATOM 437 CA PHE A 26 -10.946 -3.626 -3.714 1.00 23.23 C ATOM 438 C PHE A 26 -9.861 -4.510 -3.104 1.00 14.32 C ATOM 439 O PHE A 26 -10.067 -5.705 -2.891 1.00 61.11 O ATOM 440 CB PHE A 26 -10.781 -3.574 -5.234 1.00 51.40 C ATOM 441 CG PHE A 26 -11.949 -2.948 -5.942 1.00 62.41 C ATOM 442 CD1 PHE A 26 -13.247 -3.289 -5.599 1.00 33.11 C ATOM 443 CD2 PHE A 26 -11.748 -2.020 -6.950 1.00 52.44 C ATOM 444 CE1 PHE A 26 -14.323 -2.716 -6.250 1.00 15.24 C ATOM 445 CE2 PHE A 26 -12.821 -1.443 -7.604 1.00 44.54 C ATOM 446 CZ PHE A 26 -14.110 -1.790 -7.253 1.00 21.54 C ATOM 447 H PHE A 26 -10.529 -1.550 -3.693 1.00 32.41 H ATOM 448 HA PHE A 26 -11.911 -4.047 -3.479 1.00 61.50 H ATOM 449 HB2 PHE A 26 -9.901 -2.997 -5.474 1.00 3.40 H ATOM 450 HB3 PHE A 26 -10.662 -4.578 -5.611 1.00 21.23 H ATOM 451 HD1 PHE A 26 -13.416 -4.012 -4.814 1.00 51.31 H ATOM 452 HD2 PHE A 26 -10.739 -1.746 -7.226 1.00 72.33 H ATOM 453 HE1 PHE A 26 -15.331 -2.989 -5.972 1.00 63.35 H ATOM 454 HE2 PHE A 26 -12.650 -0.719 -8.388 1.00 63.51 H ATOM 455 HZ PHE A 26 -14.949 -1.341 -7.763 1.00 31.54 H ATOM 456 N ILE A 27 -8.707 -3.913 -2.826 1.00 14.25 N ATOM 457 CA ILE A 27 -7.591 -4.645 -2.240 1.00 11.51 C ATOM 458 C ILE A 27 -8.024 -5.398 -0.987 1.00 14.22 C ATOM 459 O ILE A 27 -7.660 -6.556 -0.789 1.00 73.10 O ATOM 460 CB ILE A 27 -6.426 -3.703 -1.882 1.00 53.40 C ATOM 461 CG1 ILE A 27 -5.945 -2.955 -3.127 1.00 61.33 C ATOM 462 CG2 ILE A 27 -5.284 -4.488 -1.254 1.00 53.51 C ATOM 463 CD1 ILE A 27 -5.361 -3.862 -4.188 1.00 4.11 C ATOM 464 H ILE A 27 -8.605 -2.958 -3.018 1.00 4.31 H ATOM 465 HA ILE A 27 -7.239 -5.357 -2.972 1.00 35.30 H ATOM 466 HB ILE A 27 -6.781 -2.987 -1.156 1.00 73.22 H ATOM 467 HG12 ILE A 27 -6.776 -2.426 -3.566 1.00 11.13 H ATOM 468 HG13 ILE A 27 -5.183 -2.246 -2.840 1.00 2.54 H ATOM 469 HG21 ILE A 27 -5.475 -5.546 -1.359 1.00 4.55 H ATOM 470 HG22 ILE A 27 -4.360 -4.238 -1.753 1.00 22.11 H ATOM 471 HG23 ILE A 27 -5.208 -4.237 -0.207 1.00 21.12 H ATOM 472 HD11 ILE A 27 -5.376 -4.883 -3.837 1.00 60.34 H ATOM 473 HD12 ILE A 27 -5.944 -3.782 -5.092 1.00 53.34 H ATOM 474 HD13 ILE A 27 -4.341 -3.567 -4.391 1.00 23.53 H ATOM 475 N GLY A 28 -8.807 -4.731 -0.143 1.00 62.41 N ATOM 476 CA GLY A 28 -9.279 -5.354 1.080 1.00 61.02 C ATOM 477 C GLY A 28 -10.312 -6.432 0.820 1.00 33.20 C ATOM 478 O GLY A 28 -10.553 -7.287 1.672 1.00 72.12 O ATOM 479 H GLY A 28 -9.065 -3.810 -0.353 1.00 14.52 H ATOM 480 HA2 GLY A 28 -8.438 -5.793 1.595 1.00 2.25 H ATOM 481 HA3 GLY A 28 -9.719 -4.595 1.710 1.00 4.11 H ATOM 482 N GLN A 29 -10.925 -6.391 -0.359 1.00 0.33 N ATOM 483 CA GLN A 29 -11.940 -7.371 -0.726 1.00 51.24 C ATOM 484 C GLN A 29 -11.296 -8.660 -1.225 1.00 33.54 C ATOM 485 O GLN A 29 -11.869 -9.742 -1.097 1.00 11.34 O ATOM 486 CB GLN A 29 -12.865 -6.799 -1.803 1.00 24.43 C ATOM 487 CG GLN A 29 -13.813 -7.827 -2.398 1.00 61.44 C ATOM 488 CD GLN A 29 -14.776 -8.395 -1.375 1.00 13.03 C ATOM 489 OE1 GLN A 29 -15.341 -7.661 -0.563 1.00 74.23 O ATOM 490 NE2 GLN A 29 -14.969 -9.708 -1.407 1.00 71.43 N ATOM 491 H GLN A 29 -10.689 -5.685 -0.995 1.00 54.33 H ATOM 492 HA GLN A 29 -12.522 -7.591 0.155 1.00 34.23 H ATOM 493 HB2 GLN A 29 -13.454 -6.005 -1.370 1.00 33.44 H ATOM 494 HB3 GLN A 29 -12.261 -6.394 -2.601 1.00 64.11 H ATOM 495 HG2 GLN A 29 -14.384 -7.358 -3.186 1.00 33.05 H ATOM 496 HG3 GLN A 29 -13.231 -8.638 -2.812 1.00 2.31 H ATOM 497 HE21 GLN A 29 -14.484 -10.230 -2.081 1.00 21.42 H ATOM 498 HE22 GLN A 29 -15.586 -10.102 -0.757 1.00 2.03 H ATOM 499 N GLY A 30 -10.101 -8.538 -1.794 1.00 21.10 N ATOM 500 CA GLY A 30 -9.399 -9.702 -2.303 1.00 53.24 C ATOM 501 C GLY A 30 -9.314 -9.711 -3.817 1.00 4.32 C ATOM 502 O GLY A 30 -9.222 -10.772 -4.434 1.00 31.15 O ATOM 503 H GLY A 30 -9.692 -7.650 -1.869 1.00 33.32 H ATOM 504 HA2 GLY A 30 -8.399 -9.712 -1.896 1.00 72.44 H ATOM 505 HA3 GLY A 30 -9.919 -10.592 -1.979 1.00 3.42 H ATOM 506 N TRP A 31 -9.345 -8.526 -4.416 1.00 60.12 N ATOM 507 CA TRP A 31 -9.272 -8.402 -5.868 1.00 1.04 C ATOM 508 C TRP A 31 -7.825 -8.452 -6.346 1.00 71.41 C ATOM 509 O TRP A 31 -6.954 -7.780 -5.794 1.00 3.20 O ATOM 510 CB TRP A 31 -9.927 -7.097 -6.322 1.00 52.30 C ATOM 511 CG TRP A 31 -11.423 -7.171 -6.378 1.00 31.12 C ATOM 512 CD1 TRP A 31 -12.228 -8.023 -5.677 1.00 60.31 C ATOM 513 CD2 TRP A 31 -12.292 -6.363 -7.179 1.00 0.22 C ATOM 514 NE1 TRP A 31 -13.545 -7.793 -5.994 1.00 71.53 N ATOM 515 CE2 TRP A 31 -13.611 -6.779 -6.913 1.00 31.24 C ATOM 516 CE3 TRP A 31 -12.084 -5.327 -8.093 1.00 55.32 C ATOM 517 CZ2 TRP A 31 -14.714 -6.196 -7.530 1.00 14.55 C ATOM 518 CZ3 TRP A 31 -13.180 -4.749 -8.705 1.00 15.32 C ATOM 519 CH2 TRP A 31 -14.482 -5.183 -8.421 1.00 21.34 C ATOM 520 H TRP A 31 -9.419 -7.715 -3.870 1.00 70.21 H ATOM 521 HA TRP A 31 -9.810 -9.233 -6.298 1.00 34.40 H ATOM 522 HB2 TRP A 31 -9.658 -6.308 -5.636 1.00 10.03 H ATOM 523 HB3 TRP A 31 -9.568 -6.847 -7.310 1.00 60.41 H ATOM 524 HD1 TRP A 31 -11.868 -8.765 -4.981 1.00 21.11 H ATOM 525 HE1 TRP A 31 -14.312 -8.277 -5.622 1.00 14.33 H ATOM 526 HE3 TRP A 31 -11.089 -4.978 -8.325 1.00 50.33 H ATOM 527 HZ2 TRP A 31 -15.724 -6.519 -7.321 1.00 3.04 H ATOM 528 HZ3 TRP A 31 -13.040 -3.947 -9.415 1.00 4.22 H ATOM 529 HH2 TRP A 31 -15.308 -4.703 -8.922 1.00 30.21 H ATOM 530 N THR A 32 -7.575 -9.254 -7.377 1.00 4.21 N ATOM 531 CA THR A 32 -6.233 -9.392 -7.929 1.00 21.41 C ATOM 532 C THR A 32 -5.879 -8.205 -8.817 1.00 65.31 C ATOM 533 O THR A 32 -6.700 -7.314 -9.035 1.00 1.04 O ATOM 534 CB THR A 32 -6.093 -10.690 -8.746 1.00 70.43 C ATOM 535 OG1 THR A 32 -6.782 -10.560 -9.995 1.00 3.31 O ATOM 536 CG2 THR A 32 -6.650 -11.878 -7.976 1.00 14.22 C ATOM 537 H THR A 32 -8.311 -9.764 -7.774 1.00 61.20 H ATOM 538 HA THR A 32 -5.536 -9.434 -7.105 1.00 2.24 H ATOM 539 HB THR A 32 -5.044 -10.865 -8.939 1.00 31.31 H ATOM 540 HG1 THR A 32 -7.597 -10.070 -9.861 1.00 43.43 H ATOM 541 HG21 THR A 32 -6.116 -11.985 -7.043 1.00 53.23 H ATOM 542 HG22 THR A 32 -6.532 -12.776 -8.564 1.00 12.22 H ATOM 543 HG23 THR A 32 -7.698 -11.715 -7.773 1.00 72.14 H ATOM 544 N ILE A 33 -4.652 -8.200 -9.328 1.00 70.00 N ATOM 545 CA ILE A 33 -4.191 -7.123 -10.194 1.00 44.55 C ATOM 546 C ILE A 33 -5.044 -7.027 -11.455 1.00 24.01 C ATOM 547 O ILE A 33 -5.224 -5.945 -12.014 1.00 35.21 O ATOM 548 CB ILE A 33 -2.717 -7.317 -10.599 1.00 13.02 C ATOM 549 CG1 ILE A 33 -1.827 -7.372 -9.355 1.00 55.33 C ATOM 550 CG2 ILE A 33 -2.271 -6.198 -11.528 1.00 2.35 C ATOM 551 CD1 ILE A 33 -1.509 -8.779 -8.902 1.00 31.15 C ATOM 552 H ILE A 33 -4.043 -8.938 -9.118 1.00 75.51 H ATOM 553 HA ILE A 33 -4.273 -6.195 -9.646 1.00 32.44 H ATOM 554 HB ILE A 33 -2.634 -8.251 -11.134 1.00 12.44 H ATOM 555 HG12 ILE A 33 -0.895 -6.873 -9.565 1.00 43.44 H ATOM 556 HG13 ILE A 33 -2.327 -6.865 -8.542 1.00 41.11 H ATOM 557 HG21 ILE A 33 -2.233 -6.566 -12.542 1.00 50.33 H ATOM 558 HG22 ILE A 33 -2.973 -5.380 -11.468 1.00 41.22 H ATOM 559 HG23 ILE A 33 -1.291 -5.854 -11.232 1.00 41.05 H ATOM 560 HD11 ILE A 33 -1.639 -9.462 -9.728 1.00 31.32 H ATOM 561 HD12 ILE A 33 -0.488 -8.824 -8.553 1.00 53.54 H ATOM 562 HD13 ILE A 33 -2.176 -9.057 -8.098 1.00 24.34 H ATOM 563 N ASP A 34 -5.567 -8.166 -11.896 1.00 0.42 N ATOM 564 CA ASP A 34 -6.404 -8.211 -13.089 1.00 52.30 C ATOM 565 C ASP A 34 -7.792 -7.646 -12.801 1.00 22.11 C ATOM 566 O ASP A 34 -8.399 -7.001 -13.655 1.00 43.21 O ATOM 567 CB ASP A 34 -6.521 -9.647 -13.602 1.00 42.32 C ATOM 568 CG ASP A 34 -6.774 -9.709 -15.096 1.00 33.04 C ATOM 569 OD1 ASP A 34 -6.322 -8.792 -15.813 1.00 21.35 O ATOM 570 OD2 ASP A 34 -7.426 -10.674 -15.547 1.00 61.15 O ATOM 571 H ASP A 34 -5.387 -8.996 -11.407 1.00 5.34 H ATOM 572 HA ASP A 34 -5.933 -7.604 -13.848 1.00 32.22 H ATOM 573 HB2 ASP A 34 -5.602 -10.174 -13.390 1.00 0.12 H ATOM 574 HB3 ASP A 34 -7.338 -10.138 -13.095 1.00 53.14 H ATOM 575 N GLN A 35 -8.287 -7.895 -11.593 1.00 12.21 N ATOM 576 CA GLN A 35 -9.604 -7.413 -11.194 1.00 0.54 C ATOM 577 C GLN A 35 -9.719 -5.907 -11.406 1.00 15.44 C ATOM 578 O GLN A 35 -10.696 -5.424 -11.979 1.00 73.13 O ATOM 579 CB GLN A 35 -9.873 -7.755 -9.727 1.00 61.23 C ATOM 580 CG GLN A 35 -10.645 -9.051 -9.537 1.00 25.10 C ATOM 581 CD GLN A 35 -10.068 -10.197 -10.345 1.00 35.32 C ATOM 582 OE1 GLN A 35 -10.182 -10.227 -11.571 1.00 10.25 O ATOM 583 NE2 GLN A 35 -9.445 -11.150 -9.661 1.00 12.44 N ATOM 584 H GLN A 35 -7.755 -8.415 -10.956 1.00 12.11 H ATOM 585 HA GLN A 35 -10.339 -7.907 -11.810 1.00 30.50 H ATOM 586 HB2 GLN A 35 -8.928 -7.844 -9.212 1.00 35.43 H ATOM 587 HB3 GLN A 35 -10.443 -6.954 -9.281 1.00 52.44 H ATOM 588 HG2 GLN A 35 -10.619 -9.320 -8.491 1.00 73.14 H ATOM 589 HG3 GLN A 35 -11.668 -8.893 -9.842 1.00 74.23 H ATOM 590 HE21 GLN A 35 -9.394 -11.060 -8.685 1.00 73.34 H ATOM 591 HE22 GLN A 35 -9.064 -11.902 -10.157 1.00 72.42 H ATOM 592 N ILE A 36 -8.717 -5.170 -10.939 1.00 10.11 N ATOM 593 CA ILE A 36 -8.706 -3.719 -11.078 1.00 75.04 C ATOM 594 C ILE A 36 -8.280 -3.305 -12.483 1.00 15.23 C ATOM 595 O ILE A 36 -8.958 -2.514 -13.139 1.00 65.30 O ATOM 596 CB ILE A 36 -7.764 -3.062 -10.053 1.00 44.32 C ATOM 597 CG1 ILE A 36 -8.197 -3.415 -8.629 1.00 61.41 C ATOM 598 CG2 ILE A 36 -7.740 -1.553 -10.246 1.00 53.14 C ATOM 599 CD1 ILE A 36 -7.621 -4.722 -8.129 1.00 2.51 C ATOM 600 H ILE A 36 -7.967 -5.613 -10.491 1.00 5.40 H ATOM 601 HA ILE A 36 -9.709 -3.360 -10.897 1.00 54.22 H ATOM 602 HB ILE A 36 -6.766 -3.438 -10.222 1.00 51.42 H ATOM 603 HG12 ILE A 36 -7.878 -2.634 -7.958 1.00 24.13 H ATOM 604 HG13 ILE A 36 -9.274 -3.493 -8.598 1.00 32.23 H ATOM 605 HG21 ILE A 36 -7.016 -1.298 -11.006 1.00 23.42 H ATOM 606 HG22 ILE A 36 -8.718 -1.215 -10.556 1.00 0.15 H ATOM 607 HG23 ILE A 36 -7.471 -1.075 -9.317 1.00 3.32 H ATOM 608 HD11 ILE A 36 -8.224 -5.542 -8.487 1.00 74.42 H ATOM 609 HD12 ILE A 36 -6.610 -4.832 -8.491 1.00 2.22 H ATOM 610 HD13 ILE A 36 -7.618 -4.723 -7.048 1.00 71.12 H ATOM 611 N GLU A 37 -7.155 -3.846 -12.938 1.00 24.14 N ATOM 612 CA GLU A 37 -6.639 -3.533 -14.265 1.00 52.12 C ATOM 613 C GLU A 37 -7.718 -3.725 -15.327 1.00 72.30 C ATOM 614 O GLU A 37 -7.728 -3.040 -16.350 1.00 72.41 O ATOM 615 CB GLU A 37 -5.429 -4.412 -14.587 1.00 41.12 C ATOM 616 CG GLU A 37 -4.131 -3.907 -13.979 1.00 71.30 C ATOM 617 CD GLU A 37 -2.906 -4.532 -14.618 1.00 1.03 C ATOM 618 OE1 GLU A 37 -2.811 -5.777 -14.624 1.00 61.33 O ATOM 619 OE2 GLU A 37 -2.042 -3.776 -15.110 1.00 75.44 O ATOM 620 H GLU A 37 -6.659 -4.470 -12.367 1.00 10.20 H ATOM 621 HA GLU A 37 -6.331 -2.498 -14.266 1.00 32.32 H ATOM 622 HB2 GLU A 37 -5.614 -5.409 -14.215 1.00 3.23 H ATOM 623 HB3 GLU A 37 -5.306 -4.455 -15.659 1.00 73.33 H ATOM 624 HG2 GLU A 37 -4.080 -2.837 -14.110 1.00 4.34 H ATOM 625 HG3 GLU A 37 -4.128 -4.141 -12.924 1.00 41.35 H ATOM 626 N LYS A 38 -8.626 -4.663 -15.077 1.00 3.14 N ATOM 627 CA LYS A 38 -9.710 -4.947 -16.009 1.00 13.12 C ATOM 628 C LYS A 38 -10.933 -4.090 -15.698 1.00 33.00 C ATOM 629 O LYS A 38 -11.580 -3.564 -16.604 1.00 12.25 O ATOM 630 CB LYS A 38 -10.085 -6.430 -15.951 1.00 11.43 C ATOM 631 CG LYS A 38 -8.998 -7.353 -16.472 1.00 44.33 C ATOM 632 CD LYS A 38 -9.026 -7.447 -17.989 1.00 32.34 C ATOM 633 CE LYS A 38 -8.150 -8.584 -18.493 1.00 0.42 C ATOM 634 NZ LYS A 38 -8.417 -8.896 -19.924 1.00 64.51 N ATOM 635 H LYS A 38 -8.565 -5.176 -14.243 1.00 60.23 H ATOM 636 HA LYS A 38 -9.363 -4.711 -17.003 1.00 55.33 H ATOM 637 HB2 LYS A 38 -10.293 -6.696 -14.925 1.00 33.00 H ATOM 638 HB3 LYS A 38 -10.976 -6.587 -16.542 1.00 43.22 H ATOM 639 HG2 LYS A 38 -8.036 -6.971 -16.164 1.00 45.04 H ATOM 640 HG3 LYS A 38 -9.145 -8.339 -16.056 1.00 75.23 H ATOM 641 HD2 LYS A 38 -10.042 -7.621 -18.311 1.00 31.11 H ATOM 642 HD3 LYS A 38 -8.669 -6.516 -18.405 1.00 63.24 H ATOM 643 HE2 LYS A 38 -7.115 -8.299 -18.382 1.00 41.13 H ATOM 644 HE3 LYS A 38 -8.347 -9.463 -17.898 1.00 63.40 H ATOM 645 HZ1 LYS A 38 -8.749 -9.878 -20.019 1.00 41.42 H ATOM 646 HZ2 LYS A 38 -7.547 -8.782 -20.483 1.00 12.50 H ATOM 647 HZ3 LYS A 38 -9.145 -8.257 -20.300 1.00 51.13 H ATOM 648 N TRP A 39 -11.243 -3.954 -14.414 1.00 12.51 N ATOM 649 CA TRP A 39 -12.388 -3.159 -13.984 1.00 52.44 C ATOM 650 C TRP A 39 -12.248 -1.711 -14.441 1.00 3.31 C ATOM 651 O TRP A 39 -13.239 -1.046 -14.746 1.00 32.51 O ATOM 652 CB TRP A 39 -12.532 -3.215 -12.463 1.00 13.13 C ATOM 653 CG TRP A 39 -13.619 -2.328 -11.936 1.00 15.02 C ATOM 654 CD1 TRP A 39 -14.905 -2.689 -11.648 1.00 24.54 C ATOM 655 CD2 TRP A 39 -13.517 -0.932 -11.636 1.00 43.34 C ATOM 656 NE1 TRP A 39 -15.607 -1.602 -11.187 1.00 42.11 N ATOM 657 CE2 TRP A 39 -14.778 -0.512 -11.170 1.00 2.40 C ATOM 658 CE3 TRP A 39 -12.482 0.004 -11.715 1.00 2.11 C ATOM 659 CZ2 TRP A 39 -15.029 0.803 -10.786 1.00 70.10 C ATOM 660 CZ3 TRP A 39 -12.733 1.308 -11.334 1.00 1.43 C ATOM 661 CH2 TRP A 39 -13.998 1.698 -10.873 1.00 43.02 C ATOM 662 H TRP A 39 -10.689 -4.398 -13.738 1.00 11.30 H ATOM 663 HA TRP A 39 -13.273 -3.582 -14.437 1.00 21.34 H ATOM 664 HB2 TRP A 39 -12.756 -4.229 -12.166 1.00 2.54 H ATOM 665 HB3 TRP A 39 -11.601 -2.908 -12.009 1.00 11.40 H ATOM 666 HD1 TRP A 39 -15.298 -3.687 -11.771 1.00 24.04 H ATOM 667 HE1 TRP A 39 -16.548 -1.607 -10.914 1.00 34.13 H ATOM 668 HE3 TRP A 39 -11.500 -0.277 -12.067 1.00 52.11 H ATOM 669 HZ2 TRP A 39 -15.998 1.119 -10.428 1.00 73.44 H ATOM 670 HZ3 TRP A 39 -11.945 2.046 -11.388 1.00 34.20 H ATOM 671 HH2 TRP A 39 -14.149 2.727 -10.586 1.00 44.24 H ATOM 672 N LEU A 40 -11.011 -1.227 -14.486 1.00 55.43 N ATOM 673 CA LEU A 40 -10.741 0.144 -14.906 1.00 55.05 C ATOM 674 C LEU A 40 -10.704 0.250 -16.428 1.00 21.24 C ATOM 675 O LEU A 40 -11.350 1.117 -17.017 1.00 25.11 O ATOM 676 CB LEU A 40 -9.415 0.627 -14.317 1.00 50.03 C ATOM 677 CG LEU A 40 -8.910 1.980 -14.820 1.00 72.14 C ATOM 678 CD1 LEU A 40 -9.988 3.042 -14.669 1.00 32.21 C ATOM 679 CD2 LEU A 40 -7.648 2.389 -14.075 1.00 62.44 C ATOM 680 H LEU A 40 -10.262 -1.804 -14.231 1.00 41.55 H ATOM 681 HA LEU A 40 -11.540 0.768 -14.534 1.00 11.12 H ATOM 682 HB2 LEU A 40 -9.534 0.696 -13.247 1.00 53.10 H ATOM 683 HB3 LEU A 40 -8.663 -0.114 -14.547 1.00 23.31 H ATOM 684 HG LEU A 40 -8.668 1.899 -15.871 1.00 61.41 H ATOM 685 HD11 LEU A 40 -10.875 2.734 -15.202 1.00 65.42 H ATOM 686 HD12 LEU A 40 -9.631 3.977 -15.074 1.00 13.32 H ATOM 687 HD13 LEU A 40 -10.223 3.169 -13.622 1.00 40.42 H ATOM 688 HD21 LEU A 40 -7.364 1.602 -13.392 1.00 4.55 H ATOM 689 HD22 LEU A 40 -7.835 3.297 -13.521 1.00 52.23 H ATOM 690 HD23 LEU A 40 -6.850 2.556 -14.784 1.00 12.14 H ATOM 691 N LYS A 41 -9.945 -0.640 -17.059 1.00 11.32 N ATOM 692 CA LYS A 41 -9.825 -0.650 -18.512 1.00 11.11 C ATOM 693 C LYS A 41 -11.200 -0.700 -19.171 1.00 22.00 C ATOM 694 O LYS A 41 -11.456 0.003 -20.148 1.00 41.44 O ATOM 695 CB LYS A 41 -8.986 -1.846 -18.967 1.00 20.25 C ATOM 696 CG LYS A 41 -7.498 -1.551 -19.045 1.00 11.12 C ATOM 697 CD LYS A 41 -6.788 -2.508 -19.988 1.00 34.14 C ATOM 698 CE LYS A 41 -7.122 -2.208 -21.441 1.00 63.21 C ATOM 699 NZ LYS A 41 -6.371 -3.092 -22.376 1.00 15.02 N ATOM 700 H LYS A 41 -9.454 -1.307 -16.534 1.00 1.20 H ATOM 701 HA LYS A 41 -9.329 0.261 -18.810 1.00 51.23 H ATOM 702 HB2 LYS A 41 -9.134 -2.660 -18.272 1.00 14.43 H ATOM 703 HB3 LYS A 41 -9.322 -2.155 -19.946 1.00 12.01 H ATOM 704 HG2 LYS A 41 -7.359 -0.541 -19.402 1.00 62.41 H ATOM 705 HG3 LYS A 41 -7.069 -1.648 -18.058 1.00 2.24 H ATOM 706 HD2 LYS A 41 -5.722 -2.413 -19.848 1.00 21.11 H ATOM 707 HD3 LYS A 41 -7.095 -3.519 -19.758 1.00 42.12 H ATOM 708 HE2 LYS A 41 -8.180 -2.355 -21.592 1.00 31.12 H ATOM 709 HE3 LYS A 41 -6.868 -1.179 -21.650 1.00 22.41 H ATOM 710 HZ1 LYS A 41 -5.348 -2.945 -22.262 1.00 31.21 H ATOM 711 HZ2 LYS A 41 -6.633 -2.877 -23.359 1.00 15.32 H ATOM 712 HZ3 LYS A 41 -6.592 -4.089 -22.180 1.00 30.12 H ATOM 713 N ARG A 42 -12.081 -1.534 -18.629 1.00 22.41 N ATOM 714 CA ARG A 42 -13.429 -1.675 -19.165 1.00 34.44 C ATOM 715 C ARG A 42 -14.282 -0.458 -18.819 1.00 2.13 C ATOM 716 O ARG A 42 -15.206 -0.106 -19.552 1.00 14.41 O ATOM 717 CB ARG A 42 -14.088 -2.944 -18.619 1.00 42.11 C ATOM 718 CG ARG A 42 -13.789 -4.187 -19.441 1.00 22.00 C ATOM 719 CD ARG A 42 -14.702 -4.287 -20.653 1.00 0.41 C ATOM 720 NE ARG A 42 -14.248 -5.303 -21.598 1.00 42.24 N ATOM 721 CZ ARG A 42 -15.016 -5.813 -22.554 1.00 52.35 C ATOM 722 NH1 ARG A 42 -16.270 -5.403 -22.691 1.00 63.03 N ATOM 723 NH2 ARG A 42 -14.531 -6.734 -23.377 1.00 23.35 N ATOM 724 H ARG A 42 -11.818 -2.069 -17.851 1.00 4.24 H ATOM 725 HA ARG A 42 -13.353 -1.753 -20.239 1.00 34.32 H ATOM 726 HB2 ARG A 42 -13.737 -3.113 -17.611 1.00 55.24 H ATOM 727 HB3 ARG A 42 -15.158 -2.800 -18.600 1.00 44.13 H ATOM 728 HG2 ARG A 42 -12.764 -4.146 -19.779 1.00 42.11 H ATOM 729 HG3 ARG A 42 -13.931 -5.060 -18.821 1.00 42.40 H ATOM 730 HD2 ARG A 42 -15.697 -4.540 -20.318 1.00 3.24 H ATOM 731 HD3 ARG A 42 -14.723 -3.329 -21.150 1.00 50.44 H ATOM 732 HE ARG A 42 -13.325 -5.620 -21.515 1.00 43.12 H ATOM 733 HH11 ARG A 42 -16.638 -4.708 -22.074 1.00 62.00 H ATOM 734 HH12 ARG A 42 -16.846 -5.788 -23.413 1.00 2.21 H ATOM 735 HH21 ARG A 42 -13.586 -7.045 -23.277 1.00 31.54 H ATOM 736 HH22 ARG A 42 -15.110 -7.118 -24.096 1.00 4.55 H ATOM 737 N HIS A 43 -13.965 0.181 -17.697 1.00 23.32 N ATOM 738 CA HIS A 43 -14.701 1.359 -17.253 1.00 73.05 C ATOM 739 C HIS A 43 -16.187 1.045 -17.100 1.00 44.32 C ATOM 740 O HIS A 43 -17.036 1.721 -17.681 1.00 75.03 O ATOM 741 CB HIS A 43 -14.510 2.508 -18.244 1.00 14.24 C ATOM 742 CG HIS A 43 -14.883 3.847 -17.686 1.00 3.52 C ATOM 743 ND1 HIS A 43 -16.062 4.491 -17.998 1.00 5.33 N ATOM 744 CD2 HIS A 43 -14.225 4.664 -16.830 1.00 43.01 C ATOM 745 CE1 HIS A 43 -16.112 5.647 -17.359 1.00 63.22 C ATOM 746 NE2 HIS A 43 -15.009 5.775 -16.643 1.00 52.53 N ATOM 747 H HIS A 43 -13.218 -0.148 -17.155 1.00 24.01 H ATOM 748 HA HIS A 43 -14.308 1.654 -16.293 1.00 3.03 H ATOM 749 HB2 HIS A 43 -13.473 2.550 -18.541 1.00 1.03 H ATOM 750 HB3 HIS A 43 -15.123 2.329 -19.116 1.00 2.23 H ATOM 751 HD1 HIS A 43 -16.757 4.153 -18.599 1.00 22.52 H ATOM 752 HD2 HIS A 43 -13.261 4.477 -16.378 1.00 3.13 H ATOM 753 HE1 HIS A 43 -16.917 6.364 -17.413 1.00 2.25 H TER 754 HIS A 43