| REMARK 1 CREATED WITH OPENMM 8.0, 2023-02-21 | |
| ATOM 1 N GLY A 1 -6.048 -16.491 -2.231 1.00 0.00 N | |
| ATOM 2 CA GLY A 1 -6.772 -17.662 -2.701 1.00 0.00 C | |
| ATOM 3 C GLY A 1 -5.998 -18.954 -2.517 1.00 0.00 C | |
| ATOM 4 O GLY A 1 -4.805 -18.931 -2.212 1.00 0.00 O | |
| ATOM 5 N GLU A 2 -6.701 -20.090 -2.146 1.00 0.00 N | |
| ATOM 6 CA GLU A 2 -6.044 -21.365 -1.878 1.00 0.00 C | |
| ATOM 7 C GLU A 2 -5.856 -22.169 -3.161 1.00 0.00 C | |
| ATOM 8 CB GLU A 2 -6.843 -22.179 -0.859 1.00 0.00 C | |
| ATOM 9 O GLU A 2 -6.737 -22.187 -4.024 1.00 0.00 O | |
| ATOM 10 CG GLU A 2 -6.870 -21.566 0.534 1.00 0.00 C | |
| ATOM 11 CD GLU A 2 -7.622 -22.413 1.548 1.00 0.00 C | |
| ATOM 12 OE1 GLU A 2 -8.263 -23.412 1.149 1.00 0.00 O | |
| ATOM 13 OE2 GLU A 2 -7.571 -22.074 2.752 1.00 0.00 O | |
| ATOM 14 N PHE A 3 -4.594 -22.629 -3.438 1.00 0.00 N | |
| ATOM 15 CA PHE A 3 -4.239 -23.472 -4.573 1.00 0.00 C | |
| ATOM 16 C PHE A 3 -3.824 -24.862 -4.105 1.00 0.00 C | |
| ATOM 17 CB PHE A 3 -3.108 -22.834 -5.386 1.00 0.00 C | |
| ATOM 18 O PHE A 3 -3.409 -25.038 -2.957 1.00 0.00 O | |
| ATOM 19 CG PHE A 3 -3.485 -21.525 -6.027 1.00 0.00 C | |
| ATOM 20 CD1 PHE A 3 -4.226 -21.499 -7.202 1.00 0.00 C | |
| ATOM 21 CD2 PHE A 3 -3.099 -20.321 -5.454 1.00 0.00 C | |
| ATOM 22 CE1 PHE A 3 -4.578 -20.290 -7.797 1.00 0.00 C | |
| ATOM 23 CE2 PHE A 3 -3.446 -19.108 -6.043 1.00 0.00 C | |
| ATOM 24 CZ PHE A 3 -4.185 -19.094 -7.216 1.00 0.00 C | |
| ATOM 25 N VAL A 4 -4.038 -25.828 -4.940 1.00 0.00 N | |
| ATOM 26 CA VAL A 4 -3.700 -27.209 -4.610 1.00 0.00 C | |
| ATOM 27 C VAL A 4 -2.246 -27.488 -4.983 1.00 0.00 C | |
| ATOM 28 CB VAL A 4 -4.635 -28.209 -5.326 1.00 0.00 C | |
| ATOM 29 O VAL A 4 -1.830 -27.237 -6.117 1.00 0.00 O | |
| ATOM 30 CG1 VAL A 4 -4.235 -29.647 -5.005 1.00 0.00 C | |
| ATOM 31 CG2 VAL A 4 -6.089 -27.955 -4.931 1.00 0.00 C | |
| ATOM 32 N VAL A 5 -1.534 -27.959 -3.984 1.00 0.00 N | |
| ATOM 33 CA VAL A 5 -0.143 -28.341 -4.200 1.00 0.00 C | |
| ATOM 34 C VAL A 5 -0.080 -29.734 -4.824 1.00 0.00 C | |
| ATOM 35 CB VAL A 5 0.665 -28.310 -2.884 1.00 0.00 C | |
| ATOM 36 O VAL A 5 -0.721 -30.668 -4.336 1.00 0.00 O | |
| ATOM 37 CG1 VAL A 5 2.111 -28.740 -3.127 1.00 0.00 C | |
| ATOM 38 CG2 VAL A 5 0.617 -26.916 -2.261 1.00 0.00 C | |
| ATOM 39 N GLU A 6 0.596 -29.922 -5.859 1.00 0.00 N | |
| ATOM 40 CA GLU A 6 0.800 -31.222 -6.494 1.00 0.00 C | |
| ATOM 41 C GLU A 6 1.994 -31.951 -5.884 1.00 0.00 C | |
| ATOM 42 CB GLU A 6 0.998 -31.058 -8.003 1.00 0.00 C | |
| ATOM 43 O GLU A 6 1.928 -33.155 -5.627 1.00 0.00 O | |
| ATOM 44 CG GLU A 6 1.192 -32.373 -8.744 1.00 0.00 C | |
| ATOM 45 CD GLU A 6 1.406 -32.194 -10.238 1.00 0.00 C | |
| ATOM 46 OE1 GLU A 6 0.494 -31.679 -10.925 1.00 0.00 O | |
| ATOM 47 OE2 GLU A 6 2.493 -32.572 -10.726 1.00 0.00 O | |
| ATOM 48 N LYS A 7 3.123 -31.190 -5.762 1.00 0.00 N | |
| ATOM 49 CA LYS A 7 4.383 -31.782 -5.322 1.00 0.00 C | |
| ATOM 50 C LYS A 7 5.269 -30.744 -4.638 1.00 0.00 C | |
| ATOM 51 CB LYS A 7 5.126 -32.405 -6.505 1.00 0.00 C | |
| ATOM 52 O LYS A 7 5.226 -29.561 -4.979 1.00 0.00 O | |
| ATOM 53 CG LYS A 7 6.268 -33.327 -6.103 1.00 0.00 C | |
| ATOM 54 CD LYS A 7 6.879 -34.020 -7.314 1.00 0.00 C | |
| ATOM 55 CE LYS A 7 7.924 -35.048 -6.903 1.00 0.00 C | |
| ATOM 56 NZ LYS A 7 8.498 -35.757 -8.085 1.00 0.00 N | |
| ATOM 57 N VAL A 8 6.012 -31.185 -3.598 1.00 0.00 N | |
| ATOM 58 CA VAL A 8 7.087 -30.404 -2.997 1.00 0.00 C | |
| ATOM 59 C VAL A 8 8.411 -30.736 -3.681 1.00 0.00 C | |
| ATOM 60 CB VAL A 8 7.194 -30.659 -1.477 1.00 0.00 C | |
| ATOM 61 O VAL A 8 8.814 -31.900 -3.737 1.00 0.00 O | |
| ATOM 62 CG1 VAL A 8 8.284 -29.786 -0.857 1.00 0.00 C | |
| ATOM 63 CG2 VAL A 8 5.850 -30.403 -0.798 1.00 0.00 C | |
| ATOM 64 N LEU A 9 9.194 -29.728 -4.169 1.00 0.00 N | |
| ATOM 65 CA LEU A 9 10.352 -29.949 -5.028 1.00 0.00 C | |
| ATOM 66 C LEU A 9 11.647 -29.636 -4.286 1.00 0.00 C | |
| ATOM 67 CB LEU A 9 10.253 -29.090 -6.292 1.00 0.00 C | |
| ATOM 68 O LEU A 9 12.710 -30.154 -4.638 1.00 0.00 O | |
| ATOM 69 CG LEU A 9 9.059 -29.365 -7.206 1.00 0.00 C | |
| ATOM 70 CD1 LEU A 9 8.997 -28.329 -8.324 1.00 0.00 C | |
| ATOM 71 CD2 LEU A 9 9.139 -30.775 -7.782 1.00 0.00 C | |
| ATOM 72 N ASP A 10 11.610 -28.733 -3.339 1.00 0.00 N | |
| ATOM 73 CA ASP A 10 12.812 -28.304 -2.631 1.00 0.00 C | |
| ATOM 74 C ASP A 10 12.460 -27.670 -1.286 1.00 0.00 C | |
| ATOM 75 CB ASP A 10 13.615 -27.319 -3.483 1.00 0.00 C | |
| ATOM 76 O ASP A 10 11.295 -27.369 -1.022 1.00 0.00 O | |
| ATOM 77 CG ASP A 10 15.098 -27.323 -3.154 1.00 0.00 C | |
| ATOM 78 OD1 ASP A 10 15.499 -27.954 -2.153 1.00 0.00 O | |
| ATOM 79 OD2 ASP A 10 15.871 -26.686 -3.901 1.00 0.00 O | |
| ATOM 80 N ARG A 11 13.467 -27.475 -0.507 1.00 0.00 N | |
| ATOM 81 CA ARG A 11 13.375 -26.864 0.815 1.00 0.00 C | |
| ATOM 82 C ARG A 11 14.548 -25.923 1.066 1.00 0.00 C | |
| ATOM 83 CB ARG A 11 13.324 -27.939 1.903 1.00 0.00 C | |
| ATOM 84 O ARG A 11 15.677 -26.207 0.661 1.00 0.00 O | |
| ATOM 85 CG ARG A 11 13.198 -27.384 3.313 1.00 0.00 C | |
| ATOM 86 CD ARG A 11 13.212 -28.491 4.358 1.00 0.00 C | |
| ATOM 87 NE ARG A 11 13.091 -27.956 5.711 1.00 0.00 N | |
| ATOM 88 NH1 ARG A 11 15.365 -27.743 6.053 1.00 0.00 N | |
| ATOM 89 NH2 ARG A 11 13.892 -27.136 7.701 1.00 0.00 N | |
| ATOM 90 CZ ARG A 11 14.117 -27.613 6.485 1.00 0.00 C | |
| ATOM 91 N ARG A 12 14.307 -24.788 1.671 1.00 0.00 N | |
| ATOM 92 CA ARG A 12 15.375 -23.872 2.055 1.00 0.00 C | |
| ATOM 93 C ARG A 12 15.020 -23.121 3.334 1.00 0.00 C | |
| ATOM 94 CB ARG A 12 15.665 -22.879 0.928 1.00 0.00 C | |
| ATOM 95 O ARG A 12 13.850 -23.064 3.722 1.00 0.00 O | |
| ATOM 96 CG ARG A 12 14.582 -21.828 0.739 1.00 0.00 C | |
| ATOM 97 CD ARG A 12 14.827 -20.981 -0.502 1.00 0.00 C | |
| ATOM 98 NE ARG A 12 13.821 -19.933 -0.646 1.00 0.00 N | |
| ATOM 99 NH1 ARG A 12 14.473 -19.313 -2.774 1.00 0.00 N | |
| ATOM 100 NH2 ARG A 12 12.728 -18.240 -1.747 1.00 0.00 N | |
| ATOM 101 CZ ARG A 12 13.676 -19.164 -1.722 1.00 0.00 C | |
| ATOM 102 N VAL A 13 16.009 -22.620 4.065 1.00 0.00 N | |
| ATOM 103 CA VAL A 13 15.862 -21.747 5.225 1.00 0.00 C | |
| ATOM 104 C VAL A 13 16.323 -20.335 4.872 1.00 0.00 C | |
| ATOM 105 CB VAL A 13 16.657 -22.279 6.439 1.00 0.00 C | |
| ATOM 106 O VAL A 13 17.470 -20.132 4.467 1.00 0.00 O | |
| ATOM 107 CG1 VAL A 13 16.471 -21.364 7.649 1.00 0.00 C | |
| ATOM 108 CG2 VAL A 13 16.228 -23.707 6.773 1.00 0.00 C | |
| ATOM 109 N VAL A 14 15.389 -19.426 4.886 1.00 0.00 N | |
| ATOM 110 CA VAL A 14 15.677 -18.021 4.618 1.00 0.00 C | |
| ATOM 111 C VAL A 14 15.344 -17.180 5.849 1.00 0.00 C | |
| ATOM 112 CB VAL A 14 14.892 -17.504 3.391 1.00 0.00 C | |
| ATOM 113 O VAL A 14 14.187 -17.117 6.270 1.00 0.00 O | |
| ATOM 114 CG1 VAL A 14 15.206 -16.033 3.129 1.00 0.00 C | |
| ATOM 115 CG2 VAL A 14 15.211 -18.350 2.160 1.00 0.00 C | |
| ATOM 116 N LYS A 15 16.401 -16.550 6.442 1.00 0.00 N | |
| ATOM 117 CA LYS A 15 16.244 -15.733 7.642 1.00 0.00 C | |
| ATOM 118 C LYS A 15 15.578 -16.525 8.763 1.00 0.00 C | |
| ATOM 119 CB LYS A 15 15.430 -14.476 7.333 1.00 0.00 C | |
| ATOM 120 O LYS A 15 14.648 -16.037 9.407 1.00 0.00 O | |
| ATOM 121 CG LYS A 15 16.098 -13.531 6.346 1.00 0.00 C | |
| ATOM 122 CD LYS A 15 15.264 -12.278 6.117 1.00 0.00 C | |
| ATOM 123 CE LYS A 15 15.907 -11.356 5.090 1.00 0.00 C | |
| ATOM 124 NZ LYS A 15 15.033 -10.187 4.770 1.00 0.00 N | |
| ATOM 125 N GLY A 16 15.942 -17.715 8.989 1.00 0.00 N | |
| ATOM 126 CA GLY A 16 15.478 -18.544 10.090 1.00 0.00 C | |
| ATOM 127 C GLY A 16 14.120 -19.170 9.834 1.00 0.00 C | |
| ATOM 128 O GLY A 16 13.590 -19.885 10.687 1.00 0.00 O | |
| ATOM 129 N LYS A 17 13.555 -18.858 8.629 1.00 0.00 N | |
| ATOM 130 CA LYS A 17 12.256 -19.430 8.285 1.00 0.00 C | |
| ATOM 131 C LYS A 17 12.385 -20.444 7.152 1.00 0.00 C | |
| ATOM 132 CB LYS A 17 11.271 -18.327 7.892 1.00 0.00 C | |
| ATOM 133 O LYS A 17 13.154 -20.237 6.210 1.00 0.00 O | |
| ATOM 134 CG LYS A 17 10.944 -17.359 9.019 1.00 0.00 C | |
| ATOM 135 CD LYS A 17 9.885 -16.348 8.599 1.00 0.00 C | |
| ATOM 136 CE LYS A 17 9.539 -15.395 9.735 1.00 0.00 C | |
| ATOM 137 NZ LYS A 17 8.429 -14.468 9.360 1.00 0.00 N | |
| ATOM 138 N VAL A 18 11.590 -21.465 7.291 1.00 0.00 N | |
| ATOM 139 CA VAL A 18 11.611 -22.534 6.297 1.00 0.00 C | |
| ATOM 140 C VAL A 18 10.684 -22.179 5.137 1.00 0.00 C | |
| ATOM 141 CB VAL A 18 11.201 -23.890 6.912 1.00 0.00 C | |
| ATOM 142 O VAL A 18 9.550 -21.743 5.352 1.00 0.00 O | |
| ATOM 143 CG1 VAL A 18 11.159 -24.978 5.841 1.00 0.00 C | |
| ATOM 144 CG2 VAL A 18 12.161 -24.278 8.035 1.00 0.00 C | |
| ATOM 145 N GLU A 19 11.156 -22.447 3.926 1.00 0.00 N | |
| ATOM 146 CA GLU A 19 10.367 -22.335 2.704 1.00 0.00 C | |
| ATOM 147 C GLU A 19 10.488 -23.594 1.851 1.00 0.00 C | |
| ATOM 148 CB GLU A 19 10.798 -21.108 1.895 1.00 0.00 C | |
| ATOM 149 O GLU A 19 11.509 -24.284 1.894 1.00 0.00 O | |
| ATOM 150 CG GLU A 19 10.599 -19.789 2.627 1.00 0.00 C | |
| ATOM 151 CD GLU A 19 10.944 -18.575 1.778 1.00 0.00 C | |
| ATOM 152 OE1 GLU A 19 11.547 -18.744 0.694 1.00 0.00 O | |
| ATOM 153 OE2 GLU A 19 10.610 -17.446 2.202 1.00 0.00 O | |
| ATOM 154 N TYR A 20 9.403 -23.851 1.146 1.00 0.00 N | |
| ATOM 155 CA TYR A 20 9.375 -24.996 0.242 1.00 0.00 C | |
| ATOM 156 C TYR A 20 9.090 -24.554 -1.188 1.00 0.00 C | |
| ATOM 157 CB TYR A 20 8.322 -26.012 0.695 1.00 0.00 C | |
| ATOM 158 O TYR A 20 8.296 -23.638 -1.415 1.00 0.00 O | |
| ATOM 159 CG TYR A 20 8.644 -26.674 2.013 1.00 0.00 C | |
| ATOM 160 CD1 TYR A 20 9.451 -27.809 2.065 1.00 0.00 C | |
| ATOM 161 CD2 TYR A 20 8.143 -26.167 3.207 1.00 0.00 C | |
| ATOM 162 CE1 TYR A 20 9.749 -28.423 3.277 1.00 0.00 C | |
| ATOM 163 CE2 TYR A 20 8.434 -26.773 4.424 1.00 0.00 C | |
| ATOM 164 OH TYR A 20 9.530 -28.504 5.651 1.00 0.00 O | |
| ATOM 165 CZ TYR A 20 9.237 -27.899 4.449 1.00 0.00 C | |
| ATOM 166 N LEU A 21 9.748 -25.122 -2.137 1.00 0.00 N | |
| ATOM 167 CA LEU A 21 9.399 -24.950 -3.542 1.00 0.00 C | |
| ATOM 168 C LEU A 21 8.260 -25.883 -3.938 1.00 0.00 C | |
| ATOM 169 CB LEU A 21 10.617 -25.205 -4.433 1.00 0.00 C | |
| ATOM 170 O LEU A 21 8.388 -27.105 -3.831 1.00 0.00 O | |
| ATOM 171 CG LEU A 21 10.430 -24.945 -5.929 1.00 0.00 C | |
| ATOM 172 CD1 LEU A 21 10.096 -23.477 -6.174 1.00 0.00 C | |
| ATOM 173 CD2 LEU A 21 11.680 -25.350 -6.703 1.00 0.00 C | |
| ATOM 174 N LEU A 22 7.261 -25.302 -4.478 1.00 0.00 N | |
| ATOM 175 CA LEU A 22 6.042 -26.069 -4.711 1.00 0.00 C | |
| ATOM 176 C LEU A 22 5.701 -26.110 -6.197 1.00 0.00 C | |
| ATOM 177 CB LEU A 22 4.873 -25.470 -3.924 1.00 0.00 C | |
| ATOM 178 O LEU A 22 5.834 -25.105 -6.897 1.00 0.00 O | |
| ATOM 179 CG LEU A 22 5.058 -25.369 -2.408 1.00 0.00 C | |
| ATOM 180 CD1 LEU A 22 3.847 -24.696 -1.771 1.00 0.00 C | |
| ATOM 181 CD2 LEU A 22 5.288 -26.750 -1.804 1.00 0.00 C | |
| ATOM 182 N LYS A 23 5.286 -27.229 -6.626 1.00 0.00 N | |
| ATOM 183 CA LYS A 23 4.601 -27.401 -7.904 1.00 0.00 C | |
| ATOM 184 C LYS A 23 3.086 -27.412 -7.718 1.00 0.00 C | |
| ATOM 185 CB LYS A 23 5.054 -28.692 -8.587 1.00 0.00 C | |
| ATOM 186 O LYS A 23 2.558 -28.198 -6.929 1.00 0.00 O | |
| ATOM 187 CG LYS A 23 4.340 -28.983 -9.898 1.00 0.00 C | |
| ATOM 188 CD LYS A 23 5.068 -30.047 -10.708 1.00 0.00 C | |
| ATOM 189 CE LYS A 23 4.342 -30.355 -12.010 1.00 0.00 C | |
| ATOM 190 NZ LYS A 23 4.388 -29.201 -12.956 1.00 0.00 N | |
| ATOM 191 N TRP A 24 2.448 -26.640 -8.461 1.00 0.00 N | |
| ATOM 192 CA TRP A 24 1.010 -26.458 -8.290 1.00 0.00 C | |
| ATOM 193 C TRP A 24 0.231 -27.334 -9.265 1.00 0.00 C | |
| ATOM 194 CB TRP A 24 0.626 -24.989 -8.485 1.00 0.00 C | |
| ATOM 195 O TRP A 24 0.669 -27.556 -10.396 1.00 0.00 O | |
| ATOM 196 CG TRP A 24 1.372 -24.040 -7.595 1.00 0.00 C | |
| ATOM 197 CD1 TRP A 24 2.469 -23.294 -7.922 1.00 0.00 C | |
| ATOM 198 CD2 TRP A 24 1.075 -23.742 -6.228 1.00 0.00 C | |
| ATOM 199 CE2 TRP A 24 2.035 -22.804 -5.787 1.00 0.00 C | |
| ATOM 200 CE3 TRP A 24 0.089 -24.176 -5.332 1.00 0.00 C | |
| ATOM 201 NE1 TRP A 24 2.873 -22.547 -6.838 1.00 0.00 N | |
| ATOM 202 CH2 TRP A 24 1.062 -22.733 -3.631 1.00 0.00 C | |
| ATOM 203 CZ2 TRP A 24 2.037 -22.292 -4.487 1.00 0.00 C | |
| ATOM 204 CZ3 TRP A 24 0.093 -23.665 -4.038 1.00 0.00 C | |
| ATOM 205 N LYS A 25 -0.947 -27.804 -8.800 1.00 0.00 N | |
| ATOM 206 CA LYS A 25 -1.811 -28.590 -9.675 1.00 0.00 C | |
| ATOM 207 C LYS A 25 -2.284 -27.763 -10.867 1.00 0.00 C | |
| ATOM 208 CB LYS A 25 -3.015 -29.129 -8.900 1.00 0.00 C | |
| ATOM 209 O LYS A 25 -2.849 -26.681 -10.694 1.00 0.00 O | |
| ATOM 210 CG LYS A 25 -3.828 -30.165 -9.661 1.00 0.00 C | |
| ATOM 211 CD LYS A 25 -4.852 -30.843 -8.761 1.00 0.00 C | |
| ATOM 212 CE LYS A 25 -5.600 -31.947 -9.496 1.00 0.00 C | |
| ATOM 213 NZ LYS A 25 -6.455 -32.748 -8.570 1.00 0.00 N | |
| ATOM 214 N GLY A 26 -1.956 -28.290 -12.056 1.00 0.00 N | |
| ATOM 215 CA GLY A 26 -2.379 -27.615 -13.273 1.00 0.00 C | |
| ATOM 216 C GLY A 26 -1.420 -26.525 -13.714 1.00 0.00 C | |
| ATOM 217 O GLY A 26 -1.676 -25.825 -14.696 1.00 0.00 O | |
| ATOM 218 N GLY A 27 -0.459 -26.322 -12.922 1.00 0.00 N | |
| ATOM 219 CA GLY A 27 0.518 -25.307 -13.285 1.00 0.00 C | |
| ATOM 220 C GLY A 27 1.746 -25.878 -13.969 1.00 0.00 C | |
| ATOM 221 O GLY A 27 2.059 -27.060 -13.809 1.00 0.00 O | |
| ATOM 222 N SER A 28 2.427 -25.058 -14.734 1.00 0.00 N | |
| ATOM 223 CA SER A 28 3.705 -25.427 -15.337 1.00 0.00 C | |
| ATOM 224 C SER A 28 4.859 -25.205 -14.365 1.00 0.00 C | |
| ATOM 225 CB SER A 28 3.944 -24.625 -16.617 1.00 0.00 C | |
| ATOM 226 O SER A 28 4.664 -24.663 -13.275 1.00 0.00 O | |
| ATOM 227 OG SER A 28 4.265 -23.277 -16.314 1.00 0.00 O | |
| ATOM 228 N ASP A 29 5.996 -25.703 -14.714 1.00 0.00 N | |
| ATOM 229 CA ASP A 29 7.202 -25.532 -13.910 1.00 0.00 C | |
| ATOM 230 C ASP A 29 7.490 -24.055 -13.657 1.00 0.00 C | |
| ATOM 231 CB ASP A 29 8.401 -26.193 -14.595 1.00 0.00 C | |
| ATOM 232 O ASP A 29 8.051 -23.694 -12.621 1.00 0.00 O | |
| ATOM 233 CG ASP A 29 8.368 -27.709 -14.516 1.00 0.00 C | |
| ATOM 234 OD1 ASP A 29 7.543 -28.262 -13.757 1.00 0.00 O | |
| ATOM 235 OD2 ASP A 29 9.176 -28.356 -15.217 1.00 0.00 O | |
| ATOM 236 N GLU A 30 7.074 -23.197 -14.630 1.00 0.00 N | |
| ATOM 237 CA GLU A 30 7.299 -21.761 -14.491 1.00 0.00 C | |
| ATOM 238 C GLU A 30 6.460 -21.179 -13.356 1.00 0.00 C | |
| ATOM 239 CB GLU A 30 6.985 -21.038 -15.802 1.00 0.00 C | |
| ATOM 240 O GLU A 30 6.752 -20.089 -12.858 1.00 0.00 O | |
| ATOM 241 CG GLU A 30 7.954 -21.361 -16.930 1.00 0.00 C | |
| ATOM 242 CD GLU A 30 7.531 -20.779 -18.270 1.00 0.00 C | |
| ATOM 243 OE1 GLU A 30 6.602 -19.941 -18.301 1.00 0.00 O | |
| ATOM 244 OE2 GLU A 30 8.133 -21.165 -19.297 1.00 0.00 O | |
| ATOM 245 N ASP A 31 5.493 -21.950 -12.983 1.00 0.00 N | |
| ATOM 246 CA ASP A 31 4.571 -21.451 -11.967 1.00 0.00 C | |
| ATOM 247 C ASP A 31 4.997 -21.899 -10.571 1.00 0.00 C | |
| ATOM 248 CB ASP A 31 3.145 -21.922 -12.258 1.00 0.00 C | |
| ATOM 249 O ASP A 31 4.336 -21.578 -9.582 1.00 0.00 O | |
| ATOM 250 CG ASP A 31 2.552 -21.283 -13.502 1.00 0.00 C | |
| ATOM 251 OD1 ASP A 31 2.828 -20.094 -13.768 1.00 0.00 O | |
| ATOM 252 OD2 ASP A 31 1.799 -21.976 -14.222 1.00 0.00 O | |
| ATOM 253 N ASN A 32 6.046 -22.709 -10.523 1.00 0.00 N | |
| ATOM 254 CA ASN A 32 6.536 -23.132 -9.216 1.00 0.00 C | |
| ATOM 255 C ASN A 32 6.925 -21.937 -8.349 1.00 0.00 C | |
| ATOM 256 CB ASN A 32 7.725 -24.084 -9.371 1.00 0.00 C | |
| ATOM 257 O ASN A 32 7.482 -20.958 -8.849 1.00 0.00 O | |
| ATOM 258 CG ASN A 32 7.345 -25.386 -10.048 1.00 0.00 C | |
| ATOM 259 ND2 ASN A 32 8.346 -26.150 -10.469 1.00 0.00 N | |
| ATOM 260 OD1 ASN A 32 6.161 -25.702 -10.193 1.00 0.00 O | |
| ATOM 261 N THR A 33 6.650 -21.994 -7.138 1.00 0.00 N | |
| ATOM 262 CA THR A 33 6.991 -20.880 -6.261 1.00 0.00 C | |
| ATOM 263 C THR A 33 7.496 -21.386 -4.914 1.00 0.00 C | |
| ATOM 264 CB THR A 33 5.781 -19.951 -6.043 1.00 0.00 C | |
| ATOM 265 O THR A 33 7.155 -22.495 -4.495 1.00 0.00 O | |
| ATOM 266 CG2 THR A 33 5.248 -19.421 -7.370 1.00 0.00 C | |
| ATOM 267 OG1 THR A 33 4.741 -20.679 -5.378 1.00 0.00 O | |
| ATOM 268 N TRP A 34 8.325 -20.622 -4.319 1.00 0.00 N | |
| ATOM 269 CA TRP A 34 8.753 -20.796 -2.935 1.00 0.00 C | |
| ATOM 270 C TRP A 34 7.705 -20.255 -1.969 1.00 0.00 C | |
| ATOM 271 CB TRP A 34 10.095 -20.098 -2.696 1.00 0.00 C | |
| ATOM 272 O TRP A 34 7.306 -19.091 -2.063 1.00 0.00 O | |
| ATOM 273 CG TRP A 34 11.239 -20.703 -3.453 1.00 0.00 C | |
| ATOM 274 CD1 TRP A 34 11.751 -20.281 -4.650 1.00 0.00 C | |
| ATOM 275 CD2 TRP A 34 12.012 -21.843 -3.067 1.00 0.00 C | |
| ATOM 276 CE2 TRP A 34 12.976 -22.057 -4.076 1.00 0.00 C | |
| ATOM 277 CE3 TRP A 34 11.983 -22.707 -1.963 1.00 0.00 C | |
| ATOM 278 NE1 TRP A 34 12.795 -21.091 -5.030 1.00 0.00 N | |
| ATOM 279 CH2 TRP A 34 13.853 -23.929 -2.924 1.00 0.00 C | |
| ATOM 280 CZ2 TRP A 34 13.904 -23.099 -4.015 1.00 0.00 C | |
| ATOM 281 CZ3 TRP A 34 12.906 -23.743 -1.904 1.00 0.00 C | |
| ATOM 282 N GLU A 35 7.307 -20.964 -1.116 1.00 0.00 N | |
| ATOM 283 CA GLU A 35 6.275 -20.568 -0.162 1.00 0.00 C | |
| ATOM 284 C GLU A 35 6.730 -20.809 1.274 1.00 0.00 C | |
| ATOM 285 CB GLU A 35 4.972 -21.324 -0.435 1.00 0.00 C | |
| ATOM 286 O GLU A 35 7.319 -21.847 1.579 1.00 0.00 O | |
| ATOM 287 CG GLU A 35 4.388 -21.065 -1.816 1.00 0.00 C | |
| ATOM 288 CD GLU A 35 3.911 -19.634 -2.007 1.00 0.00 C | |
| ATOM 289 OE1 GLU A 35 3.559 -18.973 -1.004 1.00 0.00 O | |
| ATOM 290 OE2 GLU A 35 3.889 -19.171 -3.169 1.00 0.00 O | |
| ATOM 291 N PRO A 36 6.435 -19.847 2.252 1.00 0.00 N | |
| ATOM 292 CA PRO A 36 6.713 -20.083 3.671 1.00 0.00 C | |
| ATOM 293 C PRO A 36 5.903 -21.243 4.246 1.00 0.00 C | |
| ATOM 294 CB PRO A 36 6.318 -18.759 4.332 1.00 0.00 C | |
| ATOM 295 O PRO A 36 4.736 -21.422 3.890 1.00 0.00 O | |
| ATOM 296 CG PRO A 36 6.151 -17.800 3.199 1.00 0.00 C | |
| ATOM 297 CD PRO A 36 5.881 -18.584 1.946 1.00 0.00 C | |
| ATOM 298 N GLU A 37 6.530 -22.037 5.048 1.00 0.00 N | |
| ATOM 299 CA GLU A 37 5.918 -23.222 5.641 1.00 0.00 C | |
| ATOM 300 C GLU A 37 4.613 -22.873 6.352 1.00 0.00 C | |
| ATOM 301 CB GLU A 37 6.884 -23.896 6.619 1.00 0.00 C | |
| ATOM 302 O GLU A 37 3.658 -23.653 6.326 1.00 0.00 O | |
| ATOM 303 CG GLU A 37 6.354 -25.192 7.214 1.00 0.00 C | |
| ATOM 304 CD GLU A 37 7.383 -25.931 8.055 1.00 0.00 C | |
| ATOM 305 OE1 GLU A 37 7.992 -25.309 8.954 1.00 0.00 O | |
| ATOM 306 OE2 GLU A 37 7.582 -27.142 7.811 1.00 0.00 O | |
| ATOM 307 N GLU A 38 4.482 -21.687 6.941 1.00 0.00 N | |
| ATOM 308 CA GLU A 38 3.316 -21.244 7.699 1.00 0.00 C | |
| ATOM 309 C GLU A 38 2.097 -21.084 6.796 1.00 0.00 C | |
| ATOM 310 CB GLU A 38 3.612 -19.927 8.421 1.00 0.00 C | |
| ATOM 311 O GLU A 38 0.960 -21.087 7.272 1.00 0.00 O | |
| ATOM 312 CG GLU A 38 4.013 -18.792 7.490 1.00 0.00 C | |
| ATOM 313 CD GLU A 38 4.434 -17.532 8.227 1.00 0.00 C | |
| ATOM 314 OE1 GLU A 38 4.774 -17.616 9.429 1.00 0.00 O | |
| ATOM 315 OE2 GLU A 38 4.424 -16.450 7.598 1.00 0.00 O | |
| ATOM 316 N ASN A 39 2.307 -20.990 5.460 1.00 0.00 N | |
| ATOM 317 CA ASN A 39 1.195 -20.791 4.536 1.00 0.00 C | |
| ATOM 318 C ASN A 39 0.683 -22.118 3.982 1.00 0.00 C | |
| ATOM 319 CB ASN A 39 1.608 -19.863 3.391 1.00 0.00 C | |
| ATOM 320 O ASN A 39 -0.276 -22.144 3.210 1.00 0.00 O | |
| ATOM 321 CG ASN A 39 1.707 -18.413 3.823 1.00 0.00 C | |
| ATOM 322 ND2 ASN A 39 2.306 -17.582 2.977 1.00 0.00 N | |
| ATOM 323 OD1 ASN A 39 1.248 -18.043 4.906 1.00 0.00 O | |
| ATOM 324 N LEU A 40 1.356 -23.203 4.363 1.00 0.00 N | |
| ATOM 325 CA LEU A 40 1.079 -24.470 3.695 1.00 0.00 C | |
| ATOM 326 C LEU A 40 0.183 -25.355 4.556 1.00 0.00 C | |
| ATOM 327 CB LEU A 40 2.385 -25.204 3.376 1.00 0.00 C | |
| ATOM 328 O LEU A 40 0.330 -25.391 5.780 1.00 0.00 O | |
| ATOM 329 CG LEU A 40 3.372 -24.468 2.469 1.00 0.00 C | |
| ATOM 330 CD1 LEU A 40 4.627 -25.308 2.261 1.00 0.00 C | |
| ATOM 331 CD2 LEU A 40 2.720 -24.131 1.132 1.00 0.00 C | |
| ATOM 332 N ASP A 41 -0.761 -26.017 3.941 1.00 0.00 N | |
| ATOM 333 CA ASP A 41 -1.622 -27.029 4.546 1.00 0.00 C | |
| ATOM 334 C ASP A 41 -1.508 -28.360 3.806 1.00 0.00 C | |
| ATOM 335 CB ASP A 41 -3.077 -26.558 4.559 1.00 0.00 C | |
| ATOM 336 O ASP A 41 -2.517 -28.941 3.403 1.00 0.00 O | |
| ATOM 337 CG ASP A 41 -3.973 -27.425 5.424 1.00 0.00 C | |
| ATOM 338 OD1 ASP A 41 -3.456 -28.166 6.289 1.00 0.00 O | |
| ATOM 339 OD2 ASP A 41 -5.209 -27.371 5.239 1.00 0.00 O | |
| ATOM 340 N CYS A 42 -0.321 -28.876 3.635 1.00 0.00 N | |
| ATOM 341 CA CYS A 42 -0.073 -30.130 2.934 1.00 0.00 C | |
| ATOM 342 C CYS A 42 1.013 -30.939 3.630 1.00 0.00 C | |
| ATOM 343 CB CYS A 42 0.327 -29.862 1.482 1.00 0.00 C | |
| ATOM 344 O CYS A 42 2.073 -31.189 3.053 1.00 0.00 O | |
| ATOM 345 SG CYS A 42 1.721 -28.728 1.310 1.00 0.00 S | |
| ATOM 346 N PRO A 43 0.740 -31.211 4.939 1.00 0.00 N | |
| ATOM 347 CA PRO A 43 1.776 -31.878 5.732 1.00 0.00 C | |
| ATOM 348 C PRO A 43 2.190 -33.226 5.146 1.00 0.00 C | |
| ATOM 349 CB PRO A 43 1.114 -32.057 7.100 1.00 0.00 C | |
| ATOM 350 O PRO A 43 3.350 -33.628 5.272 1.00 0.00 O | |
| ATOM 351 CG PRO A 43 -0.354 -31.987 6.826 1.00 0.00 C | |
| ATOM 352 CD PRO A 43 -0.584 -31.020 5.700 1.00 0.00 C | |
| ATOM 353 N ASP A 44 1.302 -33.977 4.441 1.00 0.00 N | |
| ATOM 354 CA ASP A 44 1.644 -35.263 3.838 1.00 0.00 C | |
| ATOM 355 C ASP A 44 2.665 -35.090 2.716 1.00 0.00 C | |
| ATOM 356 CB ASP A 44 0.387 -35.955 3.304 1.00 0.00 C | |
| ATOM 357 O ASP A 44 3.601 -35.881 2.595 1.00 0.00 O | |
| ATOM 358 CG ASP A 44 -0.537 -36.439 4.408 1.00 0.00 C | |
| ATOM 359 OD1 ASP A 44 -0.069 -36.647 5.549 1.00 0.00 O | |
| ATOM 360 OD2 ASP A 44 -1.743 -36.617 4.134 1.00 0.00 O | |
| ATOM 361 N LEU A 45 2.506 -34.122 1.910 1.00 0.00 N | |
| ATOM 362 CA LEU A 45 3.438 -33.872 0.816 1.00 0.00 C | |
| ATOM 363 C LEU A 45 4.804 -33.452 1.350 1.00 0.00 C | |
| ATOM 364 CB LEU A 45 2.889 -32.792 -0.119 1.00 0.00 C | |
| ATOM 365 O LEU A 45 5.837 -33.867 0.819 1.00 0.00 O | |
| ATOM 366 CG LEU A 45 1.626 -33.153 -0.905 1.00 0.00 C | |
| ATOM 367 CD1 LEU A 45 1.191 -31.980 -1.776 1.00 0.00 C | |
| ATOM 368 CD2 LEU A 45 1.862 -34.398 -1.753 1.00 0.00 C | |
| ATOM 369 N ILE A 46 4.771 -32.607 2.415 1.00 0.00 N | |
| ATOM 370 CA ILE A 46 6.013 -32.178 3.048 1.00 0.00 C | |
| ATOM 371 C ILE A 46 6.739 -33.387 3.632 1.00 0.00 C | |
| ATOM 372 CB ILE A 46 5.750 -31.127 4.151 1.00 0.00 C | |
| ATOM 373 O ILE A 46 7.946 -33.548 3.435 1.00 0.00 O | |
| ATOM 374 CG1 ILE A 46 5.336 -29.791 3.526 1.00 0.00 C | |
| ATOM 375 CG2 ILE A 46 6.987 -30.956 5.039 1.00 0.00 C | |
| ATOM 376 CD1 ILE A 46 4.914 -28.737 4.541 1.00 0.00 C | |
| ATOM 377 N ALA A 47 5.986 -34.247 4.340 1.00 0.00 N | |
| ATOM 378 CA ALA A 47 6.580 -35.448 4.920 1.00 0.00 C | |
| ATOM 379 C ALA A 47 7.172 -36.345 3.836 1.00 0.00 C | |
| ATOM 380 CB ALA A 47 5.541 -36.216 5.732 1.00 0.00 C | |
| ATOM 381 O ALA A 47 8.273 -36.877 3.995 1.00 0.00 O | |
| ATOM 382 N GLU A 48 6.497 -36.557 2.764 1.00 0.00 N | |
| ATOM 383 CA GLU A 48 6.984 -37.353 1.641 1.00 0.00 C | |
| ATOM 384 C GLU A 48 8.292 -36.788 1.092 1.00 0.00 C | |
| ATOM 385 CB GLU A 48 5.932 -37.420 0.532 1.00 0.00 C | |
| ATOM 386 O GLU A 48 9.234 -37.537 0.825 1.00 0.00 O | |
| ATOM 387 CG GLU A 48 6.336 -38.293 -0.647 1.00 0.00 C | |
| ATOM 388 CD GLU A 48 5.306 -38.306 -1.765 1.00 0.00 C | |
| ATOM 389 OE1 GLU A 48 4.193 -37.767 -1.571 1.00 0.00 O | |
| ATOM 390 OE2 GLU A 48 5.614 -38.861 -2.843 1.00 0.00 O | |
| ATOM 391 N PHE A 49 8.304 -35.562 0.913 1.00 0.00 N | |
| ATOM 392 CA PHE A 49 9.505 -34.907 0.411 1.00 0.00 C | |
| ATOM 393 C PHE A 49 10.680 -35.130 1.356 1.00 0.00 C | |
| ATOM 394 CB PHE A 49 9.262 -33.406 0.222 1.00 0.00 C | |
| ATOM 395 O PHE A 49 11.774 -35.494 0.920 1.00 0.00 O | |
| ATOM 396 CG PHE A 49 10.513 -32.616 -0.047 1.00 0.00 C | |
| ATOM 397 CD1 PHE A 49 11.098 -32.620 -1.307 1.00 0.00 C | |
| ATOM 398 CD2 PHE A 49 11.107 -31.868 0.962 1.00 0.00 C | |
| ATOM 399 CE1 PHE A 49 12.257 -31.891 -1.559 1.00 0.00 C | |
| ATOM 400 CE2 PHE A 49 12.266 -31.136 0.718 1.00 0.00 C | |
| ATOM 401 CZ PHE A 49 12.839 -31.150 -0.543 1.00 0.00 C | |
| ATOM 402 N LEU A 50 10.475 -34.865 2.678 1.00 0.00 N | |
| ATOM 403 CA LEU A 50 11.546 -34.995 3.659 1.00 0.00 C | |
| ATOM 404 C LEU A 50 12.049 -36.433 3.728 1.00 0.00 C | |
| ATOM 405 CB LEU A 50 11.067 -34.542 5.040 1.00 0.00 C | |
| ATOM 406 O LEU A 50 13.252 -36.670 3.853 1.00 0.00 O | |
| ATOM 407 CG LEU A 50 10.773 -33.050 5.202 1.00 0.00 C | |
| ATOM 408 CD1 LEU A 50 10.137 -32.779 6.560 1.00 0.00 C | |
| ATOM 409 CD2 LEU A 50 12.047 -32.232 5.028 1.00 0.00 C | |
| ATOM 410 N GLN A 51 11.140 -37.337 3.545 1.00 0.00 N | |
| ATOM 411 CA GLN A 51 11.545 -38.738 3.529 1.00 0.00 C | |
| ATOM 412 C GLN A 51 12.394 -39.052 2.300 1.00 0.00 C | |
| ATOM 413 CB GLN A 51 10.320 -39.653 3.568 1.00 0.00 C | |
| ATOM 414 O GLN A 51 13.354 -39.821 2.382 1.00 0.00 O | |
| ATOM 415 CG GLN A 51 10.659 -41.129 3.730 1.00 0.00 C | |
| ATOM 416 CD GLN A 51 9.428 -41.998 3.903 1.00 0.00 C | |
| ATOM 417 NE2 GLN A 51 9.640 -43.267 4.235 1.00 0.00 N | |
| ATOM 418 OE1 GLN A 51 8.295 -41.533 3.739 1.00 0.00 O | |
| ATOM 419 N SER A 52 12.055 -38.506 1.202 1.00 0.00 N | |
| ATOM 420 CA SER A 52 12.791 -38.746 -0.035 1.00 0.00 C | |
| ATOM 421 C SER A 52 14.209 -38.190 0.050 1.00 0.00 C | |
| ATOM 422 CB SER A 52 12.060 -38.120 -1.224 1.00 0.00 C | |
| ATOM 423 O SER A 52 15.093 -38.614 -0.697 1.00 0.00 O | |
| ATOM 424 OG SER A 52 12.237 -36.714 -1.239 1.00 0.00 O | |
| ATOM 425 N GLN A 53 14.406 -37.153 0.843 1.00 0.00 N | |
| ATOM 426 CA GLN A 53 15.716 -36.528 0.985 1.00 0.00 C | |
| ATOM 427 C GLN A 53 16.622 -37.348 1.900 1.00 0.00 C | |
| ATOM 428 CB GLN A 53 15.577 -35.103 1.523 1.00 0.00 C | |
| ATOM 429 O GLN A 53 17.781 -36.991 2.118 1.00 0.00 O | |
| ATOM 430 CG GLN A 53 14.837 -34.161 0.585 1.00 0.00 C | |
| ATOM 431 CD GLN A 53 15.497 -34.048 -0.777 1.00 0.00 C | |
| ATOM 432 NE2 GLN A 53 14.734 -34.314 -1.831 1.00 0.00 N | |
| ATOM 433 OE1 GLN A 53 16.684 -33.721 -0.879 1.00 0.00 O | |
| ATOM 434 N LYS A 54 16.072 -38.309 2.478 1.00 0.00 N | |
| ATOM 435 CA LYS A 54 16.878 -39.151 3.358 1.00 0.00 C | |
| ATOM 436 C LYS A 54 17.546 -40.280 2.580 1.00 0.00 C | |
| ATOM 437 CB LYS A 54 16.018 -39.726 4.484 1.00 0.00 C | |
| ATOM 438 O LYS A 54 18.701 -40.622 2.841 1.00 0.00 O | |
| ATOM 439 CG LYS A 54 15.496 -38.683 5.461 1.00 0.00 C | |
| ATOM 440 CD LYS A 54 14.588 -39.306 6.513 1.00 0.00 C | |
| ATOM 441 CE LYS A 54 14.037 -38.257 7.469 1.00 0.00 C | |
| ATOM 442 NZ LYS A 54 13.114 -38.858 8.479 1.00 0.00 N | |
| ATOM 443 OXT LYS A 54 16.529 -40.392 1.958 1.00 0.00 O | |
| TER 444 LYS A 54 | |
| END | |