ATOM 1 N ALA A 1 1.145 -1.297 -1.805 1.00 1.00 N ATOM 2 CA ALA A 1 2.012 -0.141 -1.661 1.00 1.00 C ATOM 3 C ALA A 1 1.372 1.062 -2.356 1.00 1.00 C ATOM 4 O ALA A 1 0.581 0.897 -3.285 1.00 1.00 O ATOM 5 CB ALA A 1 3.398 -0.468 -2.221 1.00 1.00 C ATOM 6 H1 ALA A 1 0.552 -1.481 -1.021 1.00 99.99 H ATOM 7 HA ALA A 1 2.106 0.073 -0.597 1.00 99.99 H ATOM 8 HB1 ALA A 1 3.292 -1.075 -3.121 1.00 99.99 H ATOM 9 HB2 ALA A 1 3.919 0.457 -2.466 1.00 99.99 H ATOM 10 HB3 ALA A 1 3.970 -1.021 -1.476 1.00 99.99 H ATOM 11 N ASP A 2 1.736 2.244 -1.882 1.00 1.00 N ATOM 12 CA ASP A 2 1.207 3.473 -2.447 1.00 1.00 C ATOM 13 C ASP A 2 -0.293 3.559 -2.156 1.00 1.00 C ATOM 14 O ASP A 2 -0.764 4.541 -1.586 1.00 1.00 O ATOM 15 CB ASP A 2 1.397 3.508 -3.965 1.00 1.00 C ATOM 16 CG ASP A 2 0.288 4.225 -4.738 1.00 1.00 C ATOM 17 OD1 ASP A 2 -0.753 3.632 -5.059 1.00 1.00 O ATOM 18 OD2 ASP A 2 0.529 5.461 -5.018 1.00 1.00 O ATOM 19 H ASP A 2 2.380 2.369 -1.127 1.00 99.99 H ATOM 20 HA ASP A 2 1.770 4.274 -1.968 1.00 99.99 H ATOM 21 HB2 ASP A 2 2.346 3.996 -4.185 1.00 99.99 H ATOM 22 HB3 ASP A 2 1.471 2.485 -4.331 1.00 99.99 H ATOM 23 HD2 ASP A 2 -0.310 5.913 -5.319 1.00 99.99 H ATOM 24 N ASP A 3 -1.002 2.515 -2.561 1.00 1.00 N ATOM 25 CA ASP A 3 -2.439 2.460 -2.351 1.00 1.00 C ATOM 26 C ASP A 3 -2.736 1.631 -1.100 1.00 1.00 C ATOM 27 O ASP A 3 -2.194 0.538 -0.931 1.00 1.00 O ATOM 28 CB ASP A 3 -3.143 1.795 -3.536 1.00 1.00 C ATOM 29 CG ASP A 3 -4.567 2.287 -3.800 1.00 1.00 C ATOM 30 OD1 ASP A 3 -4.833 2.964 -4.805 1.00 1.00 O ATOM 31 OD2 ASP A 3 -5.437 1.945 -2.910 1.00 1.00 O ATOM 32 H ASP A 3 -0.611 1.719 -3.023 1.00 99.99 H ATOM 33 HA ASP A 3 -2.754 3.497 -2.248 1.00 99.99 H ATOM 34 HB2 ASP A 3 -2.546 1.959 -4.432 1.00 99.99 H ATOM 35 HB3 ASP A 3 -3.173 0.719 -3.365 1.00 99.99 H ATOM 36 HD2 ASP A 3 -5.289 0.995 -2.636 1.00 99.99 H ATOM 37 N ILE A 4 -3.594 2.181 -0.254 1.00 1.00 N ATOM 38 CA ILE A 4 -3.969 1.506 0.977 1.00 1.00 C ATOM 39 C ILE A 4 -5.466 1.189 0.944 1.00 1.00 C ATOM 40 O ILE A 4 -6.297 2.096 0.979 1.00 1.00 O ATOM 41 CB ILE A 4 -3.542 2.332 2.193 1.00 1.00 C ATOM 42 CG1 ILE A 4 -2.024 2.527 2.217 1.00 1.00 C ATOM 43 CG2 ILE A 4 -4.061 1.708 3.489 1.00 1.00 C ATOM 44 CD1 ILE A 4 -1.524 2.758 3.644 1.00 1.00 C ATOM 45 H ILE A 4 -4.029 3.070 -0.399 1.00 99.99 H ATOM 46 HA ILE A 4 -3.418 0.567 1.016 1.00 99.99 H ATOM 47 HB ILE A 4 -3.992 3.321 2.108 1.00 99.99 H ATOM 48 HG12 ILE A 4 -1.535 1.650 1.793 1.00 99.99 H ATOM 49 HG23 ILE A 4 -5.077 1.343 3.335 1.00 99.99 H ATOM 50 HD11 ILE A 4 -2.276 3.311 4.208 1.00 99.99 H ATOM 51 N VAL A 5 -5.764 -0.100 0.878 1.00 1.00 N ATOM 52 CA VAL A 5 -7.145 -0.547 0.839 1.00 1.00 C ATOM 53 C VAL A 5 -7.678 -0.665 2.269 1.00 1.00 C ATOM 54 O VAL A 5 -7.118 -1.394 3.086 1.00 1.00 O ATOM 55 CB VAL A 5 -7.250 -1.856 0.053 1.00 1.00 C ATOM 56 CG1 VAL A 5 -8.639 -2.478 0.205 1.00 1.00 C ATOM 57 CG2 VAL A 5 -6.906 -1.638 -1.422 1.00 1.00 C ATOM 58 H VAL A 5 -5.081 -0.831 0.849 1.00 99.99 H ATOM 59 HA VAL A 5 -7.723 0.211 0.311 1.00 99.99 H ATOM 60 HB VAL A 5 -6.522 -2.555 0.466 1.00 99.99 H ATOM 61 HG13 VAL A 5 -8.544 -3.486 0.611 1.00 99.99 H ATOM 62 HG21 VAL A 5 -7.798 -1.313 -1.958 1.00 99.99 H ATOM 63 N LEU A 6 -8.754 0.064 2.527 1.00 1.00 N ATOM 64 CA LEU A 6 -9.368 0.050 3.844 1.00 1.00 C ATOM 65 C LEU A 6 -10.564 -0.904 3.834 1.00 1.00 C ATOM 66 O LEU A 6 -11.706 -0.473 3.680 1.00 1.00 O ATOM 67 CB LEU A 6 -9.720 1.472 4.285 1.00 1.00 C ATOM 68 CG LEU A 6 -8.568 2.477 4.290 1.00 1.00 C ATOM 69 CD1 LEU A 6 -9.093 3.915 4.273 1.00 1.00 C ATOM 70 CD2 LEU A 6 -7.624 2.226 5.468 1.00 1.00 C ATOM 71 H LEU A 6 -9.203 0.655 1.857 1.00 99.99 H ATOM 72 HA LEU A 6 -8.627 -0.332 4.547 1.00 99.99 H ATOM 73 HB2 LEU A 6 -10.505 1.851 3.630 1.00 99.99 H ATOM 74 HB3 LEU A 6 -10.140 1.426 5.290 1.00 99.99 H ATOM 75 HG LEU A 6 -7.988 2.337 3.377 1.00 99.99 H ATOM 76 HD13 LEU A 6 -8.356 4.566 3.804 1.00 99.99 H ATOM 77 HD21 LEU A 6 -8.140 2.454 6.401 1.00 99.99 H ATOM 78 N LYS A 7 -10.261 -2.184 4.000 1.00 1.00 N ATOM 79 CA LYS A 7 -11.297 -3.203 4.011 1.00 1.00 C ATOM 80 C LYS A 7 -12.554 -2.639 4.678 1.00 1.00 C ATOM 81 O LYS A 7 -12.553 -2.360 5.875 1.00 1.00 O ATOM 82 CB LYS A 7 -10.778 -4.486 4.664 1.00 1.00 C ATOM 83 CG LYS A 7 -10.093 -5.387 3.634 1.00 1.00 C ATOM 84 CD LYS A 7 -10.614 -6.823 3.729 1.00 1.00 C ATOM 85 CE LYS A 7 -10.176 -7.645 2.516 1.00 1.00 C ATOM 86 NZ LYS A 7 -10.687 -9.031 2.618 1.00 1.00 N ATOM 87 H LYS A 7 -9.330 -2.526 4.124 1.00 99.99 H ATOM 88 HA LYS A 7 -11.532 -3.441 2.975 1.00 99.99 H ATOM 89 HB2 LYS A 7 -10.075 -4.236 5.458 1.00 99.99 H ATOM 90 HB3 LYS A 7 -11.606 -5.022 5.129 1.00 99.99 H ATOM 91 HG2 LYS A 7 -10.269 -4.998 2.631 1.00 99.99 H ATOM 92 HG3 LYS A 7 -9.015 -5.375 3.796 1.00 99.99 H ATOM 93 HD2 LYS A 7 -10.242 -7.288 4.642 1.00 99.99 H ATOM 94 HD3 LYS A 7 -11.701 -6.815 3.795 1.00 99.99 H ATOM 95 HE2 LYS A 7 -10.547 -7.182 1.602 1.00 99.99 H ATOM 96 HE3 LYS A 7 -9.088 -7.657 2.450 1.00 99.99 H ATOM 97 HZ1 LYS A 7 -10.447 -9.460 3.505 1.00 99.99 H ATOM 98 HZ2 LYS A 7 -11.697 -9.070 2.536 1.00 99.99 H ATOM 99 N ALA A 8 -13.594 -2.487 3.872 1.00 1.00 N ATOM 100 CA ALA A 8 -14.855 -1.962 4.369 1.00 1.00 C ATOM 101 C ALA A 8 -15.938 -3.032 4.228 1.00 1.00 C ATOM 102 O ALA A 8 -15.765 -4.006 3.497 1.00 1.00 O ATOM 103 CB ALA A 8 -15.204 -0.677 3.615 1.00 1.00 C ATOM 104 H ALA A 8 -13.586 -2.716 2.899 1.00 99.99 H ATOM 105 HA ALA A 8 -14.723 -1.726 5.424 1.00 99.99 H ATOM 106 HB1 ALA A 8 -14.516 -0.546 2.780 1.00 99.99 H ATOM 107 HB2 ALA A 8 -16.225 -0.742 3.239 1.00 99.99 H ATOM 108 HB3 ALA A 8 -15.119 0.174 4.291 1.00 99.99 H ATOM 109 N LYS A 9 -17.034 -2.817 4.943 1.00 1.00 N ATOM 110 CA LYS A 9 -18.146 -3.751 4.907 1.00 1.00 C ATOM 111 C LYS A 9 -19.116 -3.342 3.796 1.00 1.00 C ATOM 112 O LYS A 9 -19.886 -4.164 3.306 1.00 1.00 O ATOM 113 CB LYS A 9 -18.801 -3.856 6.287 1.00 1.00 C ATOM 114 CG LYS A 9 -19.494 -5.209 6.462 1.00 1.00 C ATOM 115 CD LYS A 9 -20.333 -5.233 7.741 1.00 1.00 C ATOM 116 CE LYS A 9 -19.792 -6.265 8.733 1.00 1.00 C ATOM 117 NZ LYS A 9 -20.778 -6.519 9.806 1.00 1.00 N ATOM 118 H LYS A 9 -17.167 -2.023 5.536 1.00 99.99 H ATOM 119 HA LYS A 9 -17.741 -4.734 4.667 1.00 99.99 H ATOM 120 HB2 LYS A 9 -18.047 -3.727 7.062 1.00 99.99 H ATOM 121 HB3 LYS A 9 -19.526 -3.053 6.411 1.00 99.99 H ATOM 122 HG2 LYS A 9 -20.131 -5.410 5.601 1.00 99.99 H ATOM 123 HG3 LYS A 9 -18.747 -6.003 6.497 1.00 99.99 H ATOM 124 HD2 LYS A 9 -20.330 -4.245 8.201 1.00 99.99 H ATOM 125 HD3 LYS A 9 -21.369 -5.467 7.496 1.00 99.99 H ATOM 126 HE2 LYS A 9 -19.565 -7.195 8.211 1.00 99.99 H ATOM 127 HE3 LYS A 9 -18.858 -5.907 9.165 1.00 99.99 H ATOM 128 HZ1 LYS A 9 -20.427 -6.244 10.717 1.00 99.99 H ATOM 129 HZ2 LYS A 9 -21.642 -6.008 9.658 1.00 99.99 H ATOM 130 N ASN A 10 -19.045 -2.069 3.432 1.00 1.00 N ATOM 131 CA ASN A 10 -19.906 -1.541 2.388 1.00 1.00 C ATOM 132 C ASN A 10 -19.049 -0.846 1.328 1.00 1.00 C ATOM 133 O ASN A 10 -19.118 0.372 1.170 1.00 1.00 O ATOM 134 CB ASN A 10 -20.887 -0.511 2.953 1.00 1.00 C ATOM 135 CG ASN A 10 -21.550 0.287 1.828 1.00 1.00 C ATOM 136 OD1 ASN A 10 -22.156 -0.255 0.921 1.00 1.00 O ATOM 137 ND2 ASN A 10 -21.400 1.604 1.940 1.00 1.00 N ATOM 138 H ASN A 10 -18.415 -1.406 3.836 1.00 99.99 H ATOM 139 HA ASN A 10 -20.440 -2.405 1.992 1.00 99.99 H ATOM 140 HB2 ASN A 10 -21.651 -1.017 3.543 1.00 99.99 H ATOM 141 HB3 ASN A 10 -20.362 0.167 3.624 1.00 99.99 H ATOM 142 HD21 ASN A 10 -21.798 2.213 1.253 1.00 99.99 H ATOM 143 N GLY A 11 -18.261 -1.651 0.630 1.00 1.00 N ATOM 144 CA GLY A 11 -17.391 -1.129 -0.410 1.00 1.00 C ATOM 145 C GLY A 11 -16.036 -0.711 0.167 1.00 1.00 C ATOM 146 O GLY A 11 -15.974 -0.084 1.222 1.00 1.00 O ATOM 147 H GLY A 11 -18.210 -2.640 0.766 1.00 99.99 H ATOM 148 HA2 GLY A 11 -17.245 -1.885 -1.181 1.00 99.99 H ATOM 149 HA3 GLY A 11 -17.866 -0.272 -0.889 1.00 99.99 H ATOM 150 N ASP A 12 -14.985 -1.077 -0.553 1.00 1.00 N ATOM 151 CA ASP A 12 -13.636 -0.749 -0.127 1.00 1.00 C ATOM 152 C ASP A 12 -13.340 0.713 -0.468 1.00 1.00 C ATOM 153 O ASP A 12 -14.109 1.357 -1.179 1.00 1.00 O ATOM 154 CB ASP A 12 -12.604 -1.620 -0.845 1.00 1.00 C ATOM 155 CG ASP A 12 -13.094 -3.016 -1.233 1.00 1.00 C ATOM 156 OD1 ASP A 12 -13.007 -3.967 -0.441 1.00 1.00 O ATOM 157 OD2 ASP A 12 -13.590 -3.110 -2.421 1.00 1.00 O ATOM 158 H ASP A 12 -15.045 -1.586 -1.411 1.00 99.99 H ATOM 159 HA ASP A 12 -13.620 -0.938 0.946 1.00 99.99 H ATOM 160 HB2 ASP A 12 -12.279 -1.102 -1.747 1.00 99.99 H ATOM 161 HB3 ASP A 12 -11.729 -1.724 -0.204 1.00 99.99 H ATOM 162 HD2 ASP A 12 -13.610 -4.068 -2.708 1.00 99.99 H ATOM 163 N VAL A 13 -12.222 1.194 0.056 1.00 1.00 N ATOM 164 CA VAL A 13 -11.814 2.568 -0.184 1.00 1.00 C ATOM 165 C VAL A 13 -10.382 2.584 -0.724 1.00 1.00 C ATOM 166 O VAL A 13 -9.434 2.329 0.017 1.00 1.00 O ATOM 167 CB VAL A 13 -11.980 3.394 1.093 1.00 1.00 C ATOM 168 CG1 VAL A 13 -11.456 4.818 0.897 1.00 1.00 C ATOM 169 CG2 VAL A 13 -13.440 3.405 1.552 1.00 1.00 C ATOM 170 H VAL A 13 -11.601 0.664 0.633 1.00 99.99 H ATOM 171 HA VAL A 13 -12.479 2.981 -0.942 1.00 99.99 H ATOM 172 HB VAL A 13 -11.387 2.923 1.876 1.00 99.99 H ATOM 173 HG13 VAL A 13 -11.354 5.025 -0.168 1.00 99.99 H ATOM 174 HG21 VAL A 13 -13.693 4.395 1.932 1.00 99.99 H ATOM 175 N LYS A 14 -10.271 2.887 -2.008 1.00 1.00 N ATOM 176 CA LYS A 14 -8.971 2.939 -2.656 1.00 1.00 C ATOM 177 C LYS A 14 -8.303 4.279 -2.341 1.00 1.00 C ATOM 178 O LYS A 14 -8.456 5.244 -3.088 1.00 1.00 O ATOM 179 CB LYS A 14 -9.107 2.657 -4.154 1.00 1.00 C ATOM 180 CG LYS A 14 -7.766 2.836 -4.869 1.00 1.00 C ATOM 181 CD LYS A 14 -7.975 3.225 -6.334 1.00 1.00 C ATOM 182 CE LYS A 14 -7.641 2.056 -7.263 1.00 1.00 C ATOM 183 NZ LYS A 14 -7.599 2.509 -8.672 1.00 1.00 N ATOM 184 H LYS A 14 -11.048 3.093 -2.603 1.00 99.99 H ATOM 185 HA LYS A 14 -8.362 2.141 -2.232 1.00 99.99 H ATOM 186 HB2 LYS A 14 -9.470 1.640 -4.305 1.00 99.99 H ATOM 187 HB3 LYS A 14 -9.848 3.328 -4.588 1.00 99.99 H ATOM 188 HG2 LYS A 14 -7.181 3.606 -4.364 1.00 99.99 H ATOM 189 HG3 LYS A 14 -7.192 1.912 -4.812 1.00 99.99 H ATOM 190 HD2 LYS A 14 -9.008 3.535 -6.488 1.00 99.99 H ATOM 191 HD3 LYS A 14 -7.346 4.081 -6.580 1.00 99.99 H ATOM 192 HE2 LYS A 14 -6.680 1.625 -6.986 1.00 99.99 H ATOM 193 HE3 LYS A 14 -8.388 1.270 -7.151 1.00 99.99 H ATOM 194 HZ1 LYS A 14 -8.358 3.148 -8.888 1.00 99.99 H ATOM 195 HZ2 LYS A 14 -6.736 2.994 -8.889 1.00 99.99 H ATOM 196 N PHE A 15 -7.576 4.295 -1.233 1.00 1.00 N ATOM 197 CA PHE A 15 -6.884 5.500 -0.810 1.00 1.00 C ATOM 198 C PHE A 15 -5.392 5.422 -1.143 1.00 1.00 C ATOM 199 O PHE A 15 -4.666 4.544 -0.682 1.00 1.00 O ATOM 200 CB PHE A 15 -7.050 5.602 0.708 1.00 1.00 C ATOM 201 CG PHE A 15 -6.417 6.853 1.321 1.00 1.00 C ATOM 202 CD1 PHE A 15 -6.841 8.087 0.938 1.00 1.00 C ATOM 203 CD2 PHE A 15 -5.430 6.731 2.248 1.00 1.00 C ATOM 204 CE1 PHE A 15 -6.254 9.247 1.506 1.00 1.00 C ATOM 205 CE2 PHE A 15 -4.842 7.891 2.817 1.00 1.00 C ATOM 206 CZ PHE A 15 -5.267 9.125 2.435 1.00 1.00 C ATOM 207 H PHE A 15 -7.456 3.505 -0.631 1.00 99.99 H ATOM 208 HA PHE A 15 -7.331 6.335 -1.348 1.00 99.99 H ATOM 209 HB2 PHE A 15 -8.113 5.590 0.948 1.00 99.99 H ATOM 210 HB3 PHE A 15 -6.609 4.720 1.171 1.00 99.99 H ATOM 211 HD1 PHE A 15 -7.632 8.185 0.194 1.00 99.99 H ATOM 212 HD2 PHE A 15 -5.091 5.742 2.556 1.00 99.99 H ATOM 213 HE1 PHE A 15 -6.593 10.237 1.199 1.00 99.99 H ATOM 214 HE2 PHE A 15 -4.053 7.794 3.561 1.00 99.99 H ATOM 215 HZ PHE A 15 -4.816 10.017 2.871 1.00 99.99 H ATOM 216 N PRO A 16 -4.948 6.374 -1.967 1.00 1.00 N ATOM 217 CA PRO A 16 -3.575 6.491 -2.413 1.00 1.00 C ATOM 218 C PRO A 16 -2.769 7.265 -1.380 1.00 1.00 C ATOM 219 O PRO A 16 -2.805 8.492 -1.388 1.00 1.00 O ATOM 220 CB PRO A 16 -3.657 7.258 -3.732 1.00 1.00 C ATOM 221 CG PRO A 16 -4.858 8.174 -3.488 1.00 1.00 C ATOM 222 CD PRO A 16 -5.775 7.419 -2.528 1.00 1.00 C ATOM 223 HA PRO A 16 -3.130 5.509 -2.571 1.00 99.99 H ATOM 224 HB2 PRO A 16 -2.770 7.867 -3.910 1.00 99.99 H ATOM 225 HB3 PRO A 16 -3.812 6.552 -4.548 1.00 99.99 H ATOM 226 HG2 PRO A 16 -4.948 9.245 -3.305 1.00 99.99 H ATOM 227 HG3 PRO A 16 -5.071 7.942 -4.532 1.00 99.99 H ATOM 228 HD2 PRO A 16 -6.159 8.084 -1.755 1.00 99.99 H ATOM 229 HD3 PRO A 16 -6.597 6.966 -3.081 1.00 99.99 H ATOM 230 N HIS A 17 -2.059 6.542 -0.513 1.00 1.00 N ATOM 231 CA HIS A 17 -1.238 7.142 0.533 1.00 1.00 C ATOM 232 C HIS A 17 -0.082 7.934 -0.103 1.00 1.00 C ATOM 233 O HIS A 17 0.064 9.128 0.153 1.00 1.00 O ATOM 234 CB HIS A 17 -0.790 6.041 1.506 1.00 1.00 C ATOM 235 CG HIS A 17 -0.156 6.495 2.800 1.00 1.00 C ATOM 236 ND1 HIS A 17 1.164 6.464 3.004 1.00 1.00 N ATOM 237 CD2 HIS A 17 -0.710 6.994 3.955 1.00 1.00 C ATOM 238 CE1 HIS A 17 1.424 6.926 4.237 1.00 1.00 C ATOM 239 NE2 HIS A 17 0.301 7.267 4.868 1.00 1.00 N ATOM 240 H HIS A 17 -2.089 5.534 -0.583 1.00 99.99 H ATOM 241 HA HIS A 17 -1.874 7.860 1.098 1.00 99.99 H ATOM 242 HB2 HIS A 17 -1.686 5.431 1.767 1.00 99.99 H ATOM 243 HB3 HIS A 17 -0.052 5.397 0.977 1.00 99.99 H ATOM 244 HD1 HIS A 17 1.843 6.139 2.318 1.00 99.99 H ATOM 245 HD2 HIS A 17 -1.785 7.152 4.129 1.00 99.99 H ATOM 246 HE1 HIS A 17 2.432 7.012 4.670 1.00 99.99 H ATOM 247 N LYS A 18 0.703 7.239 -0.913 1.00 1.00 N ATOM 248 CA LYS A 18 1.832 7.866 -1.581 1.00 1.00 C ATOM 249 C LYS A 18 1.379 9.184 -2.212 1.00 1.00 C ATOM 250 O LYS A 18 2.152 10.137 -2.289 1.00 1.00 O ATOM 251 CB LYS A 18 2.471 6.895 -2.577 1.00 1.00 C ATOM 252 CG LYS A 18 3.400 7.633 -3.543 1.00 1.00 C ATOM 253 CD LYS A 18 4.854 7.202 -3.343 1.00 1.00 C ATOM 254 CE LYS A 18 5.770 8.418 -3.189 1.00 1.00 C ATOM 255 NZ LYS A 18 6.628 8.575 -4.385 1.00 1.00 N ATOM 256 H LYS A 18 0.577 6.268 -1.117 1.00 99.99 H ATOM 257 HA LYS A 18 2.580 8.085 -0.820 1.00 99.99 H ATOM 258 HB2 LYS A 18 3.034 6.133 -2.037 1.00 99.99 H ATOM 259 HB3 LYS A 18 1.692 6.378 -3.138 1.00 99.99 H ATOM 260 HG2 LYS A 18 3.095 7.433 -4.570 1.00 99.99 H ATOM 261 HG3 LYS A 18 3.310 8.709 -3.388 1.00 99.99 H ATOM 262 HD2 LYS A 18 4.932 6.570 -2.458 1.00 99.99 H ATOM 263 HD3 LYS A 18 5.180 6.603 -4.193 1.00 99.99 H ATOM 264 HE2 LYS A 18 5.170 9.317 -3.043 1.00 99.99 H ATOM 265 HE3 LYS A 18 6.391 8.303 -2.301 1.00 99.99 H ATOM 266 HZ1 LYS A 18 7.125 7.721 -4.610 1.00 99.99 H ATOM 267 HZ2 LYS A 18 6.091 8.828 -5.207 1.00 99.99 H ATOM 268 N ALA A 19 0.127 9.195 -2.647 1.00 1.00 N ATOM 269 CA ALA A 19 -0.438 10.381 -3.268 1.00 1.00 C ATOM 270 C ALA A 19 -0.712 11.433 -2.193 1.00 1.00 C ATOM 271 O ALA A 19 -0.502 12.625 -2.409 1.00 1.00 O ATOM 272 CB ALA A 19 -1.699 9.998 -4.045 1.00 1.00 C ATOM 273 H ALA A 19 -0.495 8.415 -2.580 1.00 99.99 H ATOM 274 HA ALA A 19 0.300 10.773 -3.969 1.00 99.99 H ATOM 275 HB1 ALA A 19 -1.484 9.147 -4.690 1.00 99.99 H ATOM 276 HB2 ALA A 19 -2.491 9.733 -3.344 1.00 99.99 H ATOM 277 HB3 ALA A 19 -2.021 10.843 -4.654 1.00 99.99 H ATOM 278 N HIS A 20 -1.182 10.954 -1.042 1.00 1.00 N ATOM 279 CA HIS A 20 -1.503 11.804 0.100 1.00 1.00 C ATOM 280 C HIS A 20 -0.226 12.088 0.912 1.00 1.00 C ATOM 281 O HIS A 20 -0.305 12.571 2.040 1.00 1.00 O ATOM 282 CB HIS A 20 -2.633 11.149 0.907 1.00 1.00 C ATOM 283 CG HIS A 20 -4.047 11.462 0.473 1.00 1.00 C ATOM 284 ND1 HIS A 20 -4.583 10.965 -0.646 1.00 1.00 N ATOM 285 CD2 HIS A 20 -5.021 12.242 1.050 1.00 1.00 C ATOM 286 CE1 HIS A 20 -5.841 11.419 -0.761 1.00 1.00 C ATOM 287 NE2 HIS A 20 -6.162 12.211 0.260 1.00 1.00 N ATOM 288 H HIS A 20 -1.324 9.958 -0.954 1.00 99.99 H ATOM 289 HA HIS A 20 -1.880 12.776 -0.292 1.00 99.99 H ATOM 290 HB2 HIS A 20 -2.501 10.044 0.846 1.00 99.99 H ATOM 291 HB3 HIS A 20 -2.527 11.472 1.967 1.00 99.99 H ATOM 292 HD1 HIS A 20 -4.095 10.346 -1.289 1.00 99.99 H ATOM 293 HD2 HIS A 20 -4.911 12.803 1.991 1.00 99.99 H ATOM 294 HE1 HIS A 20 -6.520 11.167 -1.592 1.00 99.99 H ATOM 295 N GLN A 21 0.911 11.775 0.309 1.00 1.00 N ATOM 296 CA GLN A 21 2.190 11.993 0.963 1.00 1.00 C ATOM 297 C GLN A 21 2.865 13.247 0.407 1.00 1.00 C ATOM 298 O GLN A 21 4.042 13.492 0.670 1.00 1.00 O ATOM 299 CB GLN A 21 3.098 10.769 0.813 1.00 1.00 C ATOM 300 CG GLN A 21 3.906 10.526 2.087 1.00 1.00 C ATOM 301 CD GLN A 21 4.527 11.828 2.598 1.00 1.00 C ATOM 302 OE1 GLN A 21 3.844 12.781 2.936 1.00 1.00 O ATOM 303 NE2 GLN A 21 5.857 11.815 2.638 1.00 1.00 N ATOM 304 H GLN A 21 0.967 11.382 -0.610 1.00 99.99 H ATOM 305 HA GLN A 21 1.955 12.134 2.018 1.00 99.99 H ATOM 306 HB2 GLN A 21 2.494 9.890 0.587 1.00 99.99 H ATOM 307 HB3 GLN A 21 3.774 10.915 -0.030 1.00 99.99 H ATOM 308 HG2 GLN A 21 3.262 10.100 2.856 1.00 99.99 H ATOM 309 HG3 GLN A 21 4.692 9.797 1.890 1.00 99.99 H ATOM 310 HE21 GLN A 21 6.356 12.620 2.958 1.00 99.99 H ATOM 311 N LYS A 22 2.091 14.010 -0.351 1.00 1.00 N ATOM 312 CA LYS A 22 2.600 15.234 -0.946 1.00 1.00 C ATOM 313 C LYS A 22 1.428 16.163 -1.270 1.00 1.00 C ATOM 314 O LYS A 22 1.373 16.745 -2.353 1.00 1.00 O ATOM 315 CB LYS A 22 3.485 14.916 -2.153 1.00 1.00 C ATOM 316 CG LYS A 22 4.813 15.672 -2.076 1.00 1.00 C ATOM 317 CD LYS A 22 5.902 14.949 -2.869 1.00 1.00 C ATOM 318 CE LYS A 22 7.134 15.840 -3.045 1.00 1.00 C ATOM 319 NZ LYS A 22 7.744 16.145 -1.732 1.00 1.00 N ATOM 320 H LYS A 22 1.136 13.804 -0.560 1.00 99.99 H ATOM 321 HA LYS A 22 3.232 15.721 -0.204 1.00 99.99 H ATOM 322 HB2 LYS A 22 3.674 13.843 -2.198 1.00 99.99 H ATOM 323 HB3 LYS A 22 2.963 15.184 -3.072 1.00 99.99 H ATOM 324 HG2 LYS A 22 4.684 16.682 -2.465 1.00 99.99 H ATOM 325 HG3 LYS A 22 5.119 15.768 -1.034 1.00 99.99 H ATOM 326 HD2 LYS A 22 6.185 14.031 -2.353 1.00 99.99 H ATOM 327 HD3 LYS A 22 5.515 14.660 -3.846 1.00 99.99 H ATOM 328 HE2 LYS A 22 7.862 15.341 -3.684 1.00 99.99 H ATOM 329 HE3 LYS A 22 6.851 16.766 -3.546 1.00 99.99 H ATOM 330 HZ1 LYS A 22 8.443 16.878 -1.800 1.00 99.99 H ATOM 331 HZ2 LYS A 22 7.056 16.458 -1.056 1.00 99.99 H ATOM 332 N ALA A 23 0.521 16.275 -0.312 1.00 1.00 N ATOM 333 CA ALA A 23 -0.647 17.124 -0.482 1.00 1.00 C ATOM 334 C ALA A 23 -1.168 17.549 0.892 1.00 1.00 C ATOM 335 O ALA A 23 -2.377 17.604 1.111 1.00 1.00 O ATOM 336 CB ALA A 23 -1.704 16.381 -1.303 1.00 1.00 C ATOM 337 H ALA A 23 0.572 15.799 0.565 1.00 99.99 H ATOM 338 HA ALA A 23 -0.334 18.011 -1.033 1.00 99.99 H ATOM 339 HB1 ALA A 23 -1.859 15.388 -0.880 1.00 99.99 H ATOM 340 HB2 ALA A 23 -2.640 16.937 -1.277 1.00 99.99 H ATOM 341 HB3 ALA A 23 -1.364 16.289 -2.334 1.00 99.99 H ATOM 342 N VAL A 24 -0.230 17.836 1.783 1.00 1.00 N ATOM 343 CA VAL A 24 -0.578 18.253 3.129 1.00 1.00 C ATOM 344 C VAL A 24 0.536 19.138 3.690 1.00 1.00 C ATOM 345 O VAL A 24 1.716 18.791 3.672 1.00 1.00 O ATOM 346 CB VAL A 24 -0.864 17.027 4.000 1.00 1.00 C ATOM 347 CG1 VAL A 24 -1.812 17.380 5.148 1.00 1.00 C ATOM 348 CG2 VAL A 24 -1.422 15.877 3.160 1.00 1.00 C ATOM 349 H VAL A 24 0.751 17.787 1.596 1.00 99.99 H ATOM 350 HA VAL A 24 -1.494 18.842 3.064 1.00 99.99 H ATOM 351 HB VAL A 24 0.080 16.698 4.433 1.00 99.99 H ATOM 352 HG13 VAL A 24 -1.257 17.894 5.933 1.00 99.99 H ATOM 353 HG21 VAL A 24 -0.752 15.679 2.324 1.00 99.99 H ATOM 354 N PRO A 25 0.131 20.305 4.195 1.00 1.00 N ATOM 355 CA PRO A 25 1.014 21.293 4.778 1.00 1.00 C ATOM 356 C PRO A 25 1.365 20.887 6.201 1.00 1.00 C ATOM 357 O PRO A 25 1.763 21.749 6.984 1.00 1.00 O ATOM 358 CB PRO A 25 0.212 22.592 4.761 1.00 1.00 C ATOM 359 CG PRO A 25 -1.228 22.036 5.047 1.00 1.00 C ATOM 360 CD PRO A 25 -1.248 20.744 4.232 1.00 1.00 C ATOM 361 HA PRO A 25 1.924 21.400 4.188 1.00 99.99 H ATOM 362 HB2 PRO A 25 0.559 23.303 5.511 1.00 99.99 H ATOM 363 HB3 PRO A 25 0.260 23.031 3.764 1.00 99.99 H ATOM 364 HG2 PRO A 25 -1.318 21.793 6.106 1.00 99.99 H ATOM 365 HG3 PRO A 25 -2.010 22.730 4.741 1.00 99.99 H ATOM 366 HD2 PRO A 25 -1.893 20.000 4.700 1.00 99.99 H ATOM 367 HD3 PRO A 25 -1.582 20.953 3.217 1.00 99.99 H ATOM 368 N ASP A 26 1.216 19.607 6.509 1.00 1.00 N ATOM 369 CA ASP A 26 1.523 19.116 7.841 1.00 1.00 C ATOM 370 C ASP A 26 1.126 17.641 7.940 1.00 1.00 C ATOM 371 O ASP A 26 0.051 17.316 8.441 1.00 1.00 O ATOM 372 CB ASP A 26 0.741 19.888 8.906 1.00 1.00 C ATOM 373 CG ASP A 26 1.479 20.091 10.230 1.00 1.00 C ATOM 374 OD1 ASP A 26 2.606 20.607 10.261 1.00 1.00 O ATOM 375 OD2 ASP A 26 0.843 19.688 11.277 1.00 1.00 O ATOM 376 H ASP A 26 0.892 18.912 5.866 1.00 99.99 H ATOM 377 HA ASP A 26 2.595 19.268 7.963 1.00 99.99 H ATOM 378 HB2 ASP A 26 0.474 20.865 8.502 1.00 99.99 H ATOM 379 HB3 ASP A 26 -0.192 19.361 9.104 1.00 99.99 H ATOM 380 HD2 ASP A 26 1.481 19.549 12.034 1.00 99.99 H ATOM 381 N CYS A 27 2.015 16.789 7.454 1.00 1.00 N ATOM 382 CA CYS A 27 1.772 15.357 7.482 1.00 1.00 C ATOM 383 C CYS A 27 1.324 14.972 8.894 1.00 1.00 C ATOM 384 O CYS A 27 0.603 13.992 9.075 1.00 1.00 O ATOM 385 CB CYS A 27 3.004 14.564 7.039 1.00 1.00 C ATOM 386 SG CYS A 27 3.094 12.857 7.691 1.00 1.00 S ATOM 387 H CYS A 27 2.888 17.061 7.049 1.00 99.99 H ATOM 388 HA CYS A 27 0.982 15.159 6.758 1.00 99.99 H ATOM 389 HB2 CYS A 27 3.020 14.523 5.950 1.00 99.99 H ATOM 390 HB3 CYS A 27 3.897 15.104 7.351 1.00 99.99 H ATOM 391 N LYS A 28 1.770 15.764 9.857 1.00 1.00 N ATOM 392 CA LYS A 28 1.424 15.519 11.247 1.00 1.00 C ATOM 393 C LYS A 28 -0.078 15.733 11.440 1.00 1.00 C ATOM 394 O LYS A 28 -0.629 15.387 12.484 1.00 1.00 O ATOM 395 CB LYS A 28 2.291 16.375 12.174 1.00 1.00 C ATOM 396 CG LYS A 28 3.709 15.811 12.275 1.00 1.00 C ATOM 397 CD LYS A 28 3.767 14.649 13.271 1.00 1.00 C ATOM 398 CE LYS A 28 5.153 14.542 13.909 1.00 1.00 C ATOM 399 NZ LYS A 28 6.090 13.844 13.000 1.00 1.00 N ATOM 400 H LYS A 28 2.357 16.559 9.702 1.00 99.99 H ATOM 401 HA LYS A 28 1.655 14.476 11.463 1.00 99.99 H ATOM 402 HB2 LYS A 28 2.329 17.399 11.801 1.00 99.99 H ATOM 403 HB3 LYS A 28 1.840 16.416 13.165 1.00 99.99 H ATOM 404 HG2 LYS A 28 4.040 15.470 11.294 1.00 99.99 H ATOM 405 HG3 LYS A 28 4.396 16.596 12.589 1.00 99.99 H ATOM 406 HD2 LYS A 28 3.016 14.793 14.047 1.00 99.99 H ATOM 407 HD3 LYS A 28 3.524 13.716 12.760 1.00 99.99 H ATOM 408 HE2 LYS A 28 5.533 15.538 14.136 1.00 99.99 H ATOM 409 HE3 LYS A 28 5.085 14.004 14.854 1.00 99.99 H ATOM 410 HZ1 LYS A 28 6.234 12.878 13.272 1.00 99.99 H ATOM 411 HZ2 LYS A 28 5.753 13.831 12.043 1.00 99.99 H ATOM 412 N LYS A 29 -0.698 16.303 10.417 1.00 1.00 N ATOM 413 CA LYS A 29 -2.126 16.567 10.461 1.00 1.00 C ATOM 414 C LYS A 29 -2.862 15.296 10.890 1.00 1.00 C ATOM 415 O LYS A 29 -3.575 15.295 11.892 1.00 1.00 O ATOM 416 CB LYS A 29 -2.607 17.133 9.124 1.00 1.00 C ATOM 417 CG LYS A 29 -4.082 17.535 9.198 1.00 1.00 C ATOM 418 CD LYS A 29 -4.241 18.932 9.801 1.00 1.00 C ATOM 419 CE LYS A 29 -3.692 20.004 8.856 1.00 1.00 C ATOM 420 NZ LYS A 29 -2.275 20.294 9.167 1.00 1.00 N ATOM 421 H LYS A 29 -0.243 16.581 9.571 1.00 99.99 H ATOM 422 HA LYS A 29 -2.294 17.334 11.215 1.00 99.99 H ATOM 423 HB2 LYS A 29 -2.004 18.000 8.854 1.00 99.99 H ATOM 424 HB3 LYS A 29 -2.467 16.391 8.337 1.00 99.99 H ATOM 425 HG2 LYS A 29 -4.518 17.515 8.198 1.00 99.99 H ATOM 426 HG3 LYS A 29 -4.631 16.810 9.799 1.00 99.99 H ATOM 427 HD2 LYS A 29 -5.294 19.126 10.006 1.00 99.99 H ATOM 428 HD3 LYS A 29 -3.716 18.982 10.756 1.00 99.99 H ATOM 429 HE2 LYS A 29 -3.783 19.666 7.824 1.00 99.99 H ATOM 430 HE3 LYS A 29 -4.285 20.914 8.948 1.00 99.99 H ATOM 431 HZ1 LYS A 29 -1.948 21.131 8.698 1.00 99.99 H ATOM 432 HZ2 LYS A 29 -2.126 20.436 10.161 1.00 99.99 H ATOM 433 N CYS A 30 -2.665 14.243 10.109 1.00 1.00 N ATOM 434 CA CYS A 30 -3.302 12.969 10.396 1.00 1.00 C ATOM 435 C CYS A 30 -2.466 12.242 11.450 1.00 1.00 C ATOM 436 O CYS A 30 -3.003 11.665 12.393 1.00 1.00 O ATOM 437 CB CYS A 30 -3.480 12.128 9.130 1.00 1.00 C ATOM 438 SG CYS A 30 -3.730 13.221 7.683 1.00 1.00 S ATOM 439 H CYS A 30 -2.084 14.252 9.295 1.00 99.99 H ATOM 440 HA CYS A 30 -4.296 13.195 10.779 1.00 99.99 H ATOM 441 HB2 CYS A 30 -2.603 11.500 8.974 1.00 99.99 H ATOM 442 HB3 CYS A 30 -4.334 11.461 9.244 1.00 99.99 H ATOM 443 N HIS A 31 -1.147 12.290 11.257 1.00 1.00 N ATOM 444 CA HIS A 31 -0.190 11.655 12.157 1.00 1.00 C ATOM 445 C HIS A 31 0.327 12.685 13.178 1.00 1.00 C ATOM 446 O HIS A 31 1.521 12.975 13.213 1.00 1.00 O ATOM 447 CB HIS A 31 0.910 10.987 11.322 1.00 1.00 C ATOM 448 CG HIS A 31 0.465 9.952 10.314 1.00 1.00 C ATOM 449 ND1 HIS A 31 -0.363 8.951 10.628 1.00 1.00 N ATOM 450 CD2 HIS A 31 0.762 9.797 8.981 1.00 1.00 C ATOM 451 CE1 HIS A 31 -0.573 8.202 9.535 1.00 1.00 C ATOM 452 NE2 HIS A 31 0.098 8.679 8.489 1.00 1.00 N ATOM 453 H HIS A 31 -0.794 12.788 10.453 1.00 99.99 H ATOM 454 HA HIS A 31 -0.726 10.857 12.719 1.00 99.99 H ATOM 455 HB2 HIS A 31 1.450 11.787 10.764 1.00 99.99 H ATOM 456 HB3 HIS A 31 1.619 10.490 12.024 1.00 99.99 H ATOM 457 HD1 HIS A 31 -0.758 8.803 11.556 1.00 99.99 H ATOM 458 HD2 HIS A 31 1.423 10.455 8.396 1.00 99.99 H ATOM 459 HE1 HIS A 31 -1.218 7.308 9.507 1.00 99.99 H ATOM 460 N GLU A 32 -0.595 13.204 13.977 1.00 1.00 N ATOM 461 CA GLU A 32 -0.242 14.188 14.986 1.00 1.00 C ATOM 462 C GLU A 32 0.534 13.524 16.125 1.00 1.00 C ATOM 463 O GLU A 32 1.180 14.205 16.920 1.00 1.00 O ATOM 464 CB GLU A 32 -1.488 14.902 15.514 1.00 1.00 C ATOM 465 CG GLU A 32 -1.124 16.252 16.135 1.00 1.00 C ATOM 466 CD GLU A 32 -1.431 16.266 17.635 1.00 1.00 C ATOM 467 OE1 GLU A 32 -2.338 15.554 18.088 1.00 1.00 O ATOM 468 OE2 GLU A 32 -0.686 17.052 18.336 1.00 1.00 O ATOM 469 H GLU A 32 -1.565 12.964 13.942 1.00 99.99 H ATOM 470 HA GLU A 32 0.394 14.911 14.477 1.00 99.99 H ATOM 471 HB2 GLU A 32 -2.198 15.051 14.702 1.00 99.99 H ATOM 472 HB3 GLU A 32 -1.982 14.277 16.259 1.00 99.99 H ATOM 473 HG2 GLU A 32 -0.066 16.457 15.976 1.00 99.99 H ATOM 474 HG3 GLU A 32 -1.681 17.046 15.639 1.00 99.99 H ATOM 475 HE2 GLU A 32 -0.539 17.912 17.846 1.00 99.99 H ATOM 476 N LYS A 33 0.447 12.203 16.167 1.00 1.00 N ATOM 477 CA LYS A 33 1.133 11.440 17.196 1.00 1.00 C ATOM 478 C LYS A 33 2.194 10.553 16.543 1.00 1.00 C ATOM 479 O LYS A 33 2.632 9.565 17.133 1.00 1.00 O ATOM 480 CB LYS A 33 0.126 10.667 18.051 1.00 1.00 C ATOM 481 CG LYS A 33 -0.507 11.575 19.107 1.00 1.00 C ATOM 482 CD LYS A 33 -1.596 10.833 19.885 1.00 1.00 C ATOM 483 CE LYS A 33 -2.078 11.661 21.078 1.00 1.00 C ATOM 484 NZ LYS A 33 -2.703 12.922 20.615 1.00 1.00 N ATOM 485 H LYS A 33 -0.080 11.656 15.516 1.00 99.99 H ATOM 486 HA LYS A 33 1.633 12.152 17.852 1.00 99.99 H ATOM 487 HB2 LYS A 33 -0.652 10.247 17.413 1.00 99.99 H ATOM 488 HB3 LYS A 33 0.624 9.828 18.538 1.00 99.99 H ATOM 489 HG2 LYS A 33 0.260 11.926 19.796 1.00 99.99 H ATOM 490 HG3 LYS A 33 -0.934 12.455 18.627 1.00 99.99 H ATOM 491 HD2 LYS A 33 -2.436 10.616 19.225 1.00 99.99 H ATOM 492 HD3 LYS A 33 -1.211 9.876 20.236 1.00 99.99 H ATOM 493 HE2 LYS A 33 -2.797 11.086 21.661 1.00 99.99 H ATOM 494 HE3 LYS A 33 -1.239 11.885 21.736 1.00 99.99 H ATOM 495 HZ1 LYS A 33 -2.198 13.738 20.941 1.00 99.99 H ATOM 496 HZ2 LYS A 33 -2.734 12.980 19.603 1.00 99.99 H ATOM 497 N GLY A 34 2.578 10.936 15.335 1.00 1.00 N ATOM 498 CA GLY A 34 3.581 10.187 14.595 1.00 1.00 C ATOM 499 C GLY A 34 2.931 9.105 13.730 1.00 1.00 C ATOM 500 O GLY A 34 1.738 8.823 13.825 1.00 1.00 O ATOM 501 H GLY A 34 2.217 11.740 14.862 1.00 99.99 H ATOM 502 HA2 GLY A 34 4.156 10.865 13.965 1.00 99.99 H ATOM 503 HA3 GLY A 34 4.283 9.728 15.292 1.00 99.99 H ATOM 504 N PRO A 35 3.753 8.499 12.872 1.00 1.00 N ATOM 505 CA PRO A 35 3.353 7.449 11.961 1.00 1.00 C ATOM 506 C PRO A 35 2.810 6.267 12.752 1.00 1.00 C ATOM 507 O PRO A 35 2.403 6.455 13.897 1.00 1.00 O ATOM 508 CB PRO A 35 4.630 7.069 11.215 1.00 1.00 C ATOM 509 CG PRO A 35 5.797 7.517 12.220 1.00 1.00 C ATOM 510 CD PRO A 35 5.160 8.807 12.733 1.00 1.00 C ATOM 511 HA PRO A 35 2.596 7.804 11.261 1.00 99.99 H ATOM 512 HB2 PRO A 35 4.692 5.998 11.019 1.00 99.99 H ATOM 513 HB3 PRO A 35 4.684 7.635 10.285 1.00 99.99 H ATOM 514 HG2 PRO A 35 5.953 6.836 13.057 1.00 99.99 H ATOM 515 HG3 PRO A 35 6.731 7.699 11.690 1.00 99.99 H ATOM 516 HD2 PRO A 35 5.601 9.106 13.685 1.00 99.99 H ATOM 517 HD3 PRO A 35 5.281 9.598 11.994 1.00 99.99 H ATOM 518 N GLY A 36 2.812 5.091 12.140 1.00 1.00 N ATOM 519 CA GLY A 36 2.314 3.900 12.807 1.00 1.00 C ATOM 520 C GLY A 36 0.785 3.856 12.780 1.00 1.00 C ATOM 521 O GLY A 36 0.143 4.751 12.232 1.00 1.00 O ATOM 522 H GLY A 36 3.144 4.946 11.208 1.00 99.99 H ATOM 523 HA2 GLY A 36 2.715 3.012 12.319 1.00 99.99 H ATOM 524 HA3 GLY A 36 2.665 3.883 13.839 1.00 99.99 H ATOM 525 N LYS A 37 0.245 2.805 13.379 1.00 1.00 N ATOM 526 CA LYS A 37 -1.196 2.632 13.432 1.00 1.00 C ATOM 527 C LYS A 37 -1.826 3.840 14.130 1.00 1.00 C ATOM 528 O LYS A 37 -1.320 4.304 15.150 1.00 1.00 O ATOM 529 CB LYS A 37 -1.553 1.293 14.080 1.00 1.00 C ATOM 530 CG LYS A 37 -1.701 0.194 13.024 1.00 1.00 C ATOM 531 CD LYS A 37 -2.762 0.569 11.989 1.00 1.00 C ATOM 532 CE LYS A 37 -3.392 -0.681 11.372 1.00 1.00 C ATOM 533 NZ LYS A 37 -4.233 -1.382 12.368 1.00 1.00 N ATOM 534 H LYS A 37 0.774 2.080 13.822 1.00 99.99 H ATOM 535 HA LYS A 37 -1.560 2.598 12.404 1.00 99.99 H ATOM 536 HB2 LYS A 37 -0.779 1.012 14.795 1.00 99.99 H ATOM 537 HB3 LYS A 37 -2.483 1.390 14.640 1.00 99.99 H ATOM 538 HG2 LYS A 37 -0.744 0.032 12.527 1.00 99.99 H ATOM 539 HG3 LYS A 37 -1.974 -0.744 13.507 1.00 99.99 H ATOM 540 HD2 LYS A 37 -3.536 1.177 12.459 1.00 99.99 H ATOM 541 HD3 LYS A 37 -2.311 1.178 11.204 1.00 99.99 H ATOM 542 HE2 LYS A 37 -3.995 -0.403 10.508 1.00 99.99 H ATOM 543 HE3 LYS A 37 -2.610 -1.350 11.013 1.00 99.99 H ATOM 544 HZ1 LYS A 37 -5.222 -1.296 12.157 1.00 99.99 H ATOM 545 HZ2 LYS A 37 -4.027 -2.375 12.408 1.00 99.99 H ATOM 546 N ILE A 38 -2.920 4.313 13.551 1.00 1.00 N ATOM 547 CA ILE A 38 -3.623 5.458 14.105 1.00 1.00 C ATOM 548 C ILE A 38 -4.455 5.006 15.307 1.00 1.00 C ATOM 549 O ILE A 38 -5.145 3.990 15.242 1.00 1.00 O ATOM 550 CB ILE A 38 -4.441 6.161 13.020 1.00 1.00 C ATOM 551 CG1 ILE A 38 -3.529 6.901 12.039 1.00 1.00 C ATOM 552 CG2 ILE A 38 -5.489 7.087 13.637 1.00 1.00 C ATOM 553 CD1 ILE A 38 -4.327 7.887 11.185 1.00 1.00 C ATOM 554 H ILE A 38 -3.325 3.930 12.721 1.00 99.99 H ATOM 555 HA ILE A 38 -2.871 6.167 14.452 1.00 99.99 H ATOM 556 HB ILE A 38 -4.977 5.401 12.451 1.00 99.99 H ATOM 557 HG12 ILE A 38 -2.754 7.434 12.589 1.00 99.99 H ATOM 558 HG23 ILE A 38 -6.100 7.523 12.846 1.00 99.99 H ATOM 559 HD11 ILE A 38 -5.177 7.373 10.737 1.00 99.99 H ATOM 560 N GLU A 39 -4.364 5.784 16.375 1.00 1.00 N ATOM 561 CA GLU A 39 -5.101 5.478 17.590 1.00 1.00 C ATOM 562 C GLU A 39 -6.432 4.807 17.248 1.00 1.00 C ATOM 563 O GLU A 39 -7.432 5.486 17.019 1.00 1.00 O ATOM 564 CB GLU A 39 -5.320 6.737 18.431 1.00 1.00 C ATOM 565 CG GLU A 39 -6.085 6.412 19.715 1.00 1.00 C ATOM 566 CD GLU A 39 -6.581 7.689 20.396 1.00 1.00 C ATOM 567 OE1 GLU A 39 -7.277 8.499 19.765 1.00 1.00 O ATOM 568 OE2 GLU A 39 -6.218 7.827 21.627 1.00 1.00 O ATOM 569 H GLU A 39 -3.801 6.610 16.420 1.00 99.99 H ATOM 570 HA GLU A 39 -4.469 4.783 18.144 1.00 99.99 H ATOM 571 HB2 GLU A 39 -4.358 7.184 18.680 1.00 99.99 H ATOM 572 HB3 GLU A 39 -5.873 7.474 17.850 1.00 99.99 H ATOM 573 HG2 GLU A 39 -6.933 5.766 19.484 1.00 99.99 H ATOM 574 HG3 GLU A 39 -5.440 5.858 20.398 1.00 99.99 H ATOM 575 HE2 GLU A 39 -6.241 6.941 22.091 1.00 99.99 H ATOM 576 N GLY A 40 -6.404 3.483 17.224 1.00 1.00 N ATOM 577 CA GLY A 40 -7.597 2.714 16.914 1.00 1.00 C ATOM 578 C GLY A 40 -8.499 3.471 15.938 1.00 1.00 C ATOM 579 O GLY A 40 -9.407 4.189 16.355 1.00 1.00 O ATOM 580 H GLY A 40 -5.587 2.939 17.412 1.00 99.99 H ATOM 581 HA2 GLY A 40 -7.313 1.754 16.483 1.00 99.99 H ATOM 582 HA3 GLY A 40 -8.146 2.501 17.833 1.00 99.99 H ATOM 583 N PHE A 41 -8.218 3.285 14.656 1.00 1.00 N ATOM 584 CA PHE A 41 -8.993 3.942 13.617 1.00 1.00 C ATOM 585 C PHE A 41 -10.455 3.494 13.659 1.00 1.00 C ATOM 586 O PHE A 41 -10.741 2.299 13.723 1.00 1.00 O ATOM 587 CB PHE A 41 -8.383 3.529 12.276 1.00 1.00 C ATOM 588 CG PHE A 41 -9.005 4.231 11.067 1.00 1.00 C ATOM 589 CD1 PHE A 41 -10.312 4.019 10.757 1.00 1.00 C ATOM 590 CD2 PHE A 41 -8.252 5.066 10.303 1.00 1.00 C ATOM 591 CE1 PHE A 41 -10.890 4.669 9.635 1.00 1.00 C ATOM 592 CE2 PHE A 41 -8.829 5.717 9.181 1.00 1.00 C ATOM 593 CZ PHE A 41 -10.136 5.505 8.870 1.00 1.00 C ATOM 594 H PHE A 41 -7.478 2.700 14.326 1.00 99.99 H ATOM 595 HA PHE A 41 -8.937 5.015 13.802 1.00 99.99 H ATOM 596 HB2 PHE A 41 -7.313 3.740 12.295 1.00 99.99 H ATOM 597 HB3 PHE A 41 -8.493 2.452 12.155 1.00 99.99 H ATOM 598 HD1 PHE A 41 -10.915 3.349 11.369 1.00 99.99 H ATOM 599 HD2 PHE A 41 -7.203 5.236 10.552 1.00 99.99 H ATOM 600 HE1 PHE A 41 -11.937 4.500 9.386 1.00 99.99 H ATOM 601 HE2 PHE A 41 -8.225 6.386 8.568 1.00 99.99 H ATOM 602 HZ PHE A 41 -10.580 6.004 8.009 1.00 99.99 H ATOM 603 N GLY A 42 -11.342 4.477 13.619 1.00 1.00 N ATOM 604 CA GLY A 42 -12.769 4.199 13.651 1.00 1.00 C ATOM 605 C GLY A 42 -13.444 4.647 12.352 1.00 1.00 C ATOM 606 O GLY A 42 -12.849 5.375 11.558 1.00 1.00 O ATOM 607 H GLY A 42 -11.102 5.446 13.566 1.00 99.99 H ATOM 608 HA2 GLY A 42 -12.931 3.131 13.800 1.00 99.99 H ATOM 609 HA3 GLY A 42 -13.224 4.712 14.497 1.00 99.99 H ATOM 610 N LYS A 43 -14.676 4.193 12.176 1.00 1.00 N ATOM 611 CA LYS A 43 -15.437 4.538 10.988 1.00 1.00 C ATOM 612 C LYS A 43 -15.839 6.013 11.056 1.00 1.00 C ATOM 613 O LYS A 43 -15.644 6.757 10.096 1.00 1.00 O ATOM 614 CB LYS A 43 -16.622 3.585 10.816 1.00 1.00 C ATOM 615 CG LYS A 43 -16.207 2.139 11.091 1.00 1.00 C ATOM 616 CD LYS A 43 -15.364 1.583 9.942 1.00 1.00 C ATOM 617 CE LYS A 43 -13.872 1.807 10.198 1.00 1.00 C ATOM 618 NZ LYS A 43 -13.349 0.790 11.138 1.00 1.00 N ATOM 619 H LYS A 43 -15.152 3.602 12.828 1.00 99.99 H ATOM 620 HA LYS A 43 -14.783 4.397 10.129 1.00 99.99 H ATOM 621 HB2 LYS A 43 -17.426 3.872 11.494 1.00 99.99 H ATOM 622 HB3 LYS A 43 -17.016 3.669 9.803 1.00 99.99 H ATOM 623 HG2 LYS A 43 -15.639 2.090 12.020 1.00 99.99 H ATOM 624 HG3 LYS A 43 -17.095 1.521 11.227 1.00 99.99 H ATOM 625 HD2 LYS A 43 -15.560 0.518 9.824 1.00 99.99 H ATOM 626 HD3 LYS A 43 -15.652 2.065 9.008 1.00 99.99 H ATOM 627 HE2 LYS A 43 -13.324 1.757 9.258 1.00 99.99 H ATOM 628 HE3 LYS A 43 -13.713 2.804 10.608 1.00 99.99 H ATOM 629 HZ1 LYS A 43 -13.772 0.868 12.057 1.00 99.99 H ATOM 630 HZ2 LYS A 43 -13.527 -0.154 10.813 1.00 99.99 H ATOM 631 N GLU A 44 -16.393 6.391 12.199 1.00 1.00 N ATOM 632 CA GLU A 44 -16.824 7.763 12.403 1.00 1.00 C ATOM 633 C GLU A 44 -15.674 8.730 12.115 1.00 1.00 C ATOM 634 O GLU A 44 -15.875 9.774 11.497 1.00 1.00 O ATOM 635 CB GLU A 44 -17.364 7.963 13.821 1.00 1.00 C ATOM 636 CG GLU A 44 -17.717 9.431 14.071 1.00 1.00 C ATOM 637 CD GLU A 44 -18.569 9.992 12.932 1.00 1.00 C ATOM 638 OE1 GLU A 44 -18.038 10.658 12.031 1.00 1.00 O ATOM 639 OE2 GLU A 44 -19.826 9.714 13.002 1.00 1.00 O ATOM 640 H GLU A 44 -16.547 5.779 12.974 1.00 99.99 H ATOM 641 HA GLU A 44 -17.630 7.924 11.688 1.00 99.99 H ATOM 642 HB2 GLU A 44 -18.248 7.343 13.967 1.00 99.99 H ATOM 643 HB3 GLU A 44 -16.620 7.634 14.546 1.00 99.99 H ATOM 644 HG2 GLU A 44 -18.257 9.522 15.014 1.00 99.99 H ATOM 645 HG3 GLU A 44 -16.803 10.016 14.170 1.00 99.99 H ATOM 646 HE2 GLU A 44 -19.975 8.746 12.801 1.00 99.99 H ATOM 647 N MET A 45 -14.491 8.346 12.575 1.00 1.00 N ATOM 648 CA MET A 45 -13.308 9.166 12.373 1.00 1.00 C ATOM 649 C MET A 45 -13.123 9.508 10.894 1.00 1.00 C ATOM 650 O MET A 45 -12.811 10.647 10.551 1.00 1.00 O ATOM 651 CB MET A 45 -12.076 8.417 12.883 1.00 1.00 C ATOM 652 CG MET A 45 -11.187 9.331 13.727 1.00 1.00 C ATOM 653 SD MET A 45 -11.405 8.964 15.461 1.00 1.00 S ATOM 654 CE MET A 45 -11.739 10.603 16.085 1.00 1.00 C ATOM 655 H MET A 45 -14.336 7.496 13.076 1.00 99.99 H ATOM 656 HA MET A 45 -13.482 10.077 12.945 1.00 99.99 H ATOM 657 HB2 MET A 45 -12.387 7.557 13.476 1.00 99.99 H ATOM 658 HB3 MET A 45 -11.505 8.030 12.037 1.00 99.99 H ATOM 659 HG2 MET A 45 -10.142 9.198 13.448 1.00 99.99 H ATOM 660 HG3 MET A 45 -11.437 10.374 13.534 1.00 99.99 H ATOM 661 HE1 MET A 45 -10.960 11.286 15.747 1.00 99.99 H ATOM 662 HE2 MET A 45 -12.707 10.943 15.715 1.00 99.99 H ATOM 663 HE3 MET A 45 -11.755 10.581 17.175 1.00 99.99 H ATOM 664 N ALA A 46 -13.324 8.501 10.057 1.00 1.00 N ATOM 665 CA ALA A 46 -13.183 8.681 8.622 1.00 1.00 C ATOM 666 C ALA A 46 -14.021 9.881 8.179 1.00 1.00 C ATOM 667 O ALA A 46 -13.485 10.894 7.733 1.00 1.00 O ATOM 668 CB ALA A 46 -13.586 7.390 7.904 1.00 1.00 C ATOM 669 H ALA A 46 -13.578 7.577 10.345 1.00 99.99 H ATOM 670 HA ALA A 46 -12.132 8.884 8.415 1.00 99.99 H ATOM 671 HB1 ALA A 46 -14.667 7.373 7.768 1.00 99.99 H ATOM 672 HB2 ALA A 46 -13.096 7.349 6.931 1.00 99.99 H ATOM 673 HB3 ALA A 46 -13.282 6.532 8.502 1.00 99.99 H ATOM 674 N HIS A 47 -15.339 9.730 8.316 1.00 1.00 N ATOM 675 CA HIS A 47 -16.297 10.765 7.946 1.00 1.00 C ATOM 676 C HIS A 47 -16.082 12.011 8.825 1.00 1.00 C ATOM 677 O HIS A 47 -16.628 13.075 8.536 1.00 1.00 O ATOM 678 CB HIS A 47 -17.715 10.180 8.017 1.00 1.00 C ATOM 679 CG HIS A 47 -17.931 8.842 7.348 1.00 1.00 C ATOM 680 ND1 HIS A 47 -18.581 7.837 7.943 1.00 1.00 N ATOM 681 CD2 HIS A 47 -17.561 8.379 6.109 1.00 1.00 C ATOM 682 CE1 HIS A 47 -18.613 6.787 7.107 1.00 1.00 C ATOM 683 NE2 HIS A 47 -17.998 7.068 5.959 1.00 1.00 N ATOM 684 H HIS A 47 -15.690 8.861 8.692 1.00 99.99 H ATOM 685 HA HIS A 47 -16.099 11.056 6.890 1.00 99.99 H ATOM 686 HB2 HIS A 47 -17.983 10.065 9.094 1.00 99.99 H ATOM 687 HB3 HIS A 47 -18.411 10.910 7.544 1.00 99.99 H ATOM 688 HD1 HIS A 47 -18.977 7.884 8.879 1.00 99.99 H ATOM 689 HD2 HIS A 47 -17.005 8.955 5.353 1.00 99.99 H ATOM 690 HE1 HIS A 47 -19.087 5.820 7.339 1.00 99.99 H ATOM 691 N GLY A 48 -15.290 11.836 9.872 1.00 1.00 N ATOM 692 CA GLY A 48 -15.000 12.930 10.784 1.00 1.00 C ATOM 693 C GLY A 48 -14.043 13.938 10.146 1.00 1.00 C ATOM 694 O GLY A 48 -14.297 14.433 9.049 1.00 1.00 O ATOM 695 H GLY A 48 -14.848 10.968 10.102 1.00 99.99 H ATOM 696 HA2 GLY A 48 -15.928 13.430 11.063 1.00 99.99 H ATOM 697 HA3 GLY A 48 -14.563 12.538 11.702 1.00 99.99 H ATOM 698 N LYS A 49 -12.961 14.213 10.861 1.00 1.00 N ATOM 699 CA LYS A 49 -11.964 15.153 10.377 1.00 1.00 C ATOM 700 C LYS A 49 -10.650 14.411 10.124 1.00 1.00 C ATOM 701 O LYS A 49 -9.583 14.881 10.514 1.00 1.00 O ATOM 702 CB LYS A 49 -11.828 16.333 11.342 1.00 1.00 C ATOM 703 CG LYS A 49 -11.191 17.538 10.647 1.00 1.00 C ATOM 704 CD LYS A 49 -10.899 18.656 11.650 1.00 1.00 C ATOM 705 CE LYS A 49 -9.623 18.364 12.442 1.00 1.00 C ATOM 706 NZ LYS A 49 -9.520 19.265 13.611 1.00 1.00 N ATOM 707 H LYS A 49 -12.762 13.806 11.752 1.00 99.99 H ATOM 708 HA LYS A 49 -12.324 15.552 9.429 1.00 99.99 H ATOM 709 HB2 LYS A 49 -12.811 16.608 11.726 1.00 99.99 H ATOM 710 HB3 LYS A 49 -11.222 16.039 12.198 1.00 99.99 H ATOM 711 HG2 LYS A 49 -10.266 17.233 10.158 1.00 99.99 H ATOM 712 HG3 LYS A 49 -11.857 17.908 9.868 1.00 99.99 H ATOM 713 HD2 LYS A 49 -10.793 19.604 11.122 1.00 99.99 H ATOM 714 HD3 LYS A 49 -11.739 18.766 12.335 1.00 99.99 H ATOM 715 HE2 LYS A 49 -9.625 17.325 12.775 1.00 99.99 H ATOM 716 HE3 LYS A 49 -8.752 18.491 11.800 1.00 99.99 H ATOM 717 HZ1 LYS A 49 -10.405 19.709 13.827 1.00 99.99 H ATOM 718 HZ2 LYS A 49 -9.226 18.771 14.447 1.00 99.99 H ATOM 719 N GLY A 50 -10.772 13.264 9.472 1.00 1.00 N ATOM 720 CA GLY A 50 -9.606 12.452 9.164 1.00 1.00 C ATOM 721 C GLY A 50 -9.830 11.636 7.889 1.00 1.00 C ATOM 722 O GLY A 50 -9.368 10.501 7.785 1.00 1.00 O ATOM 723 H GLY A 50 -11.644 12.888 9.159 1.00 99.99 H ATOM 724 HA2 GLY A 50 -8.734 13.094 9.040 1.00 99.99 H ATOM 725 HA3 GLY A 50 -9.395 11.782 9.996 1.00 99.99 H ATOM 726 N CYS A 51 -10.540 12.247 6.950 1.00 1.00 N ATOM 727 CA CYS A 51 -10.830 11.590 5.687 1.00 1.00 C ATOM 728 C CYS A 51 -11.656 12.549 4.826 1.00 1.00 C ATOM 729 O CYS A 51 -11.167 13.067 3.824 1.00 1.00 O ATOM 730 CB CYS A 51 -11.542 10.252 5.894 1.00 1.00 C ATOM 731 SG CYS A 51 -11.094 8.949 4.690 1.00 1.00 S ATOM 732 H CYS A 51 -10.911 13.169 7.042 1.00 99.99 H ATOM 733 HA CYS A 51 -9.870 11.378 5.215 1.00 99.99 H ATOM 734 HB2 CYS A 51 -11.319 9.891 6.898 1.00 99.99 H ATOM 735 HB3 CYS A 51 -12.618 10.417 5.846 1.00 99.99 H ATOM 736 N LYS A 52 -12.895 12.754 5.250 1.00 1.00 N ATOM 737 CA LYS A 52 -13.794 13.641 4.531 1.00 1.00 C ATOM 738 C LYS A 52 -13.668 15.057 5.098 1.00 1.00 C ATOM 739 O LYS A 52 -13.385 16.001 4.362 1.00 1.00 O ATOM 740 CB LYS A 52 -15.222 13.093 4.558 1.00 1.00 C ATOM 741 CG LYS A 52 -16.118 13.851 3.578 1.00 1.00 C ATOM 742 CD LYS A 52 -16.934 14.926 4.301 1.00 1.00 C ATOM 743 CE LYS A 52 -18.410 14.852 3.905 1.00 1.00 C ATOM 744 NZ LYS A 52 -19.024 13.611 4.427 1.00 1.00 N ATOM 745 H LYS A 52 -13.284 12.329 6.066 1.00 99.99 H ATOM 746 HA LYS A 52 -13.473 13.657 3.489 1.00 99.99 H ATOM 747 HB2 LYS A 52 -15.213 12.033 4.303 1.00 99.99 H ATOM 748 HB3 LYS A 52 -15.628 13.174 5.566 1.00 99.99 H ATOM 749 HG2 LYS A 52 -15.507 14.314 2.802 1.00 99.99 H ATOM 750 HG3 LYS A 52 -16.791 13.154 3.079 1.00 99.99 H ATOM 751 HD2 LYS A 52 -16.835 14.799 5.378 1.00 99.99 H ATOM 752 HD3 LYS A 52 -16.538 15.912 4.058 1.00 99.99 H ATOM 753 HE2 LYS A 52 -18.942 15.720 4.296 1.00 99.99 H ATOM 754 HE3 LYS A 52 -18.505 14.883 2.819 1.00 99.99 H ATOM 755 HZ1 LYS A 52 -19.988 13.753 4.707 1.00 99.99 H ATOM 756 HZ2 LYS A 52 -19.026 12.868 3.736 1.00 99.99 H ATOM 757 N GLY A 53 -13.884 15.159 6.401 1.00 1.00 N ATOM 758 CA GLY A 53 -13.797 16.444 7.075 1.00 1.00 C ATOM 759 C GLY A 53 -12.720 17.326 6.441 1.00 1.00 C ATOM 760 O GLY A 53 -12.922 18.525 6.261 1.00 1.00 O ATOM 761 H GLY A 53 -14.113 14.387 6.993 1.00 99.99 H ATOM 762 HA2 GLY A 53 -14.763 16.949 7.026 1.00 99.99 H ATOM 763 HA3 GLY A 53 -13.572 16.290 8.130 1.00 99.99 H ATOM 764 N CYS A 54 -11.599 16.696 6.120 1.00 1.00 N ATOM 765 CA CYS A 54 -10.490 17.408 5.509 1.00 1.00 C ATOM 766 C CYS A 54 -11.006 18.117 4.255 1.00 1.00 C ATOM 767 O CYS A 54 -11.232 19.325 4.262 1.00 1.00 O ATOM 768 CB CYS A 54 -9.321 16.472 5.195 1.00 1.00 C ATOM 769 SG CYS A 54 -7.805 17.059 6.035 1.00 1.00 S ATOM 770 H CYS A 54 -11.444 15.719 6.270 1.00 99.99 H ATOM 771 HA CYS A 54 -10.139 18.130 6.245 1.00 99.99 H ATOM 772 HB2 CYS A 54 -9.558 15.459 5.520 1.00 99.99 H ATOM 773 HB3 CYS A 54 -9.157 16.430 4.118 1.00 99.99 H ATOM 774 N HIS A 55 -11.182 17.329 3.194 1.00 1.00 N ATOM 775 CA HIS A 55 -11.666 17.825 1.911 1.00 1.00 C ATOM 776 C HIS A 55 -12.745 18.899 2.142 1.00 1.00 C ATOM 777 O HIS A 55 -12.684 19.974 1.547 1.00 1.00 O ATOM 778 CB HIS A 55 -12.133 16.633 1.062 1.00 1.00 C ATOM 779 CG HIS A 55 -11.257 15.401 1.079 1.00 1.00 C ATOM 780 ND1 HIS A 55 -11.700 14.209 1.489 1.00 1.00 N ATOM 781 CD2 HIS A 55 -9.944 15.219 0.719 1.00 1.00 C ATOM 782 CE1 HIS A 55 -10.701 13.319 1.390 1.00 1.00 C ATOM 783 NE2 HIS A 55 -9.593 13.889 0.919 1.00 1.00 N ATOM 784 H HIS A 55 -10.970 16.345 3.281 1.00 99.99 H ATOM 785 HA HIS A 55 -10.812 18.307 1.384 1.00 99.99 H ATOM 786 HB2 HIS A 55 -13.144 16.332 1.423 1.00 99.99 H ATOM 787 HB3 HIS A 55 -12.211 16.976 0.005 1.00 99.99 H ATOM 788 HD1 HIS A 55 -12.646 14.032 1.821 1.00 99.99 H ATOM 789 HD2 HIS A 55 -9.274 16.004 0.333 1.00 99.99 H ATOM 790 HE1 HIS A 55 -10.786 12.255 1.663 1.00 99.99 H ATOM 791 N GLU A 56 -13.696 18.570 3.003 1.00 1.00 N ATOM 792 CA GLU A 56 -14.776 19.493 3.313 1.00 1.00 C ATOM 793 C GLU A 56 -14.216 20.888 3.596 1.00 1.00 C ATOM 794 O GLU A 56 -14.794 21.890 3.179 1.00 1.00 O ATOM 795 CB GLU A 56 -15.607 18.986 4.493 1.00 1.00 C ATOM 796 CG GLU A 56 -16.358 20.136 5.169 1.00 1.00 C ATOM 797 CD GLU A 56 -17.296 20.833 4.182 1.00 1.00 C ATOM 798 OE1 GLU A 56 -18.178 20.184 3.600 1.00 1.00 O ATOM 799 OE2 GLU A 56 -17.085 22.096 4.029 1.00 1.00 O ATOM 800 H GLU A 56 -13.739 17.694 3.483 1.00 99.99 H ATOM 801 HA GLU A 56 -15.401 19.519 2.421 1.00 99.99 H ATOM 802 HB2 GLU A 56 -16.319 18.237 4.145 1.00 99.99 H ATOM 803 HB3 GLU A 56 -14.958 18.496 5.217 1.00 99.99 H ATOM 804 HG2 GLU A 56 -16.932 19.754 6.013 1.00 99.99 H ATOM 805 HG3 GLU A 56 -15.644 20.855 5.569 1.00 99.99 H ATOM 806 HE2 GLU A 56 -16.115 22.299 4.164 1.00 99.99 H ATOM 807 N GLU A 57 -13.096 20.909 4.305 1.00 1.00 N ATOM 808 CA GLU A 57 -12.452 22.165 4.649 1.00 1.00 C ATOM 809 C GLU A 57 -11.351 22.492 3.638 1.00 1.00 C ATOM 810 O GLU A 57 -11.250 23.624 3.169 1.00 1.00 O ATOM 811 CB GLU A 57 -11.893 22.123 6.073 1.00 1.00 C ATOM 812 CG GLU A 57 -12.348 23.342 6.877 1.00 1.00 C ATOM 813 CD GLU A 57 -11.471 23.541 8.115 1.00 1.00 C ATOM 814 OE1 GLU A 57 -11.089 22.559 8.769 1.00 1.00 O ATOM 815 OE2 GLU A 57 -11.185 24.768 8.390 1.00 1.00 O ATOM 816 H GLU A 57 -12.632 20.089 4.641 1.00 99.99 H ATOM 817 HA GLU A 57 -13.238 22.918 4.596 1.00 99.99 H ATOM 818 HB2 GLU A 57 -12.224 21.211 6.571 1.00 99.99 H ATOM 819 HB3 GLU A 57 -10.803 22.090 6.040 1.00 99.99 H ATOM 820 HG2 GLU A 57 -12.305 24.233 6.250 1.00 99.99 H ATOM 821 HG3 GLU A 57 -13.387 23.216 7.180 1.00 99.99 H ATOM 822 HE2 GLU A 57 -10.202 24.866 8.541 1.00 99.99 H ATOM 823 N MET A 58 -10.553 21.479 3.332 1.00 1.00 N ATOM 824 CA MET A 58 -9.464 21.644 2.385 1.00 1.00 C ATOM 825 C MET A 58 -9.986 22.110 1.024 1.00 1.00 C ATOM 826 O MET A 58 -9.213 22.555 0.177 1.00 1.00 O ATOM 827 CB MET A 58 -8.724 20.315 2.221 1.00 1.00 C ATOM 828 CG MET A 58 -7.225 20.543 2.013 1.00 1.00 C ATOM 829 SD MET A 58 -6.301 19.750 3.318 1.00 1.00 S ATOM 830 CE MET A 58 -6.721 20.816 4.687 1.00 1.00 C ATOM 831 H MET A 58 -10.642 20.561 3.718 1.00 99.99 H ATOM 832 HA MET A 58 -8.816 22.408 2.814 1.00 99.99 H ATOM 833 HB2 MET A 58 -8.882 19.695 3.102 1.00 99.99 H ATOM 834 HB3 MET A 58 -9.134 19.769 1.370 1.00 99.99 H ATOM 835 HG2 MET A 58 -6.919 20.146 1.046 1.00 99.99 H ATOM 836 HG3 MET A 58 -7.011 21.611 2.001 1.00 99.99 H ATOM 837 HE1 MET A 58 -6.114 20.551 5.553 1.00 99.99 H ATOM 838 HE2 MET A 58 -6.530 21.853 4.413 1.00 99.99 H ATOM 839 HE3 MET A 58 -7.776 20.693 4.933 1.00 99.99 H ATOM 840 N LYS A 59 -11.296 21.991 0.856 1.00 1.00 N ATOM 841 CA LYS A 59 -11.930 22.394 -0.387 1.00 1.00 C ATOM 842 C LYS A 59 -11.212 21.725 -1.561 1.00 1.00 C ATOM 843 O LYS A 59 -11.055 22.327 -2.622 1.00 1.00 O ATOM 844 CB LYS A 59 -11.986 23.920 -0.490 1.00 1.00 C ATOM 845 CG LYS A 59 -12.889 24.358 -1.644 1.00 1.00 C ATOM 846 CD LYS A 59 -14.259 24.805 -1.130 1.00 1.00 C ATOM 847 CE LYS A 59 -15.310 23.715 -1.354 1.00 1.00 C ATOM 848 NZ LYS A 59 -16.666 24.238 -1.072 1.00 1.00 N ATOM 849 H LYS A 59 -11.917 21.628 1.550 1.00 99.99 H ATOM 850 HA LYS A 59 -12.958 22.034 -0.360 1.00 99.99 H ATOM 851 HB2 LYS A 59 -12.357 24.337 0.446 1.00 99.99 H ATOM 852 HB3 LYS A 59 -10.982 24.315 -0.638 1.00 99.99 H ATOM 853 HG2 LYS A 59 -12.417 25.177 -2.189 1.00 99.99 H ATOM 854 HG3 LYS A 59 -13.011 23.536 -2.348 1.00 99.99 H ATOM 855 HD2 LYS A 59 -14.194 25.039 -0.067 1.00 99.99 H ATOM 856 HD3 LYS A 59 -14.563 25.718 -1.640 1.00 99.99 H ATOM 857 HE2 LYS A 59 -15.257 23.358 -2.383 1.00 99.99 H ATOM 858 HE3 LYS A 59 -15.102 22.862 -0.709 1.00 99.99 H ATOM 859 HZ1 LYS A 59 -16.770 25.202 -1.366 1.00 99.99 H ATOM 860 HZ2 LYS A 59 -17.385 23.706 -1.551 1.00 99.99 H ATOM 861 N LYS A 60 -10.796 20.488 -1.332 1.00 1.00 N ATOM 862 CA LYS A 60 -10.099 19.731 -2.357 1.00 1.00 C ATOM 863 C LYS A 60 -10.258 18.234 -2.077 1.00 1.00 C ATOM 864 O LYS A 60 -9.973 17.773 -0.974 1.00 1.00 O ATOM 865 CB LYS A 60 -8.642 20.185 -2.462 1.00 1.00 C ATOM 866 CG LYS A 60 -8.030 20.388 -1.074 1.00 1.00 C ATOM 867 CD LYS A 60 -7.116 21.615 -1.051 1.00 1.00 C ATOM 868 CE LYS A 60 -5.777 21.313 -1.725 1.00 1.00 C ATOM 869 NZ LYS A 60 -4.872 22.480 -1.625 1.00 1.00 N ATOM 870 H LYS A 60 -10.928 20.005 -0.466 1.00 99.99 H ATOM 871 HA LYS A 60 -10.576 19.956 -3.311 1.00 99.99 H ATOM 872 HB2 LYS A 60 -8.064 19.443 -3.013 1.00 99.99 H ATOM 873 HB3 LYS A 60 -8.587 21.116 -3.027 1.00 99.99 H ATOM 874 HG2 LYS A 60 -8.824 20.507 -0.337 1.00 99.99 H ATOM 875 HG3 LYS A 60 -7.462 19.501 -0.790 1.00 99.99 H ATOM 876 HD2 LYS A 60 -7.605 22.446 -1.560 1.00 99.99 H ATOM 877 HD3 LYS A 60 -6.947 21.928 -0.021 1.00 99.99 H ATOM 878 HE2 LYS A 60 -5.313 20.446 -1.255 1.00 99.99 H ATOM 879 HE3 LYS A 60 -5.938 21.059 -2.773 1.00 99.99 H ATOM 880 HZ1 LYS A 60 -3.955 22.285 -2.015 1.00 99.99 H ATOM 881 HZ2 LYS A 60 -5.236 23.286 -2.121 1.00 99.99 H ATOM 882 N GLY A 61 -10.714 17.520 -3.096 1.00 1.00 N ATOM 883 CA GLY A 61 -10.915 16.086 -2.973 1.00 1.00 C ATOM 884 C GLY A 61 -12.385 15.719 -3.176 1.00 1.00 C ATOM 885 O GLY A 61 -13.258 16.574 -3.316 1.00 1.00 O ATOM 886 H GLY A 61 -10.942 17.904 -3.991 1.00 99.99 H ATOM 887 HA2 GLY A 61 -10.301 15.565 -3.709 1.00 99.99 H ATOM 888 HA3 GLY A 61 -10.584 15.752 -1.990 1.00 99.99 H ATOM 889 N PRO A 62 -12.643 14.410 -3.189 1.00 1.00 N ATOM 890 CA PRO A 62 -13.962 13.839 -3.364 1.00 1.00 C ATOM 891 C PRO A 62 -14.648 13.712 -2.011 1.00 1.00 C ATOM 892 O PRO A 62 -13.975 13.392 -1.032 1.00 1.00 O ATOM 893 CB PRO A 62 -13.716 12.465 -3.984 1.00 1.00 C ATOM 894 CG PRO A 62 -12.139 12.210 -3.877 1.00 1.00 C ATOM 895 CD PRO A 62 -11.642 13.377 -3.027 1.00 1.00 C ATOM 896 HA PRO A 62 -14.569 14.453 -4.029 1.00 99.99 H ATOM 897 HB2 PRO A 62 -14.287 11.680 -3.490 1.00 99.99 H ATOM 898 HB3 PRO A 62 -13.951 12.504 -5.047 1.00 99.99 H ATOM 899 HG2 PRO A 62 -12.231 11.324 -3.248 1.00 99.99 H ATOM 900 HG3 PRO A 62 -11.489 12.013 -4.729 1.00 99.99 H ATOM 901 HD2 PRO A 62 -11.535 13.082 -1.983 1.00 99.99 H ATOM 902 HD3 PRO A 62 -10.691 13.740 -3.417 1.00 99.99 H ATOM 903 N THR A 63 -15.947 13.963 -1.978 1.00 1.00 N ATOM 904 CA THR A 63 -16.697 13.872 -0.737 1.00 1.00 C ATOM 905 C THR A 63 -17.790 12.808 -0.850 1.00 1.00 C ATOM 906 O THR A 63 -18.197 12.221 0.152 1.00 1.00 O ATOM 907 CB THR A 63 -17.237 15.265 -0.407 1.00 1.00 C ATOM 908 OG1 THR A 63 -17.977 15.634 -1.566 1.00 1.00 O ATOM 909 CG2 THR A 63 -16.129 16.317 -0.321 1.00 1.00 C ATOM 910 H THR A 63 -16.488 14.224 -2.779 1.00 99.99 H ATOM 911 HA THR A 63 -16.017 13.549 0.052 1.00 99.99 H ATOM 912 HB THR A 63 -17.827 15.246 0.509 1.00 99.99 H ATOM 913 HG1 THR A 63 -18.816 15.093 -1.624 1.00 99.99 H ATOM 914 HG21 THR A 63 -16.413 17.086 0.397 1.00 99.99 H ATOM 915 N LYS A 64 -18.235 12.591 -2.078 1.00 1.00 N ATOM 916 CA LYS A 64 -19.274 11.608 -2.336 1.00 1.00 C ATOM 917 C LYS A 64 -18.790 10.230 -1.878 1.00 1.00 C ATOM 918 O LYS A 64 -17.588 10.002 -1.745 1.00 1.00 O ATOM 919 CB LYS A 64 -19.701 11.652 -3.804 1.00 1.00 C ATOM 920 CG LYS A 64 -20.531 12.904 -4.096 1.00 1.00 C ATOM 921 CD LYS A 64 -19.934 13.700 -5.257 1.00 1.00 C ATOM 922 CE LYS A 64 -21.018 14.112 -6.255 1.00 1.00 C ATOM 923 NZ LYS A 64 -20.898 15.549 -6.589 1.00 1.00 N ATOM 924 H LYS A 64 -17.899 13.072 -2.888 1.00 99.99 H ATOM 925 HA LYS A 64 -20.142 11.886 -1.739 1.00 99.99 H ATOM 926 HB2 LYS A 64 -18.819 11.638 -4.445 1.00 99.99 H ATOM 927 HB3 LYS A 64 -20.282 10.762 -4.044 1.00 99.99 H ATOM 928 HG2 LYS A 64 -21.556 12.618 -4.336 1.00 99.99 H ATOM 929 HG3 LYS A 64 -20.576 13.531 -3.206 1.00 99.99 H ATOM 930 HD2 LYS A 64 -19.432 14.588 -4.874 1.00 99.99 H ATOM 931 HD3 LYS A 64 -19.178 13.100 -5.764 1.00 99.99 H ATOM 932 HE2 LYS A 64 -20.931 13.513 -7.163 1.00 99.99 H ATOM 933 HE3 LYS A 64 -22.003 13.911 -5.835 1.00 99.99 H ATOM 934 HZ1 LYS A 64 -21.679 15.877 -7.145 1.00 99.99 H ATOM 935 HZ2 LYS A 64 -20.866 16.129 -5.757 1.00 99.99 H ATOM 936 N CYS A 65 -19.752 9.347 -1.649 1.00 1.00 N ATOM 937 CA CYS A 65 -19.439 7.998 -1.208 1.00 1.00 C ATOM 938 C CYS A 65 -18.828 7.238 -2.386 1.00 1.00 C ATOM 939 O CYS A 65 -17.673 6.816 -2.325 1.00 1.00 O ATOM 940 CB CYS A 65 -20.672 7.287 -0.648 1.00 1.00 C ATOM 941 SG CYS A 65 -22.013 8.400 -0.089 1.00 1.00 S ATOM 942 H CYS A 65 -20.726 9.541 -1.759 1.00 99.99 H ATOM 943 HA CYS A 65 -18.721 8.094 -0.394 1.00 99.99 H ATOM 944 HB2 CYS A 65 -21.068 6.619 -1.413 1.00 99.99 H ATOM 945 HB3 CYS A 65 -20.364 6.663 0.191 1.00 99.99 H ATOM 946 N GLY A 66 -19.627 7.087 -3.431 1.00 1.00 N ATOM 947 CA GLY A 66 -19.178 6.385 -4.622 1.00 1.00 C ATOM 948 C GLY A 66 -17.736 6.760 -4.969 1.00 1.00 C ATOM 949 O GLY A 66 -17.025 5.984 -5.605 1.00 1.00 O ATOM 950 H GLY A 66 -20.564 7.434 -3.473 1.00 99.99 H ATOM 951 HA2 GLY A 66 -19.249 5.310 -4.462 1.00 99.99 H ATOM 952 HA3 GLY A 66 -19.833 6.626 -5.459 1.00 99.99 H ATOM 953 N GLU A 67 -17.349 7.952 -4.537 1.00 1.00 N ATOM 954 CA GLU A 67 -16.004 8.440 -4.795 1.00 1.00 C ATOM 955 C GLU A 67 -14.999 7.736 -3.881 1.00 1.00 C ATOM 956 O GLU A 67 -13.933 7.318 -4.330 1.00 1.00 O ATOM 957 CB GLU A 67 -15.931 9.958 -4.622 1.00 1.00 C ATOM 958 CG GLU A 67 -16.793 10.671 -5.667 1.00 1.00 C ATOM 959 CD GLU A 67 -16.065 10.759 -7.011 1.00 1.00 C ATOM 960 OE1 GLU A 67 -15.889 11.862 -7.548 1.00 1.00 O ATOM 961 OE2 GLU A 67 -15.677 9.629 -7.496 1.00 1.00 O ATOM 962 H GLU A 67 -17.934 8.577 -4.020 1.00 99.99 H ATOM 963 HA GLU A 67 -15.799 8.187 -5.834 1.00 99.99 H ATOM 964 HB2 GLU A 67 -16.265 10.232 -3.622 1.00 99.99 H ATOM 965 HB3 GLU A 67 -14.895 10.288 -4.715 1.00 99.99 H ATOM 966 HG2 GLU A 67 -17.733 10.135 -5.793 1.00 99.99 H ATOM 967 HG3 GLU A 67 -17.041 11.672 -5.317 1.00 99.99 H ATOM 968 HE2 GLU A 67 -14.732 9.448 -7.226 1.00 99.99 H ATOM 969 N CYS A 68 -15.376 7.625 -2.615 1.00 1.00 N ATOM 970 CA CYS A 68 -14.521 6.977 -1.634 1.00 1.00 C ATOM 971 C CYS A 68 -14.788 5.472 -1.683 1.00 1.00 C ATOM 972 O CYS A 68 -13.867 4.672 -1.833 1.00 1.00 O ATOM 973 CB CYS A 68 -14.734 7.550 -0.232 1.00 1.00 C ATOM 974 SG CYS A 68 -13.478 8.834 0.118 1.00 1.00 S ATOM 975 H CYS A 68 -16.245 7.966 -2.257 1.00 99.99 H ATOM 976 HA CYS A 68 -13.493 7.197 -1.922 1.00 99.99 H ATOM 977 HB2 CYS A 68 -15.734 7.977 -0.153 1.00 99.99 H ATOM 978 HB3 CYS A 68 -14.669 6.754 0.509 1.00 99.99 H ATOM 979 N HIS A 69 -16.068 5.122 -1.551 1.00 1.00 N ATOM 980 CA HIS A 69 -16.516 3.734 -1.573 1.00 1.00 C ATOM 981 C HIS A 69 -16.753 3.286 -3.026 1.00 1.00 C ATOM 982 O HIS A 69 -17.375 4.010 -3.802 1.00 1.00 O ATOM 983 CB HIS A 69 -17.742 3.594 -0.659 1.00 1.00 C ATOM 984 CG HIS A 69 -17.531 3.878 0.811 1.00 1.00 C ATOM 985 ND1 HIS A 69 -16.865 3.046 1.616 1.00 1.00 N ATOM 986 CD2 HIS A 69 -17.925 4.936 1.595 1.00 1.00 C ATOM 987 CE1 HIS A 69 -16.844 3.564 2.854 1.00 1.00 C ATOM 988 NE2 HIS A 69 -17.484 4.731 2.897 1.00 1.00 N ATOM 989 H HIS A 69 -16.759 5.849 -1.431 1.00 99.99 H ATOM 990 HA HIS A 69 -15.701 3.104 -1.150 1.00 99.99 H ATOM 991 HB2 HIS A 69 -18.525 4.297 -1.028 1.00 99.99 H ATOM 992 HB3 HIS A 69 -18.117 2.549 -0.750 1.00 99.99 H ATOM 993 HD1 HIS A 69 -16.450 2.166 1.315 1.00 99.99 H ATOM 994 HD2 HIS A 69 -18.500 5.808 1.246 1.00 99.99 H ATOM 995 HE1 HIS A 69 -16.359 3.088 3.720 1.00 99.99 H ATOM 996 N LYS A 70 -16.251 2.103 -3.344 1.00 1.00 N ATOM 997 CA LYS A 70 -16.404 1.559 -4.682 1.00 1.00 C ATOM 998 C LYS A 70 -17.061 0.179 -4.596 1.00 1.00 C ATOM 999 O LYS A 70 -16.484 -0.753 -4.039 1.00 1.00 O ATOM 1000 CB LYS A 70 -15.062 1.556 -5.417 1.00 1.00 C ATOM 1001 CG LYS A 70 -14.844 2.871 -6.168 1.00 1.00 C ATOM 1002 CD LYS A 70 -14.609 2.618 -7.659 1.00 1.00 C ATOM 1003 CE LYS A 70 -13.267 3.199 -8.109 1.00 1.00 C ATOM 1004 NZ LYS A 70 -12.726 2.428 -9.250 1.00 1.00 N ATOM 1005 H LYS A 70 -15.747 1.519 -2.706 1.00 99.99 H ATOM 1006 HA LYS A 70 -17.070 2.225 -5.232 1.00 99.99 H ATOM 1007 HB2 LYS A 70 -14.253 1.403 -4.703 1.00 99.99 H ATOM 1008 HB3 LYS A 70 -15.028 0.722 -6.119 1.00 99.99 H ATOM 1009 HG2 LYS A 70 -15.713 3.516 -6.038 1.00 99.99 H ATOM 1010 HG3 LYS A 70 -13.989 3.398 -5.746 1.00 99.99 H ATOM 1011 HD2 LYS A 70 -14.631 1.546 -7.857 1.00 99.99 H ATOM 1012 HD3 LYS A 70 -15.417 3.065 -8.238 1.00 99.99 H ATOM 1013 HE2 LYS A 70 -13.394 4.243 -8.395 1.00 99.99 H ATOM 1014 HE3 LYS A 70 -12.561 3.179 -7.280 1.00 99.99 H ATOM 1015 HZ1 LYS A 70 -11.782 2.101 -9.072 1.00 99.99 H ATOM 1016 HZ2 LYS A 70 -13.287 1.609 -9.455 1.00 99.99 H ATOM 1017 N LYS A 71 -18.260 0.094 -5.155 1.00 1.00 N ATOM 1018 CA LYS A 71 -19.001 -1.155 -5.148 1.00 1.00 C ATOM 1019 C LYS A 71 -18.590 -1.994 -6.359 1.00 1.00 C ATOM 1020 O LYS A 71 -17.439 -1.945 -6.791 1.00 1.00 O ATOM 1021 CB LYS A 71 -20.506 -0.884 -5.069 1.00 1.00 C ATOM 1022 CG LYS A 71 -20.944 0.094 -6.161 1.00 1.00 C ATOM 1023 CD LYS A 71 -22.401 -0.148 -6.561 1.00 1.00 C ATOM 1024 CE LYS A 71 -22.488 -0.836 -7.925 1.00 1.00 C ATOM 1025 NZ LYS A 71 -23.074 -2.188 -7.786 1.00 1.00 N ATOM 1026 H LYS A 71 -18.722 0.859 -5.605 1.00 99.99 H ATOM 1027 HA LYS A 71 -18.723 -1.694 -4.243 1.00 99.99 H ATOM 1028 HB2 LYS A 71 -21.053 -1.821 -5.174 1.00 99.99 H ATOM 1029 HB3 LYS A 71 -20.755 -0.478 -4.090 1.00 99.99 H ATOM 1030 HG2 LYS A 71 -20.826 1.118 -5.805 1.00 99.99 H ATOM 1031 HG3 LYS A 71 -20.301 -0.016 -7.033 1.00 99.99 H ATOM 1032 HD2 LYS A 71 -22.891 -0.765 -5.807 1.00 99.99 H ATOM 1033 HD3 LYS A 71 -22.935 0.802 -6.593 1.00 99.99 H ATOM 1034 HE2 LYS A 71 -23.096 -0.237 -8.602 1.00 99.99 H ATOM 1035 HE3 LYS A 71 -21.495 -0.908 -8.367 1.00 99.99 H ATOM 1036 HZ1 LYS A 71 -24.069 -2.153 -7.594 1.00 99.99 H ATOM 1037 HZ2 LYS A 71 -22.957 -2.740 -8.629 1.00 99.99 H TER 1038 LYS A 71 HETATM 1039 FE HEC A 101 0.162 7.976 6.616 1.00 1.00 FE HETATM 1040 CHA HEC A 101 -0.906 4.814 7.715 1.00 1.00 C HETATM 1041 CHB HEC A 101 3.457 6.929 7.248 1.00 1.00 C HETATM 1042 CHC HEC A 101 1.337 11.087 5.853 1.00 1.00 C HETATM 1043 CHD HEC A 101 -3.062 8.931 6.259 1.00 1.00 C HETATM 1044 NA HEC A 101 1.082 6.237 7.380 1.00 1.00 N HETATM 1045 C1A HEC A 101 0.467 5.034 7.686 1.00 1.00 C HETATM 1046 C2A HEC A 101 1.458 4.026 7.978 1.00 1.00 C HETATM 1047 C3A HEC A 101 2.669 4.609 7.849 1.00 1.00 C HETATM 1048 C4A HEC A 101 2.439 5.985 7.477 1.00 1.00 C HETATM 1049 CMA HEC A 101 4.020 3.986 8.046 1.00 1.00 C HETATM 1050 CAA HEC A 101 1.153 2.605 8.350 1.00 1.00 C HETATM 1051 CBA HEC A 101 1.345 1.609 7.210 1.00 1.00 C HETATM 1052 CGA HEC A 101 0.271 1.781 6.145 1.00 1.00 C HETATM 1053 O1A HEC A 101 0.180 2.905 5.607 1.00 1.00 O HETATM 1054 O2A HEC A 101 -0.439 0.784 5.889 1.00 1.00 O HETATM 1055 NB HEC A 101 2.030 8.798 6.498 1.00 1.00 N HETATM 1056 C1B HEC A 101 3.235 8.264 6.920 1.00 1.00 C HETATM 1057 C2B HEC A 101 4.247 9.292 6.976 1.00 1.00 C HETATM 1058 C3B HEC A 101 3.662 10.445 6.589 1.00 1.00 C HETATM 1059 C4B HEC A 101 2.283 10.142 6.291 1.00 1.00 C HETATM 1060 CMB HEC A 101 5.673 9.072 7.392 1.00 1.00 C HETATM 1061 CAB HEC A 101 4.288 11.805 6.476 1.00 1.00 C HETATM 1062 CBB HEC A 101 5.619 11.939 7.211 1.00 1.00 C HETATM 1063 NC HEC A 101 -0.714 9.662 5.968 1.00 1.00 N HETATM 1064 C1C HEC A 101 -0.116 10.910 5.907 1.00 1.00 C HETATM 1065 C2C HEC A 101 -1.110 11.948 6.048 1.00 1.00 C HETATM 1066 C3C HEC A 101 -2.305 11.337 6.193 1.00 1.00 C HETATM 1067 C4C HEC A 101 -2.062 9.914 6.144 1.00 1.00 C HETATM 1068 CMC HEC A 101 -0.821 13.421 6.029 1.00 1.00 C HETATM 1069 CAC HEC A 101 -3.652 11.973 6.374 1.00 1.00 C HETATM 1070 CBC HEC A 101 -4.166 12.700 5.134 1.00 1.00 C HETATM 1071 ND HEC A 101 -1.605 7.056 6.928 1.00 1.00 N HETATM 1072 C1D HEC A 101 -2.843 7.634 6.712 1.00 1.00 C HETATM 1073 C2D HEC A 101 -3.896 6.695 7.022 1.00 1.00 C HETATM 1074 C3D HEC A 101 -3.301 5.552 7.427 1.00 1.00 C HETATM 1075 C4D HEC A 101 -1.875 5.772 7.369 1.00 1.00 C HETATM 1076 CMD HEC A 101 -5.364 6.980 6.903 1.00 1.00 C HETATM 1077 CAD HEC A 101 -3.956 4.273 7.860 1.00 1.00 C HETATM 1078 CBD HEC A 101 -4.240 4.198 9.358 1.00 1.00 C HETATM 1079 CGD HEC A 101 -5.105 2.991 9.691 1.00 1.00 C HETATM 1080 O1D HEC A 101 -5.974 2.666 8.853 1.00 1.00 O HETATM 1081 O2D HEC A 101 -4.882 2.416 10.778 1.00 1.00 O HETATM 1082 FE HEC A 102 -7.808 13.054 0.567 1.00 1.00 FE HETATM 1083 CHA HEC A 102 -7.750 14.256 -2.601 1.00 1.00 C HETATM 1084 CHB HEC A 102 -9.470 10.183 -0.557 1.00 1.00 C HETATM 1085 CHC HEC A 102 -7.953 11.729 3.806 1.00 1.00 C HETATM 1086 CHD HEC A 102 -6.438 15.918 1.784 1.00 1.00 C HETATM 1087 NA HEC A 102 -8.495 12.368 -1.198 1.00 1.00 N HETATM 1088 C1A HEC A 102 -8.329 13.005 -2.416 1.00 1.00 C HETATM 1089 C2A HEC A 102 -8.847 12.183 -3.484 1.00 1.00 C HETATM 1090 C3A HEC A 102 -9.325 11.054 -2.922 1.00 1.00 C HETATM 1091 C4A HEC A 102 -9.107 11.164 -1.498 1.00 1.00 C HETATM 1092 CMA HEC A 102 -9.967 9.881 -3.603 1.00 1.00 C HETATM 1093 CAA HEC A 102 -8.835 12.557 -4.938 1.00 1.00 C HETATM 1094 CBA HEC A 102 -7.442 12.585 -5.561 1.00 1.00 C HETATM 1095 CGA HEC A 102 -6.765 11.226 -5.447 1.00 1.00 C HETATM 1096 O1A HEC A 102 -5.667 11.188 -4.851 1.00 1.00 O HETATM 1097 O2A HEC A 102 -7.358 10.252 -5.960 1.00 1.00 O HETATM 1098 NB HEC A 102 -8.571 11.313 1.443 1.00 1.00 N HETATM 1099 C1B HEC A 102 -9.194 10.256 0.805 1.00 1.00 C HETATM 1100 C2B HEC A 102 -9.526 9.222 1.756 1.00 1.00 C HETATM 1101 C3B HEC A 102 -9.107 9.647 2.967 1.00 1.00 C HETATM 1102 C4B HEC A 102 -8.511 10.949 2.777 1.00 1.00 C HETATM 1103 CMB HEC A 102 -10.211 7.930 1.416 1.00 1.00 C HETATM 1104 CAB HEC A 102 -9.216 8.938 4.285 1.00 1.00 C HETATM 1105 CBB HEC A 102 -8.579 7.551 4.298 1.00 1.00 C HETATM 1106 NC HEC A 102 -7.206 13.658 2.444 1.00 1.00 N HETATM 1107 C1C HEC A 102 -7.512 13.087 3.667 1.00 1.00 C HETATM 1108 C2C HEC A 102 -7.327 14.049 4.729 1.00 1.00 C HETATM 1109 C3C HEC A 102 -6.911 15.198 4.156 1.00 1.00 C HETATM 1110 C4C HEC A 102 -6.834 14.959 2.734 1.00 1.00 C HETATM 1111 CMC HEC A 102 -7.565 13.776 6.185 1.00 1.00 C HETATM 1112 CAC HEC A 102 -6.580 16.498 4.827 1.00 1.00 C HETATM 1113 CBC HEC A 102 -5.268 16.477 5.608 1.00 1.00 C HETATM 1114 ND HEC A 102 -7.289 14.759 -0.220 1.00 1.00 N HETATM 1115 C1D HEC A 102 -6.604 15.785 0.410 1.00 1.00 C HETATM 1116 C2D HEC A 102 -6.080 16.710 -0.565 1.00 1.00 C HETATM 1117 C3D HEC A 102 -6.442 16.253 -1.783 1.00 1.00 C HETATM 1118 C4D HEC A 102 -7.194 15.038 -1.573 1.00 1.00 C HETATM 1119 CMD HEC A 102 -5.284 17.942 -0.241 1.00 1.00 C HETATM 1120 CAD HEC A 102 -6.142 16.856 -3.124 1.00 1.00 C HETATM 1121 CBD HEC A 102 -5.228 16.003 -3.998 1.00 1.00 C HETATM 1122 CGD HEC A 102 -3.837 15.891 -3.391 1.00 1.00 C HETATM 1123 O1D HEC A 102 -2.941 16.608 -3.888 1.00 1.00 O HETATM 1124 O2D HEC A 102 -3.695 15.091 -2.441 1.00 1.00 O HETATM 1125 FE HEC A 103 -17.767 5.946 4.463 1.00 1.00 FE HETATM 1126 CHA HEC A 103 -16.725 3.443 6.581 1.00 1.00 C HETATM 1127 CHB HEC A 103 -21.025 4.941 4.853 1.00 1.00 C HETATM 1128 CHC HEC A 103 -18.791 8.360 2.200 1.00 1.00 C HETATM 1129 CHD HEC A 103 -14.452 6.776 3.852 1.00 1.00 C HETATM 1130 NA HEC A 103 -18.672 4.449 5.447 1.00 1.00 N HETATM 1131 C1A HEC A 103 -18.092 3.600 6.373 1.00 1.00 C HETATM 1132 C2A HEC A 103 -19.111 2.888 7.107 1.00 1.00 C HETATM 1133 C3A HEC A 103 -20.305 3.301 6.630 1.00 1.00 C HETATM 1134 C4A HEC A 103 -20.036 4.273 5.597 1.00 1.00 C HETATM 1135 CMA HEC A 103 -21.673 2.862 7.061 1.00 1.00 C HETATM 1136 CAA HEC A 103 -18.846 1.884 8.191 1.00 1.00 C HETATM 1137 CBA HEC A 103 -18.086 0.647 7.718 1.00 1.00 C HETATM 1138 CGA HEC A 103 -18.495 -0.583 8.514 1.00 1.00 C HETATM 1139 O1A HEC A 103 -19.700 -0.679 8.833 1.00 1.00 O HETATM 1140 O2A HEC A 103 -17.595 -1.406 8.789 1.00 1.00 O HETATM 1141 NB HEC A 103 -19.533 6.505 3.664 1.00 1.00 N HETATM 1142 C1B HEC A 103 -20.783 6.011 3.998 1.00 1.00 C HETATM 1143 C2B HEC A 103 -21.815 6.768 3.330 1.00 1.00 C HETATM 1144 C3B HEC A 103 -21.199 7.717 2.594 1.00 1.00 C HETATM 1145 C4B HEC A 103 -19.778 7.557 2.800 1.00 1.00 C HETATM 1146 CMB HEC A 103 -23.288 6.511 3.461 1.00 1.00 C HETATM 1147 CAB HEC A 103 -21.829 8.759 1.717 1.00 1.00 C HETATM 1148 CBB HEC A 103 -23.054 9.429 2.330 1.00 1.00 C HETATM 1149 NC HEC A 103 -16.807 7.427 3.443 1.00 1.00 N HETATM 1150 C1C HEC A 103 -17.391 8.404 2.656 1.00 1.00 C HETATM 1151 C2C HEC A 103 -16.376 9.161 1.962 1.00 1.00 C HETATM 1152 C3C HEC A 103 -15.181 8.648 2.324 1.00 1.00 C HETATM 1153 C4C HEC A 103 -15.445 7.568 3.246 1.00 1.00 C HETATM 1154 CMC HEC A 103 -16.646 10.299 1.022 1.00 1.00 C HETATM 1155 CAC HEC A 103 -13.816 9.083 1.879 1.00 1.00 C HETATM 1156 CBC HEC A 103 -13.531 10.564 2.109 1.00 1.00 C HETATM 1157 ND HEC A 103 -15.962 5.275 5.098 1.00 1.00 N HETATM 1158 C1D HEC A 103 -14.708 5.711 4.709 1.00 1.00 C HETATM 1159 C2D HEC A 103 -13.682 4.900 5.323 1.00 1.00 C HETATM 1160 C3D HEC A 103 -14.310 3.974 6.080 1.00 1.00 C HETATM 1161 C4D HEC A 103 -15.728 4.204 5.943 1.00 1.00 C HETATM 1162 CMD HEC A 103 -12.207 5.088 5.127 1.00 1.00 C HETATM 1163 CAD HEC A 103 -13.692 2.895 6.921 1.00 1.00 C HETATM 1164 CBD HEC A 103 -13.496 1.572 6.186 1.00 1.00 C HETATM 1165 CGD HEC A 103 -13.097 0.465 7.150 1.00 1.00 C HETATM 1166 O1D HEC A 103 -11.902 0.098 7.130 1.00 1.00 O HETATM 1167 O2D HEC A 103 -13.994 0.005 7.889 1.00 1.00 O