ATOM 1 N GLY A 1 3.833 6.805 4.482 1.00 0.00 N ATOM 2 CA GLY A 1 3.825 5.734 3.446 1.00 0.00 C ATOM 3 C GLY A 1 5.167 5.008 3.452 1.00 0.00 C ATOM 4 O GLY A 1 6.225 5.638 3.415 1.00 0.00 O ATOM 5 H1 GLY A 1 2.875 6.916 4.873 1.00 0.00 H ATOM 6 H2 GLY A 1 4.137 7.702 4.051 1.00 0.00 H ATOM 7 H3 GLY A 1 4.488 6.546 5.245 1.00 0.00 H ATOM 8 HA2 GLY A 1 3.034 5.030 3.662 1.00 0.00 H ATOM 9 HA3 GLY A 1 3.661 6.172 2.474 1.00 0.00 H ATOM 10 N ARG A 2 5.114 3.680 3.491 1.00 0.00 N ATOM 11 CA ARG A 2 6.329 2.875 3.502 1.00 0.00 C ATOM 12 C ARG A 2 7.158 3.152 2.254 1.00 0.00 C ATOM 13 O ARG A 2 8.389 3.146 2.297 1.00 0.00 O ATOM 14 CB ARG A 2 5.967 1.388 3.562 1.00 0.00 C ATOM 15 CG ARG A 2 5.414 1.055 4.948 1.00 0.00 C ATOM 16 CD ARG A 2 5.023 -0.422 4.998 1.00 0.00 C ATOM 17 NE ARG A 2 4.486 -0.760 6.312 1.00 0.00 N ATOM 18 CZ ARG A 2 5.278 -1.198 7.286 1.00 0.00 C ATOM 19 NH1 ARG A 2 6.559 -1.330 7.076 1.00 0.00 N1+ ATOM 20 NH2 ARG A 2 4.773 -1.496 8.452 1.00 0.00 N ATOM 21 H ARG A 2 4.241 3.235 3.513 1.00 0.00 H ATOM 22 HA ARG A 2 6.912 3.128 4.374 1.00 0.00 H ATOM 23 HB2 ARG A 2 5.220 1.171 2.813 1.00 0.00 H ATOM 24 HB3 ARG A 2 6.846 0.794 3.377 1.00 0.00 H ATOM 25 HG2 ARG A 2 6.169 1.253 5.696 1.00 0.00 H ATOM 26 HG3 ARG A 2 4.543 1.662 5.146 1.00 0.00 H ATOM 27 HD2 ARG A 2 4.272 -0.619 4.247 1.00 0.00 H ATOM 28 HD3 ARG A 2 5.894 -1.029 4.799 1.00 0.00 H ATOM 29 HE ARG A 2 3.525 -0.662 6.479 1.00 0.00 H ATOM 30 HH11 ARG A 2 6.946 -1.102 6.183 1.00 0.00 H ATOM 31 HH12 ARG A 2 7.154 -1.659 7.809 1.00 0.00 H ATOM 32 HH21 ARG A 2 3.791 -1.395 8.613 1.00 0.00 H ATOM 33 HH22 ARG A 2 5.368 -1.825 9.183 1.00 0.00 H ATOM 34 N ILE A 3 6.474 3.404 1.146 1.00 0.00 N ATOM 35 CA ILE A 3 7.147 3.695 -0.114 1.00 0.00 C ATOM 36 C ILE A 3 7.963 4.978 0.007 1.00 0.00 C ATOM 37 O ILE A 3 9.091 5.056 -0.481 1.00 0.00 O ATOM 38 CB ILE A 3 6.118 3.847 -1.235 1.00 0.00 C ATOM 39 CG1 ILE A 3 5.445 2.496 -1.493 1.00 0.00 C ATOM 40 CG2 ILE A 3 6.818 4.318 -2.510 1.00 0.00 C ATOM 41 CD1 ILE A 3 6.495 1.478 -1.937 1.00 0.00 C ATOM 42 H ILE A 3 5.495 3.400 1.176 1.00 0.00 H ATOM 43 HA ILE A 3 7.812 2.877 -0.358 1.00 0.00 H ATOM 44 HB ILE A 3 5.373 4.573 -0.943 1.00 0.00 H ATOM 45 HG12 ILE A 3 4.968 2.152 -0.587 1.00 0.00 H ATOM 46 HG13 ILE A 3 4.703 2.607 -2.270 1.00 0.00 H ATOM 47 HG21 ILE A 3 6.624 3.615 -3.308 1.00 0.00 H ATOM 48 HG22 ILE A 3 7.883 4.378 -2.335 1.00 0.00 H ATOM 49 HG23 ILE A 3 6.443 5.291 -2.788 1.00 0.00 H ATOM 50 HD11 ILE A 3 7.182 1.292 -1.124 1.00 0.00 H ATOM 51 HD12 ILE A 3 7.039 1.867 -2.786 1.00 0.00 H ATOM 52 HD13 ILE A 3 6.008 0.554 -2.214 1.00 0.00 H ATOM 53 N ASP A 4 7.383 5.987 0.653 1.00 0.00 N ATOM 54 CA ASP A 4 8.068 7.265 0.818 1.00 0.00 C ATOM 55 C ASP A 4 9.378 7.077 1.577 1.00 0.00 C ATOM 56 O ASP A 4 9.454 6.296 2.525 1.00 0.00 O ATOM 57 CB ASP A 4 7.174 8.242 1.584 1.00 0.00 C ATOM 58 CG ASP A 4 6.120 8.826 0.651 1.00 0.00 C ATOM 59 OD1 ASP A 4 6.194 8.559 -0.536 1.00 0.00 O ATOM 60 OD2 ASP A 4 5.252 9.534 1.139 1.00 0.00 O1- ATOM 61 H ASP A 4 6.480 5.872 1.020 1.00 0.00 H ATOM 62 HA ASP A 4 8.282 7.678 -0.156 1.00 0.00 H ATOM 63 HB2 ASP A 4 6.686 7.721 2.395 1.00 0.00 H ATOM 64 HB3 ASP A 4 7.779 9.041 1.985 1.00 0.00 H HETATM 65 N DBU A 5 10.410 7.796 1.147 1.00 0.00 N HETATM 66 CA DBU A 5 11.680 7.717 1.753 1.00 0.00 C HETATM 67 CB DBU A 5 12.167 8.409 2.869 1.00 0.00 C HETATM 68 CG DBU A 5 11.376 9.418 3.666 1.00 0.00 C HETATM 69 C DBU A 5 12.544 6.726 1.014 1.00 0.00 C HETATM 70 O DBU A 5 13.708 6.983 0.709 1.00 0.00 O HETATM 71 H DBU A 5 10.302 8.404 0.385 1.00 0.00 H HETATM 72 HB DBU A 5 13.178 8.223 3.198 1.00 0.00 H HETATM 73 HG1 DBU A 5 10.490 8.951 4.067 1.00 0.00 H HETATM 74 HG2 DBU A 5 11.984 9.792 4.476 1.00 0.00 H HETATM 75 HG3 DBU A 5 11.093 10.237 3.021 1.00 0.00 H ATOM 76 N CYS A 6 11.962 5.570 0.717 1.00 0.00 N ATOM 77 CA CYS A 6 12.684 4.524 0.002 1.00 0.00 C ATOM 78 C CYS A 6 12.354 4.580 -1.488 1.00 0.00 C ATOM 79 O CYS A 6 11.299 5.080 -1.880 1.00 0.00 O ATOM 80 CB CYS A 6 12.313 3.151 0.574 1.00 0.00 C ATOM 81 SG CYS A 6 13.780 2.100 0.642 1.00 0.00 S ATOM 82 H CYS A 6 11.031 5.416 0.982 1.00 0.00 H ATOM 83 HA CYS A 6 13.741 4.681 0.131 1.00 0.00 H ATOM 84 HB2 CYS A 6 11.920 3.270 1.571 1.00 0.00 H ATOM 85 HB3 CYS A 6 11.567 2.687 -0.055 1.00 0.00 H ATOM 86 N PRO A 7 13.230 4.082 -2.319 1.00 0.00 N ATOM 87 CA PRO A 7 13.030 4.081 -3.799 1.00 0.00 C ATOM 88 C PRO A 7 11.739 3.372 -4.199 1.00 0.00 C ATOM 89 O PRO A 7 11.171 3.658 -5.255 1.00 0.00 O ATOM 90 CB PRO A 7 14.258 3.336 -4.339 1.00 0.00 C ATOM 91 CG PRO A 7 15.287 3.449 -3.263 1.00 0.00 C ATOM 92 CD PRO A 7 14.514 3.467 -1.948 1.00 0.00 C ATOM 93 HA PRO A 7 13.028 5.091 -4.173 1.00 0.00 H ATOM 94 HB2 PRO A 7 14.016 2.298 -4.521 1.00 0.00 H ATOM 95 HB3 PRO A 7 14.617 3.805 -5.242 1.00 0.00 H ATOM 96 HG2 PRO A 7 15.954 2.599 -3.296 1.00 0.00 H ATOM 97 HG3 PRO A 7 15.841 4.368 -3.371 1.00 0.00 H ATOM 98 HD2 PRO A 7 14.368 2.459 -1.587 1.00 0.00 H ATOM 99 HD3 PRO A 7 15.020 4.071 -1.212 1.00 0.00 H ATOM 100 N ALA A 8 11.290 2.450 -3.348 1.00 0.00 N ATOM 101 CA ALA A 8 10.065 1.690 -3.600 1.00 0.00 C ATOM 102 C ALA A 8 10.399 0.319 -4.170 1.00 0.00 C ATOM 103 O ALA A 8 9.756 -0.150 -5.109 1.00 0.00 O ATOM 104 CB ALA A 8 9.145 2.443 -4.566 1.00 0.00 C ATOM 105 H ALA A 8 11.797 2.274 -2.525 1.00 0.00 H ATOM 106 HA ALA A 8 9.545 1.556 -2.662 1.00 0.00 H ATOM 107 HB1 ALA A 8 8.123 2.138 -4.398 1.00 0.00 H ATOM 108 HB2 ALA A 8 9.428 2.214 -5.584 1.00 0.00 H ATOM 109 HB3 ALA A 8 9.237 3.505 -4.396 1.00 0.00 H ATOM 110 N GLY A 9 11.409 -0.317 -3.591 1.00 0.00 N ATOM 111 CA GLY A 9 11.829 -1.638 -4.038 1.00 0.00 C ATOM 112 C GLY A 9 11.194 -2.724 -3.179 1.00 0.00 C ATOM 113 O GLY A 9 11.787 -3.779 -2.955 1.00 0.00 O ATOM 114 H GLY A 9 11.880 0.110 -2.844 1.00 0.00 H ATOM 115 HA2 GLY A 9 11.531 -1.775 -5.068 1.00 0.00 H ATOM 116 HA3 GLY A 9 12.904 -1.712 -3.965 1.00 0.00 H ATOM 117 N GLY A 10 9.985 -2.454 -2.695 1.00 0.00 N ATOM 118 CA GLY A 10 9.278 -3.411 -1.854 1.00 0.00 C ATOM 119 C GLY A 10 9.889 -3.457 -0.461 1.00 0.00 C ATOM 120 O GLY A 10 9.237 -3.114 0.526 1.00 0.00 O ATOM 121 H GLY A 10 9.564 -1.595 -2.905 1.00 0.00 H ATOM 122 HA2 GLY A 10 8.239 -3.121 -1.779 1.00 0.00 H ATOM 123 HA3 GLY A 10 9.340 -4.391 -2.298 1.00 0.00 H ATOM 124 N GLY A 11 11.147 -3.871 -0.388 1.00 0.00 N ATOM 125 CA GLY A 11 11.840 -3.946 0.891 1.00 0.00 C ATOM 126 C GLY A 11 11.967 -2.559 1.503 1.00 0.00 C ATOM 127 O GLY A 11 11.829 -2.383 2.714 1.00 0.00 O ATOM 128 H GLY A 11 11.621 -4.126 -1.208 1.00 0.00 H ATOM 129 HA2 GLY A 11 11.287 -4.587 1.561 1.00 0.00 H ATOM 130 HA3 GLY A 11 12.830 -4.352 0.737 1.00 0.00 H HETATM 131 N DBB A 12 12.239 -1.580 0.649 1.00 0.00 N HETATM 132 CA DBB A 12 12.398 -0.204 1.092 1.00 0.00 C HETATM 133 C DBB A 12 13.308 -0.163 2.305 1.00 0.00 C HETATM 134 O DBB A 12 13.311 0.800 3.073 1.00 0.00 O HETATM 135 CB DBB A 12 13.009 0.612 -0.037 1.00 0.00 C HETATM 136 CG DBB A 12 14.053 -0.246 -0.744 1.00 0.00 C HETATM 137 H DBB A 12 12.346 -1.793 -0.299 1.00 0.00 H HETATM 138 HA DBB A 12 11.436 0.205 1.348 1.00 0.00 H HETATM 139 HB2 DBB A 12 12.237 0.894 -0.738 1.00 0.00 H HETATM 140 HG1 DBB A 12 14.513 -0.908 -0.025 1.00 0.00 H HETATM 141 HG2 DBB A 12 14.805 0.392 -1.183 1.00 0.00 H HETATM 142 HG3 DBB A 12 13.576 -0.830 -1.519 1.00 0.00 H HETATM 143 N DAL A 13 14.078 -1.229 2.461 1.00 0.00 N HETATM 144 CA DAL A 13 15.003 -1.350 3.575 1.00 0.00 C HETATM 145 CB DAL A 13 14.219 -1.393 4.879 1.00 0.00 C HETATM 146 C DAL A 13 15.983 -0.175 3.595 1.00 0.00 C HETATM 147 O DAL A 13 15.714 0.862 2.990 1.00 0.00 O HETATM 148 H DAL A 13 14.016 -1.956 1.811 1.00 0.00 H HETATM 149 HA DAL A 13 15.543 -2.278 3.465 1.00 0.00 H HETATM 150 HB1 DAL A 13 13.344 -0.773 4.796 1.00 0.00 H HETATM 151 HB2 DAL A 13 13.920 -2.409 5.081 1.00 0.00 H ATOM 152 N GLU A 14 17.119 -0.331 4.291 1.00 0.00 N ATOM 153 CA GLU A 14 18.104 0.740 4.359 1.00 0.00 C ATOM 154 C GLU A 14 18.230 1.429 3.005 1.00 0.00 C ATOM 155 O GLU A 14 18.686 2.568 2.915 1.00 0.00 O ATOM 156 CB GLU A 14 19.463 0.172 4.778 1.00 0.00 C ATOM 157 CG GLU A 14 19.389 -0.314 6.226 1.00 0.00 C ATOM 158 CD GLU A 14 20.711 -0.963 6.626 1.00 0.00 C ATOM 159 OE1 GLU A 14 21.607 -0.993 5.799 1.00 0.00 O ATOM 160 OE2 GLU A 14 20.807 -1.418 7.754 1.00 0.00 O1- ATOM 161 H GLU A 14 17.294 -1.169 4.765 1.00 0.00 H ATOM 162 HA GLU A 14 17.787 1.464 5.095 1.00 0.00 H ATOM 163 HB2 GLU A 14 19.721 -0.655 4.132 1.00 0.00 H ATOM 164 HB3 GLU A 14 20.216 0.942 4.696 1.00 0.00 H ATOM 165 HG2 GLU A 14 19.190 0.525 6.876 1.00 0.00 H ATOM 166 HG3 GLU A 14 18.594 -1.039 6.322 1.00 0.00 H ATOM 167 N GLN A 15 17.808 0.734 1.954 1.00 0.00 N ATOM 168 CA GLN A 15 17.864 1.292 0.610 1.00 0.00 C ATOM 169 C GLN A 15 17.142 2.635 0.565 1.00 0.00 C ATOM 170 O GLN A 15 17.206 3.354 -0.432 1.00 0.00 O ATOM 171 CB GLN A 15 17.215 0.324 -0.387 1.00 0.00 C ATOM 172 CG GLN A 15 18.111 -0.905 -0.559 1.00 0.00 C ATOM 173 CD GLN A 15 17.449 -1.906 -1.501 1.00 0.00 C ATOM 174 OE1 GLN A 15 16.389 -2.449 -1.185 1.00 0.00 O ATOM 175 NE2 GLN A 15 18.013 -2.182 -2.646 1.00 0.00 N ATOM 176 H GLN A 15 17.445 -0.167 2.085 1.00 0.00 H ATOM 177 HA GLN A 15 18.897 1.439 0.333 1.00 0.00 H ATOM 178 HB2 GLN A 15 16.248 0.016 -0.011 1.00 0.00 H ATOM 179 HB3 GLN A 15 17.091 0.816 -1.341 1.00 0.00 H ATOM 180 HG2 GLN A 15 19.061 -0.599 -0.973 1.00 0.00 H ATOM 181 HG3 GLN A 15 18.270 -1.369 0.402 1.00 0.00 H ATOM 182 HE21 GLN A 15 18.854 -1.747 -2.894 1.00 0.00 H ATOM 183 HE22 GLN A 15 17.594 -2.825 -3.255 1.00 0.00 H HETATM 184 N DBB A 16 16.453 2.965 1.652 1.00 0.00 N HETATM 185 CA DBB A 16 15.717 4.222 1.727 1.00 0.00 C HETATM 186 C DBB A 16 14.446 4.051 2.553 1.00 0.00 C HETATM 187 O DBB A 16 14.142 2.949 3.011 1.00 0.00 O HETATM 188 CB DBB A 16 16.586 5.315 2.351 1.00 0.00 C HETATM 189 CG DBB A 16 16.263 6.654 1.683 1.00 0.00 C HETATM 190 H DBB A 16 16.434 2.350 2.414 1.00 0.00 H HETATM 191 HA DBB A 16 15.450 4.524 0.728 1.00 0.00 H HETATM 192 HB2 DBB A 16 17.630 5.080 2.206 1.00 0.00 H HETATM 193 HG1 DBB A 16 15.432 7.118 2.193 1.00 0.00 H HETATM 194 HG2 DBB A 16 15.998 6.483 0.649 1.00 0.00 H HETATM 195 HG3 DBB A 16 17.125 7.303 1.732 1.00 0.00 H ATOM 196 N GLY A 17 13.716 5.152 2.737 1.00 0.00 N ATOM 197 CA GLY A 17 12.473 5.134 3.507 1.00 0.00 C ATOM 198 C GLY A 17 12.286 3.804 4.226 1.00 0.00 C ATOM 199 O GLY A 17 13.099 3.423 5.066 1.00 0.00 O ATOM 200 H GLY A 17 14.021 5.996 2.344 1.00 0.00 H ATOM 201 HA2 GLY A 17 12.500 5.930 4.237 1.00 0.00 H ATOM 202 HA3 GLY A 17 11.640 5.293 2.840 1.00 0.00 H HETATM 203 N DBU A 18 11.210 3.101 3.883 1.00 0.00 N HETATM 204 CA DBU A 18 10.921 1.852 4.465 1.00 0.00 C HETATM 205 CB DBU A 18 10.194 0.779 3.932 1.00 0.00 C HETATM 206 CG DBU A 18 9.547 0.748 2.567 1.00 0.00 C HETATM 207 C DBU A 18 11.517 1.742 5.845 1.00 0.00 C HETATM 208 O DBU A 18 10.899 2.082 6.854 1.00 0.00 O HETATM 209 H DBU A 18 10.594 3.447 3.205 1.00 0.00 H HETATM 210 HB DBU A 18 10.075 -0.111 4.531 1.00 0.00 H HETATM 211 HG1 DBU A 18 8.509 1.028 2.647 1.00 0.00 H HETATM 212 HG2 DBU A 18 10.056 1.442 1.915 1.00 0.00 H HETATM 213 HG3 DBU A 18 9.620 -0.251 2.159 1.00 0.00 H ATOM 214 N CYS A 19 12.751 1.250 5.885 1.00 0.00 N ATOM 215 CA CYS A 19 13.456 1.082 7.149 1.00 0.00 C ATOM 216 C CYS A 19 14.695 1.974 7.207 1.00 0.00 C ATOM 217 O CYS A 19 15.312 2.125 8.261 1.00 0.00 O ATOM 218 CB CYS A 19 13.861 -0.383 7.321 1.00 0.00 C ATOM 219 SG CYS A 19 15.243 -0.774 6.227 1.00 0.00 S ATOM 220 H CYS A 19 13.195 0.995 5.050 1.00 0.00 H ATOM 221 HA CYS A 19 12.794 1.355 7.956 1.00 0.00 H ATOM 222 HB2 CYS A 19 14.152 -0.561 8.335 1.00 0.00 H ATOM 223 HB3 CYS A 19 13.023 -1.018 7.073 1.00 0.00 H ATOM 224 N CYS A 20 15.050 2.565 6.071 1.00 0.00 N ATOM 225 CA CYS A 20 16.215 3.441 6.011 1.00 0.00 C ATOM 226 C CYS A 20 15.932 4.755 6.737 1.00 0.00 C ATOM 227 O CYS A 20 14.766 5.073 6.909 1.00 0.00 O ATOM 228 CB CYS A 20 16.590 3.716 4.549 1.00 0.00 C ATOM 229 SG CYS A 20 16.230 5.440 4.123 1.00 0.00 S ATOM 230 OXT CYS A 20 16.883 5.418 7.112 1.00 0.00 O ATOM 231 H CYS A 20 14.520 2.411 5.260 1.00 0.00 H ATOM 232 HA CYS A 20 17.045 2.949 6.497 1.00 0.00 H ATOM 233 HB2 CYS A 20 17.644 3.525 4.409 1.00 0.00 H ATOM 234 HB3 CYS A 20 16.020 3.060 3.908 1.00 0.00 H TER 235 CYS A 20