ATOM 1 N GLY A 1 3.378 0.870 -4.556 1.00 0.00 N ATOM 2 CA GLY A 1 2.711 0.548 -3.263 1.00 0.00 C ATOM 3 C GLY A 1 3.710 -0.122 -2.327 1.00 0.00 C ATOM 4 O GLY A 1 3.828 0.248 -1.160 1.00 0.00 O ATOM 5 H1 GLY A 1 3.793 1.821 -4.506 1.00 0.00 H ATOM 6 H2 GLY A 1 2.677 0.836 -5.325 1.00 0.00 H ATOM 7 H3 GLY A 1 4.129 0.176 -4.741 1.00 0.00 H ATOM 8 HA2 GLY A 1 2.347 1.460 -2.810 1.00 0.00 H ATOM 9 HA3 GLY A 1 1.884 -0.122 -3.440 1.00 0.00 H ATOM 10 N ARG A 2 4.430 -1.110 -2.846 1.00 0.00 N ATOM 11 CA ARG A 2 5.418 -1.826 -2.047 1.00 0.00 C ATOM 12 C ARG A 2 6.514 -0.878 -1.574 1.00 0.00 C ATOM 13 O ARG A 2 7.027 -1.011 -0.463 1.00 0.00 O ATOM 14 CB ARG A 2 6.038 -2.956 -2.872 1.00 0.00 C ATOM 15 CG ARG A 2 4.992 -4.044 -3.118 1.00 0.00 C ATOM 16 CD ARG A 2 5.588 -5.135 -4.007 1.00 0.00 C ATOM 17 NE ARG A 2 6.678 -5.812 -3.312 1.00 0.00 N ATOM 18 CZ ARG A 2 7.416 -6.733 -3.923 1.00 0.00 C ATOM 19 NH1 ARG A 2 7.172 -7.045 -5.166 1.00 0.00 N1+ ATOM 20 NH2 ARG A 2 8.385 -7.326 -3.280 1.00 0.00 N ATOM 21 H ARG A 2 4.295 -1.362 -3.784 1.00 0.00 H ATOM 22 HA ARG A 2 4.927 -2.254 -1.186 1.00 0.00 H ATOM 23 HB2 ARG A 2 6.381 -2.564 -3.818 1.00 0.00 H ATOM 24 HB3 ARG A 2 6.872 -3.379 -2.333 1.00 0.00 H ATOM 25 HG2 ARG A 2 4.689 -4.472 -2.174 1.00 0.00 H ATOM 26 HG3 ARG A 2 4.133 -3.612 -3.610 1.00 0.00 H ATOM 27 HD2 ARG A 2 4.823 -5.854 -4.254 1.00 0.00 H ATOM 28 HD3 ARG A 2 5.965 -4.689 -4.917 1.00 0.00 H ATOM 29 HE ARG A 2 6.868 -5.585 -2.379 1.00 0.00 H ATOM 30 HH11 ARG A 2 6.429 -6.592 -5.659 1.00 0.00 H ATOM 31 HH12 ARG A 2 7.727 -7.739 -5.626 1.00 0.00 H ATOM 32 HH21 ARG A 2 8.572 -7.086 -2.327 1.00 0.00 H ATOM 33 HH22 ARG A 2 8.941 -8.018 -3.740 1.00 0.00 H ATOM 34 N ILE A 3 6.870 0.077 -2.424 1.00 0.00 N ATOM 35 CA ILE A 3 7.910 1.042 -2.082 1.00 0.00 C ATOM 36 C ILE A 3 7.606 1.703 -0.741 1.00 0.00 C ATOM 37 O ILE A 3 8.513 1.988 0.039 1.00 0.00 O ATOM 38 CB ILE A 3 8.003 2.114 -3.172 1.00 0.00 C ATOM 39 CG1 ILE A 3 7.013 3.243 -2.869 1.00 0.00 C ATOM 40 CG2 ILE A 3 7.667 1.495 -4.530 1.00 0.00 C ATOM 41 CD1 ILE A 3 5.584 2.741 -3.084 1.00 0.00 C ATOM 42 H ILE A 3 6.426 0.136 -3.295 1.00 0.00 H ATOM 43 HA ILE A 3 8.859 0.532 -2.017 1.00 0.00 H ATOM 44 HB ILE A 3 9.008 2.512 -3.199 1.00 0.00 H ATOM 45 HG12 ILE A 3 7.133 3.560 -1.845 1.00 0.00 H ATOM 46 HG13 ILE A 3 7.203 4.077 -3.527 1.00 0.00 H ATOM 47 HG21 ILE A 3 8.142 0.529 -4.613 1.00 0.00 H ATOM 48 HG22 ILE A 3 8.023 2.140 -5.319 1.00 0.00 H ATOM 49 HG23 ILE A 3 6.599 1.377 -4.621 1.00 0.00 H ATOM 50 HD11 ILE A 3 5.543 1.680 -2.898 1.00 0.00 H ATOM 51 HD12 ILE A 3 5.284 2.939 -4.101 1.00 0.00 H ATOM 52 HD13 ILE A 3 4.918 3.249 -2.404 1.00 0.00 H ATOM 53 N ASP A 4 6.326 1.949 -0.484 1.00 0.00 N ATOM 54 CA ASP A 4 5.917 2.583 0.763 1.00 0.00 C ATOM 55 C ASP A 4 6.988 3.556 1.248 1.00 0.00 C ATOM 56 O ASP A 4 7.480 3.442 2.369 1.00 0.00 O ATOM 57 CB ASP A 4 5.668 1.519 1.834 1.00 0.00 C ATOM 58 CG ASP A 4 4.331 0.830 1.582 1.00 0.00 C ATOM 59 OD1 ASP A 4 3.574 1.330 0.768 1.00 0.00 O ATOM 60 OD2 ASP A 4 4.082 -0.183 2.214 1.00 0.00 O1- ATOM 61 H ASP A 4 5.644 1.704 -1.146 1.00 0.00 H ATOM 62 HA ASP A 4 5.000 3.128 0.596 1.00 0.00 H ATOM 63 HB2 ASP A 4 6.460 0.787 1.799 1.00 0.00 H ATOM 64 HB3 ASP A 4 5.653 1.986 2.807 1.00 0.00 H HETATM 65 N DBU A 5 7.343 4.511 0.395 1.00 0.00 N HETATM 66 CA DBU A 5 8.323 5.466 0.735 1.00 0.00 C HETATM 67 CB DBU A 5 8.263 6.469 1.711 1.00 0.00 C HETATM 68 CG DBU A 5 7.082 6.721 2.615 1.00 0.00 C HETATM 69 C DBU A 5 9.553 5.293 -0.122 1.00 0.00 C HETATM 70 O DBU A 5 9.776 6.032 -1.081 1.00 0.00 O HETATM 71 H DBU A 5 6.923 4.563 -0.488 1.00 0.00 H HETATM 72 HB DBU A 5 9.114 7.121 1.840 1.00 0.00 H HETATM 73 HG1 DBU A 5 6.977 5.898 3.307 1.00 0.00 H HETATM 74 HG2 DBU A 5 7.240 7.637 3.166 1.00 0.00 H HETATM 75 HG3 DBU A 5 6.185 6.809 2.020 1.00 0.00 H ATOM 76 N CYS A 6 10.363 4.301 0.227 1.00 0.00 N ATOM 77 CA CYS A 6 11.585 4.027 -0.521 1.00 0.00 C ATOM 78 C CYS A 6 11.254 3.507 -1.917 1.00 0.00 C ATOM 79 O CYS A 6 10.776 2.384 -2.074 1.00 0.00 O ATOM 80 CB CYS A 6 12.424 2.988 0.219 1.00 0.00 C ATOM 81 SG CYS A 6 11.437 1.498 0.503 1.00 0.00 S ATOM 82 H CYS A 6 10.136 3.744 1.001 1.00 0.00 H ATOM 83 HA CYS A 6 12.157 4.937 -0.608 1.00 0.00 H ATOM 84 HB2 CYS A 6 13.289 2.731 -0.370 1.00 0.00 H ATOM 85 HB3 CYS A 6 12.745 3.392 1.169 1.00 0.00 H ATOM 86 N PRO A 7 11.493 4.302 -2.925 1.00 0.00 N ATOM 87 CA PRO A 7 11.212 3.924 -4.339 1.00 0.00 C ATOM 88 C PRO A 7 12.283 3.001 -4.912 1.00 0.00 C ATOM 89 O PRO A 7 12.409 2.857 -6.129 1.00 0.00 O ATOM 90 CB PRO A 7 11.198 5.264 -5.074 1.00 0.00 C ATOM 91 CG PRO A 7 12.065 6.177 -4.265 1.00 0.00 C ATOM 92 CD PRO A 7 12.064 5.654 -2.823 1.00 0.00 C ATOM 93 HA PRO A 7 10.242 3.463 -4.415 1.00 0.00 H ATOM 94 HB2 PRO A 7 11.601 5.148 -6.072 1.00 0.00 H ATOM 95 HB3 PRO A 7 10.193 5.656 -5.120 1.00 0.00 H ATOM 96 HG2 PRO A 7 13.070 6.171 -4.662 1.00 0.00 H ATOM 97 HG3 PRO A 7 11.665 7.178 -4.287 1.00 0.00 H ATOM 98 HD2 PRO A 7 13.074 5.614 -2.438 1.00 0.00 H ATOM 99 HD3 PRO A 7 11.445 6.274 -2.197 1.00 0.00 H ATOM 100 N ALA A 8 13.056 2.378 -4.027 1.00 0.00 N ATOM 101 CA ALA A 8 14.118 1.475 -4.457 1.00 0.00 C ATOM 102 C ALA A 8 13.570 0.070 -4.681 1.00 0.00 C ATOM 103 O ALA A 8 13.921 -0.596 -5.655 1.00 0.00 O ATOM 104 CB ALA A 8 15.225 1.433 -3.402 1.00 0.00 C ATOM 105 H ALA A 8 12.908 2.530 -3.070 1.00 0.00 H ATOM 106 HA ALA A 8 14.534 1.840 -5.384 1.00 0.00 H ATOM 107 HB1 ALA A 8 16.036 2.078 -3.705 1.00 0.00 H ATOM 108 HB2 ALA A 8 15.588 0.420 -3.302 1.00 0.00 H ATOM 109 HB3 ALA A 8 14.832 1.770 -2.455 1.00 0.00 H ATOM 110 N GLY A 9 12.710 -0.376 -3.771 1.00 0.00 N ATOM 111 CA GLY A 9 12.121 -1.705 -3.878 1.00 0.00 C ATOM 112 C GLY A 9 11.019 -1.898 -2.843 1.00 0.00 C ATOM 113 O GLY A 9 10.826 -1.057 -1.964 1.00 0.00 O ATOM 114 H GLY A 9 12.468 0.199 -3.015 1.00 0.00 H ATOM 115 HA2 GLY A 9 11.706 -1.830 -4.867 1.00 0.00 H ATOM 116 HA3 GLY A 9 12.888 -2.447 -3.718 1.00 0.00 H ATOM 117 N GLY A 10 10.298 -3.010 -2.952 1.00 0.00 N ATOM 118 CA GLY A 10 9.216 -3.300 -2.018 1.00 0.00 C ATOM 119 C GLY A 10 9.742 -3.401 -0.590 1.00 0.00 C ATOM 120 O GLY A 10 9.135 -2.875 0.342 1.00 0.00 O ATOM 121 H GLY A 10 10.497 -3.644 -3.673 1.00 0.00 H ATOM 122 HA2 GLY A 10 8.480 -2.512 -2.073 1.00 0.00 H ATOM 123 HA3 GLY A 10 8.755 -4.235 -2.288 1.00 0.00 H ATOM 124 N GLY A 11 10.876 -4.076 -0.428 1.00 0.00 N ATOM 125 CA GLY A 11 11.476 -4.235 0.893 1.00 0.00 C ATOM 126 C GLY A 11 11.428 -2.924 1.669 1.00 0.00 C ATOM 127 O GLY A 11 10.654 -2.779 2.615 1.00 0.00 O ATOM 128 H GLY A 11 11.315 -4.473 -1.208 1.00 0.00 H ATOM 129 HA2 GLY A 11 10.936 -4.995 1.440 1.00 0.00 H ATOM 130 HA3 GLY A 11 12.507 -4.538 0.780 1.00 0.00 H HETATM 131 N DBB A 12 12.261 -1.972 1.266 1.00 0.00 N HETATM 132 CA DBB A 12 12.301 -0.675 1.928 1.00 0.00 C HETATM 133 C DBB A 12 13.206 -0.732 3.154 1.00 0.00 C HETATM 134 O DBB A 12 12.985 -0.017 4.127 1.00 0.00 O HETATM 135 CB DBB A 12 12.805 0.396 0.951 1.00 0.00 C HETATM 136 CG DBB A 12 13.918 1.212 1.610 1.00 0.00 C HETATM 137 H DBB A 12 12.860 -2.143 0.512 1.00 0.00 H HETATM 138 HA DBB A 12 11.307 -0.412 2.243 1.00 0.00 H HETATM 139 HB2 DBB A 12 13.185 -0.081 0.060 1.00 0.00 H HETATM 140 HG1 DBB A 12 13.501 1.785 2.423 1.00 0.00 H HETATM 141 HG2 DBB A 12 14.358 1.877 0.885 1.00 0.00 H HETATM 142 HG3 DBB A 12 14.674 0.542 1.993 1.00 0.00 H HETATM 143 N DAL A 13 14.240 -1.558 3.080 1.00 0.00 N HETATM 144 CA DAL A 13 15.185 -1.673 4.174 1.00 0.00 C HETATM 145 CB DAL A 13 14.433 -1.731 5.508 1.00 0.00 C HETATM 146 C DAL A 13 16.132 -0.469 4.141 1.00 0.00 C HETATM 147 O DAL A 13 15.719 0.627 3.764 1.00 0.00 O HETATM 148 H DAL A 13 14.379 -2.082 2.263 1.00 0.00 H HETATM 149 HA DAL A 13 15.746 -2.588 4.050 1.00 0.00 H HETATM 150 HB1 DAL A 13 13.378 -1.593 5.332 1.00 0.00 H HETATM 151 HB2 DAL A 13 14.591 -2.699 5.961 1.00 0.00 H ATOM 152 N GLU A 14 17.402 -0.662 4.513 1.00 0.00 N ATOM 153 CA GLU A 14 18.367 0.433 4.490 1.00 0.00 C ATOM 154 C GLU A 14 18.394 1.095 3.114 1.00 0.00 C ATOM 155 O GLU A 14 19.053 2.116 2.917 1.00 0.00 O ATOM 156 CB GLU A 14 19.763 -0.094 4.828 1.00 0.00 C ATOM 157 CG GLU A 14 20.240 -1.031 3.716 1.00 0.00 C ATOM 158 CD GLU A 14 21.636 -1.554 4.038 1.00 0.00 C ATOM 159 OE1 GLU A 14 22.223 -1.071 4.993 1.00 0.00 O ATOM 160 OE2 GLU A 14 22.099 -2.430 3.325 1.00 0.00 O1- ATOM 161 H GLU A 14 17.702 -1.546 4.801 1.00 0.00 H ATOM 162 HA GLU A 14 18.086 1.170 5.225 1.00 0.00 H ATOM 163 HB2 GLU A 14 20.449 0.735 4.921 1.00 0.00 H ATOM 164 HB3 GLU A 14 19.725 -0.638 5.759 1.00 0.00 H ATOM 165 HG2 GLU A 14 19.556 -1.862 3.629 1.00 0.00 H ATOM 166 HG3 GLU A 14 20.270 -0.490 2.780 1.00 0.00 H ATOM 167 N GLN A 15 17.675 0.506 2.162 1.00 0.00 N ATOM 168 CA GLN A 15 17.623 1.047 0.810 1.00 0.00 C ATOM 169 C GLN A 15 17.179 2.506 0.833 1.00 0.00 C ATOM 170 O GLN A 15 17.697 3.335 0.085 1.00 0.00 O ATOM 171 CB GLN A 15 16.650 0.230 -0.043 1.00 0.00 C ATOM 172 CG GLN A 15 17.251 -1.148 -0.324 1.00 0.00 C ATOM 173 CD GLN A 15 16.289 -1.974 -1.171 1.00 0.00 C ATOM 174 OE1 GLN A 15 15.801 -1.500 -2.198 1.00 0.00 O ATOM 175 NE2 GLN A 15 15.984 -3.187 -0.801 1.00 0.00 N ATOM 176 H GLN A 15 17.173 -0.306 2.373 1.00 0.00 H ATOM 177 HA GLN A 15 18.607 0.987 0.371 1.00 0.00 H ATOM 178 HB2 GLN A 15 15.714 0.110 0.488 1.00 0.00 H ATOM 179 HB3 GLN A 15 16.472 0.741 -0.977 1.00 0.00 H ATOM 180 HG2 GLN A 15 18.185 -1.030 -0.855 1.00 0.00 H ATOM 181 HG3 GLN A 15 17.433 -1.659 0.609 1.00 0.00 H ATOM 182 HE21 GLN A 15 16.372 -3.562 0.017 1.00 0.00 H ATOM 183 HE22 GLN A 15 15.366 -3.723 -1.340 1.00 0.00 H HETATM 184 N DBB A 16 16.219 2.814 1.698 1.00 0.00 N HETATM 185 CA DBB A 16 15.716 4.179 1.812 1.00 0.00 C HETATM 186 C DBB A 16 14.475 4.217 2.694 1.00 0.00 C HETATM 187 O DBB A 16 14.247 3.309 3.487 1.00 0.00 O HETATM 188 CB DBB A 16 16.794 5.084 2.407 1.00 0.00 C HETATM 189 CG DBB A 16 16.652 6.495 1.833 1.00 0.00 C HETATM 190 H DBB A 16 15.846 2.113 2.272 1.00 0.00 H HETATM 191 HA DBB A 16 15.460 4.541 0.829 1.00 0.00 H HETATM 192 HB2 DBB A 16 17.771 4.692 2.165 1.00 0.00 H HETATM 193 HG1 DBB A 16 16.342 7.173 2.613 1.00 0.00 H HETATM 194 HG2 DBB A 16 15.912 6.488 1.046 1.00 0.00 H HETATM 195 HG3 DBB A 16 17.601 6.817 1.432 1.00 0.00 H ATOM 196 N GLY A 17 13.681 5.275 2.546 1.00 0.00 N ATOM 197 CA GLY A 17 12.463 5.425 3.335 1.00 0.00 C ATOM 198 C GLY A 17 12.139 4.146 4.093 1.00 0.00 C ATOM 199 O GLY A 17 12.818 3.811 5.064 1.00 0.00 O ATOM 200 H GLY A 17 13.920 5.968 1.895 1.00 0.00 H ATOM 201 HA2 GLY A 17 12.598 6.230 4.043 1.00 0.00 H ATOM 202 HA3 GLY A 17 11.642 5.663 2.678 1.00 0.00 H HETATM 203 N DBU A 18 11.110 3.437 3.639 1.00 0.00 N HETATM 204 CA DBU A 18 10.723 2.231 4.258 1.00 0.00 C HETATM 205 CB DBU A 18 9.937 1.195 3.738 1.00 0.00 C HETATM 206 CG DBU A 18 9.332 1.180 2.355 1.00 0.00 C HETATM 207 C DBU A 18 11.276 2.144 5.661 1.00 0.00 C HETATM 208 O DBU A 18 10.635 2.546 6.631 1.00 0.00 O HETATM 209 H DBU A 18 10.607 3.748 2.857 1.00 0.00 H HETATM 210 HB DBU A 18 9.733 0.333 4.358 1.00 0.00 H HETATM 211 HG1 DBU A 18 8.260 1.093 2.430 1.00 0.00 H HETATM 212 HG2 DBU A 18 9.584 2.099 1.845 1.00 0.00 H HETATM 213 HG3 DBU A 18 9.719 0.341 1.796 1.00 0.00 H ATOM 214 N CYS A 19 12.494 1.620 5.768 1.00 0.00 N ATOM 215 CA CYS A 19 13.144 1.481 7.065 1.00 0.00 C ATOM 216 C CYS A 19 14.442 2.282 7.130 1.00 0.00 C ATOM 217 O CYS A 19 14.785 2.830 8.176 1.00 0.00 O ATOM 218 CB CYS A 19 13.441 0.007 7.339 1.00 0.00 C ATOM 219 SG CYS A 19 15.036 -0.434 6.618 1.00 0.00 S ATOM 220 H CYS A 19 12.962 1.328 4.960 1.00 0.00 H ATOM 221 HA CYS A 19 12.476 1.847 7.828 1.00 0.00 H ATOM 222 HB2 CYS A 19 13.473 -0.164 8.403 1.00 0.00 H ATOM 223 HB3 CYS A 19 12.667 -0.607 6.898 1.00 0.00 H ATOM 224 N CYS A 20 15.164 2.339 6.014 1.00 0.00 N ATOM 225 CA CYS A 20 16.425 3.075 5.973 1.00 0.00 C ATOM 226 C CYS A 20 16.313 4.374 6.764 1.00 0.00 C ATOM 227 O CYS A 20 15.410 5.142 6.474 1.00 0.00 O ATOM 228 CB CYS A 20 16.804 3.381 4.522 1.00 0.00 C ATOM 229 SG CYS A 20 16.603 5.153 4.199 1.00 0.00 S ATOM 230 OXT CYS A 20 17.137 4.589 7.636 1.00 0.00 O ATOM 231 H CYS A 20 14.847 1.882 5.208 1.00 0.00 H ATOM 232 HA CYS A 20 17.199 2.463 6.413 1.00 0.00 H ATOM 233 HB2 CYS A 20 17.833 3.099 4.352 1.00 0.00 H ATOM 234 HB3 CYS A 20 16.166 2.819 3.860 1.00 0.00 H TER 235 CYS A 20