ATOM 1 N GLY A 1 8.076 3.915 8.538 1.00 0.00 N ATOM 2 CA GLY A 1 8.782 2.626 8.287 1.00 0.00 C ATOM 3 C GLY A 1 9.304 2.601 6.854 1.00 0.00 C ATOM 4 O GLY A 1 8.557 2.326 5.915 1.00 0.00 O ATOM 5 H1 GLY A 1 8.773 4.658 8.746 1.00 0.00 H ATOM 6 H2 GLY A 1 7.434 3.804 9.349 1.00 0.00 H ATOM 7 H3 GLY A 1 7.529 4.180 7.696 1.00 0.00 H ATOM 8 HA2 GLY A 1 9.610 2.529 8.974 1.00 0.00 H ATOM 9 HA3 GLY A 1 8.095 1.805 8.430 1.00 0.00 H ATOM 10 N ARG A 2 10.592 2.888 6.694 1.00 0.00 N ATOM 11 CA ARG A 2 11.205 2.894 5.371 1.00 0.00 C ATOM 12 C ARG A 2 11.164 1.497 4.761 1.00 0.00 C ATOM 13 O ARG A 2 10.926 1.337 3.564 1.00 0.00 O ATOM 14 CB ARG A 2 12.654 3.371 5.471 1.00 0.00 C ATOM 15 CG ARG A 2 12.680 4.868 5.781 1.00 0.00 C ATOM 16 CD ARG A 2 14.130 5.335 5.927 1.00 0.00 C ATOM 17 NE ARG A 2 14.171 6.761 6.233 1.00 0.00 N ATOM 18 CZ ARG A 2 14.244 7.669 5.266 1.00 0.00 C ATOM 19 NH1 ARG A 2 14.279 7.292 4.018 1.00 0.00 N1+ ATOM 20 NH2 ARG A 2 14.281 8.939 5.565 1.00 0.00 N ATOM 21 H ARG A 2 11.139 3.098 7.480 1.00 0.00 H ATOM 22 HA ARG A 2 10.657 3.572 4.733 1.00 0.00 H ATOM 23 HB2 ARG A 2 13.157 2.829 6.259 1.00 0.00 H ATOM 24 HB3 ARG A 2 13.158 3.191 4.532 1.00 0.00 H ATOM 25 HG2 ARG A 2 12.205 5.410 4.976 1.00 0.00 H ATOM 26 HG3 ARG A 2 12.150 5.054 6.704 1.00 0.00 H ATOM 27 HD2 ARG A 2 14.603 4.787 6.727 1.00 0.00 H ATOM 28 HD3 ARG A 2 14.659 5.148 5.004 1.00 0.00 H ATOM 29 HE ARG A 2 14.145 7.053 7.168 1.00 0.00 H ATOM 30 HH11 ARG A 2 14.252 6.318 3.788 1.00 0.00 H ATOM 31 HH12 ARG A 2 14.335 7.976 3.290 1.00 0.00 H ATOM 32 HH21 ARG A 2 14.253 9.228 6.522 1.00 0.00 H ATOM 33 HH22 ARG A 2 14.336 9.623 4.838 1.00 0.00 H ATOM 34 N ILE A 3 11.393 0.490 5.596 1.00 0.00 N ATOM 35 CA ILE A 3 11.376 -0.894 5.136 1.00 0.00 C ATOM 36 C ILE A 3 9.967 -1.294 4.716 1.00 0.00 C ATOM 37 O ILE A 3 9.785 -2.193 3.895 1.00 0.00 O ATOM 38 CB ILE A 3 11.862 -1.810 6.258 1.00 0.00 C ATOM 39 CG1 ILE A 3 13.327 -1.496 6.562 1.00 0.00 C ATOM 40 CG2 ILE A 3 11.734 -3.270 5.818 1.00 0.00 C ATOM 41 CD1 ILE A 3 13.728 -2.156 7.880 1.00 0.00 C ATOM 42 H ILE A 3 11.574 0.680 6.541 1.00 0.00 H ATOM 43 HA ILE A 3 12.039 -0.996 4.289 1.00 0.00 H ATOM 44 HB ILE A 3 11.264 -1.646 7.143 1.00 0.00 H ATOM 45 HG12 ILE A 3 13.950 -1.875 5.764 1.00 0.00 H ATOM 46 HG13 ILE A 3 13.457 -0.427 6.642 1.00 0.00 H ATOM 47 HG21 ILE A 3 10.689 -3.540 5.771 1.00 0.00 H ATOM 48 HG22 ILE A 3 12.238 -3.906 6.531 1.00 0.00 H ATOM 49 HG23 ILE A 3 12.182 -3.393 4.845 1.00 0.00 H ATOM 50 HD11 ILE A 3 14.787 -2.019 8.044 1.00 0.00 H ATOM 51 HD12 ILE A 3 13.504 -3.211 7.837 1.00 0.00 H ATOM 52 HD13 ILE A 3 13.177 -1.703 8.690 1.00 0.00 H ATOM 53 N ASP A 4 8.971 -0.618 5.281 1.00 0.00 N ATOM 54 CA ASP A 4 7.581 -0.909 4.957 1.00 0.00 C ATOM 55 C ASP A 4 7.306 -0.629 3.482 1.00 0.00 C ATOM 56 O ASP A 4 6.628 -1.405 2.809 1.00 0.00 O ATOM 57 CB ASP A 4 6.651 -0.054 5.821 1.00 0.00 C ATOM 58 CG ASP A 4 5.196 -0.371 5.492 1.00 0.00 C ATOM 59 OD1 ASP A 4 4.971 -1.118 4.555 1.00 0.00 O ATOM 60 OD2 ASP A 4 4.329 0.139 6.182 1.00 0.00 O1- ATOM 61 H ASP A 4 9.178 0.091 5.928 1.00 0.00 H ATOM 62 HA ASP A 4 7.383 -1.951 5.158 1.00 0.00 H ATOM 63 HB2 ASP A 4 6.837 -0.267 6.864 1.00 0.00 H ATOM 64 HB3 ASP A 4 6.842 0.991 5.627 1.00 0.00 H HETATM 65 N DBU A 5 7.841 0.481 2.984 1.00 0.00 N HETATM 66 CA DBU A 5 7.646 0.825 1.630 1.00 0.00 C HETATM 67 CB DBU A 5 7.010 1.950 1.090 1.00 0.00 C HETATM 68 CG DBU A 5 6.381 3.068 1.885 1.00 0.00 C HETATM 69 C DBU A 5 8.244 -0.243 0.746 1.00 0.00 C HETATM 70 O DBU A 5 7.592 -0.776 -0.152 1.00 0.00 O HETATM 71 H DBU A 5 8.377 1.070 3.558 1.00 0.00 H HETATM 72 HB DBU A 5 6.954 2.045 0.016 1.00 0.00 H HETATM 73 HG1 DBU A 5 7.146 3.760 2.204 1.00 0.00 H HETATM 74 HG2 DBU A 5 5.662 3.585 1.267 1.00 0.00 H HETATM 75 HG3 DBU A 5 5.883 2.659 2.751 1.00 0.00 H ATOM 76 N CYS A 6 9.508 -0.561 1.006 1.00 0.00 N ATOM 77 CA CYS A 6 10.203 -1.581 0.229 1.00 0.00 C ATOM 78 C CYS A 6 10.894 -2.573 1.158 1.00 0.00 C ATOM 79 O CYS A 6 12.097 -2.488 1.401 1.00 0.00 O ATOM 80 CB CYS A 6 11.233 -0.927 -0.697 1.00 0.00 C ATOM 81 SG CYS A 6 12.618 -0.288 0.268 1.00 0.00 S ATOM 82 H CYS A 6 9.979 -0.107 1.735 1.00 0.00 H ATOM 83 HA CYS A 6 9.481 -2.112 -0.373 1.00 0.00 H ATOM 84 HB2 CYS A 6 11.601 -1.657 -1.401 1.00 0.00 H ATOM 85 HB3 CYS A 6 10.766 -0.116 -1.234 1.00 0.00 H ATOM 86 N PRO A 7 10.150 -3.507 1.682 1.00 0.00 N ATOM 87 CA PRO A 7 10.690 -4.538 2.612 1.00 0.00 C ATOM 88 C PRO A 7 11.783 -5.376 1.958 1.00 0.00 C ATOM 89 O PRO A 7 11.713 -5.691 0.769 1.00 0.00 O ATOM 90 CB PRO A 7 9.474 -5.406 2.960 1.00 0.00 C ATOM 91 CG PRO A 7 8.274 -4.603 2.576 1.00 0.00 C ATOM 92 CD PRO A 7 8.712 -3.676 1.447 1.00 0.00 C ATOM 93 HA PRO A 7 11.067 -4.072 3.507 1.00 0.00 H ATOM 94 HB2 PRO A 7 9.503 -6.329 2.399 1.00 0.00 H ATOM 95 HB3 PRO A 7 9.454 -5.612 4.019 1.00 0.00 H ATOM 96 HG2 PRO A 7 7.483 -5.259 2.236 1.00 0.00 H ATOM 97 HG3 PRO A 7 7.935 -4.016 3.415 1.00 0.00 H ATOM 98 HD2 PRO A 7 8.533 -4.139 0.485 1.00 0.00 H ATOM 99 HD3 PRO A 7 8.208 -2.726 1.515 1.00 0.00 H ATOM 100 N ALA A 8 12.792 -5.735 2.743 1.00 0.00 N ATOM 101 CA ALA A 8 13.897 -6.537 2.232 1.00 0.00 C ATOM 102 C ALA A 8 14.447 -5.939 0.940 1.00 0.00 C ATOM 103 O ALA A 8 15.178 -6.600 0.204 1.00 0.00 O ATOM 104 CB ALA A 8 13.427 -7.969 1.972 1.00 0.00 C ATOM 105 H ALA A 8 12.793 -5.452 3.682 1.00 0.00 H ATOM 106 HA ALA A 8 14.684 -6.559 2.971 1.00 0.00 H ATOM 107 HB1 ALA A 8 13.270 -8.110 0.912 1.00 0.00 H ATOM 108 HB2 ALA A 8 12.500 -8.146 2.498 1.00 0.00 H ATOM 109 HB3 ALA A 8 14.177 -8.664 2.321 1.00 0.00 H ATOM 110 N GLY A 9 14.092 -4.686 0.670 1.00 0.00 N ATOM 111 CA GLY A 9 14.564 -4.016 -0.537 1.00 0.00 C ATOM 112 C GLY A 9 16.013 -3.570 -0.380 1.00 0.00 C ATOM 113 O GLY A 9 16.673 -3.218 -1.357 1.00 0.00 O ATOM 114 H GLY A 9 13.508 -4.203 1.292 1.00 0.00 H ATOM 115 HA2 GLY A 9 14.488 -4.698 -1.372 1.00 0.00 H ATOM 116 HA3 GLY A 9 13.946 -3.150 -0.729 1.00 0.00 H ATOM 117 N GLY A 10 16.501 -3.586 0.857 1.00 0.00 N ATOM 118 CA GLY A 10 17.875 -3.180 1.130 1.00 0.00 C ATOM 119 C GLY A 10 18.091 -1.720 0.759 1.00 0.00 C ATOM 120 O GLY A 10 18.030 -0.836 1.615 1.00 0.00 O ATOM 121 H GLY A 10 15.929 -3.877 1.598 1.00 0.00 H ATOM 122 HA2 GLY A 10 18.084 -3.317 2.181 1.00 0.00 H ATOM 123 HA3 GLY A 10 18.547 -3.792 0.553 1.00 0.00 H ATOM 124 N GLY A 11 18.337 -1.471 -0.522 1.00 0.00 N ATOM 125 CA GLY A 11 18.553 -0.110 -0.992 1.00 0.00 C ATOM 126 C GLY A 11 17.327 0.743 -0.709 1.00 0.00 C ATOM 127 O GLY A 11 17.437 1.912 -0.341 1.00 0.00 O ATOM 128 H GLY A 11 18.369 -2.213 -1.162 1.00 0.00 H ATOM 129 HA2 GLY A 11 19.411 0.313 -0.489 1.00 0.00 H ATOM 130 HA3 GLY A 11 18.730 -0.124 -2.058 1.00 0.00 H HETATM 131 N DBB A 12 16.160 0.143 -0.896 1.00 0.00 N HETATM 132 CA DBB A 12 14.910 0.844 -0.674 1.00 0.00 C HETATM 133 C DBB A 12 14.941 2.156 -1.445 1.00 0.00 C HETATM 134 O DBB A 12 14.368 3.160 -1.026 1.00 0.00 O HETATM 135 CB DBB A 12 13.740 -0.047 -1.130 1.00 0.00 C HETATM 136 CG DBB A 12 13.014 0.595 -2.313 1.00 0.00 C HETATM 137 H DBB A 12 16.143 -0.783 -1.200 1.00 0.00 H HETATM 138 HA DBB A 12 14.803 1.053 0.379 1.00 0.00 H HETATM 139 HB2 DBB A 12 14.118 -1.014 -1.440 1.00 0.00 H HETATM 140 HG1 DBB A 12 12.555 1.518 -1.994 1.00 0.00 H HETATM 141 HG2 DBB A 12 12.254 -0.078 -2.678 1.00 0.00 H HETATM 142 HG3 DBB A 12 13.724 0.802 -3.101 1.00 0.00 H HETATM 143 N DAL A 13 15.635 2.129 -2.573 1.00 0.00 N HETATM 144 CA DAL A 13 15.766 3.309 -3.408 1.00 0.00 C HETATM 145 CB DAL A 13 16.268 4.474 -2.564 1.00 0.00 C HETATM 146 C DAL A 13 14.418 3.648 -4.048 1.00 0.00 C HETATM 147 O DAL A 13 13.385 3.133 -3.621 1.00 0.00 O HETATM 148 H DAL A 13 16.076 1.296 -2.845 1.00 0.00 H HETATM 149 HA DAL A 13 16.489 3.100 -4.180 1.00 0.00 H HETATM 150 HB1 DAL A 13 16.059 4.282 -1.522 1.00 0.00 H HETATM 151 HB2 DAL A 13 17.333 4.574 -2.700 1.00 0.00 H ATOM 152 N GLU A 14 14.418 4.496 -5.080 1.00 0.00 N ATOM 153 CA GLU A 14 13.172 4.842 -5.747 1.00 0.00 C ATOM 154 C GLU A 14 12.326 3.583 -5.932 1.00 0.00 C ATOM 155 O GLU A 14 11.117 3.657 -6.142 1.00 0.00 O ATOM 156 CB GLU A 14 13.462 5.475 -7.108 1.00 0.00 C ATOM 157 CG GLU A 14 14.085 4.428 -8.034 1.00 0.00 C ATOM 158 CD GLU A 14 14.436 5.059 -9.378 1.00 0.00 C ATOM 159 OE1 GLU A 14 15.390 5.818 -9.422 1.00 0.00 O ATOM 160 OE2 GLU A 14 13.748 4.771 -10.343 1.00 0.00 O1- ATOM 161 H GLU A 14 15.259 4.883 -5.404 1.00 0.00 H ATOM 162 HA GLU A 14 12.626 5.548 -5.137 1.00 0.00 H ATOM 163 HB2 GLU A 14 12.541 5.839 -7.542 1.00 0.00 H ATOM 164 HB3 GLU A 14 14.151 6.298 -6.985 1.00 0.00 H ATOM 165 HG2 GLU A 14 14.981 4.034 -7.578 1.00 0.00 H ATOM 166 HG3 GLU A 14 13.379 3.624 -8.192 1.00 0.00 H ATOM 167 N GLN A 15 12.984 2.428 -5.842 1.00 0.00 N ATOM 168 CA GLN A 15 12.302 1.148 -5.989 1.00 0.00 C ATOM 169 C GLN A 15 11.152 1.031 -4.994 1.00 0.00 C ATOM 170 O GLN A 15 10.343 0.106 -5.071 1.00 0.00 O ATOM 171 CB GLN A 15 13.298 0.003 -5.762 1.00 0.00 C ATOM 172 CG GLN A 15 14.274 -0.065 -6.937 1.00 0.00 C ATOM 173 CD GLN A 15 15.314 -1.153 -6.687 1.00 0.00 C ATOM 174 OE1 GLN A 15 16.074 -1.077 -5.724 1.00 0.00 O ATOM 175 NE2 GLN A 15 15.389 -2.168 -7.504 1.00 0.00 N ATOM 176 H GLN A 15 13.948 2.437 -5.670 1.00 0.00 H ATOM 177 HA GLN A 15 11.908 1.072 -6.992 1.00 0.00 H ATOM 178 HB2 GLN A 15 13.850 0.181 -4.846 1.00 0.00 H ATOM 179 HB3 GLN A 15 12.763 -0.932 -5.684 1.00 0.00 H ATOM 180 HG2 GLN A 15 13.729 -0.289 -7.842 1.00 0.00 H ATOM 181 HG3 GLN A 15 14.772 0.886 -7.044 1.00 0.00 H ATOM 182 HE21 GLN A 15 14.782 -2.228 -8.272 1.00 0.00 H ATOM 183 HE22 GLN A 15 16.054 -2.872 -7.350 1.00 0.00 H HETATM 184 N DBB A 16 11.082 1.976 -4.060 1.00 0.00 N HETATM 185 CA DBB A 16 10.024 1.968 -3.056 1.00 0.00 C HETATM 186 C DBB A 16 10.553 2.464 -1.714 1.00 0.00 C HETATM 187 O DBB A 16 11.492 3.260 -1.663 1.00 0.00 O HETATM 188 CB DBB A 16 8.867 2.861 -3.510 1.00 0.00 C HETATM 189 CG DBB A 16 8.017 2.092 -4.520 1.00 0.00 C HETATM 190 H DBB A 16 11.754 2.690 -4.048 1.00 0.00 H HETATM 191 HA DBB A 16 9.660 0.958 -2.938 1.00 0.00 H HETATM 192 HB2 DBB A 16 8.251 3.132 -2.662 1.00 0.00 H HETATM 193 HG1 DBB A 16 7.105 2.637 -4.712 1.00 0.00 H HETATM 194 HG2 DBB A 16 7.777 1.117 -4.119 1.00 0.00 H HETATM 195 HG3 DBB A 16 8.570 1.976 -5.440 1.00 0.00 H ATOM 196 N GLY A 17 9.946 1.988 -0.632 1.00 0.00 N ATOM 197 CA GLY A 17 10.365 2.390 0.706 1.00 0.00 C ATOM 198 C GLY A 17 11.853 2.716 0.732 1.00 0.00 C ATOM 199 O GLY A 17 12.622 2.204 -0.077 1.00 0.00 O ATOM 200 H GLY A 17 9.205 1.354 -0.735 1.00 0.00 H ATOM 201 HA2 GLY A 17 9.803 3.261 1.008 1.00 0.00 H ATOM 202 HA3 GLY A 17 10.170 1.583 1.396 1.00 0.00 H HETATM 203 N DBU A 18 12.257 3.572 1.661 1.00 0.00 N HETATM 204 CA DBU A 18 13.629 3.890 1.702 1.00 0.00 C HETATM 205 CB DBU A 18 14.703 3.112 2.160 1.00 0.00 C HETATM 206 CG DBU A 18 14.615 1.715 2.730 1.00 0.00 C HETATM 207 C DBU A 18 13.874 5.275 1.152 1.00 0.00 C HETATM 208 O DBU A 18 14.127 6.221 1.897 1.00 0.00 O HETATM 209 H DBU A 18 11.613 3.961 2.290 1.00 0.00 H HETATM 210 HB DBU A 18 15.695 3.532 2.109 1.00 0.00 H HETATM 211 HG1 DBU A 18 14.875 1.736 3.777 1.00 0.00 H HETATM 212 HG2 DBU A 18 13.607 1.347 2.617 1.00 0.00 H HETATM 213 HG3 DBU A 18 15.298 1.063 2.203 1.00 0.00 H ATOM 214 N CYS A 19 13.803 5.397 -0.171 1.00 0.00 N ATOM 215 CA CYS A 19 14.026 6.684 -0.820 1.00 0.00 C ATOM 216 C CYS A 19 13.008 6.925 -1.932 1.00 0.00 C ATOM 217 O CYS A 19 13.218 7.771 -2.802 1.00 0.00 O ATOM 218 CB CYS A 19 15.440 6.730 -1.404 1.00 0.00 C ATOM 219 SG CYS A 19 15.441 6.001 -3.055 1.00 0.00 S ATOM 220 H CYS A 19 13.601 4.611 -0.719 1.00 0.00 H ATOM 221 HA CYS A 19 13.932 7.468 -0.084 1.00 0.00 H ATOM 222 HB2 CYS A 19 15.776 7.749 -1.462 1.00 0.00 H ATOM 223 HB3 CYS A 19 16.108 6.167 -0.769 1.00 0.00 H ATOM 224 N CYS A 20 11.905 6.182 -1.902 1.00 0.00 N ATOM 225 CA CYS A 20 10.871 6.340 -2.919 1.00 0.00 C ATOM 226 C CYS A 20 10.270 7.739 -2.856 1.00 0.00 C ATOM 227 O CYS A 20 10.080 8.231 -1.756 1.00 0.00 O ATOM 228 CB CYS A 20 9.762 5.304 -2.721 1.00 0.00 C ATOM 229 SG CYS A 20 9.545 4.364 -4.253 1.00 0.00 S ATOM 230 OXT CYS A 20 10.008 8.298 -3.908 1.00 0.00 O ATOM 231 H CYS A 20 11.785 5.520 -1.188 1.00 0.00 H ATOM 232 HA CYS A 20 11.313 6.193 -3.893 1.00 0.00 H ATOM 233 HB2 CYS A 20 10.031 4.636 -1.919 1.00 0.00 H ATOM 234 HB3 CYS A 20 8.840 5.809 -2.475 1.00 0.00 H TER 235 CYS A 20