HETATM 1 C ACE A 1 3.355 4.087 6.785 1.00 0.00 C HETATM 2 O ACE A 1 3.373 3.026 6.159 1.00 0.00 O HETATM 3 CH3 ACE A 1 4.007 4.180 8.160 1.00 0.00 C HETATM 4 H1 ACE A 1 4.449 3.210 8.455 1.00 0.00 H HETATM 5 H2 ACE A 1 4.823 4.926 8.170 1.00 0.00 H HETATM 6 H3 ACE A 1 3.275 4.459 8.940 1.00 0.00 H ATOM 7 N ILE A 2 2.787 5.218 6.342 1.00 0.00 N ATOM 8 CA ILE A 2 2.102 5.346 5.027 1.00 0.00 C ATOM 9 C ILE A 2 2.790 6.456 4.182 1.00 0.00 C ATOM 10 O ILE A 2 3.062 7.556 4.679 1.00 0.00 O ATOM 11 CB ILE A 2 0.545 5.481 5.185 1.00 0.00 C ATOM 12 CG1 ILE A 2 -0.193 5.292 3.825 1.00 0.00 C ATOM 13 CG2 ILE A 2 0.090 6.780 5.903 1.00 0.00 C ATOM 14 CD1 ILE A 2 -1.705 5.034 3.914 1.00 0.00 C ATOM 15 H ILE A 2 2.864 6.014 6.972 1.00 0.00 H ATOM 16 HA ILE A 2 2.300 4.410 4.494 1.00 0.00 H ATOM 17 HB ILE A 2 0.225 4.636 5.828 1.00 0.00 H ATOM 18 HG12 ILE A 2 -0.014 6.168 3.171 1.00 0.00 H ATOM 19 HG13 ILE A 2 0.252 4.438 3.280 1.00 0.00 H ATOM 20 HG21 ILE A 2 -0.994 6.780 6.116 1.00 0.00 H ATOM 21 HG22 ILE A 2 0.597 6.908 6.878 1.00 0.00 H ATOM 22 HG23 ILE A 2 0.307 7.683 5.302 1.00 0.00 H ATOM 23 HD11 ILE A 2 -2.246 5.872 4.389 1.00 0.00 H ATOM 24 HD12 ILE A 2 -2.139 4.907 2.907 1.00 0.00 H ATOM 25 HD13 ILE A 2 -1.931 4.117 4.489 1.00 0.00 H ATOM 26 N TRP A 3 3.048 6.156 2.892 1.00 0.00 N ATOM 27 CA TRP A 3 3.743 7.104 1.974 1.00 0.00 C ATOM 28 C TRP A 3 3.020 7.128 0.595 1.00 0.00 C ATOM 29 O TRP A 3 3.521 6.615 -0.413 1.00 0.00 O ATOM 30 CB TRP A 3 5.257 6.749 1.850 1.00 0.00 C ATOM 31 CG TRP A 3 6.031 6.414 3.137 1.00 0.00 C ATOM 32 CD1 TRP A 3 6.503 7.325 4.095 1.00 0.00 C ATOM 33 CD2 TRP A 3 6.228 5.163 3.690 1.00 0.00 C ATOM 34 NE1 TRP A 3 7.063 6.673 5.212 1.00 0.00 N ATOM 35 CE2 TRP A 3 6.870 5.328 4.942 1.00 0.00 C ATOM 36 CE3 TRP A 3 5.770 3.886 3.280 1.00 0.00 C ATOM 37 CZ2 TRP A 3 7.100 4.204 5.774 1.00 0.00 C ATOM 38 CZ3 TRP A 3 6.022 2.792 4.107 1.00 0.00 C ATOM 39 CH2 TRP A 3 6.684 2.946 5.332 1.00 0.00 C ATOM 40 H TRP A 3 2.760 5.220 2.585 1.00 0.00 H ATOM 41 HA TRP A 3 3.700 8.135 2.380 1.00 0.00 H ATOM 42 HB2 TRP A 3 5.368 5.894 1.161 1.00 0.00 H ATOM 43 HB3 TRP A 3 5.776 7.576 1.332 1.00 0.00 H ATOM 44 HD1 TRP A 3 6.298 8.381 4.049 1.00 0.00 H ATOM 45 HE1 TRP A 3 7.397 7.095 6.084 1.00 0.00 H ATOM 46 HE3 TRP A 3 5.181 3.787 2.377 1.00 0.00 H ATOM 47 HZ2 TRP A 3 7.564 4.318 6.742 1.00 0.00 H ATOM 48 HZ3 TRP A 3 5.671 1.816 3.816 1.00 0.00 H ATOM 49 HH2 TRP A 3 6.842 2.081 5.960 1.00 0.00 H ATOM 50 N GLY A 4 1.819 7.730 0.571 1.00 0.00 N ATOM 51 CA GLY A 4 1.004 7.839 -0.669 1.00 0.00 C ATOM 52 C GLY A 4 0.004 6.686 -0.886 1.00 0.00 C ATOM 53 O GLY A 4 -1.205 6.883 -0.738 1.00 0.00 O ATOM 54 H GLY A 4 1.462 7.904 1.520 1.00 0.00 H ATOM 55 HA2 GLY A 4 0.441 8.790 -0.640 1.00 0.00 H ATOM 56 HA3 GLY A 4 1.643 7.948 -1.570 1.00 0.00 H ATOM 57 N ASP A 5 0.518 5.496 -1.249 1.00 0.00 N ATOM 58 CA ASP A 5 -0.318 4.294 -1.516 1.00 0.00 C ATOM 59 C ASP A 5 -0.962 3.674 -0.233 1.00 0.00 C ATOM 60 O ASP A 5 -0.278 3.439 0.768 1.00 0.00 O ATOM 61 CB ASP A 5 0.478 3.275 -2.381 1.00 0.00 C ATOM 62 CG ASP A 5 1.636 2.477 -1.739 1.00 0.00 C ATOM 63 OD1 ASP A 5 1.408 1.354 -1.281 1.00 0.00 O ATOM 64 H ASP A 5 1.542 5.470 -1.289 1.00 0.00 H ATOM 65 HA ASP A 5 -1.136 4.637 -2.184 1.00 0.00 H ATOM 66 HB2 ASP A 5 -0.244 2.532 -2.771 1.00 0.00 H ATOM 67 HB3 ASP A 5 0.842 3.775 -3.300 1.00 0.00 H ATOM 68 N SER A 6 -2.285 3.420 -0.295 1.00 0.00 N ATOM 69 CA SER A 6 -3.069 2.839 0.817 1.00 0.00 C ATOM 70 C SER A 6 -3.411 1.355 0.506 1.00 0.00 C ATOM 71 O SER A 6 -4.405 1.039 -0.158 1.00 0.00 O ATOM 72 CB SER A 6 -4.316 3.714 1.090 1.00 0.00 C ATOM 73 OG SER A 6 -4.992 3.265 2.260 1.00 0.00 O ATOM 74 H SER A 6 -2.703 3.518 -1.215 1.00 0.00 H ATOM 75 HA SER A 6 -2.466 2.892 1.732 1.00 0.00 H ATOM 76 HB2 SER A 6 -4.031 4.774 1.237 1.00 0.00 H ATOM 77 HB3 SER A 6 -5.018 3.701 0.234 1.00 0.00 H ATOM 78 HG SER A 6 -5.761 3.832 2.364 1.00 0.00 H ATOM 79 N GLY A 7 -2.549 0.458 0.999 1.00 0.00 N ATOM 80 CA GLY A 7 -2.704 -1.001 0.810 1.00 0.00 C ATOM 81 C GLY A 7 -1.468 -1.699 1.394 1.00 0.00 C ATOM 82 O GLY A 7 -1.435 -2.002 2.590 1.00 0.00 O ATOM 83 H GLY A 7 -1.719 0.878 1.430 1.00 0.00 H ATOM 84 HA2 GLY A 7 -3.612 -1.357 1.333 1.00 0.00 H ATOM 85 HA3 GLY A 7 -2.847 -1.250 -0.260 1.00 0.00 H ATOM 86 N LYS A 8 -0.453 -1.939 0.544 1.00 0.00 N ATOM 87 CA LYS A 8 0.824 -2.566 0.960 1.00 0.00 C ATOM 88 C LYS A 8 1.729 -1.437 1.529 1.00 0.00 C ATOM 89 O LYS A 8 2.150 -0.544 0.785 1.00 0.00 O ATOM 90 CB LYS A 8 1.510 -3.299 -0.224 1.00 0.00 C ATOM 91 CG LYS A 8 0.788 -4.575 -0.714 1.00 0.00 C ATOM 92 CD LYS A 8 1.535 -5.276 -1.866 1.00 0.00 C ATOM 93 CE LYS A 8 0.814 -6.548 -2.349 1.00 0.00 C ATOM 94 NZ LYS A 8 1.558 -7.192 -3.452 1.00 0.00 N ATOM 95 H LYS A 8 -0.624 -1.700 -0.432 1.00 0.00 H ATOM 96 HA LYS A 8 0.604 -3.321 1.733 1.00 0.00 H ATOM 97 HB2 LYS A 8 1.650 -2.598 -1.071 1.00 0.00 H ATOM 98 HB3 LYS A 8 2.536 -3.583 0.082 1.00 0.00 H ATOM 99 HG2 LYS A 8 0.667 -5.277 0.135 1.00 0.00 H ATOM 100 HG3 LYS A 8 -0.239 -4.318 -1.039 1.00 0.00 H ATOM 101 HD2 LYS A 8 1.654 -4.567 -2.709 1.00 0.00 H ATOM 102 HD3 LYS A 8 2.562 -5.528 -1.535 1.00 0.00 H ATOM 103 HE2 LYS A 8 0.696 -7.266 -1.514 1.00 0.00 H ATOM 104 HE3 LYS A 8 -0.212 -6.304 -2.688 1.00 0.00 H ATOM 105 HZ1 LYS A 8 1.660 -6.567 -4.259 1.00 0.00 H ATOM 106 HZ2 LYS A 8 2.506 -7.463 -3.165 1.00 0.00 H ATOM 107 HZ3 LYS A 8 1.093 -8.043 -3.788 1.00 0.00 H ATOM 108 N LEU A 9 2.026 -1.481 2.842 1.00 0.00 N ATOM 109 CA LEU A 9 2.855 -0.435 3.510 1.00 0.00 C ATOM 110 C LEU A 9 4.390 -0.672 3.346 1.00 0.00 C ATOM 111 O LEU A 9 5.108 -1.037 4.282 1.00 0.00 O ATOM 112 CB LEU A 9 2.406 -0.258 4.991 1.00 0.00 C ATOM 113 CG LEU A 9 0.928 0.151 5.268 1.00 0.00 C ATOM 114 CD1 LEU A 9 0.677 0.250 6.784 1.00 0.00 C ATOM 115 CD2 LEU A 9 0.503 1.470 4.587 1.00 0.00 C ATOM 116 H LEU A 9 1.611 -2.262 3.360 1.00 0.00 H ATOM 117 HA LEU A 9 2.645 0.544 3.033 1.00 0.00 H ATOM 118 HB2 LEU A 9 2.626 -1.195 5.539 1.00 0.00 H ATOM 119 HB3 LEU A 9 3.067 0.496 5.462 1.00 0.00 H ATOM 120 HG LEU A 9 0.269 -0.649 4.879 1.00 0.00 H ATOM 121 HD11 LEU A 9 1.290 1.041 7.257 1.00 0.00 H ATOM 122 HD12 LEU A 9 -0.382 0.477 7.012 1.00 0.00 H ATOM 123 HD13 LEU A 9 0.914 -0.701 7.300 1.00 0.00 H ATOM 124 HD21 LEU A 9 0.559 1.402 3.485 1.00 0.00 H ATOM 125 HD22 LEU A 9 -0.542 1.739 4.827 1.00 0.00 H ATOM 126 HD23 LEU A 9 1.138 2.319 4.897 1.00 0.00 H ATOM 127 N ILE A 10 4.865 -0.434 2.113 1.00 0.00 N ATOM 128 CA ILE A 10 6.290 -0.558 1.705 1.00 0.00 C ATOM 129 C ILE A 10 6.377 0.293 0.397 1.00 0.00 C ATOM 130 O ILE A 10 6.294 -0.234 -0.716 1.00 0.00 O ATOM 131 CB ILE A 10 6.816 -2.043 1.653 1.00 0.00 C ATOM 132 CG1 ILE A 10 8.365 -2.175 1.593 1.00 0.00 C ATOM 133 CG2 ILE A 10 6.113 -3.005 0.659 1.00 0.00 C ATOM 134 CD1 ILE A 10 9.073 -1.758 0.292 1.00 0.00 C ATOM 135 H ILE A 10 4.144 -0.138 1.444 1.00 0.00 H ATOM 136 HA ILE A 10 6.899 -0.045 2.478 1.00 0.00 H ATOM 137 HB ILE A 10 6.569 -2.465 2.647 1.00 0.00 H ATOM 138 HG12 ILE A 10 8.809 -1.604 2.430 1.00 0.00 H ATOM 139 HG13 ILE A 10 8.639 -3.225 1.807 1.00 0.00 H ATOM 140 HG21 ILE A 10 6.320 -2.750 -0.397 1.00 0.00 H ATOM 141 HG22 ILE A 10 6.443 -4.051 0.804 1.00 0.00 H ATOM 142 HG23 ILE A 10 5.015 -2.998 0.788 1.00 0.00 H ATOM 143 HD11 ILE A 10 10.155 -1.976 0.344 1.00 0.00 H ATOM 144 HD12 ILE A 10 8.674 -2.299 -0.586 1.00 0.00 H ATOM 145 HD13 ILE A 10 8.972 -0.677 0.093 1.00 0.00 H HETATM 146 N DAB A 11 6.510 1.627 0.549 1.00 0.00 N HETATM 147 CA DAB A 11 6.584 2.579 -0.594 1.00 0.00 C HETATM 148 C DAB A 11 7.681 3.624 -0.207 1.00 0.00 C HETATM 149 O DAB A 11 7.360 4.589 0.491 1.00 0.00 O HETATM 150 CB DAB A 11 5.200 3.250 -0.869 1.00 0.00 C HETATM 151 CG DAB A 11 4.069 2.301 -1.332 1.00 0.00 C HETATM 152 ND DAB A 11 2.856 3.040 -1.749 1.00 0.00 N HETATM 153 H DAB A 11 6.553 1.951 1.522 1.00 0.00 H HETATM 154 HA DAB A 11 6.836 2.054 -1.539 1.00 0.00 H HETATM 155 HB2 DAB A 11 4.857 3.802 0.028 1.00 0.00 H HETATM 156 HB3 DAB A 11 5.346 4.030 -1.642 1.00 0.00 H HETATM 157 HG2 DAB A 11 4.417 1.685 -2.184 1.00 0.00 H HETATM 158 HG3 DAB A 11 3.833 1.586 -0.520 1.00 0.00 H HETATM 159 HD2 DAB A 11 2.899 3.977 -2.161 1.00 0.00 H ATOM 160 N THR A 12 8.966 3.471 -0.622 1.00 0.00 N ATOM 161 CA THR A 12 10.042 4.449 -0.264 1.00 0.00 C ATOM 162 C THR A 12 9.890 5.766 -1.095 1.00 0.00 C ATOM 163 O THR A 12 10.333 5.850 -2.245 1.00 0.00 O ATOM 164 CB THR A 12 11.460 3.804 -0.399 1.00 0.00 C ATOM 165 OG1 THR A 12 11.511 2.554 0.286 1.00 0.00 O ATOM 166 CG2 THR A 12 12.594 4.665 0.189 1.00 0.00 C ATOM 167 H THR A 12 9.254 2.529 -0.906 1.00 0.00 H ATOM 168 HA THR A 12 9.928 4.680 0.814 1.00 0.00 H ATOM 169 HB THR A 12 11.695 3.626 -1.466 1.00 0.00 H ATOM 170 HG1 THR A 12 12.418 2.249 0.215 1.00 0.00 H ATOM 171 HG21 THR A 12 13.575 4.169 0.082 1.00 0.00 H ATOM 172 HG22 THR A 12 12.672 5.644 -0.322 1.00 0.00 H ATOM 173 HG23 THR A 12 12.442 4.866 1.266 1.00 0.00 H ATOM 174 N THR A 13 9.250 6.781 -0.485 1.00 0.00 N ATOM 175 CA THR A 13 9.004 8.104 -1.119 1.00 0.00 C ATOM 176 C THR A 13 8.791 9.163 0.005 1.00 0.00 C ATOM 177 O THR A 13 7.983 8.970 0.921 1.00 0.00 O ATOM 178 CB THR A 13 7.851 8.068 -2.177 1.00 0.00 C ATOM 179 OG1 THR A 13 7.763 9.329 -2.830 1.00 0.00 O ATOM 180 CG2 THR A 13 6.442 7.697 -1.676 1.00 0.00 C ATOM 181 H THR A 13 8.883 6.554 0.447 1.00 0.00 H ATOM 182 HA THR A 13 9.924 8.374 -1.678 1.00 0.00 H ATOM 183 HB THR A 13 8.126 7.325 -2.949 1.00 0.00 H ATOM 184 HG1 THR A 13 7.380 9.934 -2.190 1.00 0.00 H ATOM 185 HG21 THR A 13 6.431 6.706 -1.185 1.00 0.00 H ATOM 186 HG22 THR A 13 6.053 8.432 -0.948 1.00 0.00 H ATOM 187 HG23 THR A 13 5.718 7.651 -2.510 1.00 0.00 H ATOM 188 N ALA A 14 9.503 10.302 -0.092 1.00 0.00 N ATOM 189 CA ALA A 14 9.407 11.400 0.901 1.00 0.00 C ATOM 190 C ALA A 14 8.229 12.346 0.563 1.00 0.00 C ATOM 191 O ALA A 14 8.325 13.353 -0.139 1.00 0.00 O ATOM 192 CB ALA A 14 10.764 12.128 0.960 1.00 0.00 C ATOM 193 OXT ALA A 14 7.052 11.914 1.121 1.00 0.00 O ATOM 194 H ALA A 14 10.138 10.352 -0.896 1.00 0.00 H ATOM 195 HA ALA A 14 9.236 10.981 1.912 1.00 0.00 H ATOM 196 HB1 ALA A 14 10.753 12.941 1.709 1.00 0.00 H ATOM 197 HB2 ALA A 14 11.585 11.444 1.248 1.00 0.00 H ATOM 198 HB3 ALA A 14 11.040 12.585 -0.010 1.00 0.00 H ATOM 199 HXT ALA A 14 7.163 11.089 1.599 1.00 0.00 H TER 200 ALA A 14