HETATM 1 C ACE A 1 -9.215 0.938 7.251 1.00 0.00 C HETATM 2 O ACE A 1 -8.939 -0.151 7.759 1.00 0.00 O HETATM 3 CH3 ACE A 1 -9.578 2.131 8.129 1.00 0.00 C HETATM 4 H1 ACE A 1 -10.585 2.520 7.892 1.00 0.00 H HETATM 5 H2 ACE A 1 -9.577 1.852 9.199 1.00 0.00 H HETATM 6 H3 ACE A 1 -8.854 2.957 8.006 1.00 0.00 H ATOM 7 N ILE A 2 -9.220 1.175 5.932 1.00 0.00 N ATOM 8 CA ILE A 2 -8.887 0.140 4.908 1.00 0.00 C ATOM 9 C ILE A 2 -7.564 0.588 4.228 1.00 0.00 C ATOM 10 O ILE A 2 -7.535 1.426 3.322 1.00 0.00 O ATOM 11 CB ILE A 2 -10.104 -0.165 3.977 1.00 0.00 C ATOM 12 CG1 ILE A 2 -9.984 -1.476 3.144 1.00 0.00 C ATOM 13 CG2 ILE A 2 -10.649 1.011 3.127 1.00 0.00 C ATOM 14 CD1 ILE A 2 -8.972 -1.509 1.984 1.00 0.00 C ATOM 15 H ILE A 2 -9.392 2.150 5.673 1.00 0.00 H ATOM 16 HA ILE A 2 -8.707 -0.829 5.422 1.00 0.00 H ATOM 17 HB ILE A 2 -10.898 -0.393 4.708 1.00 0.00 H ATOM 18 HG12 ILE A 2 -9.758 -2.319 3.826 1.00 0.00 H ATOM 19 HG13 ILE A 2 -10.980 -1.723 2.731 1.00 0.00 H ATOM 20 HG21 ILE A 2 -11.593 0.743 2.617 1.00 0.00 H ATOM 21 HG22 ILE A 2 -10.866 1.901 3.745 1.00 0.00 H ATOM 22 HG23 ILE A 2 -9.936 1.327 2.343 1.00 0.00 H ATOM 23 HD11 ILE A 2 -9.040 -2.462 1.428 1.00 0.00 H ATOM 24 HD12 ILE A 2 -9.147 -0.697 1.257 1.00 0.00 H ATOM 25 HD13 ILE A 2 -7.928 -1.422 2.337 1.00 0.00 H ATOM 26 N TRP A 3 -6.472 -0.016 4.711 1.00 0.00 N ATOM 27 CA TRP A 3 -5.098 0.269 4.251 1.00 0.00 C ATOM 28 C TRP A 3 -4.613 -0.817 3.252 1.00 0.00 C ATOM 29 O TRP A 3 -4.324 -1.955 3.641 1.00 0.00 O ATOM 30 CB TRP A 3 -4.151 0.386 5.481 1.00 0.00 C ATOM 31 CG TRP A 3 -4.300 1.674 6.311 1.00 0.00 C ATOM 32 CD1 TRP A 3 -5.392 2.007 7.148 1.00 0.00 C ATOM 33 CD2 TRP A 3 -3.423 2.743 6.406 1.00 0.00 C ATOM 34 NE1 TRP A 3 -5.216 3.261 7.762 1.00 0.00 N ATOM 35 CE2 TRP A 3 -3.989 3.699 7.290 1.00 0.00 C ATOM 36 CE3 TRP A 3 -2.164 2.989 5.798 1.00 0.00 C ATOM 37 CZ2 TRP A 3 -3.299 4.902 7.572 1.00 0.00 C ATOM 38 CZ3 TRP A 3 -1.501 4.181 6.093 1.00 0.00 C ATOM 39 CH2 TRP A 3 -2.059 5.123 6.966 1.00 0.00 C ATOM 40 H TRP A 3 -6.668 -0.569 5.543 1.00 0.00 H ATOM 41 HA TRP A 3 -5.089 1.255 3.761 1.00 0.00 H ATOM 42 HB2 TRP A 3 -4.265 -0.493 6.145 1.00 0.00 H ATOM 43 HB3 TRP A 3 -3.101 0.319 5.136 1.00 0.00 H ATOM 44 HD1 TRP A 3 -6.274 1.393 7.274 1.00 0.00 H ATOM 45 HE1 TRP A 3 -5.853 3.746 8.405 1.00 0.00 H ATOM 46 HE3 TRP A 3 -1.720 2.273 5.121 1.00 0.00 H ATOM 47 HZ2 TRP A 3 -3.719 5.637 8.243 1.00 0.00 H ATOM 48 HZ3 TRP A 3 -0.543 4.383 5.639 1.00 0.00 H ATOM 49 HH2 TRP A 3 -1.522 6.037 7.175 1.00 0.00 H ATOM 50 N GLY A 4 -4.529 -0.446 1.963 1.00 0.00 N ATOM 51 CA GLY A 4 -4.048 -1.353 0.892 1.00 0.00 C ATOM 52 C GLY A 4 -2.558 -1.078 0.622 1.00 0.00 C ATOM 53 O GLY A 4 -2.225 -0.317 -0.290 1.00 0.00 O ATOM 54 H GLY A 4 -4.758 0.536 1.779 1.00 0.00 H ATOM 55 HA2 GLY A 4 -4.231 -2.420 1.128 1.00 0.00 H ATOM 56 HA3 GLY A 4 -4.627 -1.159 -0.029 1.00 0.00 H HETATM 57 N BCX A 5 -1.686 -1.712 1.426 1.00 0.00 N HETATM 58 CC BCX A 5 0.484 -2.722 0.680 1.00 0.00 C HETATM 59 CA BCX A 5 -0.221 -1.526 1.332 1.00 0.00 C HETATM 60 C BCX A 5 1.947 -2.421 0.265 1.00 0.00 C HETATM 61 O BCX A 5 2.246 -1.405 -0.366 1.00 0.00 O HETATM 62 CB BCX A 5 0.318 -1.202 2.746 1.00 0.00 C HETATM 63 SG BCX A 5 -0.576 0.162 3.516 1.00 0.00 S HETATM 64 H BCX A 5 -2.127 -2.229 2.194 1.00 0.00 H HETATM 65 HC1 BCX A 5 -0.064 -2.994 -0.242 1.00 0.00 H HETATM 66 HC2 BCX A 5 0.390 -3.610 1.336 1.00 0.00 H HETATM 67 HA BCX A 5 0.021 -0.693 0.663 1.00 0.00 H HETATM 68 HB2 BCX A 5 0.255 -2.078 3.416 1.00 0.00 H HETATM 69 HB3 BCX A 5 1.389 -0.921 2.704 1.00 0.00 H ATOM 70 N SER A 6 2.804 -3.413 0.494 1.00 0.00 N ATOM 71 CA SER A 6 4.029 -3.616 -0.336 1.00 0.00 C ATOM 72 C SER A 6 3.614 -4.303 -1.671 1.00 0.00 C ATOM 73 O SER A 6 3.588 -5.532 -1.792 1.00 0.00 O ATOM 74 CB SER A 6 5.081 -4.385 0.494 1.00 0.00 C ATOM 75 OG SER A 6 6.292 -4.524 -0.243 1.00 0.00 O ATOM 76 H SER A 6 2.291 -4.181 0.926 1.00 0.00 H ATOM 77 HA SER A 6 4.491 -2.630 -0.553 1.00 0.00 H ATOM 78 HB2 SER A 6 5.302 -3.847 1.437 1.00 0.00 H ATOM 79 HB3 SER A 6 4.712 -5.385 0.791 1.00 0.00 H ATOM 80 HG SER A 6 6.891 -5.028 0.314 1.00 0.00 H ATOM 81 N GLY A 7 3.277 -3.454 -2.655 1.00 0.00 N ATOM 82 CA GLY A 7 2.780 -3.897 -3.980 1.00 0.00 C ATOM 83 C GLY A 7 1.644 -2.969 -4.475 1.00 0.00 C ATOM 84 O GLY A 7 1.712 -2.468 -5.599 1.00 0.00 O ATOM 85 H GLY A 7 3.236 -2.465 -2.370 1.00 0.00 H ATOM 86 HA2 GLY A 7 3.615 -3.888 -4.704 1.00 0.00 H ATOM 87 HA3 GLY A 7 2.405 -4.939 -3.961 1.00 0.00 H ATOM 88 N LYS A 8 0.599 -2.762 -3.642 1.00 0.00 N ATOM 89 CA LYS A 8 -0.548 -1.870 -3.956 1.00 0.00 C ATOM 90 C LYS A 8 -0.123 -0.368 -3.874 1.00 0.00 C ATOM 91 O LYS A 8 -0.171 0.319 -4.898 1.00 0.00 O ATOM 92 CB LYS A 8 -1.754 -2.210 -3.028 1.00 0.00 C ATOM 93 CG LYS A 8 -2.442 -3.568 -3.295 1.00 0.00 C ATOM 94 CD LYS A 8 -3.603 -3.841 -2.313 1.00 0.00 C ATOM 95 CE LYS A 8 -4.302 -5.202 -2.497 1.00 0.00 C ATOM 96 NZ LYS A 8 -5.116 -5.271 -3.727 1.00 0.00 N ATOM 97 H LYS A 8 0.723 -3.141 -2.698 1.00 0.00 H ATOM 98 HA LYS A 8 -0.872 -2.061 -4.998 1.00 0.00 H ATOM 99 HB2 LYS A 8 -1.437 -2.172 -1.967 1.00 0.00 H ATOM 100 HB3 LYS A 8 -2.524 -1.418 -3.114 1.00 0.00 H ATOM 101 HG2 LYS A 8 -2.814 -3.593 -4.336 1.00 0.00 H ATOM 102 HG3 LYS A 8 -1.700 -4.385 -3.220 1.00 0.00 H ATOM 103 HD2 LYS A 8 -3.208 -3.800 -1.280 1.00 0.00 H ATOM 104 HD3 LYS A 8 -4.349 -3.024 -2.365 1.00 0.00 H ATOM 105 HE2 LYS A 8 -3.561 -6.023 -2.496 1.00 0.00 H ATOM 106 HE3 LYS A 8 -4.960 -5.396 -1.630 1.00 0.00 H ATOM 107 HZ1 LYS A 8 -4.528 -5.101 -4.551 1.00 0.00 H ATOM 108 HZ2 LYS A 8 -5.817 -4.520 -3.731 1.00 0.00 H ATOM 109 N LEU A 9 0.305 0.134 -2.692 1.00 0.00 N ATOM 110 CA LEU A 9 0.727 1.542 -2.499 1.00 0.00 C ATOM 111 C LEU A 9 1.618 1.527 -1.229 1.00 0.00 C ATOM 112 O LEU A 9 1.099 1.344 -0.123 1.00 0.00 O ATOM 113 CB LEU A 9 -0.555 2.403 -2.331 1.00 0.00 C ATOM 114 CG LEU A 9 -0.416 3.951 -2.390 1.00 0.00 C ATOM 115 CD1 LEU A 9 -1.804 4.601 -2.561 1.00 0.00 C ATOM 116 CD2 LEU A 9 0.282 4.572 -1.162 1.00 0.00 C ATOM 117 H LEU A 9 0.221 -0.468 -1.869 1.00 0.00 H ATOM 118 HA LEU A 9 1.288 1.895 -3.387 1.00 0.00 H ATOM 119 HB2 LEU A 9 -1.240 2.098 -3.146 1.00 0.00 H ATOM 120 HB3 LEU A 9 -1.073 2.083 -1.405 1.00 0.00 H ATOM 121 HG LEU A 9 0.178 4.210 -3.287 1.00 0.00 H ATOM 122 HD11 LEU A 9 -2.470 4.391 -1.704 1.00 0.00 H ATOM 123 HD12 LEU A 9 -1.733 5.700 -2.661 1.00 0.00 H ATOM 124 HD13 LEU A 9 -2.317 4.236 -3.471 1.00 0.00 H ATOM 125 HD21 LEU A 9 -0.208 4.283 -0.214 1.00 0.00 H ATOM 126 HD22 LEU A 9 1.341 4.267 -1.092 1.00 0.00 H ATOM 127 HD23 LEU A 9 0.288 5.678 -1.206 1.00 0.00 H ATOM 128 N ILE A 10 2.945 1.739 -1.368 1.00 0.00 N ATOM 129 CA ILE A 10 3.901 1.736 -0.213 1.00 0.00 C ATOM 130 C ILE A 10 3.503 2.752 0.914 1.00 0.00 C ATOM 131 O ILE A 10 3.462 3.967 0.703 1.00 0.00 O ATOM 132 CB ILE A 10 5.410 1.830 -0.656 1.00 0.00 C ATOM 133 CG1 ILE A 10 5.805 2.829 -1.789 1.00 0.00 C ATOM 134 CG2 ILE A 10 5.950 0.431 -1.049 1.00 0.00 C ATOM 135 CD1 ILE A 10 5.529 4.317 -1.536 1.00 0.00 C ATOM 136 H ILE A 10 3.274 1.814 -2.335 1.00 0.00 H ATOM 137 HA ILE A 10 3.787 0.724 0.233 1.00 0.00 H ATOM 138 HB ILE A 10 5.998 2.120 0.237 1.00 0.00 H ATOM 139 HG12 ILE A 10 6.890 2.736 -1.989 1.00 0.00 H ATOM 140 HG13 ILE A 10 5.319 2.538 -2.740 1.00 0.00 H ATOM 141 HG21 ILE A 10 5.816 -0.305 -0.234 1.00 0.00 H ATOM 142 HG22 ILE A 10 5.437 0.023 -1.939 1.00 0.00 H ATOM 143 HG23 ILE A 10 7.032 0.450 -1.273 1.00 0.00 H ATOM 144 HD11 ILE A 10 5.945 4.657 -0.570 1.00 0.00 H ATOM 145 HD12 ILE A 10 5.980 4.946 -2.326 1.00 0.00 H ATOM 146 HD13 ILE A 10 4.446 4.537 -1.536 1.00 0.00 H ATOM 147 N CYS A 11 3.178 2.216 2.108 1.00 0.00 N ATOM 148 CA CYS A 11 2.732 3.023 3.269 1.00 0.00 C ATOM 149 C CYS A 11 3.920 3.483 4.157 1.00 0.00 C ATOM 150 O CYS A 11 4.232 2.881 5.190 1.00 0.00 O ATOM 151 CB CYS A 11 1.667 2.213 4.032 1.00 0.00 C ATOM 152 SG CYS A 11 0.262 1.878 2.949 1.00 0.00 S ATOM 153 H CYS A 11 3.310 1.203 2.174 1.00 0.00 H ATOM 154 HA CYS A 11 2.180 3.908 2.900 1.00 0.00 H ATOM 155 HB2 CYS A 11 2.075 1.256 4.409 1.00 0.00 H ATOM 156 HB3 CYS A 11 1.304 2.767 4.918 1.00 0.00 H ATOM 157 N THR A 12 4.566 4.585 3.737 1.00 0.00 N ATOM 158 CA THR A 12 5.728 5.178 4.449 1.00 0.00 C ATOM 159 C THR A 12 5.226 6.114 5.585 1.00 0.00 C ATOM 160 O THR A 12 4.683 7.192 5.318 1.00 0.00 O ATOM 161 CB THR A 12 6.700 5.916 3.479 1.00 0.00 C ATOM 162 OG1 THR A 12 6.036 6.971 2.787 1.00 0.00 O ATOM 163 CG2 THR A 12 7.387 5.010 2.440 1.00 0.00 C ATOM 164 H THR A 12 4.339 4.862 2.779 1.00 0.00 H ATOM 165 HA THR A 12 6.314 4.349 4.883 1.00 0.00 H ATOM 166 HB THR A 12 7.508 6.371 4.084 1.00 0.00 H ATOM 167 HG1 THR A 12 5.601 7.495 3.467 1.00 0.00 H ATOM 168 HG21 THR A 12 7.968 4.203 2.925 1.00 0.00 H ATOM 169 HG22 THR A 12 6.656 4.530 1.764 1.00 0.00 H ATOM 170 HG23 THR A 12 8.089 5.584 1.809 1.00 0.00 H ATOM 171 N THR A 13 5.392 5.674 6.845 1.00 0.00 N ATOM 172 CA THR A 13 4.968 6.451 8.038 1.00 0.00 C ATOM 173 C THR A 13 6.079 6.236 9.106 1.00 0.00 C ATOM 174 O THR A 13 6.318 5.130 9.602 1.00 0.00 O ATOM 175 CB THR A 13 3.575 6.032 8.586 1.00 0.00 C ATOM 176 OG1 THR A 13 2.619 5.898 7.538 1.00 0.00 O ATOM 177 CG2 THR A 13 2.977 7.003 9.620 1.00 0.00 C ATOM 178 H THR A 13 5.938 4.814 6.944 1.00 0.00 H ATOM 179 HA THR A 13 4.894 7.526 7.764 1.00 0.00 H ATOM 180 HB THR A 13 3.708 5.058 9.078 1.00 0.00 H ATOM 181 HG1 THR A 13 3.038 5.351 6.868 1.00 0.00 H ATOM 182 HG21 THR A 13 2.001 6.640 9.989 1.00 0.00 H ATOM 183 HG22 THR A 13 3.631 7.123 10.503 1.00 0.00 H ATOM 184 HG23 THR A 13 2.810 8.008 9.190 1.00 0.00 H ATOM 185 N ALA A 14 6.727 7.349 9.438 1.00 0.00 N ATOM 186 CA ALA A 14 7.825 7.403 10.432 1.00 0.00 C ATOM 187 C ALA A 14 7.271 7.702 11.844 1.00 0.00 C ATOM 188 O ALA A 14 6.733 8.762 12.166 1.00 0.00 O ATOM 189 CB ALA A 14 8.846 8.465 9.986 1.00 0.00 C ATOM 190 OXT ALA A 14 7.439 6.643 12.699 1.00 0.00 O ATOM 191 H ALA A 14 6.353 8.136 8.905 1.00 0.00 H ATOM 192 HA ALA A 14 8.363 6.434 10.455 1.00 0.00 H ATOM 193 HB1 ALA A 14 9.701 8.523 10.685 1.00 0.00 H ATOM 194 HB2 ALA A 14 9.268 8.234 8.989 1.00 0.00 H ATOM 195 HB3 ALA A 14 8.404 9.479 9.928 1.00 0.00 H ATOM 196 HXT ALA A 14 7.083 6.841 13.568 1.00 0.00 H TER 197 ALA A 14