HETATM 1 C ACE A 1 -8.636 4.522 -11.037 1.00 0.00 C HETATM 2 O ACE A 1 -9.238 3.719 -11.748 1.00 0.00 O HETATM 3 CH3 ACE A 1 -8.273 5.870 -11.558 1.00 0.00 C HETATM 4 H1 ACE A 1 -7.632 5.760 -12.433 1.00 0.00 H HETATM 5 H2 ACE A 1 -9.179 6.408 -11.836 1.00 0.00 H HETATM 6 H3 ACE A 1 -7.742 6.427 -10.786 1.00 0.00 H ATOM 7 N ILE A 2 -8.262 4.285 -9.788 1.00 0.00 N ATOM 8 CA ILE A 2 -8.550 3.012 -9.149 1.00 0.00 C ATOM 9 C ILE A 2 -8.346 3.146 -7.639 1.00 0.00 C ATOM 10 O ILE A 2 -7.213 3.159 -7.160 1.00 0.00 O ATOM 11 CB ILE A 2 -7.721 1.894 -9.784 1.00 0.00 C ATOM 12 CG1 ILE A 2 -7.548 0.721 -8.817 1.00 0.00 C ATOM 13 CG2 ILE A 2 -6.376 2.426 -10.286 1.00 0.00 C ATOM 14 CD1 ILE A 2 -8.879 0.005 -8.581 1.00 0.00 C ATOM 15 H ILE A 2 -7.771 4.943 -9.217 1.00 0.00 H ATOM 16 HA ILE A 2 -9.598 2.782 -9.337 1.00 0.00 H ATOM 17 HB ILE A 2 -8.262 1.519 -10.652 1.00 0.00 H ATOM 18 HG13 ILE A 2 -7.152 1.083 -7.868 1.00 0.00 H ATOM 19 HG21 ILE A 2 -5.596 1.693 -10.080 1.00 0.00 H ATOM 20 HG22 ILE A 2 -6.433 2.604 -11.360 1.00 0.00 H ATOM 21 HG23 ILE A 2 -6.142 3.360 -9.774 1.00 0.00 H ATOM 22 HD11 ILE A 2 -9.336 -0.238 -9.540 1.00 0.00 H ATOM 23 HD12 ILE A 2 -8.703 -0.913 -8.019 1.00 0.00 H ATOM 24 HD13 ILE A 2 -9.546 0.655 -8.014 1.00 0.00 H ATOM 25 N TRP A 3 -9.461 3.243 -6.930 1.00 0.00 N ATOM 26 CA TRP A 3 -9.419 3.377 -5.483 1.00 0.00 C ATOM 27 C TRP A 3 -8.825 2.090 -4.907 1.00 0.00 C ATOM 28 O TRP A 3 -9.225 0.991 -5.292 1.00 0.00 O ATOM 29 CB TRP A 3 -10.806 3.699 -4.922 1.00 0.00 C ATOM 30 CG TRP A 3 -11.117 5.195 -4.857 1.00 0.00 C ATOM 31 CD1 TRP A 3 -10.607 6.108 -4.019 1.00 0.00 C ATOM 32 CD2 TRP A 3 -12.038 5.920 -5.700 1.00 0.00 C ATOM 33 NE1 TRP A 3 -11.129 7.363 -4.259 1.00 0.00 N ATOM 34 CE2 TRP A 3 -12.026 7.244 -5.314 1.00 0.00 C ATOM 35 CE3 TRP A 3 -12.852 5.470 -6.753 1.00 0.00 C ATOM 36 CZ2 TRP A 3 -12.809 8.229 -5.928 1.00 0.00 C ATOM 37 CZ3 TRP A 3 -13.630 6.466 -7.357 1.00 0.00 C ATOM 38 CH2 TRP A 3 -13.630 7.804 -6.981 1.00 0.00 C ATOM 39 H TRP A 3 -10.379 3.232 -7.326 1.00 0.00 H ATOM 40 HA TRP A 3 -8.775 4.223 -5.245 1.00 0.00 H ATOM 41 HB3 TRP A 3 -10.888 3.277 -3.921 1.00 0.00 H ATOM 42 HD1 TRP A 3 -9.872 5.888 -3.245 1.00 0.00 H ATOM 43 HE1 TRP A 3 -10.882 8.278 -3.721 1.00 0.00 H ATOM 44 HE3 TRP A 3 -12.880 4.430 -7.076 1.00 0.00 H ATOM 45 HZ2 TRP A 3 -12.783 9.269 -5.606 1.00 0.00 H ATOM 46 HZ3 TRP A 3 -14.280 6.171 -8.181 1.00 0.00 H ATOM 47 HH2 TRP A 3 -14.265 8.519 -7.503 1.00 0.00 H ATOM 48 N GLY A 4 -7.881 2.268 -3.995 1.00 0.00 N ATOM 49 CA GLY A 4 -7.228 1.134 -3.362 1.00 0.00 C ATOM 50 C GLY A 4 -5.899 1.550 -2.731 1.00 0.00 C ATOM 51 O GLY A 4 -5.761 1.551 -1.508 1.00 0.00 O ATOM 52 H GLY A 4 -7.562 3.164 -3.688 1.00 0.00 H ATOM 53 HA2 GLY A 4 -7.883 0.713 -2.598 1.00 0.00 H ATOM 54 HA3 GLY A 4 -7.055 0.351 -4.100 1.00 0.00 H ATOM 55 N CYS A 5 -4.952 1.892 -3.592 1.00 0.00 N ATOM 56 CA CYS A 5 -3.637 2.308 -3.135 1.00 0.00 C ATOM 57 C CYS A 5 -3.083 3.328 -4.130 1.00 0.00 C ATOM 58 O CYS A 5 -3.220 3.198 -5.346 1.00 0.00 O ATOM 59 CB CYS A 5 -2.696 1.115 -2.955 1.00 0.00 C ATOM 60 SG CYS A 5 -1.123 1.499 -2.103 1.00 0.00 S ATOM 61 H CYS A 5 -5.071 1.887 -4.585 1.00 0.00 H ATOM 62 HA CYS A 5 -3.777 2.762 -2.153 1.00 0.00 H ATOM 63 HB3 CYS A 5 -2.469 0.699 -3.937 1.00 0.00 H HETATM 64 N B3S A 6 -2.442 4.365 -3.579 1.00 0.00 N HETATM 65 OD B3S A 6 -3.618 6.876 -4.385 1.00 0.00 O HETATM 66 CG B3S A 6 -2.620 6.248 -5.194 1.00 0.00 C HETATM 67 CB B3S A 6 -1.665 5.350 -4.373 1.00 0.00 C HETATM 68 CA B3S A 6 -0.770 6.196 -3.434 1.00 0.00 C HETATM 69 C B3S A 6 0.267 5.417 -2.619 1.00 0.00 C HETATM 70 O B3S A 6 1.421 5.356 -3.042 1.00 0.00 O HETATM 71 H B3S A 6 -2.411 4.331 -2.557 1.00 0.00 H HETATM 72 HD B3S A 6 -4.397 6.966 -4.945 1.00 0.00 H HETATM 73 HG2 B3S A 6 -3.110 5.647 -5.985 1.00 0.00 H HETATM 74 HB B3S A 6 -1.006 4.820 -5.095 1.00 0.00 H HETATM 75 HA1 B3S A 6 -0.254 6.982 -4.016 1.00 0.00 H HETATM 76 HA2 B3S A 6 -1.402 6.762 -2.725 1.00 0.00 H ATOM 77 N GLY A 7 -0.153 4.840 -1.503 1.00 0.00 N ATOM 78 CA GLY A 7 0.754 4.067 -0.673 1.00 0.00 C ATOM 79 C GLY A 7 2.183 4.601 -0.777 1.00 0.00 C ATOM 80 O GLY A 7 2.946 4.180 -1.646 1.00 0.00 O ATOM 81 H GLY A 7 -1.093 4.894 -1.166 1.00 0.00 H ATOM 82 HA2 GLY A 7 0.423 4.104 0.366 1.00 0.00 H ATOM 83 HA3 GLY A 7 0.730 3.020 -0.977 1.00 0.00 H ATOM 84 N LYS A 8 2.504 5.521 0.122 1.00 0.00 N ATOM 85 CA LYS A 8 3.829 6.117 0.141 1.00 0.00 C ATOM 86 C LYS A 8 4.816 5.135 0.777 1.00 0.00 C ATOM 87 O LYS A 8 5.509 5.479 1.734 1.00 0.00 O ATOM 88 CB LYS A 8 3.792 7.483 0.829 1.00 0.00 C ATOM 89 CG LYS A 8 3.729 8.614 -0.200 1.00 0.00 C ATOM 90 CD LYS A 8 5.091 8.828 -0.864 1.00 0.00 C ATOM 91 CE LYS A 8 5.945 9.807 -0.057 1.00 0.00 C ATOM 92 NZ LYS A 8 6.447 9.163 1.177 1.00 0.00 N ATOM 93 H LYS A 8 1.878 5.858 0.824 1.00 0.00 H ATOM 94 HA LYS A 8 4.127 6.286 -0.894 1.00 0.00 H ATOM 95 HB3 LYS A 8 4.676 7.604 1.454 1.00 0.00 H ATOM 96 HG3 LYS A 8 3.407 9.535 0.286 1.00 0.00 H ATOM 97 HD3 LYS A 8 4.950 9.209 -1.875 1.00 0.00 H ATOM 98 HE3 LYS A 8 5.356 10.688 0.199 1.00 0.00 H ATOM 99 HZ1 LYS A 8 7.386 9.468 1.410 1.00 0.00 H ATOM 100 HZ2 LYS A 8 5.864 9.372 1.979 1.00 0.00 H ATOM 101 N LEU A 9 4.848 3.935 0.218 1.00 0.00 N ATOM 102 CA LEU A 9 5.739 2.901 0.719 1.00 0.00 C ATOM 103 C LEU A 9 5.801 1.754 -0.291 1.00 0.00 C ATOM 104 O LEU A 9 6.809 1.576 -0.973 1.00 0.00 O ATOM 105 CB LEU A 9 5.317 2.462 2.122 1.00 0.00 C ATOM 106 CG LEU A 9 6.012 1.217 2.674 1.00 0.00 C ATOM 107 CD1 LEU A 9 6.973 1.581 3.807 1.00 0.00 C ATOM 108 CD2 LEU A 9 4.989 0.164 3.107 1.00 0.00 C ATOM 109 H LEU A 9 4.282 3.664 -0.559 1.00 0.00 H ATOM 110 HA LEU A 9 6.733 3.340 0.805 1.00 0.00 H ATOM 111 HB3 LEU A 9 4.241 2.282 2.117 1.00 0.00 H ATOM 112 HG LEU A 9 6.608 0.776 1.875 1.00 0.00 H ATOM 113 HD11 LEU A 9 7.102 2.663 3.840 1.00 0.00 H ATOM 114 HD12 LEU A 9 6.565 1.233 4.756 1.00 0.00 H ATOM 115 HD13 LEU A 9 7.939 1.106 3.631 1.00 0.00 H ATOM 116 HD21 LEU A 9 5.471 -0.566 3.757 1.00 0.00 H ATOM 117 HD22 LEU A 9 4.176 0.648 3.647 1.00 0.00 H ATOM 118 HD23 LEU A 9 4.592 -0.340 2.226 1.00 0.00 H ATOM 119 N ILE A 10 4.709 1.005 -0.356 1.00 0.00 N ATOM 120 CA ILE A 10 4.626 -0.119 -1.272 1.00 0.00 C ATOM 121 C ILE A 10 3.165 -0.346 -1.663 1.00 0.00 C ATOM 122 O ILE A 10 2.379 -0.863 -0.869 1.00 0.00 O ATOM 123 CB ILE A 10 5.301 -1.353 -0.667 1.00 0.00 C ATOM 124 CG1 ILE A 10 6.820 -1.285 -0.834 1.00 0.00 C ATOM 125 CG2 ILE A 10 4.716 -2.640 -1.254 1.00 0.00 C ATOM 126 CD1 ILE A 10 7.203 -1.119 -2.306 1.00 0.00 C ATOM 127 H ILE A 10 3.893 1.157 0.202 1.00 0.00 H ATOM 128 HA ILE A 10 5.186 0.147 -2.168 1.00 0.00 H ATOM 129 HB ILE A 10 5.094 -1.365 0.403 1.00 0.00 H ATOM 130 HG13 ILE A 10 7.274 -2.192 -0.435 1.00 0.00 H ATOM 131 HG21 ILE A 10 3.684 -2.754 -0.925 1.00 0.00 H ATOM 132 HG22 ILE A 10 4.747 -2.589 -2.343 1.00 0.00 H ATOM 133 HG23 ILE A 10 5.303 -3.493 -0.914 1.00 0.00 H ATOM 134 HD11 ILE A 10 8.213 -1.498 -2.463 1.00 0.00 H ATOM 135 HD12 ILE A 10 6.505 -1.680 -2.928 1.00 0.00 H ATOM 136 HD13 ILE A 10 7.163 -0.064 -2.576 1.00 0.00 H ATOM 137 N CYS A 11 2.844 0.049 -2.886 1.00 0.00 N ATOM 138 CA CYS A 11 1.491 -0.105 -3.391 1.00 0.00 C ATOM 139 C CYS A 11 1.410 -1.431 -4.151 1.00 0.00 C ATOM 140 O CYS A 11 0.613 -1.572 -5.078 1.00 0.00 O ATOM 141 CB CYS A 11 1.075 1.080 -4.266 1.00 0.00 C ATOM 142 SG CYS A 11 0.108 2.370 -3.400 1.00 0.00 S ATOM 143 H CYS A 11 3.489 0.467 -3.525 1.00 0.00 H ATOM 144 HA CYS A 11 0.832 -0.116 -2.523 1.00 0.00 H ATOM 145 HB3 CYS A 11 0.487 0.706 -5.104 1.00 0.00 H ATOM 146 N THR A 12 2.245 -2.369 -3.730 1.00 0.00 N ATOM 147 CA THR A 12 2.278 -3.678 -4.359 1.00 0.00 C ATOM 148 C THR A 12 2.694 -4.747 -3.346 1.00 0.00 C ATOM 149 O THR A 12 3.111 -4.425 -2.235 1.00 0.00 O ATOM 150 CB THR A 12 3.207 -3.597 -5.573 1.00 0.00 C ATOM 151 OG1 THR A 12 2.539 -4.361 -6.573 1.00 0.00 O ATOM 152 CG2 THR A 12 4.525 -4.343 -5.352 1.00 0.00 C ATOM 153 H THR A 12 2.890 -2.247 -2.975 1.00 0.00 H ATOM 154 HA THR A 12 1.269 -3.926 -4.689 1.00 0.00 H ATOM 155 HB THR A 12 3.389 -2.560 -5.855 1.00 0.00 H ATOM 156 HG1 THR A 12 2.587 -5.334 -6.349 1.00 0.00 H ATOM 157 HG21 THR A 12 5.027 -3.940 -4.472 1.00 0.00 H ATOM 158 HG22 THR A 12 4.322 -5.403 -5.200 1.00 0.00 H ATOM 159 HG23 THR A 12 5.165 -4.217 -6.225 1.00 0.00 H ATOM 160 N THR A 13 2.566 -5.997 -3.766 1.00 0.00 N ATOM 161 CA THR A 13 2.923 -7.115 -2.909 1.00 0.00 C ATOM 162 C THR A 13 3.102 -8.387 -3.738 1.00 0.00 C ATOM 163 O THR A 13 4.219 -8.729 -4.124 1.00 0.00 O ATOM 164 CB THR A 13 1.850 -7.242 -1.826 1.00 0.00 C ATOM 165 OG1 THR A 13 0.644 -6.865 -2.485 1.00 0.00 O ATOM 166 CG2 THR A 13 2.010 -6.200 -0.717 1.00 0.00 C ATOM 167 H THR A 13 2.224 -6.251 -4.671 1.00 0.00 H ATOM 168 HA THR A 13 3.885 -6.897 -2.444 1.00 0.00 H ATOM 169 HB THR A 13 1.831 -8.250 -1.413 1.00 0.00 H ATOM 170 HG1 THR A 13 -0.141 -7.049 -1.895 1.00 0.00 H ATOM 171 HG21 THR A 13 1.486 -5.286 -0.999 1.00 0.00 H ATOM 172 HG22 THR A 13 1.590 -6.588 0.211 1.00 0.00 H ATOM 173 HG23 THR A 13 3.069 -5.982 -0.573 1.00 0.00 H ATOM 174 N ALA A 14 1.985 -9.054 -3.990 1.00 0.00 N ATOM 175 CA ALA A 14 2.004 -10.281 -4.767 1.00 0.00 C ATOM 176 C ALA A 14 1.949 -9.937 -6.257 1.00 0.00 C ATOM 177 O ALA A 14 0.939 -10.181 -6.917 1.00 0.00 O ATOM 178 CB ALA A 14 0.845 -11.179 -4.332 1.00 0.00 C ATOM 179 H ALA A 14 1.080 -8.769 -3.673 1.00 0.00 H ATOM 180 HA ALA A 14 2.944 -10.793 -4.556 1.00 0.00 H ATOM 181 HB1 ALA A 14 -0.094 -10.636 -4.433 1.00 0.00 H ATOM 182 HB2 ALA A 14 0.818 -12.069 -4.962 1.00 0.00 H ATOM 183 HB3 ALA A 14 0.985 -11.475 -3.293 1.00 0.00 H TER 184 ALA A 14