HETATM 1 C ACE A 1 -8.277 3.111 5.386 1.00 0.00 C HETATM 2 O ACE A 1 -7.091 2.967 5.681 1.00 0.00 O HETATM 3 CH3 ACE A 1 -9.307 3.272 6.450 1.00 0.00 C HETATM 4 H1 ACE A 1 -9.523 4.331 6.589 1.00 0.00 H HETATM 5 H2 ACE A 1 -10.218 2.750 6.155 1.00 0.00 H HETATM 6 H3 ACE A 1 -8.934 2.851 7.384 1.00 0.00 H ATOM 7 N ILE A 2 -8.743 3.136 4.146 1.00 0.00 N ATOM 8 CA ILE A 2 -7.851 2.991 3.008 1.00 0.00 C ATOM 9 C ILE A 2 -8.137 4.104 1.996 1.00 0.00 C ATOM 10 O ILE A 2 -9.118 4.039 1.258 1.00 0.00 O ATOM 11 CB ILE A 2 -7.958 1.583 2.420 1.00 0.00 C ATOM 12 CG1 ILE A 2 -9.364 1.320 1.879 1.00 0.00 C ATOM 13 CG2 ILE A 2 -7.530 0.527 3.442 1.00 0.00 C ATOM 14 CD1 ILE A 2 -9.366 1.284 0.349 1.00 0.00 C ATOM 15 H ILE A 2 -9.709 3.254 3.914 1.00 0.00 H ATOM 16 HA ILE A 2 -6.832 3.110 3.374 1.00 0.00 H ATOM 17 HB ILE A 2 -7.270 1.512 1.577 1.00 0.00 H ATOM 18 HG13 ILE A 2 -10.044 2.098 2.227 1.00 0.00 H ATOM 19 HG21 ILE A 2 -7.216 -0.377 2.920 1.00 0.00 H ATOM 20 HG22 ILE A 2 -6.700 0.912 4.035 1.00 0.00 H ATOM 21 HG23 ILE A 2 -8.370 0.296 4.098 1.00 0.00 H ATOM 22 HD11 ILE A 2 -8.415 0.887 -0.006 1.00 0.00 H ATOM 23 HD12 ILE A 2 -10.179 0.646 0.001 1.00 0.00 H ATOM 24 HD13 ILE A 2 -9.504 2.294 -0.039 1.00 0.00 H ATOM 25 N TRP A 3 -7.261 5.098 1.996 1.00 0.00 N ATOM 26 CA TRP A 3 -7.406 6.222 1.087 1.00 0.00 C ATOM 27 C TRP A 3 -6.205 6.223 0.140 1.00 0.00 C ATOM 28 O TRP A 3 -5.061 6.311 0.583 1.00 0.00 O ATOM 29 CB TRP A 3 -7.560 7.534 1.859 1.00 0.00 C ATOM 30 CG TRP A 3 -8.943 8.176 1.726 1.00 0.00 C ATOM 31 CD1 TRP A 3 -9.794 8.095 0.694 1.00 0.00 C ATOM 32 CD2 TRP A 3 -9.603 9.005 2.705 1.00 0.00 C ATOM 33 NE1 TRP A 3 -10.950 8.809 0.935 1.00 0.00 N ATOM 34 CE2 TRP A 3 -10.831 9.380 2.197 1.00 0.00 C ATOM 35 CE3 TRP A 3 -9.178 9.425 3.977 1.00 0.00 C ATOM 36 CZ2 TRP A 3 -11.733 10.191 2.894 1.00 0.00 C ATOM 37 CZ3 TRP A 3 -10.092 10.236 4.661 1.00 0.00 C ATOM 38 CH2 TRP A 3 -11.331 10.622 4.164 1.00 0.00 C ATOM 39 H TRP A 3 -6.465 5.142 2.599 1.00 0.00 H ATOM 40 HA TRP A 3 -8.326 6.076 0.521 1.00 0.00 H ATOM 41 HB3 TRP A 3 -6.808 8.241 1.509 1.00 0.00 H ATOM 42 HD1 TRP A 3 -9.598 7.536 -0.221 1.00 0.00 H ATOM 43 HE1 TRP A 3 -11.801 8.907 0.261 1.00 0.00 H ATOM 44 HE3 TRP A 3 -8.214 9.143 4.401 1.00 0.00 H ATOM 45 HZ2 TRP A 3 -12.697 10.474 2.471 1.00 0.00 H ATOM 46 HZ3 TRP A 3 -9.812 10.590 5.654 1.00 0.00 H ATOM 47 HH2 TRP A 3 -11.987 11.256 4.761 1.00 0.00 H ATOM 48 N GLY A 4 -6.506 6.124 -1.147 1.00 0.00 N ATOM 49 CA GLY A 4 -5.465 6.113 -2.160 1.00 0.00 C ATOM 50 C GLY A 4 -4.883 4.709 -2.333 1.00 0.00 C ATOM 51 O GLY A 4 -5.330 3.948 -3.190 1.00 0.00 O ATOM 52 H GLY A 4 -7.439 6.053 -1.499 1.00 0.00 H ATOM 53 HA2 GLY A 4 -5.873 6.461 -3.109 1.00 0.00 H ATOM 54 HA3 GLY A 4 -4.672 6.807 -1.881 1.00 0.00 H ATOM 55 N CYS A 5 -3.893 4.407 -1.505 1.00 0.00 N ATOM 56 CA CYS A 5 -3.246 3.108 -1.556 1.00 0.00 C ATOM 57 C CYS A 5 -2.497 2.893 -0.239 1.00 0.00 C ATOM 58 O CYS A 5 -2.145 3.832 0.476 1.00 0.00 O ATOM 59 CB CYS A 5 -2.319 2.983 -2.766 1.00 0.00 C ATOM 60 SG CYS A 5 -1.391 1.410 -2.865 1.00 0.00 S ATOM 61 H CYS A 5 -3.535 5.032 -0.811 1.00 0.00 H ATOM 62 HA CYS A 5 -4.037 2.367 -1.675 1.00 0.00 H ATOM 63 HB3 CYS A 5 -1.606 3.809 -2.747 1.00 0.00 H HETATM 64 N B3S A 6 -2.253 1.615 0.072 1.00 0.00 N HETATM 65 OD B3S A 6 -2.490 -0.188 2.909 1.00 0.00 O HETATM 66 CG B3S A 6 -1.750 -0.208 1.687 1.00 0.00 C HETATM 67 CB B3S A 6 -1.372 1.210 1.195 1.00 0.00 C HETATM 68 CA B3S A 6 0.112 1.269 0.749 1.00 0.00 C HETATM 69 C B3S A 6 0.465 2.377 -0.248 1.00 0.00 C HETATM 70 O B3S A 6 0.874 2.055 -1.362 1.00 0.00 O HETATM 71 H B3S A 6 -2.607 0.951 -0.623 1.00 0.00 H HETATM 72 HD B3S A 6 -2.146 0.556 3.417 1.00 0.00 H HETATM 73 HG2 B3S A 6 -0.833 -0.814 1.820 1.00 0.00 H HETATM 74 HB B3S A 6 -1.503 1.905 2.052 1.00 0.00 H HETATM 75 HA1 B3S A 6 0.765 1.361 1.636 1.00 0.00 H HETATM 76 HA2 B3S A 6 0.407 0.303 0.301 1.00 0.00 H ATOM 77 N GLY A 7 0.317 3.627 0.165 1.00 0.00 N ATOM 78 CA GLY A 7 0.643 4.746 -0.704 1.00 0.00 C ATOM 79 C GLY A 7 2.143 4.785 -1.009 1.00 0.00 C ATOM 80 O GLY A 7 2.690 3.837 -1.571 1.00 0.00 O ATOM 81 H GLY A 7 -0.016 3.881 1.073 1.00 0.00 H ATOM 82 HA2 GLY A 7 0.082 4.664 -1.635 1.00 0.00 H ATOM 83 HA3 GLY A 7 0.340 5.679 -0.231 1.00 0.00 H ATOM 84 N LYS A 8 2.763 5.891 -0.626 1.00 0.00 N ATOM 85 CA LYS A 8 4.187 6.066 -0.851 1.00 0.00 C ATOM 86 C LYS A 8 4.966 5.168 0.113 1.00 0.00 C ATOM 87 O LYS A 8 5.781 5.653 0.897 1.00 0.00 O ATOM 88 CB LYS A 8 4.567 7.545 -0.755 1.00 0.00 C ATOM 89 CG LYS A 8 5.678 7.892 -1.748 1.00 0.00 C ATOM 90 CD LYS A 8 5.235 9.002 -2.703 1.00 0.00 C ATOM 91 CE LYS A 8 4.609 8.416 -3.970 1.00 0.00 C ATOM 92 NZ LYS A 8 3.888 9.465 -4.725 1.00 0.00 N ATOM 93 H LYS A 8 2.310 6.657 -0.169 1.00 0.00 H ATOM 94 HA LYS A 8 4.399 5.744 -1.870 1.00 0.00 H ATOM 95 HB3 LYS A 8 4.895 7.776 0.259 1.00 0.00 H ATOM 96 HG3 LYS A 8 5.951 7.004 -2.318 1.00 0.00 H ATOM 97 HD3 LYS A 8 6.090 9.621 -2.968 1.00 0.00 H ATOM 98 HE3 LYS A 8 3.922 7.612 -3.706 1.00 0.00 H ATOM 99 HZ1 LYS A 8 3.261 9.997 -4.131 1.00 0.00 H ATOM 100 HZ2 LYS A 8 4.523 10.130 -5.152 1.00 0.00 H ATOM 101 N LEU A 9 4.689 3.875 0.021 1.00 0.00 N ATOM 102 CA LEU A 9 5.353 2.906 0.875 1.00 0.00 C ATOM 103 C LEU A 9 5.436 1.563 0.145 1.00 0.00 C ATOM 104 O LEU A 9 6.523 1.122 -0.227 1.00 0.00 O ATOM 105 CB LEU A 9 4.657 2.823 2.235 1.00 0.00 C ATOM 106 CG LEU A 9 5.160 1.731 3.181 1.00 0.00 C ATOM 107 CD1 LEU A 9 5.847 2.339 4.405 1.00 0.00 C ATOM 108 CD2 LEU A 9 4.028 0.780 3.572 1.00 0.00 C ATOM 109 H LEU A 9 4.025 3.490 -0.620 1.00 0.00 H ATOM 110 HA LEU A 9 6.366 3.266 1.052 1.00 0.00 H ATOM 111 HB3 LEU A 9 3.591 2.668 2.067 1.00 0.00 H ATOM 112 HG LEU A 9 5.909 1.140 2.653 1.00 0.00 H ATOM 113 HD11 LEU A 9 6.913 2.449 4.207 1.00 0.00 H ATOM 114 HD12 LEU A 9 5.414 3.318 4.616 1.00 0.00 H ATOM 115 HD13 LEU A 9 5.702 1.686 5.265 1.00 0.00 H ATOM 116 HD21 LEU A 9 3.832 0.091 2.751 1.00 0.00 H ATOM 117 HD22 LEU A 9 4.318 0.216 4.459 1.00 0.00 H ATOM 118 HD23 LEU A 9 3.127 1.356 3.786 1.00 0.00 H ATOM 119 N ILE A 10 4.276 0.952 -0.038 1.00 0.00 N ATOM 120 CA ILE A 10 4.203 -0.331 -0.717 1.00 0.00 C ATOM 121 C ILE A 10 2.846 -0.461 -1.411 1.00 0.00 C ATOM 122 O ILE A 10 1.897 -0.986 -0.833 1.00 0.00 O ATOM 123 CB ILE A 10 4.507 -1.470 0.257 1.00 0.00 C ATOM 124 CG1 ILE A 10 6.015 -1.673 0.412 1.00 0.00 C ATOM 125 CG2 ILE A 10 3.795 -2.757 -0.165 1.00 0.00 C ATOM 126 CD1 ILE A 10 6.672 -1.955 -0.941 1.00 0.00 C ATOM 127 H ILE A 10 3.396 1.318 0.267 1.00 0.00 H ATOM 128 HA ILE A 10 4.984 -0.341 -1.478 1.00 0.00 H ATOM 129 HB ILE A 10 4.118 -1.194 1.238 1.00 0.00 H ATOM 130 HG13 ILE A 10 6.207 -2.502 1.093 1.00 0.00 H ATOM 131 HG21 ILE A 10 4.425 -3.614 0.073 1.00 0.00 H ATOM 132 HG22 ILE A 10 2.849 -2.841 0.369 1.00 0.00 H ATOM 133 HG23 ILE A 10 3.606 -2.732 -1.237 1.00 0.00 H ATOM 134 HD11 ILE A 10 7.001 -1.017 -1.387 1.00 0.00 H ATOM 135 HD12 ILE A 10 7.531 -2.611 -0.799 1.00 0.00 H ATOM 136 HD13 ILE A 10 5.951 -2.438 -1.601 1.00 0.00 H ATOM 137 N CYS A 11 2.798 0.029 -2.642 1.00 0.00 N ATOM 138 CA CYS A 11 1.574 -0.026 -3.422 1.00 0.00 C ATOM 139 C CYS A 11 1.615 -1.282 -4.295 1.00 0.00 C ATOM 140 O CYS A 11 0.981 -1.331 -5.348 1.00 0.00 O ATOM 141 CB CYS A 11 1.376 1.242 -4.254 1.00 0.00 C ATOM 142 SG CYS A 11 -0.369 1.658 -4.618 1.00 0.00 S ATOM 143 H CYS A 11 3.575 0.454 -3.105 1.00 0.00 H ATOM 144 HA CYS A 11 0.750 -0.078 -2.708 1.00 0.00 H ATOM 145 HB3 CYS A 11 1.911 1.128 -5.197 1.00 0.00 H ATOM 146 N THR A 12 2.369 -2.266 -3.826 1.00 0.00 N ATOM 147 CA THR A 12 2.500 -3.518 -4.551 1.00 0.00 C ATOM 148 C THR A 12 3.103 -4.596 -3.647 1.00 0.00 C ATOM 149 O THR A 12 3.898 -4.293 -2.758 1.00 0.00 O ATOM 150 CB THR A 12 3.327 -3.250 -5.810 1.00 0.00 C ATOM 151 OG1 THR A 12 2.829 -4.190 -6.758 1.00 0.00 O ATOM 152 CG2 THR A 12 4.797 -3.637 -5.639 1.00 0.00 C ATOM 153 H THR A 12 2.881 -2.217 -2.968 1.00 0.00 H ATOM 154 HA THR A 12 1.505 -3.858 -4.833 1.00 0.00 H ATOM 155 HB THR A 12 3.231 -2.211 -6.124 1.00 0.00 H ATOM 156 HG1 THR A 12 2.810 -5.105 -6.355 1.00 0.00 H ATOM 157 HG21 THR A 12 5.239 -3.042 -4.839 1.00 0.00 H ATOM 158 HG22 THR A 12 4.868 -4.695 -5.388 1.00 0.00 H ATOM 159 HG23 THR A 12 5.332 -3.448 -6.569 1.00 0.00 H ATOM 160 N THR A 13 2.702 -5.832 -3.906 1.00 0.00 N ATOM 161 CA THR A 13 3.192 -6.957 -3.127 1.00 0.00 C ATOM 162 C THR A 13 2.882 -8.275 -3.839 1.00 0.00 C ATOM 163 O THR A 13 1.724 -8.683 -3.919 1.00 0.00 O ATOM 164 CB THR A 13 2.582 -6.864 -1.727 1.00 0.00 C ATOM 165 OG1 THR A 13 3.401 -5.912 -1.053 1.00 0.00 O ATOM 166 CG2 THR A 13 2.767 -8.152 -0.922 1.00 0.00 C ATOM 167 H THR A 13 2.055 -6.069 -4.630 1.00 0.00 H ATOM 168 HA THR A 13 4.277 -6.879 -3.057 1.00 0.00 H ATOM 169 HB THR A 13 1.530 -6.584 -1.779 1.00 0.00 H ATOM 170 HG1 THR A 13 4.367 -6.141 -1.181 1.00 0.00 H ATOM 171 HG21 THR A 13 2.620 -7.942 0.138 1.00 0.00 H ATOM 172 HG22 THR A 13 2.039 -8.893 -1.249 1.00 0.00 H ATOM 173 HG23 THR A 13 3.774 -8.537 -1.079 1.00 0.00 H ATOM 174 N ALA A 14 3.935 -8.902 -4.340 1.00 0.00 N ATOM 175 CA ALA A 14 3.790 -10.166 -5.044 1.00 0.00 C ATOM 176 C ALA A 14 2.919 -11.110 -4.212 1.00 0.00 C ATOM 177 O ALA A 14 3.209 -11.360 -3.043 1.00 0.00 O ATOM 178 CB ALA A 14 5.173 -10.752 -5.333 1.00 0.00 C ATOM 179 H ALA A 14 4.873 -8.563 -4.271 1.00 0.00 H ATOM 180 HA ALA A 14 3.289 -9.963 -5.990 1.00 0.00 H ATOM 181 HB1 ALA A 14 5.707 -10.098 -6.024 1.00 0.00 H ATOM 182 HB2 ALA A 14 5.735 -10.833 -4.403 1.00 0.00 H ATOM 183 HB3 ALA A 14 5.062 -11.740 -5.779 1.00 0.00 H TER 184 ALA A 14