HETATM 1 C ACE A 1 -1.014 13.852 -10.511 1.00 0.00 C HETATM 2 O ACE A 1 -1.807 14.058 -9.593 1.00 0.00 O HETATM 3 CH3 ACE A 1 -0.551 14.973 -11.377 1.00 0.00 C HETATM 4 H1 ACE A 1 0.538 15.016 -11.363 1.00 0.00 H HETATM 5 H2 ACE A 1 -0.895 14.810 -12.398 1.00 0.00 H HETATM 6 H3 ACE A 1 -0.957 15.913 -11.002 1.00 0.00 H ATOM 7 N ILE A 2 -0.510 12.665 -10.815 1.00 0.00 N ATOM 8 CA ILE A 2 -0.874 11.481 -10.056 1.00 0.00 C ATOM 9 C ILE A 2 0.111 10.354 -10.372 1.00 0.00 C ATOM 10 O ILE A 2 0.099 9.806 -11.474 1.00 0.00 O ATOM 11 CB ILE A 2 -2.336 11.108 -10.311 1.00 0.00 C ATOM 12 CG1 ILE A 2 -2.571 9.615 -10.078 1.00 0.00 C ATOM 13 CG2 ILE A 2 -2.778 11.548 -11.708 1.00 0.00 C ATOM 14 CD1 ILE A 2 -3.943 9.367 -9.448 1.00 0.00 C ATOM 15 H ILE A 2 0.134 12.506 -11.563 1.00 0.00 H ATOM 16 HA ILE A 2 -0.785 11.730 -8.998 1.00 0.00 H ATOM 17 HB ILE A 2 -2.955 11.647 -9.593 1.00 0.00 H ATOM 18 HG13 ILE A 2 -1.791 9.217 -9.428 1.00 0.00 H ATOM 19 HG21 ILE A 2 -3.764 11.136 -11.923 1.00 0.00 H ATOM 20 HG22 ILE A 2 -2.821 12.636 -11.750 1.00 0.00 H ATOM 21 HG23 ILE A 2 -2.063 11.184 -12.446 1.00 0.00 H ATOM 22 HD11 ILE A 2 -3.882 8.517 -8.768 1.00 0.00 H ATOM 23 HD12 ILE A 2 -4.255 10.253 -8.896 1.00 0.00 H ATOM 24 HD13 ILE A 2 -4.669 9.153 -10.233 1.00 0.00 H ATOM 25 N TRP A 3 0.940 10.042 -9.387 1.00 0.00 N ATOM 26 CA TRP A 3 1.930 8.990 -9.547 1.00 0.00 C ATOM 27 C TRP A 3 2.425 8.591 -8.155 1.00 0.00 C ATOM 28 O TRP A 3 2.217 9.320 -7.186 1.00 0.00 O ATOM 29 CB TRP A 3 3.059 9.437 -10.477 1.00 0.00 C ATOM 30 CG TRP A 3 4.430 8.864 -10.113 1.00 0.00 C ATOM 31 CD1 TRP A 3 4.886 7.621 -10.318 1.00 0.00 C ATOM 32 CD2 TRP A 3 5.512 9.568 -9.466 1.00 0.00 C ATOM 33 NE1 TRP A 3 6.176 7.473 -9.853 1.00 0.00 N ATOM 34 CE2 TRP A 3 6.569 8.694 -9.318 1.00 0.00 C ATOM 35 CE3 TRP A 3 5.593 10.899 -9.020 1.00 0.00 C ATOM 36 CZ2 TRP A 3 7.785 9.055 -8.725 1.00 0.00 C ATOM 37 CZ3 TRP A 3 6.815 11.245 -8.430 1.00 0.00 C ATOM 38 CH2 TRP A 3 7.889 10.377 -8.275 1.00 0.00 C ATOM 39 H TRP A 3 0.942 10.493 -8.494 1.00 0.00 H ATOM 40 HA TRP A 3 1.441 8.142 -10.025 1.00 0.00 H ATOM 41 HB3 TRP A 3 3.117 10.526 -10.465 1.00 0.00 H ATOM 42 HD1 TRP A 3 4.309 6.827 -10.793 1.00 0.00 H ATOM 43 HE1 TRP A 3 6.778 6.564 -9.896 1.00 0.00 H ATOM 44 HE3 TRP A 3 4.772 11.609 -9.126 1.00 0.00 H ATOM 45 HZ2 TRP A 3 8.605 8.346 -8.620 1.00 0.00 H ATOM 46 HZ3 TRP A 3 6.931 12.266 -8.067 1.00 0.00 H ATOM 47 HH2 TRP A 3 8.808 10.722 -7.803 1.00 0.00 H ATOM 48 N GLY A 4 3.071 7.436 -8.101 1.00 0.00 N ATOM 49 CA GLY A 4 3.597 6.931 -6.844 1.00 0.00 C ATOM 50 C GLY A 4 2.636 5.922 -6.212 1.00 0.00 C ATOM 51 O GLY A 4 2.623 4.751 -6.589 1.00 0.00 O ATOM 52 H GLY A 4 3.236 6.849 -8.894 1.00 0.00 H ATOM 53 HA2 GLY A 4 4.565 6.460 -7.014 1.00 0.00 H ATOM 54 HA3 GLY A 4 3.763 7.760 -6.156 1.00 0.00 H ATOM 55 N CYS A 5 1.854 6.413 -5.263 1.00 0.00 N ATOM 56 CA CYS A 5 0.891 5.569 -4.574 1.00 0.00 C ATOM 57 C CYS A 5 -0.230 6.459 -4.036 1.00 0.00 C ATOM 58 O CYS A 5 -0.416 7.604 -4.452 1.00 0.00 O ATOM 59 CB CYS A 5 1.550 4.747 -3.465 1.00 0.00 C ATOM 60 SG CYS A 5 0.955 3.022 -3.331 1.00 0.00 S ATOM 61 H CYS A 5 1.870 7.367 -4.961 1.00 0.00 H ATOM 62 HA CYS A 5 0.506 4.867 -5.314 1.00 0.00 H ATOM 63 HB3 CYS A 5 1.383 5.250 -2.512 1.00 0.00 H HETATM 64 N B3S A 6 -0.987 5.902 -3.085 1.00 0.00 N HETATM 65 OD B3S A 6 -2.793 4.716 -0.992 1.00 0.00 O HETATM 66 CG B3S A 6 -3.173 5.746 -1.909 1.00 0.00 C HETATM 67 CB B3S A 6 -1.990 6.664 -2.300 1.00 0.00 C HETATM 68 CA B3S A 6 -1.320 7.278 -1.044 1.00 0.00 C HETATM 69 C B3S A 6 -0.283 6.396 -0.341 1.00 0.00 C HETATM 70 O B3S A 6 0.594 6.941 0.326 1.00 0.00 O HETATM 71 H B3S A 6 -0.709 4.946 -2.847 1.00 0.00 H HETATM 72 HD B3S A 6 -3.516 4.644 -0.358 1.00 0.00 H HETATM 73 HG2 B3S A 6 -3.607 5.288 -2.820 1.00 0.00 H HETATM 74 HB B3S A 6 -2.402 7.494 -2.913 1.00 0.00 H HETATM 75 HA1 B3S A 6 -0.854 8.246 -1.303 1.00 0.00 H HETATM 76 HA2 B3S A 6 -2.094 7.548 -0.302 1.00 0.00 H ATOM 77 N GLY A 7 -0.392 5.087 -0.513 1.00 0.00 N ATOM 78 CA GLY A 7 0.555 4.171 0.100 1.00 0.00 C ATOM 79 C GLY A 7 1.965 4.388 -0.454 1.00 0.00 C ATOM 80 O GLY A 7 2.522 3.507 -1.105 1.00 0.00 O ATOM 81 H GLY A 7 -1.108 4.652 -1.058 1.00 0.00 H ATOM 82 HA2 GLY A 7 0.558 4.315 1.181 1.00 0.00 H ATOM 83 HA3 GLY A 7 0.243 3.143 -0.083 1.00 0.00 H ATOM 84 N LYS A 8 2.502 5.567 -0.173 1.00 0.00 N ATOM 85 CA LYS A 8 3.836 5.911 -0.634 1.00 0.00 C ATOM 86 C LYS A 8 4.868 5.114 0.165 1.00 0.00 C ATOM 87 O LYS A 8 5.669 5.690 0.899 1.00 0.00 O ATOM 88 CB LYS A 8 4.048 7.425 -0.578 1.00 0.00 C ATOM 89 CG LYS A 8 4.891 7.905 -1.761 1.00 0.00 C ATOM 90 CD LYS A 8 6.353 7.482 -1.601 1.00 0.00 C ATOM 91 CE LYS A 8 7.206 8.014 -2.754 1.00 0.00 C ATOM 92 NZ LYS A 8 8.605 7.548 -2.620 1.00 0.00 N ATOM 93 H LYS A 8 2.042 6.278 0.358 1.00 0.00 H ATOM 94 HA LYS A 8 3.906 5.615 -1.681 1.00 0.00 H ATOM 95 HB3 LYS A 8 4.542 7.691 0.357 1.00 0.00 H ATOM 96 HG3 LYS A 8 4.829 8.991 -1.839 1.00 0.00 H ATOM 97 HD3 LYS A 8 6.418 6.395 -1.566 1.00 0.00 H ATOM 98 HE3 LYS A 8 7.178 9.102 -2.764 1.00 0.00 H ATOM 99 HZ1 LYS A 8 8.860 7.387 -1.652 1.00 0.00 H ATOM 100 HZ2 LYS A 8 8.765 6.678 -3.115 1.00 0.00 H ATOM 101 N LEU A 9 4.816 3.801 -0.005 1.00 0.00 N ATOM 102 CA LEU A 9 5.737 2.919 0.692 1.00 0.00 C ATOM 103 C LEU A 9 5.702 1.535 0.040 1.00 0.00 C ATOM 104 O LEU A 9 6.745 0.917 -0.170 1.00 0.00 O ATOM 105 CB LEU A 9 5.433 2.902 2.191 1.00 0.00 C ATOM 106 CG LEU A 9 6.574 2.448 3.102 1.00 0.00 C ATOM 107 CD1 LEU A 9 7.563 3.588 3.352 1.00 0.00 C ATOM 108 CD2 LEU A 9 6.033 1.861 4.407 1.00 0.00 C ATOM 109 H LEU A 9 4.162 3.341 -0.604 1.00 0.00 H ATOM 110 HA LEU A 9 6.738 3.332 0.571 1.00 0.00 H ATOM 111 HB3 LEU A 9 4.577 2.248 2.359 1.00 0.00 H ATOM 112 HG LEU A 9 7.121 1.653 2.594 1.00 0.00 H ATOM 113 HD11 LEU A 9 7.669 4.182 2.445 1.00 0.00 H ATOM 114 HD12 LEU A 9 7.192 4.220 4.158 1.00 0.00 H ATOM 115 HD13 LEU A 9 8.532 3.174 3.632 1.00 0.00 H ATOM 116 HD21 LEU A 9 6.705 2.118 5.227 1.00 0.00 H ATOM 117 HD22 LEU A 9 5.043 2.271 4.607 1.00 0.00 H ATOM 118 HD23 LEU A 9 5.967 0.777 4.320 1.00 0.00 H ATOM 119 N ILE A 10 4.492 1.088 -0.260 1.00 0.00 N ATOM 120 CA ILE A 10 4.307 -0.211 -0.883 1.00 0.00 C ATOM 121 C ILE A 10 3.069 -0.171 -1.781 1.00 0.00 C ATOM 122 O ILE A 10 1.942 -0.280 -1.296 1.00 0.00 O ATOM 123 CB ILE A 10 4.262 -1.312 0.178 1.00 0.00 C ATOM 124 CG1 ILE A 10 5.673 -1.708 0.618 1.00 0.00 C ATOM 125 CG2 ILE A 10 3.457 -2.516 -0.315 1.00 0.00 C ATOM 126 CD1 ILE A 10 6.513 -2.164 -0.577 1.00 0.00 C ATOM 127 H ILE A 10 3.649 1.597 -0.086 1.00 0.00 H ATOM 128 HA ILE A 10 5.180 -0.401 -1.508 1.00 0.00 H ATOM 129 HB ILE A 10 3.748 -0.920 1.056 1.00 0.00 H ATOM 130 HG13 ILE A 10 5.617 -2.509 1.355 1.00 0.00 H ATOM 131 HG21 ILE A 10 3.569 -3.341 0.389 1.00 0.00 H ATOM 132 HG22 ILE A 10 2.404 -2.244 -0.390 1.00 0.00 H ATOM 133 HG23 ILE A 10 3.824 -2.822 -1.294 1.00 0.00 H ATOM 134 HD11 ILE A 10 7.267 -2.875 -0.240 1.00 0.00 H ATOM 135 HD12 ILE A 10 5.867 -2.641 -1.313 1.00 0.00 H ATOM 136 HD13 ILE A 10 7.001 -1.301 -1.028 1.00 0.00 H ATOM 137 N CYS A 11 3.317 -0.013 -3.072 1.00 0.00 N ATOM 138 CA CYS A 11 2.236 0.043 -4.041 1.00 0.00 C ATOM 139 C CYS A 11 2.027 -1.361 -4.611 1.00 0.00 C ATOM 140 O CYS A 11 1.571 -1.515 -5.743 1.00 0.00 O ATOM 141 CB CYS A 11 2.515 1.070 -5.141 1.00 0.00 C ATOM 142 SG CYS A 11 1.249 2.381 -5.307 1.00 0.00 S ATOM 143 H CYS A 11 4.235 0.075 -3.458 1.00 0.00 H ATOM 144 HA CYS A 11 1.350 0.378 -3.502 1.00 0.00 H ATOM 145 HB3 CYS A 11 2.601 0.546 -6.094 1.00 0.00 H ATOM 146 N THR A 12 2.370 -2.351 -3.799 1.00 0.00 N ATOM 147 CA THR A 12 2.227 -3.738 -4.208 1.00 0.00 C ATOM 148 C THR A 12 2.149 -4.650 -2.983 1.00 0.00 C ATOM 149 O THR A 12 2.181 -4.175 -1.847 1.00 0.00 O ATOM 150 CB THR A 12 3.388 -4.078 -5.145 1.00 0.00 C ATOM 151 OG1 THR A 12 2.767 -4.744 -6.240 1.00 0.00 O ATOM 152 CG2 THR A 12 4.328 -5.131 -4.554 1.00 0.00 C ATOM 153 H THR A 12 2.740 -2.218 -2.880 1.00 0.00 H ATOM 154 HA THR A 12 1.284 -3.842 -4.744 1.00 0.00 H ATOM 155 HB THR A 12 3.937 -3.179 -5.426 1.00 0.00 H ATOM 156 HG1 THR A 12 2.122 -5.429 -5.902 1.00 0.00 H ATOM 157 HG21 THR A 12 4.474 -4.932 -3.492 1.00 0.00 H ATOM 158 HG22 THR A 12 3.891 -6.121 -4.682 1.00 0.00 H ATOM 159 HG23 THR A 12 5.289 -5.088 -5.067 1.00 0.00 H ATOM 160 N THR A 13 2.046 -5.943 -3.252 1.00 0.00 N ATOM 161 CA THR A 13 1.963 -6.926 -2.185 1.00 0.00 C ATOM 162 C THR A 13 2.407 -8.300 -2.690 1.00 0.00 C ATOM 163 O THR A 13 3.530 -8.729 -2.425 1.00 0.00 O ATOM 164 CB THR A 13 0.533 -6.912 -1.640 1.00 0.00 C ATOM 165 OG1 THR A 13 0.275 -5.536 -1.377 1.00 0.00 O ATOM 166 CG2 THR A 13 0.423 -7.579 -0.268 1.00 0.00 C ATOM 167 H THR A 13 2.020 -6.321 -4.178 1.00 0.00 H ATOM 168 HA THR A 13 2.656 -6.636 -1.395 1.00 0.00 H ATOM 169 HB THR A 13 -0.158 -7.365 -2.351 1.00 0.00 H ATOM 170 HG1 THR A 13 -0.704 -5.350 -1.459 1.00 0.00 H ATOM 171 HG21 THR A 13 -0.628 -7.710 -0.010 1.00 0.00 H ATOM 172 HG22 THR A 13 0.913 -8.553 -0.297 1.00 0.00 H ATOM 173 HG23 THR A 13 0.907 -6.952 0.482 1.00 0.00 H ATOM 174 N ALA A 14 1.505 -8.952 -3.407 1.00 0.00 N ATOM 175 CA ALA A 14 1.789 -10.268 -3.952 1.00 0.00 C ATOM 176 C ALA A 14 2.924 -10.160 -4.972 1.00 0.00 C ATOM 177 O ALA A 14 3.825 -9.337 -4.818 1.00 0.00 O ATOM 178 CB ALA A 14 0.514 -10.857 -4.559 1.00 0.00 C ATOM 179 H ALA A 14 0.594 -8.595 -3.618 1.00 0.00 H ATOM 180 HA ALA A 14 2.112 -10.905 -3.128 1.00 0.00 H ATOM 181 HB1 ALA A 14 0.779 -11.625 -5.286 1.00 0.00 H ATOM 182 HB2 ALA A 14 -0.094 -11.299 -3.769 1.00 0.00 H ATOM 183 HB3 ALA A 14 -0.051 -10.068 -5.053 1.00 0.00 H TER 184 ALA A 14