HETATM 1 C ACE A 1 -7.867 11.409 1.896 1.00 0.00 C HETATM 2 O ACE A 1 -9.087 11.540 1.795 1.00 0.00 O HETATM 3 CH3 ACE A 1 -7.071 12.352 2.731 1.00 0.00 C HETATM 4 H1 ACE A 1 -6.365 11.789 3.342 1.00 0.00 H HETATM 5 H2 ACE A 1 -6.526 13.038 2.084 1.00 0.00 H HETATM 6 H3 ACE A 1 -7.741 12.917 3.379 1.00 0.00 H ATOM 7 N ILE A 2 -7.163 10.457 1.301 1.00 0.00 N ATOM 8 CA ILE A 2 -7.809 9.467 0.454 1.00 0.00 C ATOM 9 C ILE A 2 -7.142 8.107 0.669 1.00 0.00 C ATOM 10 O ILE A 2 -5.999 7.901 0.264 1.00 0.00 O ATOM 11 CB ILE A 2 -7.810 9.928 -1.004 1.00 0.00 C ATOM 12 CG1 ILE A 2 -6.422 9.772 -1.629 1.00 0.00 C ATOM 13 CG2 ILE A 2 -8.337 11.359 -1.127 1.00 0.00 C ATOM 14 CD1 ILE A 2 -5.360 10.490 -0.794 1.00 0.00 C ATOM 15 H ILE A 2 -6.173 10.357 1.387 1.00 0.00 H ATOM 16 HA ILE A 2 -8.849 9.396 0.771 1.00 0.00 H ATOM 17 HB ILE A 2 -8.489 9.285 -1.565 1.00 0.00 H ATOM 18 HG13 ILE A 2 -6.428 10.176 -2.642 1.00 0.00 H ATOM 19 HG21 ILE A 2 -9.396 11.380 -0.870 1.00 0.00 H ATOM 20 HG22 ILE A 2 -7.785 12.008 -0.447 1.00 0.00 H ATOM 21 HG23 ILE A 2 -8.205 11.708 -2.151 1.00 0.00 H ATOM 22 HD11 ILE A 2 -5.807 11.358 -0.308 1.00 0.00 H ATOM 23 HD12 ILE A 2 -4.973 9.809 -0.037 1.00 0.00 H ATOM 24 HD13 ILE A 2 -4.546 10.815 -1.442 1.00 0.00 H ATOM 25 N TRP A 3 -7.885 7.214 1.307 1.00 0.00 N ATOM 26 CA TRP A 3 -7.379 5.879 1.580 1.00 0.00 C ATOM 27 C TRP A 3 -7.734 4.986 0.389 1.00 0.00 C ATOM 28 O TRP A 3 -8.906 4.706 0.145 1.00 0.00 O ATOM 29 CB TRP A 3 -7.924 5.349 2.908 1.00 0.00 C ATOM 30 CG TRP A 3 -6.979 5.552 4.094 1.00 0.00 C ATOM 31 CD1 TRP A 3 -6.477 4.621 4.918 1.00 0.00 C ATOM 32 CD2 TRP A 3 -6.439 6.808 4.557 1.00 0.00 C ATOM 33 NE1 TRP A 3 -5.657 5.184 5.875 1.00 0.00 N ATOM 34 CE2 TRP A 3 -5.633 6.555 5.649 1.00 0.00 C ATOM 35 CE3 TRP A 3 -6.625 8.113 4.071 1.00 0.00 C ATOM 36 CZ2 TRP A 3 -4.950 7.559 6.345 1.00 0.00 C ATOM 37 CZ3 TRP A 3 -5.937 9.105 4.778 1.00 0.00 C ATOM 38 CH2 TRP A 3 -5.121 8.868 5.878 1.00 0.00 C ATOM 39 H TRP A 3 -8.813 7.389 1.633 1.00 0.00 H ATOM 40 HA TRP A 3 -6.296 5.947 1.686 1.00 0.00 H ATOM 41 HB3 TRP A 3 -8.135 4.284 2.803 1.00 0.00 H ATOM 42 HD1 TRP A 3 -6.690 3.556 4.842 1.00 0.00 H ATOM 43 HE1 TRP A 3 -5.126 4.650 6.663 1.00 0.00 H ATOM 44 HE3 TRP A 3 -7.257 8.338 3.211 1.00 0.00 H ATOM 45 HZ2 TRP A 3 -4.319 7.334 7.205 1.00 0.00 H ATOM 46 HZ3 TRP A 3 -6.046 10.137 4.442 1.00 0.00 H ATOM 47 HH2 TRP A 3 -4.617 9.696 6.375 1.00 0.00 H ATOM 48 N GLY A 4 -6.698 4.564 -0.322 1.00 0.00 N ATOM 49 CA GLY A 4 -6.885 3.709 -1.481 1.00 0.00 C ATOM 50 C GLY A 4 -5.739 2.702 -1.611 1.00 0.00 C ATOM 51 O GLY A 4 -5.973 1.519 -1.853 1.00 0.00 O ATOM 52 H GLY A 4 -5.747 4.796 -0.117 1.00 0.00 H ATOM 53 HA2 GLY A 4 -7.833 3.177 -1.397 1.00 0.00 H ATOM 54 HA3 GLY A 4 -6.941 4.319 -2.382 1.00 0.00 H ATOM 55 N CYS A 5 -4.528 3.209 -1.443 1.00 0.00 N ATOM 56 CA CYS A 5 -3.346 2.369 -1.538 1.00 0.00 C ATOM 57 C CYS A 5 -2.651 2.361 -0.176 1.00 0.00 C ATOM 58 O CYS A 5 -2.593 3.365 0.536 1.00 0.00 O ATOM 59 CB CYS A 5 -2.408 2.837 -2.654 1.00 0.00 C ATOM 60 SG CYS A 5 -1.296 1.542 -3.314 1.00 0.00 S ATOM 61 H CYS A 5 -4.347 4.173 -1.246 1.00 0.00 H ATOM 62 HA CYS A 5 -3.692 1.370 -1.802 1.00 0.00 H ATOM 63 HB3 CYS A 5 -1.801 3.661 -2.278 1.00 0.00 H HETATM 64 N B3S A 6 -2.115 1.188 0.180 1.00 0.00 N HETATM 65 OD B3S A 6 -0.937 -1.431 1.229 1.00 0.00 O HETATM 66 CG B3S A 6 -1.461 -0.357 2.014 1.00 0.00 C HETATM 67 CB B3S A 6 -1.232 1.027 1.361 1.00 0.00 C HETATM 68 CA B3S A 6 0.248 1.210 0.943 1.00 0.00 C HETATM 69 C B3S A 6 0.523 2.328 -0.068 1.00 0.00 C HETATM 70 O B3S A 6 0.892 2.018 -1.199 1.00 0.00 O HETATM 71 H B3S A 6 -2.246 0.451 -0.518 1.00 0.00 H HETATM 72 HD B3S A 6 -0.473 -2.009 1.844 1.00 0.00 H HETATM 73 HG2 B3S A 6 -2.545 -0.517 2.182 1.00 0.00 H HETATM 74 HB B3S A 6 -1.474 1.798 2.124 1.00 0.00 H HETATM 75 HA1 B3S A 6 0.873 1.374 1.840 1.00 0.00 H HETATM 76 HA2 B3S A 6 0.637 0.266 0.519 1.00 0.00 H ATOM 77 N GLY A 7 0.357 3.573 0.353 1.00 0.00 N ATOM 78 CA GLY A 7 0.608 4.701 -0.529 1.00 0.00 C ATOM 79 C GLY A 7 2.048 4.682 -1.045 1.00 0.00 C ATOM 80 O GLY A 7 2.461 3.732 -1.708 1.00 0.00 O ATOM 81 H GLY A 7 0.056 3.817 1.275 1.00 0.00 H ATOM 82 HA2 GLY A 7 -0.084 4.671 -1.369 1.00 0.00 H ATOM 83 HA3 GLY A 7 0.422 5.633 0.004 1.00 0.00 H ATOM 84 N LYS A 8 2.774 5.742 -0.721 1.00 0.00 N ATOM 85 CA LYS A 8 4.158 5.859 -1.144 1.00 0.00 C ATOM 86 C LYS A 8 5.046 5.038 -0.206 1.00 0.00 C ATOM 87 O LYS A 8 6.067 5.525 0.274 1.00 0.00 O ATOM 88 CB LYS A 8 4.566 7.331 -1.244 1.00 0.00 C ATOM 89 CG LYS A 8 4.075 7.948 -2.555 1.00 0.00 C ATOM 90 CD LYS A 8 5.114 8.915 -3.128 1.00 0.00 C ATOM 91 CE LYS A 8 5.316 8.678 -4.626 1.00 0.00 C ATOM 92 NZ LYS A 8 5.178 9.947 -5.375 1.00 0.00 N ATOM 93 H LYS A 8 2.430 6.511 -0.181 1.00 0.00 H ATOM 94 HA LYS A 8 4.231 5.437 -2.146 1.00 0.00 H ATOM 95 HB3 LYS A 8 5.651 7.417 -1.181 1.00 0.00 H ATOM 96 HG3 LYS A 8 3.138 8.476 -2.384 1.00 0.00 H ATOM 97 HD3 LYS A 8 6.062 8.787 -2.606 1.00 0.00 H ATOM 98 HE3 LYS A 8 4.585 7.954 -4.988 1.00 0.00 H ATOM 99 HZ1 LYS A 8 5.421 10.751 -4.808 1.00 0.00 H ATOM 100 HZ2 LYS A 8 5.775 9.973 -6.193 1.00 0.00 H ATOM 101 N LEU A 9 4.621 3.805 0.028 1.00 0.00 N ATOM 102 CA LEU A 9 5.365 2.911 0.900 1.00 0.00 C ATOM 103 C LEU A 9 5.397 1.512 0.281 1.00 0.00 C ATOM 104 O LEU A 9 6.469 0.945 0.077 1.00 0.00 O ATOM 105 CB LEU A 9 4.787 2.943 2.317 1.00 0.00 C ATOM 106 CG LEU A 9 5.781 3.249 3.439 1.00 0.00 C ATOM 107 CD1 LEU A 9 6.767 4.339 3.016 1.00 0.00 C ATOM 108 CD2 LEU A 9 5.051 3.609 4.735 1.00 0.00 C ATOM 109 H LEU A 9 3.788 3.416 -0.366 1.00 0.00 H ATOM 110 HA LEU A 9 6.385 3.286 0.960 1.00 0.00 H ATOM 111 HB3 LEU A 9 4.324 1.977 2.521 1.00 0.00 H ATOM 112 HG LEU A 9 6.362 2.348 3.636 1.00 0.00 H ATOM 113 HD11 LEU A 9 7.180 4.820 3.903 1.00 0.00 H ATOM 114 HD12 LEU A 9 7.575 3.893 2.435 1.00 0.00 H ATOM 115 HD13 LEU A 9 6.250 5.081 2.407 1.00 0.00 H ATOM 116 HD21 LEU A 9 5.065 2.753 5.409 1.00 0.00 H ATOM 117 HD22 LEU A 9 5.550 4.453 5.211 1.00 0.00 H ATOM 118 HD23 LEU A 9 4.019 3.877 4.509 1.00 0.00 H ATOM 119 N ILE A 10 4.210 0.996 0.001 1.00 0.00 N ATOM 120 CA ILE A 10 4.088 -0.326 -0.590 1.00 0.00 C ATOM 121 C ILE A 10 2.790 -0.402 -1.397 1.00 0.00 C ATOM 122 O ILE A 10 1.786 -0.924 -0.915 1.00 0.00 O ATOM 123 CB ILE A 10 4.209 -1.407 0.486 1.00 0.00 C ATOM 124 CG1 ILE A 10 5.676 -1.730 0.776 1.00 0.00 C ATOM 125 CG2 ILE A 10 3.412 -2.656 0.100 1.00 0.00 C ATOM 126 CD1 ILE A 10 6.415 -2.124 -0.504 1.00 0.00 C ATOM 127 H ILE A 10 3.342 1.464 0.171 1.00 0.00 H ATOM 128 HA ILE A 10 4.928 -0.456 -1.274 1.00 0.00 H ATOM 129 HB ILE A 10 3.775 -1.020 1.408 1.00 0.00 H ATOM 130 HG13 ILE A 10 5.736 -2.544 1.500 1.00 0.00 H ATOM 131 HG21 ILE A 10 3.318 -2.706 -0.985 1.00 0.00 H ATOM 132 HG22 ILE A 10 3.931 -3.543 0.461 1.00 0.00 H ATOM 133 HG23 ILE A 10 2.420 -2.606 0.549 1.00 0.00 H ATOM 134 HD11 ILE A 10 6.963 -1.262 -0.887 1.00 0.00 H ATOM 135 HD12 ILE A 10 7.115 -2.930 -0.287 1.00 0.00 H ATOM 136 HD13 ILE A 10 5.696 -2.457 -1.251 1.00 0.00 H ATOM 137 N CYS A 11 2.853 0.125 -2.610 1.00 0.00 N ATOM 138 CA CYS A 11 1.695 0.124 -3.488 1.00 0.00 C ATOM 139 C CYS A 11 1.744 -1.143 -4.345 1.00 0.00 C ATOM 140 O CYS A 11 1.180 -1.180 -5.438 1.00 0.00 O ATOM 141 CB CYS A 11 1.632 1.391 -4.344 1.00 0.00 C ATOM 142 SG CYS A 11 0.322 2.575 -3.866 1.00 0.00 S ATOM 143 H CYS A 11 3.674 0.548 -2.994 1.00 0.00 H ATOM 144 HA CYS A 11 0.815 0.121 -2.846 1.00 0.00 H ATOM 145 HB3 CYS A 11 1.478 1.102 -5.384 1.00 0.00 H ATOM 146 N THR A 12 2.424 -2.150 -3.817 1.00 0.00 N ATOM 147 CA THR A 12 2.554 -3.414 -4.521 1.00 0.00 C ATOM 148 C THR A 12 3.050 -4.506 -3.570 1.00 0.00 C ATOM 149 O THR A 12 3.667 -4.210 -2.547 1.00 0.00 O ATOM 150 CB THR A 12 3.473 -3.195 -5.724 1.00 0.00 C ATOM 151 OG1 THR A 12 2.943 -4.056 -6.727 1.00 0.00 O ATOM 152 CG2 THR A 12 4.887 -3.726 -5.486 1.00 0.00 C ATOM 153 H THR A 12 2.879 -2.113 -2.928 1.00 0.00 H ATOM 154 HA THR A 12 1.566 -3.719 -4.868 1.00 0.00 H ATOM 155 HB THR A 12 3.495 -2.143 -6.009 1.00 0.00 H ATOM 156 HG1 THR A 12 2.751 -4.957 -6.339 1.00 0.00 H ATOM 157 HG21 THR A 12 5.348 -3.178 -4.663 1.00 0.00 H ATOM 158 HG22 THR A 12 4.840 -4.785 -5.235 1.00 0.00 H ATOM 159 HG23 THR A 12 5.483 -3.593 -6.389 1.00 0.00 H ATOM 160 N THR A 13 2.762 -5.745 -3.939 1.00 0.00 N ATOM 161 CA THR A 13 3.171 -6.881 -3.131 1.00 0.00 C ATOM 162 C THR A 13 3.125 -8.168 -3.959 1.00 0.00 C ATOM 163 O THR A 13 2.063 -8.765 -4.126 1.00 0.00 O ATOM 164 CB THR A 13 2.278 -6.925 -1.890 1.00 0.00 C ATOM 165 OG1 THR A 13 1.013 -6.465 -2.356 1.00 0.00 O ATOM 166 CG2 THR A 13 2.687 -5.891 -0.838 1.00 0.00 C ATOM 167 H THR A 13 2.260 -5.977 -4.772 1.00 0.00 H ATOM 168 HA THR A 13 4.208 -6.733 -2.829 1.00 0.00 H ATOM 169 HB THR A 13 2.255 -7.927 -1.462 1.00 0.00 H ATOM 170 HG1 THR A 13 0.323 -6.575 -1.640 1.00 0.00 H ATOM 171 HG21 THR A 13 3.768 -5.764 -0.855 1.00 0.00 H ATOM 172 HG22 THR A 13 2.205 -4.937 -1.061 1.00 0.00 H ATOM 173 HG23 THR A 13 2.375 -6.234 0.149 1.00 0.00 H ATOM 174 N ALA A 14 4.289 -8.557 -4.455 1.00 0.00 N ATOM 175 CA ALA A 14 4.396 -9.761 -5.260 1.00 0.00 C ATOM 176 C ALA A 14 4.952 -10.897 -4.400 1.00 0.00 C ATOM 177 O ALA A 14 6.166 -11.024 -4.241 1.00 0.00 O ATOM 178 CB ALA A 14 5.265 -9.480 -6.488 1.00 0.00 C ATOM 179 H ALA A 14 5.149 -8.065 -4.315 1.00 0.00 H ATOM 180 HA ALA A 14 3.392 -10.027 -5.594 1.00 0.00 H ATOM 181 HB1 ALA A 14 4.877 -10.034 -7.342 1.00 0.00 H ATOM 182 HB2 ALA A 14 5.248 -8.412 -6.708 1.00 0.00 H ATOM 183 HB3 ALA A 14 6.290 -9.792 -6.286 1.00 0.00 H TER 184 ALA A 14