HETATM 1 C ACE A 1 -3.854 2.873 -2.019 1.00 0.00 C HETATM 2 O ACE A 1 -4.871 2.518 -1.419 1.00 0.00 O HETATM 3 CH3 ACE A 1 -2.785 3.694 -1.306 1.00 0.00 C HETATM 4 H1 ACE A 1 -1.909 3.068 -1.056 1.00 0.00 H HETATM 5 H2 ACE A 1 -2.433 4.545 -1.919 1.00 0.00 H HETATM 6 H3 ACE A 1 -3.172 4.111 -0.358 1.00 0.00 H ATOM 7 N ILE A 2 -3.599 2.569 -3.300 1.00 0.00 N ATOM 8 CA ILE A 2 -4.534 1.768 -4.151 1.00 0.00 C ATOM 9 C ILE A 2 -4.385 0.238 -3.861 1.00 0.00 C ATOM 10 O ILE A 2 -3.292 -0.236 -3.530 1.00 0.00 O ATOM 11 CB ILE A 2 -4.446 2.154 -5.677 1.00 0.00 C ATOM 12 CG1 ILE A 2 -3.087 1.904 -6.404 1.00 0.00 C ATOM 13 CG2 ILE A 2 -4.909 3.613 -5.918 1.00 0.00 C ATOM 14 CD1 ILE A 2 -2.860 0.465 -6.897 1.00 0.00 C ATOM 15 H ILE A 2 -2.685 2.887 -3.643 1.00 0.00 H ATOM 16 HA ILE A 2 -5.563 2.046 -3.844 1.00 0.00 H ATOM 17 HB ILE A 2 -5.203 1.546 -6.208 1.00 0.00 H ATOM 18 HG12 ILE A 2 -3.014 2.549 -7.301 1.00 0.00 H ATOM 19 HG13 ILE A 2 -2.242 2.221 -5.766 1.00 0.00 H ATOM 20 HG21 ILE A 2 -4.210 4.350 -5.480 1.00 0.00 H ATOM 21 HG22 ILE A 2 -4.993 3.846 -6.996 1.00 0.00 H ATOM 22 HG23 ILE A 2 -5.905 3.806 -5.477 1.00 0.00 H ATOM 23 HD11 ILE A 2 -1.944 0.396 -7.511 1.00 0.00 H ATOM 24 HD12 ILE A 2 -2.738 -0.252 -6.067 1.00 0.00 H ATOM 25 HD13 ILE A 2 -3.697 0.107 -7.525 1.00 0.00 H ATOM 26 N TRP A 3 -5.482 -0.534 -4.026 1.00 0.00 N ATOM 27 CA TRP A 3 -5.501 -2.006 -3.769 1.00 0.00 C ATOM 28 C TRP A 3 -4.452 -2.820 -4.589 1.00 0.00 C ATOM 29 O TRP A 3 -4.278 -2.631 -5.797 1.00 0.00 O ATOM 30 CB TRP A 3 -6.926 -2.584 -4.014 1.00 0.00 C ATOM 31 CG TRP A 3 -7.922 -2.394 -2.861 1.00 0.00 C ATOM 32 CD1 TRP A 3 -8.593 -1.198 -2.547 1.00 0.00 C ATOM 33 CD2 TRP A 3 -8.403 -3.334 -1.964 1.00 0.00 C ATOM 34 NE1 TRP A 3 -9.496 -1.363 -1.481 1.00 0.00 N ATOM 35 CE2 TRP A 3 -9.370 -2.700 -1.143 1.00 0.00 C ATOM 36 CE3 TRP A 3 -8.099 -4.708 -1.784 1.00 0.00 C ATOM 37 CZ2 TRP A 3 -10.053 -3.440 -0.148 1.00 0.00 C ATOM 38 CZ3 TRP A 3 -8.777 -5.414 -0.788 1.00 0.00 C ATOM 39 CH2 TRP A 3 -9.741 -4.791 0.014 1.00 0.00 C ATOM 40 H TRP A 3 -6.344 -0.023 -4.245 1.00 0.00 H ATOM 41 HA TRP A 3 -5.279 -2.128 -2.688 1.00 0.00 H ATOM 42 HB2 TRP A 3 -7.354 -2.176 -4.950 1.00 0.00 H ATOM 43 HB3 TRP A 3 -6.864 -3.671 -4.214 1.00 0.00 H ATOM 44 HD1 TRP A 3 -8.428 -0.270 -3.069 1.00 0.00 H ATOM 45 HE1 TRP A 3 -10.106 -0.659 -1.051 1.00 0.00 H ATOM 46 HE3 TRP A 3 -7.360 -5.203 -2.397 1.00 0.00 H ATOM 47 HZ2 TRP A 3 -10.791 -2.968 0.484 1.00 0.00 H ATOM 48 HZ3 TRP A 3 -8.555 -6.460 -0.636 1.00 0.00 H ATOM 49 HH2 TRP A 3 -10.248 -5.365 0.777 1.00 0.00 H ATOM 50 N GLY A 4 -3.783 -3.733 -3.873 1.00 0.00 N ATOM 51 CA GLY A 4 -2.725 -4.604 -4.432 1.00 0.00 C ATOM 52 C GLY A 4 -1.422 -4.354 -3.653 1.00 0.00 C ATOM 53 O GLY A 4 -1.294 -4.809 -2.512 1.00 0.00 O ATOM 54 H GLY A 4 -4.059 -3.752 -2.883 1.00 0.00 H ATOM 55 HA2 GLY A 4 -3.023 -5.660 -4.304 1.00 0.00 H ATOM 56 HA3 GLY A 4 -2.587 -4.467 -5.523 1.00 0.00 H HETATM 57 N SET A 5 -0.459 -3.652 -4.277 1.00 0.00 N HETATM 58 CA SET A 5 0.832 -3.313 -3.618 1.00 0.00 C HETATM 59 CB SET A 5 1.376 -1.987 -4.226 1.00 0.00 C HETATM 60 OG SET A 5 2.212 -2.004 -5.135 1.00 0.00 O HETATM 61 NT SET A 5 2.827 -4.392 -2.541 1.00 0.00 N HETATM 62 C SET A 5 1.850 -4.499 -3.654 1.00 0.00 C HETATM 63 H SET A 5 -0.701 -3.322 -5.218 1.00 0.00 H HETATM 64 HA SET A 5 0.605 -3.105 -2.554 1.00 0.00 H HETATM 65 HB2 SET A 5 1.319 -5.472 -3.614 1.00 0.00 H HETATM 66 HB3 SET A 5 2.391 -4.530 -4.618 1.00 0.00 H HETATM 67 HNT2 SET A 5 3.462 -3.590 -2.465 1.00 0.00 H ATOM 68 N SER A 6 0.877 -0.839 -3.724 1.00 0.00 N ATOM 69 CA SER A 6 1.280 0.516 -4.190 1.00 0.00 C ATOM 70 C SER A 6 0.722 1.529 -3.155 1.00 0.00 C ATOM 71 O SER A 6 -0.497 1.702 -3.037 1.00 0.00 O ATOM 72 CB SER A 6 0.753 0.870 -5.605 1.00 0.00 C ATOM 73 OG SER A 6 1.463 0.170 -6.620 1.00 0.00 O ATOM 74 H SER A 6 0.259 -0.954 -2.912 1.00 0.00 H ATOM 75 HA SER A 6 2.388 0.572 -4.215 1.00 0.00 H ATOM 76 HB2 SER A 6 -0.326 0.646 -5.685 1.00 0.00 H ATOM 77 HB3 SER A 6 0.852 1.954 -5.804 1.00 0.00 H ATOM 78 HG SER A 6 1.576 -0.729 -6.295 1.00 0.00 H ATOM 79 N GLY A 7 1.620 2.203 -2.421 1.00 0.00 N ATOM 80 CA GLY A 7 1.218 3.193 -1.399 1.00 0.00 C ATOM 81 C GLY A 7 2.388 4.111 -1.024 1.00 0.00 C ATOM 82 O GLY A 7 2.517 5.200 -1.589 1.00 0.00 O ATOM 83 H GLY A 7 2.604 2.001 -2.632 1.00 0.00 H ATOM 84 HA2 GLY A 7 0.388 3.823 -1.773 1.00 0.00 H ATOM 85 HA3 GLY A 7 0.816 2.674 -0.506 1.00 0.00 H ATOM 86 N LYS A 8 3.219 3.674 -0.060 1.00 0.00 N ATOM 87 CA LYS A 8 4.398 4.461 0.398 1.00 0.00 C ATOM 88 C LYS A 8 5.524 3.474 0.831 1.00 0.00 C ATOM 89 O LYS A 8 6.331 3.085 -0.018 1.00 0.00 O ATOM 90 CB LYS A 8 3.972 5.562 1.422 1.00 0.00 C ATOM 91 CG LYS A 8 5.085 6.571 1.782 1.00 0.00 C ATOM 92 CD LYS A 8 4.612 7.651 2.780 1.00 0.00 C ATOM 93 CE LYS A 8 5.696 8.663 3.204 1.00 0.00 C ATOM 94 NZ LYS A 8 6.065 9.601 2.121 1.00 0.00 N ATOM 95 H LYS A 8 3.032 2.711 0.245 1.00 0.00 H ATOM 96 HA LYS A 8 4.812 5.000 -0.479 1.00 0.00 H ATOM 97 HB2 LYS A 8 3.117 6.130 1.008 1.00 0.00 H ATOM 98 HB3 LYS A 8 3.580 5.088 2.342 1.00 0.00 H ATOM 99 HG2 LYS A 8 5.954 6.034 2.207 1.00 0.00 H ATOM 100 HG3 LYS A 8 5.455 7.051 0.856 1.00 0.00 H ATOM 101 HD2 LYS A 8 3.733 8.187 2.373 1.00 0.00 H ATOM 102 HD3 LYS A 8 4.240 7.147 3.692 1.00 0.00 H ATOM 103 HE2 LYS A 8 5.330 9.245 4.072 1.00 0.00 H ATOM 104 HE3 LYS A 8 6.598 8.132 3.569 1.00 0.00 H ATOM 105 HZ1 LYS A 8 5.256 10.139 1.790 1.00 0.00 H ATOM 106 HZ2 LYS A 8 6.774 10.281 2.420 1.00 0.00 H ATOM 107 HZ3 LYS A 8 6.447 9.110 1.304 1.00 0.00 H ATOM 108 N LEU A 9 5.582 3.070 2.117 1.00 0.00 N ATOM 109 CA LEU A 9 6.619 2.133 2.640 1.00 0.00 C ATOM 110 C LEU A 9 6.158 0.638 2.719 1.00 0.00 C ATOM 111 O LEU A 9 6.989 -0.232 2.444 1.00 0.00 O ATOM 112 CB LEU A 9 7.177 2.715 3.979 1.00 0.00 C ATOM 113 CG LEU A 9 8.334 1.943 4.677 1.00 0.00 C ATOM 114 CD1 LEU A 9 9.630 1.909 3.840 1.00 0.00 C ATOM 115 CD2 LEU A 9 8.628 2.545 6.064 1.00 0.00 C ATOM 116 H LEU A 9 4.861 3.472 2.725 1.00 0.00 H ATOM 117 HA LEU A 9 7.478 2.141 1.941 1.00 0.00 H ATOM 118 HB2 LEU A 9 7.527 3.755 3.809 1.00 0.00 H ATOM 119 HB3 LEU A 9 6.345 2.824 4.701 1.00 0.00 H ATOM 120 HG LEU A 9 8.010 0.898 4.842 1.00 0.00 H ATOM 121 HD11 LEU A 9 10.008 2.924 3.616 1.00 0.00 H ATOM 122 HD12 LEU A 9 10.439 1.365 4.362 1.00 0.00 H ATOM 123 HD13 LEU A 9 9.481 1.393 2.874 1.00 0.00 H ATOM 124 HD21 LEU A 9 8.967 3.596 6.000 1.00 0.00 H ATOM 125 HD22 LEU A 9 7.733 2.528 6.714 1.00 0.00 H ATOM 126 HD23 LEU A 9 9.415 1.979 6.598 1.00 0.00 H ATOM 127 N ILE A 10 4.895 0.321 3.093 1.00 0.00 N ATOM 128 CA ILE A 10 4.394 -1.083 3.197 1.00 0.00 C ATOM 129 C ILE A 10 3.478 -1.441 1.984 1.00 0.00 C ATOM 130 O ILE A 10 2.781 -0.589 1.418 1.00 0.00 O ATOM 131 CB ILE A 10 3.737 -1.375 4.600 1.00 0.00 C ATOM 132 CG1 ILE A 10 2.648 -0.394 5.139 1.00 0.00 C ATOM 133 CG2 ILE A 10 4.828 -1.542 5.688 1.00 0.00 C ATOM 134 CD1 ILE A 10 1.332 -0.328 4.350 1.00 0.00 C ATOM 135 H ILE A 10 4.225 1.097 3.115 1.00 0.00 H ATOM 136 HA ILE A 10 5.262 -1.772 3.126 1.00 0.00 H ATOM 137 HB ILE A 10 3.253 -2.369 4.535 1.00 0.00 H ATOM 138 HG12 ILE A 10 2.379 -0.687 6.172 1.00 0.00 H ATOM 139 HG13 ILE A 10 3.064 0.627 5.237 1.00 0.00 H ATOM 140 HG21 ILE A 10 5.575 -2.307 5.407 1.00 0.00 H ATOM 141 HG22 ILE A 10 5.380 -0.601 5.870 1.00 0.00 H ATOM 142 HG23 ILE A 10 4.402 -1.864 6.657 1.00 0.00 H ATOM 143 HD11 ILE A 10 0.559 0.228 4.910 1.00 0.00 H ATOM 144 HD12 ILE A 10 1.453 0.190 3.383 1.00 0.00 H ATOM 145 HD13 ILE A 10 0.926 -1.335 4.143 1.00 0.00 H ATOM 146 N ASP A 11 3.489 -2.729 1.590 1.00 0.00 N ATOM 147 CA ASP A 11 2.661 -3.237 0.460 1.00 0.00 C ATOM 148 C ASP A 11 1.143 -3.458 0.787 1.00 0.00 C ATOM 149 O ASP A 11 0.326 -3.236 -0.110 1.00 0.00 O ATOM 150 CB ASP A 11 3.355 -4.499 -0.140 1.00 0.00 C ATOM 151 CG ASP A 11 2.669 -5.076 -1.396 1.00 0.00 C ATOM 152 OD1 ASP A 11 1.947 -6.070 -1.290 1.00 0.00 O ATOM 153 H ASP A 11 4.156 -3.330 2.086 1.00 0.00 H ATOM 154 HA ASP A 11 2.691 -2.469 -0.340 1.00 0.00 H ATOM 155 HB2 ASP A 11 4.413 -4.278 -0.382 1.00 0.00 H ATOM 156 HB3 ASP A 11 3.403 -5.297 0.626 1.00 0.00 H ATOM 157 N THR A 12 0.753 -3.884 2.010 1.00 0.00 N ATOM 158 CA THR A 12 -0.674 -4.129 2.380 1.00 0.00 C ATOM 159 C THR A 12 -1.579 -2.857 2.247 1.00 0.00 C ATOM 160 O THR A 12 -1.419 -1.876 2.979 1.00 0.00 O ATOM 161 CB THR A 12 -0.763 -4.846 3.762 1.00 0.00 C ATOM 162 OG1 THR A 12 -2.109 -5.247 3.998 1.00 0.00 O ATOM 163 CG2 THR A 12 -0.281 -4.065 5.001 1.00 0.00 C ATOM 164 H THR A 12 1.516 -4.022 2.680 1.00 0.00 H ATOM 165 HA THR A 12 -1.036 -4.891 1.659 1.00 0.00 H ATOM 166 HB THR A 12 -0.156 -5.770 3.704 1.00 0.00 H ATOM 167 HG1 THR A 12 -2.114 -5.661 4.864 1.00 0.00 H ATOM 168 HG21 THR A 12 0.770 -3.741 4.899 1.00 0.00 H ATOM 169 HG22 THR A 12 -0.890 -3.160 5.184 1.00 0.00 H ATOM 170 HG23 THR A 12 -0.340 -4.685 5.914 1.00 0.00 H ATOM 171 N THR A 13 -2.508 -2.902 1.276 1.00 0.00 N ATOM 172 CA THR A 13 -3.448 -1.787 0.978 1.00 0.00 C ATOM 173 C THR A 13 -4.874 -2.396 0.853 1.00 0.00 C ATOM 174 O THR A 13 -5.254 -2.931 -0.195 1.00 0.00 O ATOM 175 CB THR A 13 -3.027 -0.985 -0.294 1.00 0.00 C ATOM 176 OG1 THR A 13 -2.792 -1.853 -1.401 1.00 0.00 O ATOM 177 CG2 THR A 13 -1.780 -0.105 -0.110 1.00 0.00 C ATOM 178 H THR A 13 -2.521 -3.768 0.730 1.00 0.00 H ATOM 179 HA THR A 13 -3.457 -1.058 1.815 1.00 0.00 H ATOM 180 HB THR A 13 -3.858 -0.305 -0.567 1.00 0.00 H ATOM 181 HG1 THR A 13 -2.726 -1.283 -2.174 1.00 0.00 H ATOM 182 HG21 THR A 13 -1.908 0.619 0.715 1.00 0.00 H ATOM 183 HG22 THR A 13 -0.878 -0.706 0.111 1.00 0.00 H ATOM 184 HG23 THR A 13 -1.568 0.479 -1.024 1.00 0.00 H ATOM 185 N ALA A 14 -5.646 -2.317 1.952 1.00 0.00 N ATOM 186 CA ALA A 14 -7.030 -2.846 2.013 1.00 0.00 C ATOM 187 C ALA A 14 -7.960 -1.820 2.693 1.00 0.00 C ATOM 188 O ALA A 14 -8.868 -1.240 2.098 1.00 0.00 O ATOM 189 CB ALA A 14 -7.046 -4.223 2.704 1.00 0.00 C ATOM 190 OXT ALA A 14 -7.670 -1.621 4.021 1.00 0.00 O ATOM 191 H ALA A 14 -5.178 -1.916 2.771 1.00 0.00 H ATOM 192 HA ALA A 14 -7.424 -2.992 0.990 1.00 0.00 H ATOM 193 HB1 ALA A 14 -8.069 -4.643 2.745 1.00 0.00 H ATOM 194 HB2 ALA A 14 -6.425 -4.957 2.157 1.00 0.00 H ATOM 195 HB3 ALA A 14 -6.667 -4.179 3.742 1.00 0.00 H ATOM 196 HXT ALA A 14 -8.265 -0.978 4.413 1.00 0.00 H TER 197 ALA A 14