HETATM 1 C ACE A 1 -8.199 -2.403 3.476 1.00 0.00 C HETATM 2 O ACE A 1 -9.297 -2.348 2.919 1.00 0.00 O HETATM 3 CH3 ACE A 1 -7.957 -3.386 4.616 1.00 0.00 C HETATM 4 H1 ACE A 1 -7.151 -4.102 4.370 1.00 0.00 H HETATM 5 H2 ACE A 1 -7.679 -2.864 5.550 1.00 0.00 H HETATM 6 H3 ACE A 1 -8.867 -3.978 4.829 1.00 0.00 H ATOM 7 N ILE A 2 -7.150 -1.638 3.144 1.00 0.00 N ATOM 8 CA ILE A 2 -7.188 -0.619 2.053 1.00 0.00 C ATOM 9 C ILE A 2 -6.683 -1.265 0.722 1.00 0.00 C ATOM 10 O ILE A 2 -5.483 -1.444 0.503 1.00 0.00 O ATOM 11 CB ILE A 2 -6.465 0.731 2.433 1.00 0.00 C ATOM 12 CG1 ILE A 2 -5.154 0.684 3.280 1.00 0.00 C ATOM 13 CG2 ILE A 2 -7.446 1.695 3.146 1.00 0.00 C ATOM 14 CD1 ILE A 2 -3.990 -0.124 2.697 1.00 0.00 C ATOM 15 H ILE A 2 -6.309 -1.795 3.709 1.00 0.00 H ATOM 16 HA ILE A 2 -8.249 -0.341 1.878 1.00 0.00 H ATOM 17 HB ILE A 2 -6.209 1.239 1.483 1.00 0.00 H ATOM 18 HG12 ILE A 2 -4.786 1.717 3.435 1.00 0.00 H ATOM 19 HG13 ILE A 2 -5.371 0.304 4.296 1.00 0.00 H ATOM 20 HG21 ILE A 2 -6.991 2.686 3.337 1.00 0.00 H ATOM 21 HG22 ILE A 2 -8.351 1.884 2.538 1.00 0.00 H ATOM 22 HG23 ILE A 2 -7.785 1.295 4.120 1.00 0.00 H ATOM 23 HD11 ILE A 2 -4.211 -1.207 2.685 1.00 0.00 H ATOM 24 HD12 ILE A 2 -3.762 0.181 1.659 1.00 0.00 H ATOM 25 HD13 ILE A 2 -3.069 0.011 3.291 1.00 0.00 H ATOM 26 N TRP A 3 -7.626 -1.612 -0.172 1.00 0.00 N ATOM 27 CA TRP A 3 -7.315 -2.250 -1.481 1.00 0.00 C ATOM 28 C TRP A 3 -7.057 -1.164 -2.559 1.00 0.00 C ATOM 29 O TRP A 3 -7.945 -0.385 -2.920 1.00 0.00 O ATOM 30 CB TRP A 3 -8.448 -3.210 -1.936 1.00 0.00 C ATOM 31 CG TRP A 3 -8.525 -4.543 -1.175 1.00 0.00 C ATOM 32 CD1 TRP A 3 -8.932 -4.693 0.163 1.00 0.00 C ATOM 33 CD2 TRP A 3 -8.219 -5.820 -1.614 1.00 0.00 C ATOM 34 NE1 TRP A 3 -8.887 -6.035 0.583 1.00 0.00 N ATOM 35 CE2 TRP A 3 -8.445 -6.718 -0.538 1.00 0.00 C ATOM 36 CE3 TRP A 3 -7.752 -6.301 -2.864 1.00 0.00 C ATOM 37 CZ2 TRP A 3 -8.208 -8.102 -0.708 1.00 0.00 C ATOM 38 CZ3 TRP A 3 -7.531 -7.672 -3.009 1.00 0.00 C ATOM 39 CH2 TRP A 3 -7.756 -8.559 -1.948 1.00 0.00 C ATOM 40 H TRP A 3 -8.583 -1.407 0.131 1.00 0.00 H ATOM 41 HA TRP A 3 -6.411 -2.885 -1.362 1.00 0.00 H ATOM 42 HB2 TRP A 3 -9.427 -2.696 -1.887 1.00 0.00 H ATOM 43 HB3 TRP A 3 -8.315 -3.439 -3.011 1.00 0.00 H ATOM 44 HD1 TRP A 3 -9.182 -3.859 0.798 1.00 0.00 H ATOM 45 HE1 TRP A 3 -9.116 -6.419 1.506 1.00 0.00 H ATOM 46 HE3 TRP A 3 -7.570 -5.629 -3.691 1.00 0.00 H ATOM 47 HZ2 TRP A 3 -8.373 -8.795 0.104 1.00 0.00 H ATOM 48 HZ3 TRP A 3 -7.177 -8.055 -3.955 1.00 0.00 H ATOM 49 HH2 TRP A 3 -7.573 -9.614 -2.090 1.00 0.00 H ATOM 50 N GLY A 4 -5.816 -1.152 -3.055 1.00 0.00 N ATOM 51 CA GLY A 4 -5.367 -0.200 -4.095 1.00 0.00 C ATOM 52 C GLY A 4 -3.879 0.158 -3.931 1.00 0.00 C ATOM 53 O GLY A 4 -3.024 -0.733 -3.882 1.00 0.00 O ATOM 54 H GLY A 4 -5.220 -1.880 -2.642 1.00 0.00 H ATOM 55 HA2 GLY A 4 -5.505 -0.663 -5.089 1.00 0.00 H ATOM 56 HA3 GLY A 4 -5.999 0.712 -4.104 1.00 0.00 H HETATM 57 N SET A 5 -3.585 1.469 -3.878 1.00 0.00 N HETATM 58 CA SET A 5 -2.197 1.980 -3.714 1.00 0.00 C HETATM 59 CB SET A 5 -2.224 3.066 -2.603 1.00 0.00 C HETATM 60 OG SET A 5 -2.493 4.242 -2.872 1.00 0.00 O HETATM 61 NT SET A 5 -0.137 2.422 -5.086 1.00 0.00 N HETATM 62 C SET A 5 -1.621 2.466 -5.080 1.00 0.00 C HETATM 63 H SET A 5 -4.395 2.098 -3.922 1.00 0.00 H HETATM 64 HA SET A 5 -1.555 1.152 -3.355 1.00 0.00 H HETATM 65 HB2 SET A 5 -2.031 1.859 -5.913 1.00 0.00 H HETATM 66 HB3 SET A 5 -1.957 3.494 -5.310 1.00 0.00 H HETATM 67 HNT2 SET A 5 0.416 2.946 -4.398 1.00 0.00 H ATOM 68 N SER A 6 -1.965 2.651 -1.347 1.00 0.00 N ATOM 69 CA SER A 6 -1.970 3.561 -0.172 1.00 0.00 C ATOM 70 C SER A 6 -1.206 2.859 0.981 1.00 0.00 C ATOM 71 O SER A 6 -1.708 1.895 1.570 1.00 0.00 O ATOM 72 CB SER A 6 -3.404 3.975 0.258 1.00 0.00 C ATOM 73 OG SER A 6 -4.224 2.851 0.573 1.00 0.00 O ATOM 74 H SER A 6 -1.662 1.673 -1.262 1.00 0.00 H ATOM 75 HA SER A 6 -1.439 4.496 -0.449 1.00 0.00 H ATOM 76 HB2 SER A 6 -3.361 4.651 1.133 1.00 0.00 H ATOM 77 HB3 SER A 6 -3.892 4.562 -0.542 1.00 0.00 H ATOM 78 HG SER A 6 -3.705 2.302 1.168 1.00 0.00 H ATOM 79 N GLY A 7 0.001 3.347 1.299 1.00 0.00 N ATOM 80 CA GLY A 7 0.825 2.761 2.376 1.00 0.00 C ATOM 81 C GLY A 7 1.940 3.727 2.791 1.00 0.00 C ATOM 82 O GLY A 7 1.716 4.589 3.645 1.00 0.00 O ATOM 83 H GLY A 7 0.299 4.176 0.771 1.00 0.00 H ATOM 84 HA2 GLY A 7 0.204 2.540 3.266 1.00 0.00 H ATOM 85 HA3 GLY A 7 1.235 1.784 2.051 1.00 0.00 H ATOM 86 N LYS A 8 3.137 3.562 2.200 1.00 0.00 N ATOM 87 CA LYS A 8 4.305 4.437 2.506 1.00 0.00 C ATOM 88 C LYS A 8 5.267 4.438 1.276 1.00 0.00 C ATOM 89 O LYS A 8 5.073 5.263 0.378 1.00 0.00 O ATOM 90 CB LYS A 8 4.925 4.104 3.903 1.00 0.00 C ATOM 91 CG LYS A 8 5.821 5.221 4.479 1.00 0.00 C ATOM 92 CD LYS A 8 6.505 4.822 5.802 1.00 0.00 C ATOM 93 CE LYS A 8 7.406 5.939 6.357 1.00 0.00 C ATOM 94 NZ LYS A 8 8.045 5.526 7.624 1.00 0.00 N ATOM 95 H LYS A 8 3.115 2.900 1.414 1.00 0.00 H ATOM 96 HA LYS A 8 3.924 5.477 2.574 1.00 0.00 H ATOM 97 HB2 LYS A 8 4.118 3.919 4.639 1.00 0.00 H ATOM 98 HB3 LYS A 8 5.480 3.147 3.854 1.00 0.00 H ATOM 99 HG2 LYS A 8 6.587 5.503 3.737 1.00 0.00 H ATOM 100 HG3 LYS A 8 5.211 6.132 4.634 1.00 0.00 H ATOM 101 HD2 LYS A 8 5.731 4.553 6.547 1.00 0.00 H ATOM 102 HD3 LYS A 8 7.102 3.903 5.641 1.00 0.00 H ATOM 103 HE2 LYS A 8 8.187 6.207 5.619 1.00 0.00 H ATOM 104 HE3 LYS A 8 6.816 6.862 6.525 1.00 0.00 H ATOM 105 HZ1 LYS A 8 8.651 6.259 8.010 1.00 0.00 H ATOM 106 HZ2 LYS A 8 7.351 5.300 8.346 1.00 0.00 H ATOM 107 HZ3 LYS A 8 8.629 4.690 7.502 1.00 0.00 H ATOM 108 N LEU A 9 6.278 3.544 1.215 1.00 0.00 N ATOM 109 CA LEU A 9 7.238 3.465 0.068 1.00 0.00 C ATOM 110 C LEU A 9 6.796 2.519 -1.099 1.00 0.00 C ATOM 111 O LEU A 9 7.246 2.753 -2.224 1.00 0.00 O ATOM 112 CB LEU A 9 8.678 3.097 0.563 1.00 0.00 C ATOM 113 CG LEU A 9 9.590 4.209 1.144 1.00 0.00 C ATOM 114 CD1 LEU A 9 10.034 5.241 0.089 1.00 0.00 C ATOM 115 CD2 LEU A 9 9.044 4.913 2.397 1.00 0.00 C ATOM 116 H LEU A 9 6.348 2.912 2.019 1.00 0.00 H ATOM 117 HA LEU A 9 7.315 4.467 -0.396 1.00 0.00 H ATOM 118 HB2 LEU A 9 8.641 2.268 1.294 1.00 0.00 H ATOM 119 HB3 LEU A 9 9.267 2.663 -0.272 1.00 0.00 H ATOM 120 HG LEU A 9 10.498 3.670 1.465 1.00 0.00 H ATOM 121 HD11 LEU A 9 9.191 5.858 -0.274 1.00 0.00 H ATOM 122 HD12 LEU A 9 10.794 5.936 0.493 1.00 0.00 H ATOM 123 HD13 LEU A 9 10.488 4.755 -0.794 1.00 0.00 H ATOM 124 HD21 LEU A 9 8.183 5.562 2.153 1.00 0.00 H ATOM 125 HD22 LEU A 9 8.713 4.188 3.163 1.00 0.00 H ATOM 126 HD23 LEU A 9 9.810 5.555 2.870 1.00 0.00 H ATOM 127 N ILE A 10 5.966 1.474 -0.868 1.00 0.00 N ATOM 128 CA ILE A 10 5.514 0.530 -1.934 1.00 0.00 C ATOM 129 C ILE A 10 3.971 0.640 -2.140 1.00 0.00 C ATOM 130 O ILE A 10 3.198 0.810 -1.188 1.00 0.00 O ATOM 131 CB ILE A 10 5.971 -0.952 -1.678 1.00 0.00 C ATOM 132 CG1 ILE A 10 5.460 -1.589 -0.350 1.00 0.00 C ATOM 133 CG2 ILE A 10 7.506 -1.110 -1.829 1.00 0.00 C ATOM 134 CD1 ILE A 10 5.450 -3.125 -0.341 1.00 0.00 C ATOM 135 H ILE A 10 5.524 1.467 0.059 1.00 0.00 H ATOM 136 HA ILE A 10 5.984 0.823 -2.896 1.00 0.00 H ATOM 137 HB ILE A 10 5.536 -1.546 -2.506 1.00 0.00 H ATOM 138 HG12 ILE A 10 6.046 -1.212 0.509 1.00 0.00 H ATOM 139 HG13 ILE A 10 4.423 -1.263 -0.149 1.00 0.00 H ATOM 140 HG21 ILE A 10 8.057 -0.580 -1.030 1.00 0.00 H ATOM 141 HG22 ILE A 10 7.820 -2.169 -1.796 1.00 0.00 H ATOM 142 HG23 ILE A 10 7.866 -0.707 -2.794 1.00 0.00 H ATOM 143 HD11 ILE A 10 6.466 -3.546 -0.446 1.00 0.00 H ATOM 144 HD12 ILE A 10 5.028 -3.513 0.603 1.00 0.00 H ATOM 145 HD13 ILE A 10 4.834 -3.528 -1.165 1.00 0.00 H ATOM 146 N ASP A 11 3.538 0.508 -3.406 1.00 0.00 N ATOM 147 CA ASP A 11 2.097 0.572 -3.780 1.00 0.00 C ATOM 148 C ASP A 11 1.280 -0.755 -3.591 1.00 0.00 C ATOM 149 O ASP A 11 0.060 -0.651 -3.455 1.00 0.00 O ATOM 150 CB ASP A 11 1.983 1.174 -5.213 1.00 0.00 C ATOM 151 CG ASP A 11 0.542 1.439 -5.701 1.00 0.00 C ATOM 152 OD1 ASP A 11 0.048 0.702 -6.558 1.00 0.00 O ATOM 153 H ASP A 11 4.284 0.380 -4.099 1.00 0.00 H ATOM 154 HA ASP A 11 1.614 1.310 -3.108 1.00 0.00 H ATOM 155 HB2 ASP A 11 2.553 2.121 -5.278 1.00 0.00 H ATOM 156 HB3 ASP A 11 2.477 0.498 -5.938 1.00 0.00 H ATOM 157 N THR A 12 1.877 -1.970 -3.573 1.00 0.00 N ATOM 158 CA THR A 12 1.122 -3.249 -3.397 1.00 0.00 C ATOM 159 C THR A 12 0.556 -3.363 -1.945 1.00 0.00 C ATOM 160 O THR A 12 1.279 -3.709 -1.005 1.00 0.00 O ATOM 161 CB THR A 12 1.981 -4.490 -3.791 1.00 0.00 C ATOM 162 OG1 THR A 12 3.173 -4.560 -3.012 1.00 0.00 O ATOM 163 CG2 THR A 12 2.371 -4.558 -5.278 1.00 0.00 C ATOM 164 H THR A 12 2.895 -1.962 -3.691 1.00 0.00 H ATOM 165 HA THR A 12 0.272 -3.238 -4.111 1.00 0.00 H ATOM 166 HB THR A 12 1.387 -5.399 -3.578 1.00 0.00 H ATOM 167 HG1 THR A 12 2.892 -4.492 -2.096 1.00 0.00 H ATOM 168 HG21 THR A 12 1.482 -4.548 -5.935 1.00 0.00 H ATOM 169 HG22 THR A 12 3.013 -3.708 -5.576 1.00 0.00 H ATOM 170 HG23 THR A 12 2.932 -5.483 -5.503 1.00 0.00 H ATOM 171 N THR A 13 -0.741 -3.038 -1.793 1.00 0.00 N ATOM 172 CA THR A 13 -1.450 -3.052 -0.487 1.00 0.00 C ATOM 173 C THR A 13 -2.881 -3.600 -0.747 1.00 0.00 C ATOM 174 O THR A 13 -3.732 -2.910 -1.321 1.00 0.00 O ATOM 175 CB THR A 13 -1.483 -1.649 0.202 1.00 0.00 C ATOM 176 OG1 THR A 13 -2.071 -0.659 -0.643 1.00 0.00 O ATOM 177 CG2 THR A 13 -0.112 -1.128 0.668 1.00 0.00 C ATOM 178 H THR A 13 -1.229 -2.778 -2.656 1.00 0.00 H ATOM 179 HA THR A 13 -0.927 -3.736 0.214 1.00 0.00 H ATOM 180 HB THR A 13 -2.112 -1.734 1.108 1.00 0.00 H ATOM 181 HG1 THR A 13 -2.899 -1.036 -0.956 1.00 0.00 H ATOM 182 HG21 THR A 13 0.401 -1.855 1.323 1.00 0.00 H ATOM 183 HG22 THR A 13 0.560 -0.917 -0.185 1.00 0.00 H ATOM 184 HG23 THR A 13 -0.211 -0.189 1.241 1.00 0.00 H ATOM 185 N ALA A 14 -3.120 -4.854 -0.326 1.00 0.00 N ATOM 186 CA ALA A 14 -4.428 -5.534 -0.488 1.00 0.00 C ATOM 187 C ALA A 14 -5.164 -5.571 0.869 1.00 0.00 C ATOM 188 O ALA A 14 -5.133 -6.518 1.656 1.00 0.00 O ATOM 189 CB ALA A 14 -4.173 -6.933 -1.080 1.00 0.00 C ATOM 190 OXT ALA A 14 -5.860 -4.415 1.105 1.00 0.00 O ATOM 191 H ALA A 14 -2.291 -5.336 0.033 1.00 0.00 H ATOM 192 HA ALA A 14 -5.075 -4.996 -1.209 1.00 0.00 H ATOM 193 HB1 ALA A 14 -3.521 -7.553 -0.437 1.00 0.00 H ATOM 194 HB2 ALA A 14 -5.117 -7.491 -1.212 1.00 0.00 H ATOM 195 HB3 ALA A 14 -3.697 -6.876 -2.077 1.00 0.00 H ATOM 196 HXT ALA A 14 -6.320 -4.451 1.946 1.00 0.00 H TER 197 ALA A 14