HETATM 1 C ACE A 1 -0.445 0.767 8.532 1.00 0.00 C HETATM 2 O ACE A 1 0.126 -0.233 8.090 1.00 0.00 O HETATM 3 CH3 ACE A 1 -0.419 1.073 10.026 1.00 0.00 C HETATM 4 H1 ACE A 1 0.054 2.051 10.232 1.00 0.00 H HETATM 5 H2 ACE A 1 -1.438 1.088 10.455 1.00 0.00 H HETATM 6 H3 ACE A 1 0.158 0.308 10.578 1.00 0.00 H ATOM 7 N ILE A 2 -1.123 1.646 7.779 1.00 0.00 N ATOM 8 CA ILE A 2 -1.259 1.518 6.296 1.00 0.00 C ATOM 9 C ILE A 2 -0.450 2.674 5.630 1.00 0.00 C ATOM 10 O ILE A 2 -0.497 3.839 6.040 1.00 0.00 O ATOM 11 CB ILE A 2 -2.755 1.442 5.822 1.00 0.00 C ATOM 12 CG1 ILE A 2 -3.571 0.274 6.462 1.00 0.00 C ATOM 13 CG2 ILE A 2 -2.957 1.413 4.283 1.00 0.00 C ATOM 14 CD1 ILE A 2 -3.048 -1.151 6.192 1.00 0.00 C ATOM 15 H ILE A 2 -1.488 2.451 8.299 1.00 0.00 H ATOM 16 HA ILE A 2 -0.810 0.556 5.986 1.00 0.00 H ATOM 17 HB ILE A 2 -3.219 2.388 6.141 1.00 0.00 H ATOM 18 HG12 ILE A 2 -3.622 0.423 7.557 1.00 0.00 H ATOM 19 HG13 ILE A 2 -4.626 0.334 6.133 1.00 0.00 H ATOM 20 HG21 ILE A 2 -2.568 2.326 3.797 1.00 0.00 H ATOM 21 HG22 ILE A 2 -2.443 0.555 3.817 1.00 0.00 H ATOM 22 HG23 ILE A 2 -4.025 1.347 4.003 1.00 0.00 H ATOM 23 HD11 ILE A 2 -3.687 -1.914 6.670 1.00 0.00 H ATOM 24 HD12 ILE A 2 -3.016 -1.383 5.113 1.00 0.00 H ATOM 25 HD13 ILE A 2 -2.025 -1.297 6.586 1.00 0.00 H ATOM 26 N TRP A 3 0.255 2.307 4.550 1.00 0.00 N ATOM 27 CA TRP A 3 1.106 3.246 3.761 1.00 0.00 C ATOM 28 C TRP A 3 0.322 4.273 2.891 1.00 0.00 C ATOM 29 O TRP A 3 0.453 5.483 3.094 1.00 0.00 O ATOM 30 CB TRP A 3 2.215 2.493 2.966 1.00 0.00 C ATOM 31 CG TRP A 3 3.217 1.663 3.784 1.00 0.00 C ATOM 32 CD1 TRP A 3 3.374 0.263 3.708 1.00 0.00 C ATOM 33 CD2 TRP A 3 4.152 2.090 4.713 1.00 0.00 C ATOM 34 NE1 TRP A 3 4.373 -0.200 4.582 1.00 0.00 N ATOM 35 CE2 TRP A 3 4.843 0.948 5.195 1.00 0.00 C ATOM 36 CE3 TRP A 3 4.481 3.383 5.197 1.00 0.00 C ATOM 37 CZ2 TRP A 3 5.861 1.091 6.167 1.00 0.00 C ATOM 38 CZ3 TRP A 3 5.487 3.499 6.156 1.00 0.00 C ATOM 39 CH2 TRP A 3 6.167 2.371 6.635 1.00 0.00 C ATOM 40 H TRP A 3 0.160 1.304 4.361 1.00 0.00 H ATOM 41 HA TRP A 3 1.636 3.875 4.479 1.00 0.00 H ATOM 42 HB2 TRP A 3 1.746 1.842 2.207 1.00 0.00 H ATOM 43 HB3 TRP A 3 2.804 3.223 2.379 1.00 0.00 H ATOM 44 HD1 TRP A 3 2.801 -0.385 3.060 1.00 0.00 H ATOM 45 HE1 TRP A 3 4.683 -1.169 4.724 1.00 0.00 H ATOM 46 HE3 TRP A 3 3.969 4.263 4.834 1.00 0.00 H ATOM 47 HZ2 TRP A 3 6.393 0.229 6.542 1.00 0.00 H ATOM 48 HZ3 TRP A 3 5.748 4.476 6.535 1.00 0.00 H ATOM 49 HH2 TRP A 3 6.942 2.493 7.377 1.00 0.00 H ATOM 50 N GLY A 4 -0.475 3.782 1.939 1.00 0.00 N ATOM 51 CA GLY A 4 -1.273 4.637 1.037 1.00 0.00 C ATOM 52 C GLY A 4 -2.114 3.795 0.056 1.00 0.00 C ATOM 53 O GLY A 4 -1.678 3.621 -1.086 1.00 0.00 O ATOM 54 H GLY A 4 -0.436 2.763 1.897 1.00 0.00 H ATOM 55 HA2 GLY A 4 -1.903 5.342 1.613 1.00 0.00 H ATOM 56 HA3 GLY A 4 -0.583 5.290 0.459 1.00 0.00 H ATOM 57 N GLU A 5 -3.304 3.286 0.462 1.00 0.00 N ATOM 58 CA GLU A 5 -4.166 2.466 -0.440 1.00 0.00 C ATOM 59 C GLU A 5 -5.053 3.381 -1.342 1.00 0.00 C ATOM 60 O GLU A 5 -6.127 3.832 -0.927 1.00 0.00 O ATOM 61 CB GLU A 5 -5.022 1.429 0.366 1.00 0.00 C ATOM 62 CG GLU A 5 -4.829 -0.053 -0.053 1.00 0.00 C ATOM 63 CD GLU A 5 -4.093 -0.918 0.985 1.00 0.00 C ATOM 64 OE1 GLU A 5 -4.745 -1.572 1.803 1.00 0.00 O ATOM 65 H GLU A 5 -3.563 3.432 1.446 1.00 0.00 H ATOM 66 HA GLU A 5 -3.493 1.883 -1.103 1.00 0.00 H ATOM 67 HB2 GLU A 5 -4.885 1.539 1.459 1.00 0.00 H ATOM 68 HB3 GLU A 5 -6.104 1.646 0.258 1.00 0.00 H ATOM 69 HG2 GLU A 5 -5.829 -0.499 -0.213 1.00 0.00 H ATOM 70 HG3 GLU A 5 -4.353 -0.141 -1.050 1.00 0.00 H ATOM 71 N SER A 6 -4.580 3.669 -2.569 1.00 0.00 N ATOM 72 CA SER A 6 -5.317 4.514 -3.545 1.00 0.00 C ATOM 73 C SER A 6 -4.746 4.219 -4.960 1.00 0.00 C ATOM 74 O SER A 6 -3.789 4.865 -5.403 1.00 0.00 O ATOM 75 CB SER A 6 -5.246 6.018 -3.168 1.00 0.00 C ATOM 76 OG SER A 6 -6.042 6.803 -4.050 1.00 0.00 O ATOM 77 H SER A 6 -3.652 3.282 -2.775 1.00 0.00 H ATOM 78 HA SER A 6 -6.386 4.219 -3.523 1.00 0.00 H ATOM 79 HB2 SER A 6 -5.599 6.183 -2.133 1.00 0.00 H ATOM 80 HB3 SER A 6 -4.201 6.385 -3.191 1.00 0.00 H ATOM 81 HG SER A 6 -6.952 6.528 -3.912 1.00 0.00 H ATOM 82 N GLY A 7 -5.327 3.224 -5.661 1.00 0.00 N ATOM 83 CA GLY A 7 -4.870 2.836 -7.021 1.00 0.00 C ATOM 84 C GLY A 7 -3.719 1.810 -7.019 1.00 0.00 C ATOM 85 O GLY A 7 -3.931 0.633 -7.323 1.00 0.00 O ATOM 86 H GLY A 7 -6.052 2.704 -5.154 1.00 0.00 H ATOM 87 HA2 GLY A 7 -5.731 2.401 -7.562 1.00 0.00 H ATOM 88 HA3 GLY A 7 -4.591 3.727 -7.619 1.00 0.00 H ATOM 89 N LYS A 8 -2.504 2.278 -6.681 1.00 0.00 N ATOM 90 CA LYS A 8 -1.286 1.425 -6.612 1.00 0.00 C ATOM 91 C LYS A 8 -1.285 0.530 -5.334 1.00 0.00 C ATOM 92 O LYS A 8 -1.725 0.951 -4.257 1.00 0.00 O ATOM 93 CB LYS A 8 -0.014 2.321 -6.633 1.00 0.00 C ATOM 94 CG LYS A 8 0.252 3.068 -7.961 1.00 0.00 C ATOM 95 CD LYS A 8 1.535 3.921 -7.917 1.00 0.00 C ATOM 96 CE LYS A 8 1.793 4.669 -9.238 1.00 0.00 C ATOM 97 NZ LYS A 8 3.026 5.479 -9.157 1.00 0.00 N ATOM 98 H LYS A 8 -2.497 3.264 -6.396 1.00 0.00 H ATOM 99 HA LYS A 8 -1.259 0.778 -7.513 1.00 0.00 H ATOM 100 HB2 LYS A 8 -0.054 3.048 -5.796 1.00 0.00 H ATOM 101 HB3 LYS A 8 0.872 1.692 -6.418 1.00 0.00 H ATOM 102 HG2 LYS A 8 0.318 2.334 -8.787 1.00 0.00 H ATOM 103 HG3 LYS A 8 -0.613 3.715 -8.203 1.00 0.00 H ATOM 104 HD2 LYS A 8 1.462 4.646 -7.082 1.00 0.00 H ATOM 105 HD3 LYS A 8 2.399 3.271 -7.677 1.00 0.00 H ATOM 106 HE2 LYS A 8 1.876 3.951 -10.077 1.00 0.00 H ATOM 107 HE3 LYS A 8 0.934 5.326 -9.482 1.00 0.00 H ATOM 108 HZ1 LYS A 8 3.851 4.900 -8.963 1.00 0.00 H ATOM 109 HZ2 LYS A 8 3.215 5.986 -10.029 1.00 0.00 H ATOM 110 HZ3 LYS A 8 2.974 6.180 -8.409 1.00 0.00 H ATOM 111 N LEU A 9 -0.758 -0.703 -5.468 1.00 0.00 N ATOM 112 CA LEU A 9 -0.684 -1.680 -4.348 1.00 0.00 C ATOM 113 C LEU A 9 0.522 -1.349 -3.412 1.00 0.00 C ATOM 114 O LEU A 9 1.665 -1.736 -3.673 1.00 0.00 O ATOM 115 CB LEU A 9 -0.614 -3.114 -4.962 1.00 0.00 C ATOM 116 CG LEU A 9 -0.652 -4.323 -3.971 1.00 0.00 C ATOM 117 CD1 LEU A 9 -2.037 -5.002 -3.886 1.00 0.00 C ATOM 118 CD2 LEU A 9 0.406 -5.383 -4.338 1.00 0.00 C ATOM 119 H LEU A 9 -0.427 -0.934 -6.411 1.00 0.00 H ATOM 120 HA LEU A 9 -1.628 -1.603 -3.769 1.00 0.00 H ATOM 121 HB2 LEU A 9 -1.423 -3.238 -5.710 1.00 0.00 H ATOM 122 HB3 LEU A 9 0.307 -3.165 -5.577 1.00 0.00 H ATOM 123 HG LEU A 9 -0.395 -3.972 -2.954 1.00 0.00 H ATOM 124 HD11 LEU A 9 -2.829 -4.296 -3.579 1.00 0.00 H ATOM 125 HD12 LEU A 9 -2.348 -5.444 -4.853 1.00 0.00 H ATOM 126 HD13 LEU A 9 -2.045 -5.828 -3.149 1.00 0.00 H ATOM 127 HD21 LEU A 9 0.413 -6.223 -3.619 1.00 0.00 H ATOM 128 HD22 LEU A 9 0.236 -5.811 -5.344 1.00 0.00 H ATOM 129 HD23 LEU A 9 1.425 -4.953 -4.332 1.00 0.00 H ATOM 130 N ILE A 10 0.235 -0.608 -2.328 1.00 0.00 N ATOM 131 CA ILE A 10 1.243 -0.195 -1.316 1.00 0.00 C ATOM 132 C ILE A 10 0.463 -0.013 0.023 1.00 0.00 C ATOM 133 O ILE A 10 0.046 1.101 0.355 1.00 0.00 O ATOM 134 CB ILE A 10 2.146 1.011 -1.773 1.00 0.00 C ATOM 135 CG1 ILE A 10 3.207 1.463 -0.729 1.00 0.00 C ATOM 136 CG2 ILE A 10 1.389 2.264 -2.284 1.00 0.00 C ATOM 137 CD1 ILE A 10 4.056 0.343 -0.107 1.00 0.00 C ATOM 138 H ILE A 10 -0.728 -0.258 -2.288 1.00 0.00 H ATOM 139 HA ILE A 10 1.959 -1.034 -1.193 1.00 0.00 H ATOM 140 HB ILE A 10 2.717 0.630 -2.640 1.00 0.00 H ATOM 141 HG12 ILE A 10 3.894 2.193 -1.198 1.00 0.00 H ATOM 142 HG13 ILE A 10 2.715 2.022 0.088 1.00 0.00 H ATOM 143 HG21 ILE A 10 0.813 2.760 -1.481 1.00 0.00 H ATOM 144 HG22 ILE A 10 2.081 3.021 -2.699 1.00 0.00 H ATOM 145 HG23 ILE A 10 0.676 2.018 -3.092 1.00 0.00 H ATOM 146 HD11 ILE A 10 4.556 -0.266 -0.881 1.00 0.00 H ATOM 147 HD12 ILE A 10 4.831 0.757 0.560 1.00 0.00 H ATOM 148 HD13 ILE A 10 3.438 -0.340 0.506 1.00 0.00 H HETATM 149 N SET A 11 0.262 -1.114 0.783 1.00 0.00 N HETATM 150 CA SET A 11 -0.498 -1.075 2.074 1.00 0.00 C HETATM 151 CB SET A 11 0.281 -1.637 3.304 1.00 0.00 C HETATM 152 OG SET A 11 0.356 -0.916 4.303 1.00 0.00 O HETATM 153 NT SET A 11 -2.754 -0.908 0.953 1.00 0.00 N HETATM 154 C SET A 11 -1.928 -1.673 1.920 1.00 0.00 C HETATM 155 H SET A 11 0.356 -1.980 0.242 1.00 0.00 H HETATM 156 HA SET A 11 -0.667 -0.014 2.350 1.00 0.00 H HETATM 157 HB2 SET A 11 -1.892 -2.732 1.605 1.00 0.00 H HETATM 158 HB3 SET A 11 -2.433 -1.677 2.907 1.00 0.00 H HETATM 159 HNT2 SET A 11 -2.310 -0.325 0.232 1.00 0.00 H ATOM 160 N THR A 12 0.838 -2.873 3.291 1.00 0.00 N ATOM 161 CA THR A 12 1.601 -3.439 4.447 1.00 0.00 C ATOM 162 C THR A 12 2.978 -3.941 3.918 1.00 0.00 C ATOM 163 O THR A 12 3.975 -3.233 4.086 1.00 0.00 O ATOM 164 CB THR A 12 0.788 -4.476 5.289 1.00 0.00 C ATOM 165 OG1 THR A 12 0.279 -5.528 4.474 1.00 0.00 O ATOM 166 CG2 THR A 12 -0.386 -3.871 6.076 1.00 0.00 C ATOM 167 H THR A 12 0.753 -3.422 2.433 1.00 0.00 H ATOM 168 HA THR A 12 1.862 -2.625 5.154 1.00 0.00 H ATOM 169 HB THR A 12 1.474 -4.924 6.034 1.00 0.00 H ATOM 170 HG1 THR A 12 -0.280 -6.059 5.047 1.00 0.00 H ATOM 171 HG21 THR A 12 -0.054 -3.053 6.742 1.00 0.00 H ATOM 172 HG22 THR A 12 -1.158 -3.453 5.403 1.00 0.00 H ATOM 173 HG23 THR A 12 -0.882 -4.627 6.712 1.00 0.00 H ATOM 174 N THR A 13 3.049 -5.132 3.286 1.00 0.00 N ATOM 175 CA THR A 13 4.316 -5.687 2.721 1.00 0.00 C ATOM 176 C THR A 13 4.479 -5.253 1.230 1.00 0.00 C ATOM 177 O THR A 13 5.399 -4.488 0.926 1.00 0.00 O ATOM 178 CB THR A 13 4.467 -7.225 2.950 1.00 0.00 C ATOM 179 OG1 THR A 13 3.317 -7.939 2.503 1.00 0.00 O ATOM 180 CG2 THR A 13 4.752 -7.632 4.407 1.00 0.00 C ATOM 181 H THR A 13 2.159 -5.638 3.224 1.00 0.00 H ATOM 182 HA THR A 13 5.177 -5.233 3.253 1.00 0.00 H ATOM 183 HB THR A 13 5.329 -7.576 2.352 1.00 0.00 H ATOM 184 HG1 THR A 13 2.648 -7.811 3.180 1.00 0.00 H ATOM 185 HG21 THR A 13 5.678 -7.162 4.788 1.00 0.00 H ATOM 186 HG22 THR A 13 3.932 -7.345 5.090 1.00 0.00 H ATOM 187 HG23 THR A 13 4.889 -8.725 4.500 1.00 0.00 H ATOM 188 N ALA A 14 3.598 -5.715 0.316 1.00 0.00 N ATOM 189 CA ALA A 14 3.660 -5.363 -1.123 1.00 0.00 C ATOM 190 C ALA A 14 2.863 -4.076 -1.444 1.00 0.00 C ATOM 191 O ALA A 14 1.718 -3.847 -1.047 1.00 0.00 O ATOM 192 CB ALA A 14 3.127 -6.556 -1.936 1.00 0.00 C ATOM 193 OXT ALA A 14 3.572 -3.224 -2.249 1.00 0.00 O ATOM 194 H ALA A 14 2.895 -6.362 0.689 1.00 0.00 H ATOM 195 HA ALA A 14 4.716 -5.214 -1.425 1.00 0.00 H ATOM 196 HB1 ALA A 14 3.191 -6.365 -3.023 1.00 0.00 H ATOM 197 HB2 ALA A 14 3.710 -7.477 -1.744 1.00 0.00 H ATOM 198 HB3 ALA A 14 2.068 -6.784 -1.707 1.00 0.00 H ATOM 199 HXT ALA A 14 3.042 -2.464 -2.505 1.00 0.00 H TER 200 ALA A 14