HETATM 1 C ACE A 1 2.059 13.896 -10.197 1.00 0.00 C HETATM 2 O ACE A 1 3.229 13.801 -9.827 1.00 0.00 O HETATM 3 CH3 ACE A 1 1.704 14.738 -11.374 1.00 0.00 C HETATM 4 H1 ACE A 1 0.861 14.290 -11.899 1.00 0.00 H HETATM 5 H2 ACE A 1 1.432 15.738 -11.036 1.00 0.00 H HETATM 6 H3 ACE A 1 2.559 14.802 -12.046 1.00 0.00 H ATOM 7 N ILE A 2 1.037 13.289 -9.613 1.00 0.00 N ATOM 8 CA ILE A 2 1.236 12.435 -8.453 1.00 0.00 C ATOM 9 C ILE A 2 0.536 11.095 -8.686 1.00 0.00 C ATOM 10 O ILE A 2 -0.234 10.638 -7.844 1.00 0.00 O ATOM 11 CB ILE A 2 0.785 13.150 -7.179 1.00 0.00 C ATOM 12 CG1 ILE A 2 -0.722 13.419 -7.204 1.00 0.00 C ATOM 13 CG2 ILE A 2 1.592 14.431 -6.953 1.00 0.00 C ATOM 14 CD1 ILE A 2 -1.030 14.753 -7.886 1.00 0.00 C ATOM 15 H ILE A 2 0.089 13.372 -9.918 1.00 0.00 H ATOM 16 HA ILE A 2 2.307 12.255 -8.360 1.00 0.00 H ATOM 17 HB ILE A 2 0.981 12.494 -6.331 1.00 0.00 H ATOM 18 HG13 ILE A 2 -1.109 13.428 -6.185 1.00 0.00 H ATOM 19 HG21 ILE A 2 2.654 14.193 -6.938 1.00 0.00 H ATOM 20 HG22 ILE A 2 1.388 15.135 -7.761 1.00 0.00 H ATOM 21 HG23 ILE A 2 1.306 14.879 -6.001 1.00 0.00 H ATOM 22 HD11 ILE A 2 -0.888 15.567 -7.173 1.00 0.00 H ATOM 23 HD12 ILE A 2 -0.359 14.891 -8.733 1.00 0.00 H ATOM 24 HD13 ILE A 2 -2.062 14.752 -8.235 1.00 0.00 H ATOM 25 N TRP A 3 0.831 10.502 -9.834 1.00 0.00 N ATOM 26 CA TRP A 3 0.240 9.222 -10.189 1.00 0.00 C ATOM 27 C TRP A 3 1.170 8.116 -9.685 1.00 0.00 C ATOM 28 O TRP A 3 2.185 7.820 -10.314 1.00 0.00 O ATOM 29 CB TRP A 3 -0.028 9.140 -11.693 1.00 0.00 C ATOM 30 CG TRP A 3 -0.935 10.250 -12.225 1.00 0.00 C ATOM 31 CD1 TRP A 3 -2.032 10.765 -11.652 1.00 0.00 C ATOM 32 CD2 TRP A 3 -0.781 10.964 -13.470 1.00 0.00 C ATOM 33 NE1 TRP A 3 -2.592 11.756 -12.432 1.00 0.00 N ATOM 34 CE2 TRP A 3 -1.808 11.881 -13.573 1.00 0.00 C ATOM 35 CE3 TRP A 3 0.195 10.841 -14.475 1.00 0.00 C ATOM 36 CZ2 TRP A 3 -1.957 12.744 -14.665 1.00 0.00 C ATOM 37 CZ3 TRP A 3 0.031 11.710 -15.559 1.00 0.00 C ATOM 38 CH2 TRP A 3 -0.998 12.639 -15.678 1.00 0.00 C ATOM 39 H TRP A 3 1.458 10.880 -10.514 1.00 0.00 H ATOM 40 HA TRP A 3 -0.727 9.153 -9.690 1.00 0.00 H ATOM 41 HB3 TRP A 3 -0.480 8.175 -11.919 1.00 0.00 H ATOM 42 HD1 TRP A 3 -2.430 10.443 -10.690 1.00 0.00 H ATOM 43 HE1 TRP A 3 -3.485 12.334 -12.197 1.00 0.00 H ATOM 44 HE3 TRP A 3 1.015 10.125 -14.417 1.00 0.00 H ATOM 45 HZ2 TRP A 3 -2.777 13.460 -14.722 1.00 0.00 H ATOM 46 HZ3 TRP A 3 0.760 11.656 -16.368 1.00 0.00 H ATOM 47 HH2 TRP A 3 -1.056 13.282 -16.556 1.00 0.00 H ATOM 48 N GLY A 4 0.789 7.536 -8.556 1.00 0.00 N ATOM 49 CA GLY A 4 1.576 6.470 -7.961 1.00 0.00 C ATOM 50 C GLY A 4 0.746 5.673 -6.953 1.00 0.00 C ATOM 51 O GLY A 4 -0.065 4.831 -7.338 1.00 0.00 O ATOM 52 H GLY A 4 -0.038 7.783 -8.052 1.00 0.00 H ATOM 53 HA2 GLY A 4 1.943 5.804 -8.743 1.00 0.00 H ATOM 54 HA3 GLY A 4 2.451 6.891 -7.466 1.00 0.00 H ATOM 55 N CYS A 5 0.977 5.965 -5.681 1.00 0.00 N ATOM 56 CA CYS A 5 0.261 5.285 -4.615 1.00 0.00 C ATOM 57 C CYS A 5 -0.648 6.303 -3.924 1.00 0.00 C ATOM 58 O CYS A 5 -0.496 7.517 -4.061 1.00 0.00 O ATOM 59 CB CYS A 5 1.219 4.613 -3.629 1.00 0.00 C ATOM 60 SG CYS A 5 2.468 3.519 -4.398 1.00 0.00 S ATOM 61 H CYS A 5 1.639 6.650 -5.377 1.00 0.00 H ATOM 62 HA CYS A 5 -0.327 4.498 -5.086 1.00 0.00 H ATOM 63 HB3 CYS A 5 0.634 4.029 -2.918 1.00 0.00 H HETATM 64 N B3S A 6 -1.613 5.775 -3.163 1.00 0.00 N HETATM 65 OD B3S A 6 -4.567 5.873 -3.364 1.00 0.00 O HETATM 66 CG B3S A 6 -3.771 6.997 -2.979 1.00 0.00 C HETATM 67 CB B3S A 6 -2.464 6.585 -2.258 1.00 0.00 C HETATM 68 CA B3S A 6 -2.768 5.788 -0.965 1.00 0.00 C HETATM 69 C B3S A 6 -1.649 5.764 0.082 1.00 0.00 C HETATM 70 O B3S A 6 -1.839 6.331 1.156 1.00 0.00 O HETATM 71 H B3S A 6 -1.609 4.750 -3.150 1.00 0.00 H HETATM 72 HD B3S A 6 -5.412 5.979 -2.914 1.00 0.00 H HETATM 73 HG2 B3S A 6 -3.528 7.602 -3.876 1.00 0.00 H HETATM 74 HB B3S A 6 -1.934 7.520 -1.973 1.00 0.00 H HETATM 75 HA1 B3S A 6 -3.691 6.175 -0.495 1.00 0.00 H HETATM 76 HA2 B3S A 6 -3.018 4.742 -1.219 1.00 0.00 H ATOM 77 N GLY A 7 -0.530 5.137 -0.250 1.00 0.00 N ATOM 78 CA GLY A 7 0.593 5.074 0.671 1.00 0.00 C ATOM 79 C GLY A 7 1.908 4.860 -0.083 1.00 0.00 C ATOM 80 O GLY A 7 2.178 3.764 -0.569 1.00 0.00 O ATOM 81 H GLY A 7 -0.384 4.678 -1.126 1.00 0.00 H ATOM 82 HA2 GLY A 7 0.646 5.996 1.248 1.00 0.00 H ATOM 83 HA3 GLY A 7 0.441 4.262 1.380 1.00 0.00 H ATOM 84 N LYS A 8 2.690 5.928 -0.156 1.00 0.00 N ATOM 85 CA LYS A 8 3.970 5.871 -0.842 1.00 0.00 C ATOM 86 C LYS A 8 4.941 5.013 -0.030 1.00 0.00 C ATOM 87 O LYS A 8 5.984 5.495 0.409 1.00 0.00 O ATOM 88 CB LYS A 8 4.487 7.283 -1.127 1.00 0.00 C ATOM 89 CG LYS A 8 3.476 8.081 -1.953 1.00 0.00 C ATOM 90 CD LYS A 8 4.069 8.486 -3.303 1.00 0.00 C ATOM 91 CE LYS A 8 4.340 7.258 -4.174 1.00 0.00 C ATOM 92 NZ LYS A 8 3.436 7.245 -5.347 1.00 0.00 N ATOM 93 H LYS A 8 2.462 6.816 0.242 1.00 0.00 H ATOM 94 HA LYS A 8 3.804 5.387 -1.804 1.00 0.00 H ATOM 95 HB3 LYS A 8 5.435 7.224 -1.663 1.00 0.00 H ATOM 96 HG3 LYS A 8 3.174 8.971 -1.402 1.00 0.00 H ATOM 97 HD3 LYS A 8 4.997 9.038 -3.147 1.00 0.00 H ATOM 98 HE3 LYS A 8 4.198 6.351 -3.588 1.00 0.00 H ATOM 99 HZ1 LYS A 8 3.498 8.102 -5.884 1.00 0.00 H ATOM 100 HZ2 LYS A 8 3.650 6.484 -5.982 1.00 0.00 H ATOM 101 N LEU A 9 4.564 3.755 0.145 1.00 0.00 N ATOM 102 CA LEU A 9 5.390 2.824 0.898 1.00 0.00 C ATOM 103 C LEU A 9 5.561 1.535 0.091 1.00 0.00 C ATOM 104 O LEU A 9 6.666 1.006 -0.013 1.00 0.00 O ATOM 105 CB LEU A 9 4.811 2.603 2.296 1.00 0.00 C ATOM 106 CG LEU A 9 4.528 1.150 2.683 1.00 0.00 C ATOM 107 CD1 LEU A 9 5.824 0.409 3.016 1.00 0.00 C ATOM 108 CD2 LEU A 9 3.513 1.074 3.825 1.00 0.00 C ATOM 109 H LEU A 9 3.716 3.370 -0.215 1.00 0.00 H ATOM 110 HA LEU A 9 6.370 3.285 1.024 1.00 0.00 H ATOM 111 HB3 LEU A 9 3.880 3.167 2.375 1.00 0.00 H ATOM 112 HG LEU A 9 4.082 0.648 1.823 1.00 0.00 H ATOM 113 HD11 LEU A 9 6.589 1.128 3.307 1.00 0.00 H ATOM 114 HD12 LEU A 9 5.645 -0.284 3.838 1.00 0.00 H ATOM 115 HD13 LEU A 9 6.160 -0.146 2.140 1.00 0.00 H ATOM 116 HD21 LEU A 9 3.339 2.074 4.223 1.00 0.00 H ATOM 117 HD22 LEU A 9 2.575 0.663 3.453 1.00 0.00 H ATOM 118 HD23 LEU A 9 3.903 0.431 4.615 1.00 0.00 H ATOM 119 N ILE A 10 4.450 1.066 -0.457 1.00 0.00 N ATOM 120 CA ILE A 10 4.463 -0.151 -1.250 1.00 0.00 C ATOM 121 C ILE A 10 3.160 -0.251 -2.046 1.00 0.00 C ATOM 122 O ILE A 10 2.085 -0.402 -1.467 1.00 0.00 O ATOM 123 CB ILE A 10 4.735 -1.367 -0.362 1.00 0.00 C ATOM 124 CG1 ILE A 10 5.644 -2.373 -1.073 1.00 0.00 C ATOM 125 CG2 ILE A 10 3.427 -2.007 0.107 1.00 0.00 C ATOM 126 CD1 ILE A 10 6.962 -1.720 -1.492 1.00 0.00 C ATOM 127 H ILE A 10 3.555 1.502 -0.367 1.00 0.00 H ATOM 128 HA ILE A 10 5.292 -0.074 -1.953 1.00 0.00 H ATOM 129 HB ILE A 10 5.265 -1.027 0.528 1.00 0.00 H ATOM 130 HG13 ILE A 10 5.135 -2.770 -1.950 1.00 0.00 H ATOM 131 HG21 ILE A 10 3.649 -2.861 0.748 1.00 0.00 H ATOM 132 HG22 ILE A 10 2.843 -1.275 0.666 1.00 0.00 H ATOM 133 HG23 ILE A 10 2.856 -2.342 -0.759 1.00 0.00 H ATOM 134 HD11 ILE A 10 7.738 -2.482 -1.566 1.00 0.00 H ATOM 135 HD12 ILE A 10 6.836 -1.235 -2.460 1.00 0.00 H ATOM 136 HD13 ILE A 10 7.252 -0.977 -0.748 1.00 0.00 H ATOM 137 N CYS A 11 3.298 -0.160 -3.361 1.00 0.00 N ATOM 138 CA CYS A 11 2.145 -0.239 -4.241 1.00 0.00 C ATOM 139 C CYS A 11 1.977 -1.693 -4.686 1.00 0.00 C ATOM 140 O CYS A 11 1.428 -1.960 -5.753 1.00 0.00 O ATOM 141 CB CYS A 11 2.279 0.711 -5.434 1.00 0.00 C ATOM 142 SG CYS A 11 1.183 2.175 -5.376 1.00 0.00 S ATOM 143 H CYS A 11 4.176 -0.038 -3.823 1.00 0.00 H ATOM 144 HA CYS A 11 1.284 0.090 -3.659 1.00 0.00 H ATOM 145 HB3 CYS A 11 2.071 0.154 -6.348 1.00 0.00 H ATOM 146 N THR A 12 2.461 -2.595 -3.844 1.00 0.00 N ATOM 147 CA THR A 12 2.371 -4.015 -4.138 1.00 0.00 C ATOM 148 C THR A 12 2.368 -4.828 -2.841 1.00 0.00 C ATOM 149 O THR A 12 3.054 -4.477 -1.882 1.00 0.00 O ATOM 150 CB THR A 12 3.522 -4.378 -5.078 1.00 0.00 C ATOM 151 OG1 THR A 12 4.692 -4.007 -4.354 1.00 0.00 O ATOM 152 CG2 THR A 12 3.559 -3.493 -6.326 1.00 0.00 C ATOM 153 H THR A 12 2.906 -2.369 -2.978 1.00 0.00 H ATOM 154 HA THR A 12 1.421 -4.204 -4.636 1.00 0.00 H ATOM 155 HB THR A 12 3.485 -5.433 -5.350 1.00 0.00 H ATOM 156 HG1 THR A 12 5.460 -4.588 -4.623 1.00 0.00 H ATOM 157 HG21 THR A 12 3.808 -2.471 -6.040 1.00 0.00 H ATOM 158 HG22 THR A 12 4.313 -3.870 -7.017 1.00 0.00 H ATOM 159 HG23 THR A 12 2.583 -3.507 -6.810 1.00 0.00 H ATOM 160 N THR A 13 1.587 -5.898 -2.853 1.00 0.00 N ATOM 161 CA THR A 13 1.485 -6.764 -1.691 1.00 0.00 C ATOM 162 C THR A 13 1.004 -8.156 -2.103 1.00 0.00 C ATOM 163 O THR A 13 -0.197 -8.392 -2.222 1.00 0.00 O ATOM 164 CB THR A 13 0.569 -6.081 -0.673 1.00 0.00 C ATOM 165 OG1 THR A 13 1.231 -4.854 -0.377 1.00 0.00 O ATOM 166 CG2 THR A 13 0.533 -6.817 0.669 1.00 0.00 C ATOM 167 H THR A 13 1.032 -6.177 -3.637 1.00 0.00 H ATOM 168 HA THR A 13 2.480 -6.883 -1.262 1.00 0.00 H ATOM 169 HB THR A 13 -0.436 -5.957 -1.075 1.00 0.00 H ATOM 170 HG1 THR A 13 2.202 -5.021 -0.209 1.00 0.00 H ATOM 171 HG21 THR A 13 0.464 -7.890 0.492 1.00 0.00 H ATOM 172 HG22 THR A 13 1.444 -6.599 1.226 1.00 0.00 H ATOM 173 HG23 THR A 13 -0.332 -6.487 1.242 1.00 0.00 H ATOM 174 N ALA A 14 1.967 -9.042 -2.310 1.00 0.00 N ATOM 175 CA ALA A 14 1.657 -10.406 -2.707 1.00 0.00 C ATOM 176 C ALA A 14 1.771 -11.325 -1.488 1.00 0.00 C ATOM 177 O ALA A 14 2.838 -11.877 -1.221 1.00 0.00 O ATOM 178 CB ALA A 14 2.586 -10.830 -3.846 1.00 0.00 C ATOM 179 H ALA A 14 2.942 -8.843 -2.211 1.00 0.00 H ATOM 180 HA ALA A 14 0.629 -10.421 -3.067 1.00 0.00 H ATOM 181 HB1 ALA A 14 2.452 -10.157 -4.693 1.00 0.00 H ATOM 182 HB2 ALA A 14 3.620 -10.786 -3.507 1.00 0.00 H ATOM 183 HB3 ALA A 14 2.346 -11.848 -4.150 1.00 0.00 H TER 184 ALA A 14