HETATM 1 C ACE A 1 1.146 -2.383 -14.810 1.00 0.00 C HETATM 2 O ACE A 1 0.148 -1.939 -15.378 1.00 0.00 O HETATM 3 CH3 ACE A 1 2.310 -2.874 -15.600 1.00 0.00 C HETATM 4 H1 ACE A 1 3.159 -2.207 -15.449 1.00 0.00 H HETATM 5 H2 ACE A 1 2.574 -3.879 -15.272 1.00 0.00 H HETATM 6 H3 ACE A 1 2.048 -2.894 -16.658 1.00 0.00 H ATOM 7 N ILE A 2 1.286 -2.468 -13.496 1.00 0.00 N ATOM 8 CA ILE A 2 0.230 -2.026 -12.601 1.00 0.00 C ATOM 9 C ILE A 2 0.846 -1.252 -11.434 1.00 0.00 C ATOM 10 O ILE A 2 0.489 -1.476 -10.278 1.00 0.00 O ATOM 11 CB ILE A 2 -0.634 -3.211 -12.164 1.00 0.00 C ATOM 12 CG1 ILE A 2 0.223 -4.312 -11.537 1.00 0.00 C ATOM 13 CG2 ILE A 2 -1.477 -3.733 -13.329 1.00 0.00 C ATOM 14 CD1 ILE A 2 0.716 -5.295 -12.601 1.00 0.00 C ATOM 15 H ILE A 2 2.101 -2.829 -13.042 1.00 0.00 H ATOM 16 HA ILE A 2 -0.413 -1.349 -13.163 1.00 0.00 H ATOM 17 HB ILE A 2 -1.326 -2.865 -11.396 1.00 0.00 H ATOM 18 HG13 ILE A 2 -0.357 -4.846 -10.785 1.00 0.00 H ATOM 19 HG21 ILE A 2 -2.097 -4.562 -12.986 1.00 0.00 H ATOM 20 HG22 ILE A 2 -2.115 -2.934 -13.704 1.00 0.00 H ATOM 21 HG23 ILE A 2 -0.819 -4.078 -14.127 1.00 0.00 H ATOM 22 HD11 ILE A 2 -0.082 -5.997 -12.844 1.00 0.00 H ATOM 23 HD12 ILE A 2 1.004 -4.747 -13.498 1.00 0.00 H ATOM 24 HD13 ILE A 2 1.578 -5.844 -12.218 1.00 0.00 H ATOM 25 N TRP A 3 1.761 -0.357 -11.777 1.00 0.00 N ATOM 26 CA TRP A 3 2.431 0.451 -10.772 1.00 0.00 C ATOM 27 C TRP A 3 1.553 1.671 -10.485 1.00 0.00 C ATOM 28 O TRP A 3 1.390 2.539 -11.340 1.00 0.00 O ATOM 29 CB TRP A 3 3.845 0.825 -11.223 1.00 0.00 C ATOM 30 CG TRP A 3 4.918 -0.182 -10.807 1.00 0.00 C ATOM 31 CD1 TRP A 3 5.769 -0.854 -11.595 1.00 0.00 C ATOM 32 CD2 TRP A 3 5.222 -0.609 -9.462 1.00 0.00 C ATOM 33 NE1 TRP A 3 6.596 -1.678 -10.860 1.00 0.00 N ATOM 34 CE2 TRP A 3 6.253 -1.525 -9.522 1.00 0.00 C ATOM 35 CE3 TRP A 3 4.645 -0.233 -8.237 1.00 0.00 C ATOM 36 CZ2 TRP A 3 6.797 -2.141 -8.388 1.00 0.00 C ATOM 37 CZ3 TRP A 3 5.200 -0.859 -7.113 1.00 0.00 C ATOM 38 CH2 TRP A 3 6.238 -1.782 -7.156 1.00 0.00 C ATOM 39 H TRP A 3 2.046 -0.182 -12.720 1.00 0.00 H ATOM 40 HA TRP A 3 2.535 -0.154 -9.873 1.00 0.00 H ATOM 41 HB3 TRP A 3 4.100 1.802 -10.811 1.00 0.00 H ATOM 42 HD1 TRP A 3 5.804 -0.760 -12.681 1.00 0.00 H ATOM 43 HE1 TRP A 3 7.375 -2.330 -11.256 1.00 0.00 H ATOM 44 HE3 TRP A 3 3.831 0.488 -8.163 1.00 0.00 H ATOM 45 HZ2 TRP A 3 7.611 -2.862 -8.461 1.00 0.00 H ATOM 46 HZ3 TRP A 3 4.789 -0.603 -6.137 1.00 0.00 H ATOM 47 HH2 TRP A 3 6.615 -2.225 -6.234 1.00 0.00 H ATOM 48 N GLY A 4 1.010 1.696 -9.276 1.00 0.00 N ATOM 49 CA GLY A 4 0.152 2.794 -8.865 1.00 0.00 C ATOM 50 C GLY A 4 -0.027 2.811 -7.345 1.00 0.00 C ATOM 51 O GLY A 4 -0.516 1.842 -6.765 1.00 0.00 O ATOM 52 H GLY A 4 1.146 0.986 -8.586 1.00 0.00 H ATOM 53 HA2 GLY A 4 0.583 3.740 -9.194 1.00 0.00 H ATOM 54 HA3 GLY A 4 -0.821 2.703 -9.349 1.00 0.00 H ATOM 55 N CYS A 5 0.376 3.920 -6.745 1.00 0.00 N ATOM 56 CA CYS A 5 0.265 4.075 -5.305 1.00 0.00 C ATOM 57 C CYS A 5 -0.479 5.381 -5.017 1.00 0.00 C ATOM 58 O CYS A 5 -0.461 6.330 -5.800 1.00 0.00 O ATOM 59 CB CYS A 5 1.636 4.038 -4.625 1.00 0.00 C ATOM 60 SG CYS A 5 2.930 3.139 -5.556 1.00 0.00 S ATOM 61 H CYS A 5 0.772 4.703 -7.225 1.00 0.00 H ATOM 62 HA CYS A 5 -0.301 3.218 -4.940 1.00 0.00 H ATOM 63 HB3 CYS A 5 1.526 3.576 -3.644 1.00 0.00 H HETATM 64 N B3S A 6 -1.145 5.407 -3.857 1.00 0.00 N HETATM 65 OD B3S A 6 -3.188 5.450 -1.668 1.00 0.00 O HETATM 66 CG B3S A 6 -3.185 6.343 -2.785 1.00 0.00 C HETATM 67 CB B3S A 6 -1.759 6.641 -3.307 1.00 0.00 C HETATM 68 CA B3S A 6 -0.863 7.220 -2.182 1.00 0.00 C HETATM 69 C B3S A 6 0.207 6.274 -1.628 1.00 0.00 C HETATM 70 O B3S A 6 1.367 6.676 -1.562 1.00 0.00 O HETATM 71 H B3S A 6 -1.064 4.541 -3.318 1.00 0.00 H HETATM 72 HD B3S A 6 -3.929 5.719 -1.114 1.00 0.00 H HETATM 73 HG2 B3S A 6 -3.799 5.915 -3.602 1.00 0.00 H HETATM 74 HB B3S A 6 -1.851 7.409 -4.105 1.00 0.00 H HETATM 75 HA1 B3S A 6 -0.376 8.148 -2.533 1.00 0.00 H HETATM 76 HA2 B3S A 6 -1.493 7.554 -1.337 1.00 0.00 H ATOM 77 N GLY A 7 -0.191 5.064 -1.264 1.00 0.00 N ATOM 78 CA GLY A 7 0.755 4.092 -0.742 1.00 0.00 C ATOM 79 C GLY A 7 2.173 4.665 -0.715 1.00 0.00 C ATOM 80 O GLY A 7 2.974 4.389 -1.606 1.00 0.00 O ATOM 81 H GLY A 7 -1.137 4.744 -1.322 1.00 0.00 H ATOM 82 HA2 GLY A 7 0.458 3.796 0.264 1.00 0.00 H ATOM 83 HA3 GLY A 7 0.734 3.192 -1.357 1.00 0.00 H ATOM 84 N LYS A 8 2.439 5.452 0.317 1.00 0.00 N ATOM 85 CA LYS A 8 3.746 6.067 0.471 1.00 0.00 C ATOM 86 C LYS A 8 4.726 5.037 1.038 1.00 0.00 C ATOM 87 O LYS A 8 5.358 5.275 2.065 1.00 0.00 O ATOM 88 CB LYS A 8 3.642 7.343 1.310 1.00 0.00 C ATOM 89 CG LYS A 8 3.091 8.502 0.478 1.00 0.00 C ATOM 90 CD LYS A 8 4.190 9.514 0.150 1.00 0.00 C ATOM 91 CE LYS A 8 4.195 10.664 1.159 1.00 0.00 C ATOM 92 NZ LYS A 8 4.409 11.957 0.471 1.00 0.00 N ATOM 93 H LYS A 8 1.781 5.671 1.037 1.00 0.00 H ATOM 94 HA LYS A 8 4.089 6.360 -0.520 1.00 0.00 H ATOM 95 HB3 LYS A 8 4.626 7.606 1.700 1.00 0.00 H ATOM 96 HG3 LYS A 8 2.288 8.996 1.025 1.00 0.00 H ATOM 97 HD3 LYS A 8 4.039 9.908 -0.855 1.00 0.00 H ATOM 98 HE3 LYS A 8 4.981 10.505 1.898 1.00 0.00 H ATOM 99 HZ1 LYS A 8 3.777 12.676 0.808 1.00 0.00 H ATOM 100 HZ2 LYS A 8 5.351 12.308 0.605 1.00 0.00 H ATOM 101 N LEU A 9 4.820 3.913 0.342 1.00 0.00 N ATOM 102 CA LEU A 9 5.712 2.846 0.763 1.00 0.00 C ATOM 103 C LEU A 9 5.869 1.838 -0.379 1.00 0.00 C ATOM 104 O LEU A 9 6.944 1.720 -0.964 1.00 0.00 O ATOM 105 CB LEU A 9 5.221 2.222 2.070 1.00 0.00 C ATOM 106 CG LEU A 9 6.112 1.131 2.669 1.00 0.00 C ATOM 107 CD1 LEU A 9 7.153 1.733 3.616 1.00 0.00 C ATOM 108 CD2 LEU A 9 5.272 0.051 3.353 1.00 0.00 C ATOM 109 H LEU A 9 4.302 3.727 -0.493 1.00 0.00 H ATOM 110 HA LEU A 9 6.685 3.293 0.965 1.00 0.00 H ATOM 111 HB3 LEU A 9 4.231 1.800 1.899 1.00 0.00 H ATOM 112 HG LEU A 9 6.656 0.650 1.857 1.00 0.00 H ATOM 113 HD11 LEU A 9 7.050 2.818 3.627 1.00 0.00 H ATOM 114 HD12 LEU A 9 6.997 1.344 4.622 1.00 0.00 H ATOM 115 HD13 LEU A 9 8.152 1.466 3.274 1.00 0.00 H ATOM 116 HD21 LEU A 9 5.704 -0.929 3.148 1.00 0.00 H ATOM 117 HD22 LEU A 9 5.262 0.225 4.430 1.00 0.00 H ATOM 118 HD23 LEU A 9 4.253 0.086 2.970 1.00 0.00 H ATOM 119 N ILE A 10 4.780 1.137 -0.660 1.00 0.00 N ATOM 120 CA ILE A 10 4.784 0.145 -1.721 1.00 0.00 C ATOM 121 C ILE A 10 3.341 -0.242 -2.056 1.00 0.00 C ATOM 122 O ILE A 10 2.652 -0.850 -1.239 1.00 0.00 O ATOM 123 CB ILE A 10 5.666 -1.045 -1.339 1.00 0.00 C ATOM 124 CG1 ILE A 10 6.439 -1.567 -2.552 1.00 0.00 C ATOM 125 CG2 ILE A 10 4.843 -2.146 -0.667 1.00 0.00 C ATOM 126 CD1 ILE A 10 7.279 -0.456 -3.186 1.00 0.00 C ATOM 127 H ILE A 10 3.910 1.239 -0.179 1.00 0.00 H ATOM 128 HA ILE A 10 5.231 0.608 -2.601 1.00 0.00 H ATOM 129 HB ILE A 10 6.402 -0.704 -0.610 1.00 0.00 H ATOM 130 HG13 ILE A 10 5.742 -1.966 -3.287 1.00 0.00 H ATOM 131 HG21 ILE A 10 4.217 -2.638 -1.413 1.00 0.00 H ATOM 132 HG22 ILE A 10 5.513 -2.877 -0.216 1.00 0.00 H ATOM 133 HG23 ILE A 10 4.210 -1.707 0.104 1.00 0.00 H ATOM 134 HD11 ILE A 10 6.666 0.103 -3.893 1.00 0.00 H ATOM 135 HD12 ILE A 10 7.640 0.216 -2.407 1.00 0.00 H ATOM 136 HD13 ILE A 10 8.127 -0.896 -3.709 1.00 0.00 H ATOM 137 N CYS A 11 2.928 0.127 -3.260 1.00 0.00 N ATOM 138 CA CYS A 11 1.581 -0.174 -3.713 1.00 0.00 C ATOM 139 C CYS A 11 1.585 -1.571 -4.339 1.00 0.00 C ATOM 140 O CYS A 11 1.131 -1.749 -5.468 1.00 0.00 O ATOM 141 CB CYS A 11 1.061 0.886 -4.687 1.00 0.00 C ATOM 142 SG CYS A 11 2.223 1.331 -6.027 1.00 0.00 S ATOM 143 H CYS A 11 3.496 0.621 -3.919 1.00 0.00 H ATOM 144 HA CYS A 11 0.941 -0.148 -2.832 1.00 0.00 H ATOM 145 HB3 CYS A 11 0.816 1.787 -4.124 1.00 0.00 H ATOM 146 N THR A 12 2.104 -2.524 -3.578 1.00 0.00 N ATOM 147 CA THR A 12 2.172 -3.898 -4.045 1.00 0.00 C ATOM 148 C THR A 12 2.459 -4.844 -2.877 1.00 0.00 C ATOM 149 O THR A 12 2.970 -4.420 -1.841 1.00 0.00 O ATOM 150 CB THR A 12 3.222 -3.968 -5.155 1.00 0.00 C ATOM 151 OG1 THR A 12 2.755 -5.008 -6.010 1.00 0.00 O ATOM 152 CG2 THR A 12 4.574 -4.479 -4.652 1.00 0.00 C ATOM 153 H THR A 12 2.470 -2.370 -2.662 1.00 0.00 H ATOM 154 HA THR A 12 1.198 -4.174 -4.448 1.00 0.00 H ATOM 155 HB THR A 12 3.330 -3.004 -5.651 1.00 0.00 H ATOM 156 HG1 THR A 12 2.812 -5.889 -5.540 1.00 0.00 H ATOM 157 HG21 THR A 12 5.364 -4.128 -5.315 1.00 0.00 H ATOM 158 HG22 THR A 12 4.752 -4.103 -3.644 1.00 0.00 H ATOM 159 HG23 THR A 12 4.568 -5.569 -4.639 1.00 0.00 H ATOM 160 N THR A 13 2.119 -6.108 -3.083 1.00 0.00 N ATOM 161 CA THR A 13 2.334 -7.116 -2.060 1.00 0.00 C ATOM 162 C THR A 13 2.209 -8.519 -2.659 1.00 0.00 C ATOM 163 O THR A 13 1.114 -8.949 -3.018 1.00 0.00 O ATOM 164 CB THR A 13 1.347 -6.853 -0.921 1.00 0.00 C ATOM 165 OG1 THR A 13 2.114 -6.141 0.046 1.00 0.00 O ATOM 166 CG2 THR A 13 0.931 -8.135 -0.197 1.00 0.00 C ATOM 167 H THR A 13 1.704 -6.444 -3.928 1.00 0.00 H ATOM 168 HA THR A 13 3.353 -7.017 -1.687 1.00 0.00 H ATOM 169 HB THR A 13 0.473 -6.309 -1.280 1.00 0.00 H ATOM 170 HG1 THR A 13 2.290 -5.211 -0.274 1.00 0.00 H ATOM 171 HG21 THR A 13 0.465 -8.818 -0.907 1.00 0.00 H ATOM 172 HG22 THR A 13 1.812 -8.609 0.238 1.00 0.00 H ATOM 173 HG23 THR A 13 0.222 -7.892 0.595 1.00 0.00 H ATOM 174 N ALA A 14 3.346 -9.192 -2.749 1.00 0.00 N ATOM 175 CA ALA A 14 3.379 -10.537 -3.299 1.00 0.00 C ATOM 176 C ALA A 14 2.169 -11.322 -2.786 1.00 0.00 C ATOM 177 O ALA A 14 1.656 -11.041 -1.704 1.00 0.00 O ATOM 178 CB ALA A 14 4.705 -11.206 -2.934 1.00 0.00 C ATOM 179 H ALA A 14 4.233 -8.835 -2.455 1.00 0.00 H ATOM 180 HA ALA A 14 3.314 -10.453 -4.384 1.00 0.00 H ATOM 181 HB1 ALA A 14 4.520 -12.236 -2.628 1.00 0.00 H ATOM 182 HB2 ALA A 14 5.366 -11.197 -3.800 1.00 0.00 H ATOM 183 HB3 ALA A 14 5.173 -10.662 -2.113 1.00 0.00 H TER 184 ALA A 14