HETATM 1 C ACE A 1 1.251 12.215 -13.904 1.00 0.00 C HETATM 2 O ACE A 1 0.622 13.130 -13.373 1.00 0.00 O HETATM 3 CH3 ACE A 1 2.153 12.487 -15.059 1.00 0.00 C HETATM 4 H1 ACE A 1 1.762 13.326 -15.634 1.00 0.00 H HETATM 5 H2 ACE A 1 3.150 12.731 -14.691 1.00 0.00 H HETATM 6 H3 ACE A 1 2.205 11.603 -15.694 1.00 0.00 H ATOM 7 N ILE A 2 1.196 10.947 -13.523 1.00 0.00 N ATOM 8 CA ILE A 2 0.358 10.536 -12.409 1.00 0.00 C ATOM 9 C ILE A 2 1.190 9.708 -11.429 1.00 0.00 C ATOM 10 O ILE A 2 1.446 8.529 -11.668 1.00 0.00 O ATOM 11 CB ILE A 2 -0.892 9.814 -12.918 1.00 0.00 C ATOM 12 CG1 ILE A 2 -0.524 8.494 -13.600 1.00 0.00 C ATOM 13 CG2 ILE A 2 -1.715 10.722 -13.833 1.00 0.00 C ATOM 14 CD1 ILE A 2 -0.966 7.298 -12.755 1.00 0.00 C ATOM 15 H ILE A 2 1.711 10.209 -13.959 1.00 0.00 H ATOM 16 HA ILE A 2 0.023 11.440 -11.901 1.00 0.00 H ATOM 17 HB ILE A 2 -1.518 9.569 -12.060 1.00 0.00 H ATOM 18 HG13 ILE A 2 0.554 8.453 -13.759 1.00 0.00 H ATOM 19 HG21 ILE A 2 -2.774 10.607 -13.602 1.00 0.00 H ATOM 20 HG22 ILE A 2 -1.420 11.759 -13.676 1.00 0.00 H ATOM 21 HG23 ILE A 2 -1.538 10.447 -14.873 1.00 0.00 H ATOM 22 HD11 ILE A 2 -1.857 7.565 -12.187 1.00 0.00 H ATOM 23 HD12 ILE A 2 -1.190 6.455 -13.408 1.00 0.00 H ATOM 24 HD13 ILE A 2 -0.167 7.023 -12.068 1.00 0.00 H ATOM 25 N TRP A 3 1.589 10.358 -10.345 1.00 0.00 N ATOM 26 CA TRP A 3 2.388 9.696 -9.327 1.00 0.00 C ATOM 27 C TRP A 3 1.680 9.873 -7.982 1.00 0.00 C ATOM 28 O TRP A 3 0.624 10.500 -7.910 1.00 0.00 O ATOM 29 CB TRP A 3 3.822 10.229 -9.321 1.00 0.00 C ATOM 30 CG TRP A 3 4.845 9.256 -8.735 1.00 0.00 C ATOM 31 CD1 TRP A 3 5.335 8.139 -9.289 1.00 0.00 C ATOM 32 CD2 TRP A 3 5.490 9.360 -7.448 1.00 0.00 C ATOM 33 NE1 TRP A 3 6.243 7.517 -8.458 1.00 0.00 N ATOM 34 CE2 TRP A 3 6.341 8.283 -7.303 1.00 0.00 C ATOM 35 CE3 TRP A 3 5.360 10.331 -6.441 1.00 0.00 C ATOM 36 CZ2 TRP A 3 7.127 8.076 -6.163 1.00 0.00 C ATOM 37 CZ3 TRP A 3 6.152 10.110 -5.308 1.00 0.00 C ATOM 38 CH2 TRP A 3 7.013 9.031 -5.145 1.00 0.00 C ATOM 39 H TRP A 3 1.377 11.317 -10.159 1.00 0.00 H ATOM 40 HA TRP A 3 2.443 8.639 -9.583 1.00 0.00 H ATOM 41 HB3 TRP A 3 3.851 11.158 -8.753 1.00 0.00 H ATOM 42 HD1 TRP A 3 5.049 7.767 -10.273 1.00 0.00 H ATOM 43 HE1 TRP A 3 6.785 6.595 -8.668 1.00 0.00 H ATOM 44 HE3 TRP A 3 4.695 11.190 -6.531 1.00 0.00 H ATOM 45 HZ2 TRP A 3 7.792 7.217 -6.071 1.00 0.00 H ATOM 46 HZ3 TRP A 3 6.089 10.834 -4.495 1.00 0.00 H ATOM 47 HH2 TRP A 3 7.597 8.929 -4.231 1.00 0.00 H ATOM 48 N GLY A 4 2.289 9.308 -6.951 1.00 0.00 N ATOM 49 CA GLY A 4 1.730 9.396 -5.611 1.00 0.00 C ATOM 50 C GLY A 4 0.783 8.225 -5.336 1.00 0.00 C ATOM 51 O GLY A 4 -0.369 8.240 -5.764 1.00 0.00 O ATOM 52 H GLY A 4 3.147 8.800 -7.017 1.00 0.00 H ATOM 53 HA2 GLY A 4 2.535 9.398 -4.877 1.00 0.00 H ATOM 54 HA3 GLY A 4 1.192 10.338 -5.499 1.00 0.00 H ATOM 55 N CYS A 5 1.306 7.240 -4.621 1.00 0.00 N ATOM 56 CA CYS A 5 0.522 6.064 -4.282 1.00 0.00 C ATOM 57 C CYS A 5 -0.581 6.486 -3.310 1.00 0.00 C ATOM 58 O CYS A 5 -0.496 7.506 -2.626 1.00 0.00 O ATOM 59 CB CYS A 5 1.397 4.948 -3.706 1.00 0.00 C ATOM 60 SG CYS A 5 2.347 3.998 -4.949 1.00 0.00 S ATOM 61 H CYS A 5 2.245 7.235 -4.277 1.00 0.00 H ATOM 62 HA CYS A 5 0.095 5.694 -5.214 1.00 0.00 H ATOM 63 HB3 CYS A 5 0.761 4.258 -3.151 1.00 0.00 H HETATM 64 N B3S A 6 -1.636 5.665 -3.260 1.00 0.00 N HETATM 65 OD B3S A 6 -4.601 4.899 -3.576 1.00 0.00 O HETATM 66 CG B3S A 6 -4.068 6.059 -2.931 1.00 0.00 C HETATM 67 CB B3S A 6 -2.709 5.788 -2.243 1.00 0.00 C HETATM 68 CA B3S A 6 -2.766 4.505 -1.377 1.00 0.00 C HETATM 69 C B3S A 6 -1.720 4.404 -0.263 1.00 0.00 C HETATM 70 O B3S A 6 -2.082 4.016 0.848 1.00 0.00 O HETATM 71 H B3S A 6 -1.557 4.860 -3.888 1.00 0.00 H HETATM 72 HD B3S A 6 -5.384 4.650 -3.072 1.00 0.00 H HETATM 73 HG2 B3S A 6 -3.956 6.875 -3.672 1.00 0.00 H HETATM 74 HB B3S A 6 -2.499 6.649 -1.572 1.00 0.00 H HETATM 75 HA1 B3S A 6 -3.774 4.395 -0.937 1.00 0.00 H HETATM 76 HA2 B3S A 6 -2.661 3.613 -2.022 1.00 0.00 H ATOM 77 N GLY A 7 -0.481 4.759 -0.566 1.00 0.00 N ATOM 78 CA GLY A 7 0.577 4.714 0.430 1.00 0.00 C ATOM 79 C GLY A 7 1.954 4.677 -0.235 1.00 0.00 C ATOM 80 O GLY A 7 2.374 3.641 -0.747 1.00 0.00 O ATOM 81 H GLY A 7 -0.196 5.074 -1.472 1.00 0.00 H ATOM 82 HA2 GLY A 7 0.506 5.585 1.080 1.00 0.00 H ATOM 83 HA3 GLY A 7 0.449 3.833 1.059 1.00 0.00 H ATOM 84 N LYS A 8 2.620 5.822 -0.207 1.00 0.00 N ATOM 85 CA LYS A 8 3.942 5.935 -0.800 1.00 0.00 C ATOM 86 C LYS A 8 4.939 5.123 0.030 1.00 0.00 C ATOM 87 O LYS A 8 5.834 5.689 0.656 1.00 0.00 O ATOM 88 CB LYS A 8 4.331 7.405 -0.965 1.00 0.00 C ATOM 89 CG LYS A 8 4.552 8.071 0.394 1.00 0.00 C ATOM 90 CD LYS A 8 6.029 8.408 0.607 1.00 0.00 C ATOM 91 CE LYS A 8 6.373 8.458 2.097 1.00 0.00 C ATOM 92 NZ LYS A 8 6.567 9.858 2.537 1.00 0.00 N ATOM 93 H LYS A 8 2.272 6.661 0.212 1.00 0.00 H ATOM 94 HA LYS A 8 3.890 5.500 -1.798 1.00 0.00 H ATOM 95 HB3 LYS A 8 3.549 7.933 -1.509 1.00 0.00 H ATOM 96 HG3 LYS A 8 4.210 7.406 1.189 1.00 0.00 H ATOM 97 HD3 LYS A 8 6.256 9.369 0.145 1.00 0.00 H ATOM 98 HE3 LYS A 8 7.278 7.882 2.287 1.00 0.00 H ATOM 99 HZ1 LYS A 8 7.334 9.946 3.195 1.00 0.00 H ATOM 100 HZ2 LYS A 8 6.775 10.475 1.760 1.00 0.00 H ATOM 101 N LEU A 9 4.750 3.813 0.008 1.00 0.00 N ATOM 102 CA LEU A 9 5.623 2.919 0.751 1.00 0.00 C ATOM 103 C LEU A 9 5.631 1.545 0.076 1.00 0.00 C ATOM 104 O LEU A 9 6.691 0.954 -0.125 1.00 0.00 O ATOM 105 CB LEU A 9 5.216 2.877 2.225 1.00 0.00 C ATOM 106 CG LEU A 9 5.666 1.642 3.010 1.00 0.00 C ATOM 107 CD1 LEU A 9 7.159 1.712 3.335 1.00 0.00 C ATOM 108 CD2 LEU A 9 4.814 1.452 4.267 1.00 0.00 C ATOM 109 H LEU A 9 4.019 3.362 -0.504 1.00 0.00 H ATOM 110 HA LEU A 9 6.630 3.332 0.705 1.00 0.00 H ATOM 111 HB3 LEU A 9 4.131 2.946 2.285 1.00 0.00 H ATOM 112 HG LEU A 9 5.513 0.765 2.382 1.00 0.00 H ATOM 113 HD11 LEU A 9 7.658 0.829 2.937 1.00 0.00 H ATOM 114 HD12 LEU A 9 7.588 2.606 2.881 1.00 0.00 H ATOM 115 HD13 LEU A 9 7.294 1.751 4.415 1.00 0.00 H ATOM 116 HD21 LEU A 9 4.788 2.383 4.833 1.00 0.00 H ATOM 117 HD22 LEU A 9 3.801 1.173 3.980 1.00 0.00 H ATOM 118 HD23 LEU A 9 5.247 0.664 4.883 1.00 0.00 H ATOM 119 N ILE A 10 4.436 1.077 -0.255 1.00 0.00 N ATOM 120 CA ILE A 10 4.294 -0.217 -0.902 1.00 0.00 C ATOM 121 C ILE A 10 3.039 -0.206 -1.779 1.00 0.00 C ATOM 122 O ILE A 10 1.922 -0.287 -1.270 1.00 0.00 O ATOM 123 CB ILE A 10 4.310 -1.340 0.135 1.00 0.00 C ATOM 124 CG1 ILE A 10 5.738 -1.644 0.593 1.00 0.00 C ATOM 125 CG2 ILE A 10 3.601 -2.588 -0.396 1.00 0.00 C ATOM 126 CD1 ILE A 10 6.632 -1.996 -0.598 1.00 0.00 C ATOM 127 H ILE A 10 3.579 1.563 -0.088 1.00 0.00 H ATOM 128 HA ILE A 10 5.163 -0.358 -1.545 1.00 0.00 H ATOM 129 HB ILE A 10 3.756 -1.004 1.011 1.00 0.00 H ATOM 130 HG13 ILE A 10 5.729 -2.470 1.303 1.00 0.00 H ATOM 131 HG21 ILE A 10 4.170 -3.002 -1.229 1.00 0.00 H ATOM 132 HG22 ILE A 10 3.529 -3.331 0.398 1.00 0.00 H ATOM 133 HG23 ILE A 10 2.601 -2.321 -0.736 1.00 0.00 H ATOM 134 HD11 ILE A 10 6.011 -2.211 -1.467 1.00 0.00 H ATOM 135 HD12 ILE A 10 7.290 -1.156 -0.820 1.00 0.00 H ATOM 136 HD13 ILE A 10 7.233 -2.873 -0.354 1.00 0.00 H ATOM 137 N CYS A 11 3.266 -0.109 -3.080 1.00 0.00 N ATOM 138 CA CYS A 11 2.167 -0.088 -4.032 1.00 0.00 C ATOM 139 C CYS A 11 2.034 -1.485 -4.641 1.00 0.00 C ATOM 140 O CYS A 11 1.622 -1.628 -5.791 1.00 0.00 O ATOM 141 CB CYS A 11 2.369 0.985 -5.104 1.00 0.00 C ATOM 142 SG CYS A 11 1.108 2.311 -5.108 1.00 0.00 S ATOM 143 H CYS A 11 4.177 -0.045 -3.486 1.00 0.00 H ATOM 144 HA CYS A 11 1.272 0.177 -3.471 1.00 0.00 H ATOM 145 HB3 CYS A 11 2.373 0.505 -6.082 1.00 0.00 H ATOM 146 N THR A 12 2.388 -2.481 -3.843 1.00 0.00 N ATOM 147 CA THR A 12 2.312 -3.862 -4.288 1.00 0.00 C ATOM 148 C THR A 12 2.290 -4.809 -3.087 1.00 0.00 C ATOM 149 O THR A 12 2.689 -4.433 -1.986 1.00 0.00 O ATOM 150 CB THR A 12 3.482 -4.116 -5.241 1.00 0.00 C ATOM 151 OG1 THR A 12 2.959 -5.036 -6.195 1.00 0.00 O ATOM 152 CG2 THR A 12 4.626 -4.882 -4.573 1.00 0.00 C ATOM 153 H THR A 12 2.722 -2.357 -2.907 1.00 0.00 H ATOM 154 HA THR A 12 1.371 -3.999 -4.821 1.00 0.00 H ATOM 155 HB THR A 12 3.840 -3.182 -5.676 1.00 0.00 H ATOM 156 HG1 THR A 12 2.659 -5.871 -5.736 1.00 0.00 H ATOM 157 HG21 THR A 12 4.921 -4.368 -3.657 1.00 0.00 H ATOM 158 HG22 THR A 12 4.295 -5.892 -4.333 1.00 0.00 H ATOM 159 HG23 THR A 12 5.477 -4.929 -5.252 1.00 0.00 H ATOM 160 N THR A 13 1.819 -6.022 -3.340 1.00 0.00 N ATOM 161 CA THR A 13 1.740 -7.027 -2.293 1.00 0.00 C ATOM 162 C THR A 13 1.522 -8.413 -2.901 1.00 0.00 C ATOM 163 O THR A 13 0.435 -8.718 -3.390 1.00 0.00 O ATOM 164 CB THR A 13 0.635 -6.609 -1.321 1.00 0.00 C ATOM 165 OG1 THR A 13 1.257 -5.637 -0.484 1.00 0.00 O ATOM 166 CG2 THR A 13 0.246 -7.734 -0.359 1.00 0.00 C ATOM 167 H THR A 13 1.497 -6.321 -4.238 1.00 0.00 H ATOM 168 HA THR A 13 2.695 -7.054 -1.770 1.00 0.00 H ATOM 169 HB THR A 13 -0.238 -6.238 -1.858 1.00 0.00 H ATOM 170 HG1 THR A 13 0.867 -4.734 -0.662 1.00 0.00 H ATOM 171 HG21 THR A 13 1.138 -8.099 0.152 1.00 0.00 H ATOM 172 HG22 THR A 13 -0.463 -7.354 0.377 1.00 0.00 H ATOM 173 HG23 THR A 13 -0.212 -8.549 -0.917 1.00 0.00 H ATOM 174 N ALA A 14 2.573 -9.218 -2.850 1.00 0.00 N ATOM 175 CA ALA A 14 2.510 -10.566 -3.390 1.00 0.00 C ATOM 176 C ALA A 14 1.165 -11.195 -3.025 1.00 0.00 C ATOM 177 O ALA A 14 1.049 -11.880 -2.010 1.00 0.00 O ATOM 178 CB ALA A 14 3.695 -11.382 -2.867 1.00 0.00 C ATOM 179 H ALA A 14 3.453 -8.964 -2.450 1.00 0.00 H ATOM 180 HA ALA A 14 2.586 -10.493 -4.475 1.00 0.00 H ATOM 181 HB1 ALA A 14 4.611 -10.801 -2.974 1.00 0.00 H ATOM 182 HB2 ALA A 14 3.536 -11.618 -1.815 1.00 0.00 H ATOM 183 HB3 ALA A 14 3.782 -12.305 -3.438 1.00 0.00 H TER 184 ALA A 14