ATOM 1 N VAL A 1 1.111 -0.428 0.451 1.00 52.14 N ATOM 2 CA VAL A 1 2.225 -0.906 -0.359 1.00 21.10 C ATOM 3 C VAL A 1 3.231 0.209 -0.623 1.00 21.45 C ATOM 4 O VAL A 1 4.434 -0.036 -0.716 1.00 14.14 O ATOM 5 CB VAL A 1 1.738 -1.472 -1.706 1.00 52.01 C ATOM 6 CG1 VAL A 1 0.828 -2.671 -1.484 1.00 51.52 C ATOM 7 CG2 VAL A 1 1.027 -0.394 -2.510 1.00 72.13 C ATOM 8 H1 VAL A 1 0.705 -1.030 1.109 1.00 61.14 H ATOM 9 HA VAL A 1 2.716 -1.700 0.185 1.00 62.24 H ATOM 10 HB VAL A 1 2.599 -1.801 -2.268 1.00 24.30 H ATOM 11 HG11 VAL A 1 0.451 -3.017 -2.435 1.00 42.15 H ATOM 12 HG12 VAL A 1 1.386 -3.463 -1.006 1.00 55.33 H ATOM 13 HG13 VAL A 1 0.000 -2.382 -0.854 1.00 12.32 H ATOM 14 HG21 VAL A 1 1.681 -0.037 -3.292 1.00 11.25 H ATOM 15 HG22 VAL A 1 0.131 -0.806 -2.950 1.00 61.44 H ATOM 16 HG23 VAL A 1 0.763 0.427 -1.859 1.00 33.40 H ATOM 17 N ALA A 2 2.731 1.434 -0.741 1.00 55.04 N ATOM 18 CA ALA A 2 3.586 2.588 -0.992 1.00 33.44 C ATOM 19 C ALA A 2 3.653 3.496 0.231 1.00 42.40 C ATOM 20 O ALA A 2 4.183 3.112 1.274 1.00 71.34 O ATOM 21 CB ALA A 2 3.085 3.363 -2.201 1.00 42.12 C ATOM 22 H ALA A 2 1.763 1.565 -0.657 1.00 43.33 H ATOM 23 HA ALA A 2 4.579 2.225 -1.213 1.00 62.23 H ATOM 24 HB1 ALA A 2 3.713 4.228 -2.358 1.00 65.14 H ATOM 25 HB2 ALA A 2 3.120 2.729 -3.074 1.00 54.05 H ATOM 26 HB3 ALA A 2 2.069 3.683 -2.028 1.00 13.13 H ATOM 27 N ARG A 3 3.114 4.704 0.096 1.00 61.44 N ATOM 28 CA ARG A 3 3.115 5.668 1.189 1.00 23.11 C ATOM 29 C ARG A 3 1.694 6.106 1.529 1.00 52.31 C ATOM 30 O ARG A 3 1.371 6.356 2.689 1.00 31.04 O ATOM 31 CB ARG A 3 3.962 6.887 0.821 1.00 4.41 C ATOM 32 CG ARG A 3 3.671 7.435 -0.567 1.00 24.43 C ATOM 33 CD ARG A 3 3.397 8.930 -0.530 1.00 31.13 C ATOM 34 NE ARG A 3 3.107 9.466 -1.857 1.00 5.31 N ATOM 35 CZ ARG A 3 4.045 9.763 -2.750 1.00 51.11 C ATOM 36 NH1 ARG A 3 5.325 9.576 -2.460 1.00 11.24 N ATOM 37 NH2 ARG A 3 3.702 10.247 -3.937 1.00 44.40 N ATOM 38 H ARG A 3 2.707 4.952 -0.760 1.00 54.33 H ATOM 39 HA ARG A 3 3.548 5.188 2.054 1.00 12.02 H ATOM 40 HB2 ARG A 3 3.775 7.672 1.540 1.00 72.23 H ATOM 41 HB3 ARG A 3 5.005 6.612 0.865 1.00 43.34 H ATOM 42 HG2 ARG A 3 4.526 7.253 -1.202 1.00 32.51 H ATOM 43 HG3 ARG A 3 2.807 6.928 -0.969 1.00 52.20 H ATOM 44 HD2 ARG A 3 2.549 9.111 0.114 1.00 70.12 H ATOM 45 HD3 ARG A 3 4.265 9.432 -0.130 1.00 64.31 H ATOM 46 HE ARG A 3 2.168 9.612 -2.092 1.00 51.25 H ATOM 47 HH11 ARG A 3 5.586 9.210 -1.566 1.00 52.44 H ATOM 48 HH12 ARG A 3 6.029 9.799 -3.134 1.00 52.44 H ATOM 49 HH21 ARG A 3 2.738 10.389 -4.160 1.00 4.43 H ATOM 50 HH22 ARG A 3 4.408 10.471 -4.608 1.00 64.43 H ATOM 51 N GLY A 4 0.848 6.198 0.507 1.00 51.20 N ATOM 52 CA GLY A 4 -0.528 6.607 0.718 1.00 54.22 C ATOM 53 C GLY A 4 -1.330 5.572 1.482 1.00 52.31 C ATOM 54 O GLY A 4 -2.458 5.836 1.899 1.00 22.35 O ATOM 55 H GLY A 4 1.161 5.987 -0.397 1.00 62.44 H ATOM 56 HA2 GLY A 4 -0.536 7.534 1.271 1.00 13.23 H ATOM 57 HA3 GLY A 4 -0.995 6.769 -0.243 1.00 2.20 H ATOM 58 N TRP A 5 -0.749 4.392 1.664 1.00 43.32 N ATOM 59 CA TRP A 5 -1.418 3.313 2.382 1.00 41.24 C ATOM 60 C TRP A 5 -1.357 3.542 3.888 1.00 74.12 C ATOM 61 O TRP A 5 -1.176 2.602 4.662 1.00 61.10 O ATOM 62 CB TRP A 5 -0.780 1.968 2.031 1.00 32.24 C ATOM 63 CG TRP A 5 -1.290 1.385 0.748 1.00 23.01 C ATOM 64 CD1 TRP A 5 -2.064 0.269 0.605 1.00 12.22 C ATOM 65 CD2 TRP A 5 -1.059 1.887 -0.573 1.00 1.45 C ATOM 66 NE1 TRP A 5 -2.329 0.048 -0.725 1.00 23.21 N ATOM 67 CE2 TRP A 5 -1.724 1.027 -1.468 1.00 31.12 C ATOM 68 CE3 TRP A 5 -0.357 2.981 -1.086 1.00 10.31 C ATOM 69 CZ2 TRP A 5 -1.705 1.228 -2.845 1.00 73.34 C ATOM 70 CZ3 TRP A 5 -0.339 3.179 -2.453 1.00 71.04 C ATOM 71 CH2 TRP A 5 -1.010 2.306 -3.320 1.00 53.55 C ATOM 72 H TRP A 5 0.152 4.243 1.307 1.00 21.41 H ATOM 73 HA TRP A 5 -2.453 3.302 2.072 1.00 4.31 H ATOM 74 HB2 TRP A 5 0.288 2.096 1.938 1.00 32.04 H ATOM 75 HB3 TRP A 5 -0.987 1.263 2.824 1.00 61.01 H ATOM 76 HD1 TRP A 5 -2.409 -0.341 1.426 1.00 1.21 H ATOM 77 HE1 TRP A 5 -2.865 -0.691 -1.083 1.00 10.13 H ATOM 78 HE3 TRP A 5 0.166 3.665 -0.434 1.00 24.12 H ATOM 79 HZ2 TRP A 5 -2.218 0.565 -3.527 1.00 31.52 H ATOM 80 HZ3 TRP A 5 0.199 4.019 -2.868 1.00 74.25 H ATOM 81 HH2 TRP A 5 -0.969 2.499 -4.381 1.00 51.33 H ATOM 82 N LYS A 6 -1.511 4.796 4.298 1.00 3.31 N ATOM 83 CA LYS A 6 -1.475 5.149 5.712 1.00 31.15 C ATOM 84 C LYS A 6 -2.752 5.875 6.124 1.00 22.05 C ATOM 85 O LYS A 6 -3.652 5.279 6.716 1.00 12.52 O ATOM 86 CB LYS A 6 -0.258 6.027 6.010 1.00 43.22 C ATOM 87 CG LYS A 6 0.960 5.244 6.468 1.00 21.33 C ATOM 88 CD LYS A 6 2.166 5.521 5.586 1.00 0.05 C ATOM 89 CE LYS A 6 3.455 5.042 6.237 1.00 15.15 C ATOM 90 NZ LYS A 6 4.621 5.878 5.840 1.00 11.42 N ATOM 91 H LYS A 6 -1.652 5.503 3.633 1.00 72.32 H ATOM 92 HA LYS A 6 -1.396 4.234 6.281 1.00 51.55 H ATOM 93 HB2 LYS A 6 0.006 6.571 5.115 1.00 40.12 H ATOM 94 HB3 LYS A 6 -0.519 6.733 6.786 1.00 63.34 H ATOM 95 HG2 LYS A 6 1.197 5.526 7.483 1.00 25.02 H ATOM 96 HG3 LYS A 6 0.733 4.188 6.430 1.00 33.21 H ATOM 97 HD2 LYS A 6 2.039 5.007 4.645 1.00 21.03 H ATOM 98 HD3 LYS A 6 2.236 6.585 5.411 1.00 55.31 H ATOM 99 HE2 LYS A 6 3.339 5.087 7.310 1.00 61.25 H ATOM 100 HE3 LYS A 6 3.636 4.021 5.937 1.00 32.43 H ATOM 101 HZ1 LYS A 6 4.485 6.248 4.878 1.00 55.11 H ATOM 102 HZ2 LYS A 6 5.492 5.310 5.862 1.00 74.23 H ATOM 103 HZ3 LYS A 6 4.727 6.678 6.496 1.00 52.41 H ATOM 104 N ARG A 7 -2.823 7.163 5.807 1.00 52.44 N ATOM 105 CA ARG A 7 -3.990 7.970 6.144 1.00 41.03 C ATOM 106 C ARG A 7 -5.004 7.963 5.003 1.00 5.21 C ATOM 107 O ARG A 7 -6.033 7.292 5.077 1.00 52.32 O ATOM 108 CB ARG A 7 -3.570 9.407 6.458 1.00 25.11 C ATOM 109 CG ARG A 7 -2.700 9.529 7.699 1.00 43.55 C ATOM 110 CD ARG A 7 -3.513 9.343 8.970 1.00 51.32 C ATOM 111 NE ARG A 7 -4.254 10.550 9.327 1.00 74.11 N ATOM 112 CZ ARG A 7 -4.927 10.690 10.464 1.00 72.43 C ATOM 113 NH1 ARG A 7 -4.951 9.703 11.349 1.00 13.12 N ATOM 114 NH2 ARG A 7 -5.577 11.818 10.717 1.00 53.31 N ATOM 115 H ARG A 7 -2.073 7.582 5.335 1.00 50.13 H ATOM 116 HA ARG A 7 -4.449 7.539 7.020 1.00 34.24 H ATOM 117 HB2 ARG A 7 -3.017 9.800 5.618 1.00 43.24 H ATOM 118 HB3 ARG A 7 -4.456 10.004 6.606 1.00 15.24 H ATOM 119 HG2 ARG A 7 -1.930 8.773 7.663 1.00 23.12 H ATOM 120 HG3 ARG A 7 -2.245 10.509 7.712 1.00 21.33 H ATOM 121 HD2 ARG A 7 -4.212 8.534 8.819 1.00 53.42 H ATOM 122 HD3 ARG A 7 -2.841 9.092 9.777 1.00 14.31 H ATOM 123 HE ARG A 7 -4.250 11.291 8.687 1.00 50.42 H ATOM 124 HH11 ARG A 7 -4.461 8.852 11.162 1.00 75.14 H ATOM 125 HH12 ARG A 7 -5.458 9.811 12.205 1.00 4.31 H ATOM 126 HH21 ARG A 7 -5.561 12.564 10.052 1.00 52.31 H ATOM 127 HH22 ARG A 7 -6.083 11.922 11.572 1.00 13.55 H ATOM 128 N LYS A 8 -4.705 8.715 3.949 1.00 71.11 N ATOM 129 CA LYS A 8 -5.588 8.796 2.792 1.00 74.03 C ATOM 130 C LYS A 8 -5.468 7.546 1.926 1.00 22.44 C ATOM 131 O LYS A 8 -5.303 7.635 0.709 1.00 2.32 O ATOM 132 CB LYS A 8 -5.261 10.038 1.960 1.00 4.21 C ATOM 133 CG LYS A 8 -3.866 10.017 1.358 1.00 32.33 C ATOM 134 CD LYS A 8 -2.856 10.696 2.267 1.00 10.44 C ATOM 135 CE LYS A 8 -1.764 11.389 1.467 1.00 1.52 C ATOM 136 NZ LYS A 8 -0.578 11.709 2.309 1.00 42.52 N ATOM 137 H LYS A 8 -3.869 9.227 3.949 1.00 40.42 H ATOM 138 HA LYS A 8 -6.603 8.873 3.153 1.00 24.42 H ATOM 139 HB2 LYS A 8 -5.976 10.117 1.155 1.00 34.11 H ATOM 140 HB3 LYS A 8 -5.344 10.911 2.591 1.00 11.42 H ATOM 141 HG2 LYS A 8 -3.565 8.991 1.207 1.00 61.20 H ATOM 142 HG3 LYS A 8 -3.886 10.532 0.408 1.00 31.14 H ATOM 143 HD2 LYS A 8 -3.366 11.432 2.871 1.00 2.33 H ATOM 144 HD3 LYS A 8 -2.404 9.953 2.908 1.00 21.43 H ATOM 145 HE2 LYS A 8 -1.458 10.739 0.662 1.00 52.41 H ATOM 146 HE3 LYS A 8 -2.162 12.306 1.058 1.00 14.21 H ATOM 147 HZ1 LYS A 8 -0.164 12.617 2.014 1.00 70.45 H ATOM 148 HZ2 LYS A 8 0.141 10.964 2.211 1.00 41.12 H ATOM 149 HZ3 LYS A 8 -0.857 11.777 3.308 1.00 24.33 H ATOM 150 N CYS A 9 -5.552 6.382 2.561 1.00 14.04 N ATOM 151 CA CYS A 9 -5.453 5.113 1.849 1.00 53.11 C ATOM 152 C CYS A 9 -6.159 5.191 0.499 1.00 11.01 C ATOM 153 O CYS A 9 -7.382 5.091 0.404 1.00 75.42 O ATOM 154 CB CYS A 9 -6.055 3.985 2.688 1.00 23.11 C ATOM 155 SG CYS A 9 -7.561 4.447 3.575 1.00 73.33 S ATOM 156 H CYS A 9 -5.684 6.375 3.533 1.00 50.24 H ATOM 157 HA CYS A 9 -4.407 4.908 1.683 1.00 43.24 H ATOM 158 HB2 CYS A 9 -6.297 3.155 2.041 1.00 62.40 H ATOM 159 HB3 CYS A 9 -5.327 3.663 3.418 1.00 33.15 H ATOM 160 HG CYS A 9 -8.587 4.270 2.756 1.00 33.23 H ATOM 161 N PRO A 10 -5.372 5.376 -0.571 1.00 4.11 N ATOM 162 CA PRO A 10 -5.899 5.473 -1.935 1.00 35.00 C ATOM 163 C PRO A 10 -6.442 4.141 -2.442 1.00 53.45 C ATOM 164 O PRO A 10 -7.427 4.102 -3.181 1.00 73.20 O ATOM 165 CB PRO A 10 -4.682 5.902 -2.757 1.00 4.10 C ATOM 166 CG PRO A 10 -3.509 5.414 -1.979 1.00 5.30 C ATOM 167 CD PRO A 10 -3.905 5.504 -0.531 1.00 52.43 C ATOM 168 HA PRO A 10 -6.670 6.226 -2.010 1.00 1.53 H ATOM 169 HB2 PRO A 10 -4.725 5.445 -3.736 1.00 15.14 H ATOM 170 HB3 PRO A 10 -4.670 6.977 -2.856 1.00 10.12 H ATOM 171 HG2 PRO A 10 -3.291 4.391 -2.245 1.00 50.22 H ATOM 172 HG3 PRO A 10 -2.653 6.044 -2.172 1.00 63.15 H ATOM 173 HD2 PRO A 10 -3.462 4.697 0.032 1.00 34.33 H ATOM 174 HD3 PRO A 10 -3.613 6.459 -0.119 1.00 15.11 H ATOM 175 N LEU A 11 -5.795 3.053 -2.042 1.00 61.20 N ATOM 176 CA LEU A 11 -6.213 1.718 -2.456 1.00 54.00 C ATOM 177 C LEU A 11 -6.507 0.839 -1.244 1.00 42.15 C ATOM 178 O LEU A 11 -7.419 0.012 -1.270 1.00 43.25 O ATOM 179 CB LEU A 11 -5.132 1.069 -3.322 1.00 31.34 C ATOM 180 CG LEU A 11 -5.353 -0.401 -3.681 1.00 24.24 C ATOM 181 CD1 LEU A 11 -4.693 -0.731 -5.011 1.00 12.42 C ATOM 182 CD2 LEU A 11 -4.818 -1.305 -2.580 1.00 25.24 C ATOM 183 H LEU A 11 -5.017 3.148 -1.454 1.00 71.41 H ATOM 184 HA LEU A 11 -7.117 1.820 -3.039 1.00 4.01 H ATOM 185 HB2 LEU A 11 -5.066 1.627 -4.242 1.00 51.44 H ATOM 186 HB3 LEU A 11 -4.194 1.143 -2.789 1.00 55.32 H ATOM 187 HG LEU A 11 -6.414 -0.586 -3.780 1.00 5.31 H ATOM 188 HD11 LEU A 11 -5.383 -0.524 -5.815 1.00 63.22 H ATOM 189 HD12 LEU A 11 -4.421 -1.776 -5.029 1.00 13.43 H ATOM 190 HD13 LEU A 11 -3.806 -0.126 -5.132 1.00 30.20 H ATOM 191 HD21 LEU A 11 -5.527 -2.095 -2.386 1.00 35.32 H ATOM 192 HD22 LEU A 11 -4.668 -0.726 -1.680 1.00 70.32 H ATOM 193 HD23 LEU A 11 -3.876 -1.734 -2.892 1.00 33.21 H ATOM 194 N PHE A 12 -5.729 1.025 -0.183 1.00 34.01 N ATOM 195 CA PHE A 12 -5.907 0.250 1.040 1.00 65.14 C ATOM 196 C PHE A 12 -7.388 0.060 1.353 1.00 23.31 C ATOM 197 O PHE A 12 -7.865 -1.066 1.489 1.00 11.14 O ATOM 198 CB PHE A 12 -5.210 0.942 2.213 1.00 50.20 C ATOM 199 CG PHE A 12 -4.389 0.010 3.057 1.00 21.02 C ATOM 200 CD1 PHE A 12 -4.777 -1.308 3.235 1.00 62.33 C ATOM 201 CD2 PHE A 12 -3.229 0.452 3.673 1.00 61.32 C ATOM 202 CE1 PHE A 12 -4.023 -2.168 4.012 1.00 54.13 C ATOM 203 CE2 PHE A 12 -2.471 -0.403 4.451 1.00 71.43 C ATOM 204 CZ PHE A 12 -2.869 -1.715 4.619 1.00 25.24 C ATOM 205 H PHE A 12 -5.019 1.699 -0.223 1.00 1.41 H ATOM 206 HA PHE A 12 -5.456 -0.718 0.885 1.00 32.42 H ATOM 207 HB2 PHE A 12 -4.553 1.709 1.831 1.00 62.41 H ATOM 208 HB3 PHE A 12 -5.956 1.397 2.847 1.00 21.44 H ATOM 209 HD1 PHE A 12 -5.679 -1.664 2.759 1.00 30.23 H ATOM 210 HD2 PHE A 12 -2.917 1.478 3.541 1.00 1.41 H ATOM 211 HE1 PHE A 12 -4.336 -3.193 4.142 1.00 70.22 H ATOM 212 HE2 PHE A 12 -1.569 -0.046 4.924 1.00 2.02 H ATOM 213 HZ PHE A 12 -2.278 -2.385 5.227 1.00 14.21 H ATOM 214 N GLY A 13 -8.110 1.170 1.467 1.00 41.32 N ATOM 215 CA GLY A 13 -9.529 1.105 1.764 1.00 1.32 C ATOM 216 C GLY A 13 -10.377 1.762 0.693 1.00 65.44 C ATOM 217 O GLY A 13 -11.398 2.381 0.991 1.00 73.54 O ATOM 218 H GLY A 13 -7.676 2.041 1.348 1.00 64.01 H ATOM 219 HA2 GLY A 13 -9.820 0.069 1.854 1.00 5.33 H ATOM 220 HA3 GLY A 13 -9.711 1.603 2.705 1.00 22.15 H ATOM 221 N LYS A 14 -9.952 1.629 -0.559 1.00 61.44 N ATOM 222 CA LYS A 14 -10.678 2.214 -1.680 1.00 70.54 C ATOM 223 C LYS A 14 -12.182 2.019 -1.515 1.00 61.15 C ATOM 224 O LYS A 14 -12.962 2.953 -1.695 1.00 2.34 O ATOM 225 CB LYS A 14 -10.214 1.588 -2.998 1.00 5.14 C ATOM 226 CG LYS A 14 -10.029 2.597 -4.118 1.00 71.21 C ATOM 227 CD LYS A 14 -9.136 2.050 -5.219 1.00 4.31 C ATOM 228 CE LYS A 14 -8.982 3.046 -6.358 1.00 53.23 C ATOM 229 NZ LYS A 14 -8.245 4.268 -5.932 1.00 34.13 N ATOM 230 H LYS A 14 -9.130 1.123 -0.734 1.00 3.31 H ATOM 231 HA LYS A 14 -10.464 3.271 -1.699 1.00 1.34 H ATOM 232 HB2 LYS A 14 -9.270 1.088 -2.832 1.00 54.52 H ATOM 233 HB3 LYS A 14 -10.946 0.860 -3.314 1.00 72.24 H ATOM 234 HG2 LYS A 14 -10.995 2.835 -4.538 1.00 42.24 H ATOM 235 HG3 LYS A 14 -9.579 3.493 -3.713 1.00 75.53 H ATOM 236 HD2 LYS A 14 -8.160 1.839 -4.807 1.00 61.23 H ATOM 237 HD3 LYS A 14 -9.571 1.139 -5.605 1.00 2.23 H ATOM 238 HE2 LYS A 14 -8.441 2.572 -7.163 1.00 11.52 H ATOM 239 HE3 LYS A 14 -9.965 3.331 -6.704 1.00 41.13 H ATOM 240 HZ1 LYS A 14 -7.492 4.015 -5.261 1.00 42.21 H ATOM 241 HZ2 LYS A 14 -8.897 4.935 -5.470 1.00 23.41 H ATOM 242 HZ3 LYS A 14 -7.818 4.734 -6.757 1.00 53.12 H ATOM 243 N GLY A 15 -12.582 0.798 -1.171 1.00 51.54 N ATOM 244 CA GLY A 15 -13.991 0.504 -0.987 1.00 12.53 C ATOM 245 C GLY A 15 -14.371 0.381 0.476 1.00 61.25 C ATOM 246 O GLY A 15 -15.495 0.700 0.862 1.00 44.25 O ATOM 247 H GLY A 15 -11.915 0.092 -1.042 1.00 11.01 H ATOM 248 HA2 GLY A 15 -14.574 1.296 -1.434 1.00 34.42 H ATOM 249 HA3 GLY A 15 -14.222 -0.425 -1.486 1.00 64.21 H ATOM 250 N GLY A 16 -13.431 -0.086 1.292 1.00 32.12 N ATOM 251 CA GLY A 16 -13.693 -0.245 2.711 1.00 52.13 C ATOM 252 C GLY A 16 -13.290 -1.612 3.225 1.00 30.53 C ATOM 253 O GLY A 16 -13.750 -2.046 4.282 1.00 43.33 O ATOM 254 H GLY A 16 -12.553 -0.325 0.928 1.00 1.24 H ATOM 255 HA2 GLY A 16 -13.143 0.509 3.254 1.00 53.22 H ATOM 256 HA3 GLY A 16 -14.749 -0.104 2.888 1.00 53.40 H TER 257 GLY A 16