ATOM 1 N CYS A 1 3.672 6.471 -1.534 1.00 3.15 N ATOM 2 CA CYS A 1 2.236 6.249 -1.797 1.00 2.26 C ATOM 3 C CYS A 1 2.002 4.882 -2.417 1.00 1.98 C ATOM 4 O CYS A 1 2.859 4.384 -3.148 1.00 2.33 O ATOM 5 CB CYS A 1 1.705 7.349 -2.712 1.00 2.34 C ATOM 6 SG CYS A 1 -0.028 7.118 -3.142 1.00 1.91 S ATOM 7 H1 CYS A 1 4.114 5.586 -1.209 1.00 3.45 H ATOM 8 H2 CYS A 1 4.153 6.784 -2.407 1.00 3.65 H ATOM 9 H3 CYS A 1 3.796 7.197 -0.799 1.00 3.48 H ATOM 10 HA CYS A 1 1.710 6.292 -0.854 1.00 2.29 H ATOM 11 HB2 CYS A 1 1.808 8.302 -2.214 1.00 2.87 H ATOM 12 HB3 CYS A 1 2.285 7.360 -3.623 1.00 2.72 H HETATM 13 N DBB A 2 0.866 4.243 -2.107 1.00 1.75 N HETATM 14 CA DBB A 2 -0.180 4.807 -1.237 1.00 1.40 C HETATM 15 C DBB A 2 0.234 4.838 0.235 1.00 1.07 C HETATM 16 O DBB A 2 1.400 5.056 0.564 1.00 1.04 O HETATM 17 CB DBB A 2 -0.603 6.226 -1.679 1.00 1.37 C HETATM 18 CG DBB A 2 -1.989 6.201 -2.304 1.00 2.04 C HETATM 19 H DBB A 2 0.713 3.356 -2.503 1.00 2.09 H HETATM 20 HA DBB A 2 -1.044 4.167 -1.324 1.00 1.56 H HETATM 21 HB2 DBB A 2 -0.645 6.853 -0.800 1.00 1.20 H HETATM 22 HG1 DBB A 2 -2.565 7.038 -1.939 1.00 2.44 H HETATM 23 HG2 DBB A 2 -2.487 5.279 -2.038 1.00 2.43 H HETATM 24 HG3 DBB A 2 -1.901 6.265 -3.379 1.00 2.55 H ATOM 25 N PHE A 3 -0.742 4.632 1.112 1.00 0.92 N ATOM 26 CA PHE A 3 -0.511 4.639 2.550 1.00 0.68 C ATOM 27 C PHE A 3 0.527 3.591 2.941 1.00 0.63 C ATOM 28 O PHE A 3 0.264 2.391 2.898 1.00 0.81 O ATOM 29 CB PHE A 3 -1.820 4.384 3.299 1.00 0.75 C ATOM 30 CG PHE A 3 -1.707 4.560 4.787 1.00 0.72 C ATOM 31 CD1 PHE A 3 -1.229 5.744 5.323 1.00 0.68 C ATOM 32 CD2 PHE A 3 -2.079 3.540 5.649 1.00 0.92 C ATOM 33 CE1 PHE A 3 -1.124 5.909 6.690 1.00 0.82 C ATOM 34 CE2 PHE A 3 -1.975 3.699 7.017 1.00 1.03 C ATOM 35 CZ PHE A 3 -1.498 4.885 7.539 1.00 0.98 C ATOM 36 H PHE A 3 -1.658 4.485 0.777 1.00 1.06 H ATOM 37 HA PHE A 3 -0.136 5.615 2.819 1.00 0.65 H ATOM 38 HB2 PHE A 3 -2.571 5.072 2.941 1.00 0.86 H ATOM 39 HB3 PHE A 3 -2.144 3.372 3.105 1.00 0.87 H ATOM 40 HD1 PHE A 3 -0.937 6.545 4.662 1.00 0.67 H ATOM 41 HD2 PHE A 3 -2.452 2.613 5.240 1.00 1.08 H ATOM 42 HE1 PHE A 3 -0.749 6.840 7.095 1.00 0.92 H ATOM 43 HE2 PHE A 3 -2.266 2.897 7.678 1.00 1.24 H ATOM 44 HZ PHE A 3 -1.416 5.013 8.608 1.00 1.15 H HETATM 45 N DBB A 4 1.714 4.069 3.276 1.00 0.58 N HETATM 46 CA DBB A 4 2.844 3.219 3.616 1.00 0.66 C HETATM 47 C DBB A 4 4.141 3.957 3.270 1.00 0.86 C HETATM 48 O DBB A 4 4.268 4.479 2.162 1.00 1.45 O HETATM 49 CB DBB A 4 2.820 2.801 5.110 1.00 0.60 C HETATM 50 CG DBB A 4 2.265 3.915 5.991 1.00 1.01 C HETATM 51 H DBB A 4 1.854 5.040 3.236 1.00 0.61 H HETATM 52 HA DBB A 4 2.785 2.321 3.010 1.00 0.76 H HETATM 53 HB2 DBB A 4 2.175 1.941 5.212 1.00 0.86 H HETATM 54 HG1 DBB A 4 1.211 4.041 5.791 1.00 1.36 H HETATM 55 HG2 DBB A 4 2.784 4.838 5.773 1.00 1.64 H HETATM 56 HG3 DBB A 4 2.407 3.658 7.029 1.00 1.60 H ATOM 57 N LEU A 5 5.053 4.103 4.229 1.00 0.75 N ATOM 58 CA LEU A 5 6.255 4.910 4.003 1.00 0.89 C ATOM 59 C LEU A 5 7.271 4.277 3.022 1.00 0.83 C ATOM 60 O LEU A 5 7.936 5.017 2.291 1.00 1.18 O ATOM 61 CB LEU A 5 6.926 5.299 5.337 1.00 1.24 C ATOM 62 CG LEU A 5 7.475 4.159 6.204 1.00 1.68 C ATOM 63 CD1 LEU A 5 8.917 3.840 5.836 1.00 2.45 C ATOM 64 CD2 LEU A 5 7.373 4.521 7.678 1.00 1.76 C ATOM 65 H LEU A 5 4.877 3.743 5.126 1.00 1.03 H ATOM 66 HA LEU A 5 5.910 5.825 3.543 1.00 1.33 H ATOM 67 HB2 LEU A 5 7.745 5.965 5.112 1.00 1.67 H ATOM 68 HB3 LEU A 5 6.201 5.843 5.924 1.00 1.67 H ATOM 69 HG LEU A 5 6.883 3.269 6.037 1.00 2.26 H ATOM 70 HD11 LEU A 5 9.493 4.754 5.826 1.00 2.69 H ATOM 71 HD12 LEU A 5 9.333 3.162 6.566 1.00 3.10 H ATOM 72 HD13 LEU A 5 8.948 3.384 4.859 1.00 2.78 H ATOM 73 HD21 LEU A 5 6.757 5.402 7.793 1.00 1.93 H ATOM 74 HD22 LEU A 5 6.933 3.700 8.222 1.00 2.18 H ATOM 75 HD23 LEU A 5 8.361 4.721 8.066 1.00 2.25 H ATOM 76 N PRO A 6 7.459 2.929 2.990 1.00 0.96 N ATOM 77 CA PRO A 6 8.443 2.303 2.091 1.00 1.54 C ATOM 78 C PRO A 6 8.115 2.516 0.613 1.00 2.01 C ATOM 79 O PRO A 6 6.959 2.743 0.247 1.00 1.95 O ATOM 80 CB PRO A 6 8.373 0.810 2.438 1.00 2.00 C ATOM 81 CG PRO A 6 7.726 0.751 3.776 1.00 1.83 C ATOM 82 CD PRO A 6 6.785 1.917 3.823 1.00 1.07 C ATOM 83 HA PRO A 6 9.441 2.670 2.286 1.00 1.54 H ATOM 84 HB2 PRO A 6 7.785 0.295 1.693 1.00 2.42 H ATOM 85 HB3 PRO A 6 9.371 0.397 2.463 1.00 2.23 H ATOM 86 HG2 PRO A 6 7.182 -0.177 3.880 1.00 2.24 H ATOM 87 HG3 PRO A 6 8.473 0.840 4.549 1.00 2.17 H ATOM 88 HD2 PRO A 6 5.828 1.646 3.403 1.00 0.98 H ATOM 89 HD3 PRO A 6 6.668 2.271 4.838 1.00 1.27 H ATOM 90 N GLY A 7 9.134 2.419 -0.230 1.00 2.70 N ATOM 91 CA GLY A 7 8.945 2.579 -1.659 1.00 3.34 C ATOM 92 C GLY A 7 9.425 1.371 -2.434 1.00 4.03 C ATOM 93 O GLY A 7 10.615 1.242 -2.726 1.00 4.79 O ATOM 94 H GLY A 7 10.032 2.206 0.122 1.00 2.84 H ATOM 95 HA2 GLY A 7 7.894 2.729 -1.858 1.00 3.07 H ATOM 96 HA3 GLY A 7 9.492 3.449 -1.991 1.00 3.76 H ATOM 97 N GLY A 8 8.508 0.467 -2.738 1.00 4.04 N ATOM 98 CA GLY A 8 8.862 -0.738 -3.461 1.00 4.78 C ATOM 99 C GLY A 8 7.663 -1.632 -3.699 1.00 4.38 C ATOM 100 O GLY A 8 6.526 -1.156 -3.738 1.00 4.63 O ATOM 101 H GLY A 8 7.577 0.618 -2.470 1.00 3.73 H ATOM 102 HA2 GLY A 8 9.289 -0.461 -4.412 1.00 5.48 H ATOM 103 HA3 GLY A 8 9.598 -1.286 -2.891 1.00 5.13 H ATOM 104 N GLY A 9 7.910 -2.928 -3.824 1.00 3.95 N ATOM 105 CA GLY A 9 6.830 -3.873 -4.016 1.00 3.48 C ATOM 106 C GLY A 9 6.317 -4.410 -2.699 1.00 2.20 C ATOM 107 O GLY A 9 5.111 -4.558 -2.506 1.00 2.33 O ATOM 108 H GLY A 9 8.837 -3.253 -3.759 1.00 4.09 H ATOM 109 HA2 GLY A 9 6.022 -3.382 -4.538 1.00 3.88 H ATOM 110 HA3 GLY A 9 7.187 -4.698 -4.616 1.00 3.89 H ATOM 111 N GLY A 10 7.226 -4.595 -1.755 1.00 1.34 N ATOM 112 CA GLY A 10 6.834 -5.012 -0.426 1.00 0.67 C ATOM 113 C GLY A 10 6.753 -3.829 0.509 1.00 0.58 C ATOM 114 O GLY A 10 7.763 -3.406 1.072 1.00 0.84 O ATOM 115 H GLY A 10 8.165 -4.376 -1.942 1.00 1.76 H ATOM 116 HA2 GLY A 10 5.867 -5.489 -0.477 1.00 1.29 H ATOM 117 HA3 GLY A 10 7.560 -5.715 -0.043 1.00 1.20 H ATOM 118 N VAL A 11 5.591 -3.194 0.542 1.00 0.40 N ATOM 119 CA VAL A 11 5.421 -1.961 1.292 1.00 0.36 C ATOM 120 C VAL A 11 4.300 -2.054 2.297 1.00 0.46 C ATOM 121 O VAL A 11 3.390 -2.875 2.184 1.00 1.11 O ATOM 122 CB VAL A 11 5.145 -0.752 0.369 1.00 0.43 C ATOM 123 CG1 VAL A 11 6.361 -0.443 -0.484 1.00 0.61 C ATOM 124 CG2 VAL A 11 3.925 -1.005 -0.508 1.00 0.55 C ATOM 125 H VAL A 11 4.850 -3.524 -0.008 1.00 0.59 H ATOM 126 HA VAL A 11 6.336 -1.765 1.834 1.00 0.45 H ATOM 127 HB VAL A 11 4.940 0.111 0.993 1.00 0.46 H ATOM 128 HG11 VAL A 11 7.142 -1.156 -0.269 1.00 1.14 H ATOM 129 HG12 VAL A 11 6.094 -0.506 -1.529 1.00 1.25 H ATOM 130 HG13 VAL A 11 6.712 0.555 -0.262 1.00 1.24 H ATOM 131 HG21 VAL A 11 3.982 -1.998 -0.928 1.00 1.19 H ATOM 132 HG22 VAL A 11 3.029 -0.917 0.089 1.00 1.19 H ATOM 133 HG23 VAL A 11 3.899 -0.276 -1.305 1.00 1.14 H ATOM 134 N CYS A 12 4.342 -1.115 3.212 1.00 0.33 N ATOM 135 CA CYS A 12 3.301 -0.920 4.185 1.00 0.28 C ATOM 136 C CYS A 12 1.992 -0.584 3.485 1.00 0.27 C ATOM 137 O CYS A 12 1.988 0.137 2.487 1.00 0.54 O ATOM 138 CB CYS A 12 3.756 0.207 5.104 1.00 0.38 C ATOM 139 SG CYS A 12 2.441 1.191 5.845 1.00 0.40 S ATOM 140 H CYS A 12 5.066 -0.463 3.172 1.00 0.80 H ATOM 141 HA CYS A 12 3.185 -1.828 4.757 1.00 0.30 H ATOM 142 HB2 CYS A 12 4.350 -0.221 5.893 1.00 0.48 H ATOM 143 HB3 CYS A 12 4.385 0.875 4.531 1.00 0.44 H HETATM 144 N DBB A 13 0.902 -1.184 3.946 1.00 0.29 N HETATM 145 CA DBB A 13 -0.388 -0.997 3.296 1.00 0.29 C HETATM 146 C DBB A 13 -0.433 -1.712 1.958 1.00 0.29 C HETATM 147 O DBB A 13 -1.034 -1.217 1.013 1.00 0.29 O HETATM 148 CB DBB A 13 -1.571 -1.500 4.153 1.00 0.30 C HETATM 149 CG DBB A 13 -1.187 -1.592 5.622 1.00 0.42 C HETATM 150 H DBB A 13 0.980 -1.810 4.696 1.00 0.55 H HETATM 151 HA DBB A 13 -0.513 0.065 3.119 1.00 0.30 H HETATM 152 HB2 DBB A 13 -1.841 -2.489 3.810 1.00 0.41 H HETATM 153 HG1 DBB A 13 -0.461 -0.825 5.854 1.00 1.13 H HETATM 154 HG2 DBB A 13 -0.764 -2.563 5.823 1.00 1.03 H HETATM 155 HG3 DBB A 13 -2.067 -1.449 6.232 1.00 0.99 H ATOM 156 N LEU A 14 0.182 -2.880 1.887 1.00 0.32 N ATOM 157 CA LEU A 14 0.266 -3.626 0.653 1.00 0.35 C ATOM 158 C LEU A 14 -1.082 -4.236 0.269 1.00 0.30 C ATOM 159 O LEU A 14 -1.423 -5.348 0.678 1.00 0.38 O ATOM 160 CB LEU A 14 1.326 -4.716 0.801 1.00 0.45 C ATOM 161 CG LEU A 14 1.393 -5.703 -0.348 1.00 0.49 C ATOM 162 CD1 LEU A 14 1.800 -5.009 -1.638 1.00 0.51 C ATOM 163 CD2 LEU A 14 2.347 -6.841 -0.022 1.00 0.63 C ATOM 164 H LEU A 14 0.629 -3.239 2.682 1.00 0.35 H ATOM 165 HA LEU A 14 0.574 -2.946 -0.125 1.00 0.38 H ATOM 166 HB2 LEU A 14 2.290 -4.239 0.900 1.00 0.50 H ATOM 167 HB3 LEU A 14 1.120 -5.266 1.707 1.00 0.47 H ATOM 168 HG LEU A 14 0.410 -6.117 -0.486 1.00 0.44 H ATOM 169 HD11 LEU A 14 1.163 -4.153 -1.803 1.00 1.15 H ATOM 170 HD12 LEU A 14 2.828 -4.686 -1.564 1.00 1.08 H ATOM 171 HD13 LEU A 14 1.698 -5.698 -2.462 1.00 1.13 H ATOM 172 HD21 LEU A 14 2.489 -6.897 1.047 1.00 1.25 H ATOM 173 HD22 LEU A 14 1.930 -7.771 -0.378 1.00 1.24 H ATOM 174 HD23 LEU A 14 3.297 -6.664 -0.505 1.00 1.14 H HETATM 175 N DBB A 15 -1.836 -3.492 -0.531 1.00 0.24 N HETATM 176 CA DBB A 15 -3.114 -3.959 -1.053 1.00 0.31 C HETATM 177 C DBB A 15 -4.266 -3.151 -0.479 1.00 0.21 C HETATM 178 O DBB A 15 -4.071 -2.022 -0.017 1.00 0.20 O HETATM 179 CB DBB A 15 -3.147 -3.864 -2.598 1.00 0.52 C HETATM 180 CG DBB A 15 -2.289 -4.971 -3.185 1.00 1.08 C HETATM 181 H DBB A 15 -1.515 -2.600 -0.786 1.00 0.28 H HETATM 182 HA DBB A 15 -3.233 -4.994 -0.772 1.00 0.40 H HETATM 183 HB2 DBB A 15 -4.164 -4.019 -2.924 1.00 0.51 H HETATM 184 HG1 DBB A 15 -1.332 -4.990 -2.684 1.00 1.37 H HETATM 185 HG2 DBB A 15 -2.139 -4.790 -4.240 1.00 1.71 H HETATM 186 HG3 DBB A 15 -2.784 -5.920 -3.048 1.00 1.62 H HETATM 187 N DHA A 16 -5.468 -3.725 -0.542 1.00 0.22 N HETATM 188 CA DHA A 16 -6.587 -3.055 -0.117 1.00 0.26 C HETATM 189 CB DHA A 16 -7.637 -2.954 -0.943 1.00 0.40 C HETATM 190 C DHA A 16 -6.657 -2.469 1.166 1.00 0.25 C HETATM 191 O DHA A 16 -7.403 -1.512 1.378 1.00 0.30 O HETATM 192 H DHA A 16 -5.505 -4.621 -0.951 1.00 0.28 H HETATM 193 HB1 DHA A 16 -7.594 -3.397 -1.927 1.00 0.45 H HETATM 194 HB2 DHA A 16 -8.527 -2.433 -0.624 1.00 0.51 H ATOM 195 N GLU A 17 -5.872 -2.997 2.097 1.00 0.25 N ATOM 196 CA GLU A 17 -5.842 -2.473 3.451 1.00 0.31 C ATOM 197 C GLU A 17 -5.367 -1.021 3.462 1.00 0.28 C ATOM 198 O GLU A 17 -5.825 -0.215 4.275 1.00 0.36 O ATOM 199 CB GLU A 17 -4.928 -3.329 4.329 1.00 0.38 C ATOM 200 CG GLU A 17 -5.071 -3.055 5.818 1.00 0.49 C ATOM 201 CD GLU A 17 -6.427 -3.467 6.357 1.00 1.43 C ATOM 202 OE1 GLU A 17 -7.454 -2.931 5.888 1.00 2.36 O ATOM 203 OE2 GLU A 17 -6.474 -4.331 7.258 1.00 1.79 O ATOM 204 H GLU A 17 -5.301 -3.764 1.867 1.00 0.26 H ATOM 205 HA GLU A 17 -6.845 -2.515 3.845 1.00 0.37 H ATOM 206 HB2 GLU A 17 -5.157 -4.370 4.155 1.00 0.40 H ATOM 207 HB3 GLU A 17 -3.903 -3.144 4.047 1.00 0.40 H ATOM 208 HG2 GLU A 17 -4.309 -3.608 6.348 1.00 0.85 H ATOM 209 HG3 GLU A 17 -4.934 -1.998 5.994 1.00 0.90 H ATOM 210 N CYS A 18 -4.478 -0.678 2.534 1.00 0.21 N ATOM 211 CA CYS A 18 -3.988 0.688 2.435 1.00 0.22 C ATOM 212 C CYS A 18 -3.883 1.157 0.986 1.00 0.24 C ATOM 213 O CYS A 18 -4.681 1.981 0.539 1.00 0.30 O ATOM 214 CB CYS A 18 -2.614 0.837 3.069 1.00 0.23 C ATOM 215 SG CYS A 18 -2.393 0.021 4.666 1.00 0.27 S ATOM 216 H CYS A 18 -4.182 -1.346 1.879 1.00 0.19 H ATOM 217 HA CYS A 18 -4.684 1.326 2.958 1.00 0.28 H ATOM 218 HB2 CYS A 18 -1.897 0.431 2.380 1.00 0.25 H ATOM 219 HB3 CYS A 18 -2.407 1.888 3.195 1.00 0.29 H ATOM 220 N ILE A 19 -2.758 0.814 0.341 1.00 0.26 N ATOM 221 CA ILE A 19 -2.402 1.406 -0.939 1.00 0.34 C ATOM 222 C ILE A 19 -3.433 1.096 -2.021 1.00 0.40 C ATOM 223 O ILE A 19 -3.640 1.888 -2.942 1.00 0.56 O ATOM 224 CB ILE A 19 -1.006 0.962 -1.434 1.00 0.37 C ATOM 225 CG1 ILE A 19 -0.990 -0.525 -1.804 1.00 1.36 C ATOM 226 CG2 ILE A 19 0.056 1.269 -0.390 1.00 1.21 C ATOM 227 CD1 ILE A 19 0.323 -0.992 -2.394 1.00 1.88 C ATOM 228 H ILE A 19 -2.083 0.276 0.809 1.00 0.28 H ATOM 229 HA ILE A 19 -2.363 2.466 -0.780 1.00 0.42 H ATOM 230 HB ILE A 19 -0.774 1.537 -2.310 1.00 1.17 H ATOM 231 HG12 ILE A 19 -1.179 -1.110 -0.916 1.00 2.01 H ATOM 232 HG13 ILE A 19 -1.767 -0.716 -2.528 1.00 1.86 H ATOM 233 HG21 ILE A 19 -0.177 2.205 0.097 1.00 1.82 H ATOM 234 HG22 ILE A 19 0.077 0.478 0.344 1.00 1.59 H ATOM 235 HG23 ILE A 19 1.021 1.341 -0.869 1.00 1.77 H ATOM 236 HD11 ILE A 19 1.036 -0.180 -2.367 1.00 2.15 H ATOM 237 HD12 ILE A 19 0.702 -1.823 -1.819 1.00 2.27 H ATOM 238 HD13 ILE A 19 0.170 -1.301 -3.418 1.00 2.43 H HETATM 239 N TEE A 20 -4.057 -0.070 -1.915 1.00 0.49 N HETATM 240 CB TEE A 20 -5.035 -1.785 -3.274 1.00 0.68 C HETATM 241 CA TEE A 20 -4.972 -0.440 -2.862 1.00 0.60 C HETATM 242 SG TEE A 20 -4.358 -3.357 -3.844 1.00 0.89 S HETATM 243 HN1 TEE A 20 -3.815 -0.634 -1.144 1.00 0.60 H HETATM 244 HB2 TEE A 20 -5.316 -2.554 -2.569 1.00 1.16 H HETATM 245 HA TEE A 20 -5.278 -1.410 -2.497 1.00 0.52 H TER 246 TEE A 20