ATOM 1 N CYS A 1 -1.940 3.729 -5.209 1.00 3.15 N ATOM 2 CA CYS A 1 -1.442 4.667 -4.184 1.00 2.26 C ATOM 3 C CYS A 1 -0.108 4.140 -3.619 1.00 1.98 C ATOM 4 O CYS A 1 0.637 3.491 -4.355 1.00 2.33 O ATOM 5 CB CYS A 1 -2.528 4.780 -3.113 1.00 2.34 C ATOM 6 SG CYS A 1 -2.556 6.364 -2.253 1.00 1.91 S ATOM 7 H1 CYS A 1 -1.529 2.781 -5.059 1.00 3.45 H ATOM 8 H2 CYS A 1 -2.979 3.656 -5.160 1.00 3.65 H ATOM 9 H3 CYS A 1 -1.670 4.061 -6.159 1.00 3.48 H ATOM 10 HA CYS A 1 -1.279 5.632 -4.642 1.00 2.29 H ATOM 11 HB2 CYS A 1 -3.489 4.637 -3.581 1.00 2.87 H ATOM 12 HB3 CYS A 1 -2.378 3.998 -2.382 1.00 2.72 H HETATM 13 N DBB A 2 0.214 4.370 -2.333 1.00 1.75 N HETATM 14 CA DBB A 2 -0.606 5.148 -1.409 1.00 1.40 C HETATM 15 C DBB A 2 0.021 5.168 -0.020 1.00 1.07 C HETATM 16 O DBB A 2 1.246 5.192 0.116 1.00 1.04 O HETATM 17 CB DBB A 2 -0.806 6.596 -1.901 1.00 1.37 C HETATM 18 CG DBB A 2 0.532 7.220 -2.253 1.00 2.04 C HETATM 19 H DBB A 2 1.073 4.026 -2.001 1.00 2.09 H HETATM 20 HA DBB A 2 -1.565 4.680 -1.343 1.00 1.56 H HETATM 21 HB2 DBB A 2 -1.249 7.169 -1.099 1.00 1.20 H HETATM 22 HG1 DBB A 2 0.472 7.676 -3.229 1.00 2.44 H HETATM 23 HG2 DBB A 2 1.288 6.450 -2.259 1.00 2.43 H HETATM 24 HG3 DBB A 2 0.786 7.969 -1.517 1.00 2.55 H ATOM 25 N PHE A 3 -0.823 5.134 1.000 1.00 0.92 N ATOM 26 CA PHE A 3 -0.366 5.117 2.383 1.00 0.68 C ATOM 27 C PHE A 3 0.350 3.807 2.696 1.00 0.63 C ATOM 28 O PHE A 3 -0.274 2.751 2.771 1.00 0.81 O ATOM 29 CB PHE A 3 -1.550 5.314 3.335 1.00 0.75 C ATOM 30 CG PHE A 3 -1.160 5.445 4.781 1.00 0.72 C ATOM 31 CD1 PHE A 3 -0.295 6.447 5.190 1.00 0.68 C ATOM 32 CD2 PHE A 3 -1.661 4.567 5.729 1.00 0.92 C ATOM 33 CE1 PHE A 3 0.066 6.569 6.518 1.00 0.82 C ATOM 34 CE2 PHE A 3 -1.302 4.683 7.059 1.00 1.03 C ATOM 35 CZ PHE A 3 -0.440 5.689 7.454 1.00 0.98 C ATOM 36 H PHE A 3 -1.787 5.099 0.821 1.00 1.06 H ATOM 37 HA PHE A 3 0.327 5.934 2.511 1.00 0.65 H ATOM 38 HB2 PHE A 3 -2.082 6.213 3.056 1.00 0.86 H ATOM 39 HB3 PHE A 3 -2.215 4.469 3.248 1.00 0.87 H ATOM 40 HD1 PHE A 3 0.099 7.140 4.459 1.00 0.67 H ATOM 41 HD2 PHE A 3 -2.335 3.781 5.422 1.00 1.08 H ATOM 42 HE1 PHE A 3 0.742 7.353 6.825 1.00 0.92 H ATOM 43 HE2 PHE A 3 -1.699 3.993 7.789 1.00 1.24 H ATOM 44 HZ PHE A 3 -0.162 5.784 8.494 1.00 1.15 H HETATM 45 N DBB A 4 1.665 3.880 2.822 1.00 0.58 N HETATM 46 CA DBB A 4 2.479 2.700 3.089 1.00 0.66 C HETATM 47 C DBB A 4 3.885 2.875 2.511 1.00 0.86 C HETATM 48 O DBB A 4 4.226 2.269 1.497 1.00 1.45 O HETATM 49 CB DBB A 4 2.557 2.374 4.607 1.00 0.60 C HETATM 50 CG DBB A 4 2.253 3.594 5.466 1.00 1.01 C HETATM 51 H DBB A 4 2.109 4.749 2.686 1.00 0.61 H HETATM 52 HA DBB A 4 2.017 1.858 2.590 1.00 0.76 H HETATM 53 HB2 DBB A 4 1.826 1.612 4.830 1.00 0.86 H HETATM 54 HG1 DBB A 4 1.606 3.304 6.280 1.00 1.36 H HETATM 55 HG2 DBB A 4 1.763 4.345 4.866 1.00 1.64 H HETATM 56 HG3 DBB A 4 3.176 3.994 5.862 1.00 1.60 H ATOM 57 N LEU A 5 4.656 3.787 3.093 1.00 0.75 N ATOM 58 CA LEU A 5 5.979 4.129 2.570 1.00 0.89 C ATOM 59 C LEU A 5 7.071 3.060 2.829 1.00 0.83 C ATOM 60 O LEU A 5 7.963 2.908 1.995 1.00 1.18 O ATOM 61 CB LEU A 5 6.447 5.500 3.097 1.00 1.24 C ATOM 62 CG LEU A 5 6.561 5.647 4.620 1.00 1.68 C ATOM 63 CD1 LEU A 5 7.645 6.655 4.972 1.00 2.45 C ATOM 64 CD2 LEU A 5 5.233 6.086 5.228 1.00 1.76 C ATOM 65 H LEU A 5 4.294 4.303 3.843 1.00 1.03 H ATOM 66 HA LEU A 5 5.866 4.216 1.502 1.00 1.33 H ATOM 67 HB2 LEU A 5 7.417 5.708 2.668 1.00 1.67 H ATOM 68 HB3 LEU A 5 5.755 6.249 2.742 1.00 1.67 H ATOM 69 HG LEU A 5 6.832 4.696 5.052 1.00 2.26 H ATOM 70 HD11 LEU A 5 7.382 7.621 4.569 1.00 3.10 H ATOM 71 HD12 LEU A 5 7.737 6.724 6.047 1.00 2.78 H ATOM 72 HD13 LEU A 5 8.586 6.333 4.551 1.00 2.69 H ATOM 73 HD21 LEU A 5 4.548 6.363 4.440 1.00 2.18 H ATOM 74 HD22 LEU A 5 4.813 5.274 5.803 1.00 2.25 H ATOM 75 HD23 LEU A 5 5.398 6.934 5.875 1.00 1.93 H ATOM 76 N PRO A 6 7.072 2.328 3.976 1.00 0.96 N ATOM 77 CA PRO A 6 8.121 1.350 4.276 1.00 1.54 C ATOM 78 C PRO A 6 7.911 0.048 3.520 1.00 2.01 C ATOM 79 O PRO A 6 7.050 -0.035 2.645 1.00 1.95 O ATOM 80 CB PRO A 6 7.998 1.127 5.795 1.00 2.00 C ATOM 81 CG PRO A 6 6.991 2.126 6.265 1.00 1.83 C ATOM 82 CD PRO A 6 6.121 2.399 5.080 1.00 1.07 C ATOM 83 HA PRO A 6 9.102 1.737 4.045 1.00 1.54 H ATOM 84 HB2 PRO A 6 7.667 0.116 5.984 1.00 2.42 H ATOM 85 HB3 PRO A 6 8.960 1.287 6.261 1.00 2.23 H ATOM 86 HG2 PRO A 6 6.408 1.712 7.074 1.00 2.24 H ATOM 87 HG3 PRO A 6 7.488 3.032 6.583 1.00 2.17 H ATOM 88 HD2 PRO A 6 5.361 1.639 4.984 1.00 0.98 H ATOM 89 HD3 PRO A 6 5.676 3.371 5.138 1.00 1.27 H ATOM 90 N GLY A 7 8.662 -0.974 3.891 1.00 2.70 N ATOM 91 CA GLY A 7 8.541 -2.249 3.228 1.00 3.34 C ATOM 92 C GLY A 7 7.965 -3.316 4.125 1.00 4.03 C ATOM 93 O GLY A 7 6.747 -3.486 4.193 1.00 4.79 O ATOM 94 H GLY A 7 9.309 -0.861 4.625 1.00 2.84 H ATOM 95 HA2 GLY A 7 7.901 -2.135 2.367 1.00 3.07 H ATOM 96 HA3 GLY A 7 9.519 -2.563 2.897 1.00 3.76 H ATOM 97 N GLY A 8 8.840 -4.036 4.812 1.00 4.04 N ATOM 98 CA GLY A 8 8.402 -5.113 5.682 1.00 4.78 C ATOM 99 C GLY A 8 7.693 -6.213 4.915 1.00 4.38 C ATOM 100 O GLY A 8 6.656 -6.718 5.347 1.00 4.63 O ATOM 101 H GLY A 8 9.801 -3.832 4.728 1.00 3.73 H ATOM 102 HA2 GLY A 8 9.263 -5.533 6.180 1.00 5.48 H ATOM 103 HA3 GLY A 8 7.728 -4.712 6.425 1.00 5.13 H ATOM 104 N GLY A 9 8.199 -6.506 3.725 1.00 3.95 N ATOM 105 CA GLY A 9 7.552 -7.469 2.857 1.00 3.48 C ATOM 106 C GLY A 9 7.010 -6.811 1.605 1.00 2.20 C ATOM 107 O GLY A 9 5.905 -7.123 1.159 1.00 2.33 O ATOM 108 H GLY A 9 8.990 -6.017 3.408 1.00 4.09 H ATOM 109 HA2 GLY A 9 8.267 -8.229 2.576 1.00 3.88 H ATOM 110 HA3 GLY A 9 6.736 -7.933 3.390 1.00 3.89 H ATOM 111 N GLY A 10 7.744 -5.830 1.095 1.00 1.34 N ATOM 112 CA GLY A 10 7.280 -5.074 -0.046 1.00 0.67 C ATOM 113 C GLY A 10 7.017 -3.630 0.321 1.00 0.58 C ATOM 114 O GLY A 10 7.931 -2.808 0.320 1.00 0.84 O ATOM 115 H GLY A 10 8.590 -5.582 1.531 1.00 1.76 H ATOM 116 HA2 GLY A 10 8.032 -5.113 -0.823 1.00 1.29 H ATOM 117 HA3 GLY A 10 6.367 -5.517 -0.415 1.00 1.20 H ATOM 118 N VAL A 11 5.796 -3.359 0.757 1.00 0.40 N ATOM 119 CA VAL A 11 5.405 -2.041 1.252 1.00 0.36 C ATOM 120 C VAL A 11 4.333 -2.176 2.296 1.00 0.46 C ATOM 121 O VAL A 11 3.472 -3.052 2.230 1.00 1.11 O ATOM 122 CB VAL A 11 4.875 -1.100 0.137 1.00 0.43 C ATOM 123 CG1 VAL A 11 6.022 -0.516 -0.678 1.00 0.61 C ATOM 124 CG2 VAL A 11 3.893 -1.832 -0.769 1.00 0.55 C ATOM 125 H VAL A 11 5.150 -4.093 0.827 1.00 0.59 H ATOM 126 HA VAL A 11 6.261 -1.563 1.725 1.00 0.45 H ATOM 127 HB VAL A 11 4.344 -0.278 0.613 1.00 0.46 H ATOM 128 HG11 VAL A 11 6.894 -1.142 -0.572 1.00 1.25 H ATOM 129 HG12 VAL A 11 5.736 -0.469 -1.719 1.00 1.24 H ATOM 130 HG13 VAL A 11 6.248 0.477 -0.321 1.00 1.14 H ATOM 131 HG21 VAL A 11 3.405 -2.618 -0.212 1.00 1.19 H ATOM 132 HG22 VAL A 11 3.151 -1.138 -1.132 1.00 1.14 H ATOM 133 HG23 VAL A 11 4.424 -2.261 -1.605 1.00 1.19 H ATOM 134 N CYS A 12 4.351 -1.230 3.194 1.00 0.33 N ATOM 135 CA CYS A 12 3.313 -1.073 4.176 1.00 0.28 C ATOM 136 C CYS A 12 1.998 -0.715 3.490 1.00 0.27 C ATOM 137 O CYS A 12 2.004 -0.088 2.430 1.00 0.54 O ATOM 138 CB CYS A 12 3.785 0.001 5.150 1.00 0.38 C ATOM 139 SG CYS A 12 2.499 1.052 5.834 1.00 0.40 S ATOM 140 H CYS A 12 5.038 -0.533 3.121 1.00 0.80 H ATOM 141 HA CYS A 12 3.198 -2.007 4.704 1.00 0.30 H ATOM 142 HB2 CYS A 12 4.298 -0.482 5.960 1.00 0.48 H ATOM 143 HB3 CYS A 12 4.490 0.637 4.631 1.00 0.44 H HETATM 144 N DBB A 13 0.888 -1.212 4.023 1.00 0.29 N HETATM 145 CA DBB A 13 -0.405 -1.010 3.379 1.00 0.29 C HETATM 146 C DBB A 13 -0.450 -1.729 2.043 1.00 0.29 C HETATM 147 O DBB A 13 -0.964 -1.193 1.067 1.00 0.29 O HETATM 148 CB DBB A 13 -1.587 -1.506 4.244 1.00 0.30 C HETATM 149 CG DBB A 13 -1.368 -1.175 5.715 1.00 0.42 C HETATM 150 H DBB A 13 0.947 -1.780 4.823 1.00 0.55 H HETATM 151 HA DBB A 13 -0.523 0.054 3.199 1.00 0.30 H HETATM 152 HB2 DBB A 13 -1.646 -2.584 4.146 1.00 0.41 H HETATM 153 HG1 DBB A 13 -0.720 -1.917 6.158 1.00 1.13 H HETATM 154 HG2 DBB A 13 -2.317 -1.175 6.229 1.00 1.03 H HETATM 155 HG3 DBB A 13 -0.911 -0.200 5.801 1.00 0.99 H ATOM 156 N LEU A 14 0.124 -2.921 1.992 1.00 0.32 N ATOM 157 CA LEU A 14 0.244 -3.653 0.754 1.00 0.35 C ATOM 158 C LEU A 14 -1.106 -4.194 0.281 1.00 0.30 C ATOM 159 O LEU A 14 -1.483 -5.329 0.577 1.00 0.38 O ATOM 160 CB LEU A 14 1.247 -4.791 0.938 1.00 0.45 C ATOM 161 CG LEU A 14 1.301 -5.789 -0.204 1.00 0.49 C ATOM 162 CD1 LEU A 14 1.804 -5.127 -1.478 1.00 0.51 C ATOM 163 CD2 LEU A 14 2.166 -6.983 0.164 1.00 0.63 C ATOM 164 H LEU A 14 0.544 -3.293 2.798 1.00 0.35 H ATOM 165 HA LEU A 14 0.623 -2.974 0.006 1.00 0.38 H ATOM 166 HB2 LEU A 14 2.232 -4.360 1.059 1.00 0.50 H ATOM 167 HB3 LEU A 14 0.991 -5.324 1.841 1.00 0.47 H ATOM 168 HG LEU A 14 0.299 -6.140 -0.382 1.00 0.44 H ATOM 169 HD11 LEU A 14 2.749 -4.643 -1.281 1.00 1.15 H ATOM 170 HD12 LEU A 14 1.935 -5.876 -2.246 1.00 1.08 H ATOM 171 HD13 LEU A 14 1.085 -4.393 -1.810 1.00 1.13 H ATOM 172 HD21 LEU A 14 2.485 -6.894 1.192 1.00 1.25 H ATOM 173 HD22 LEU A 14 1.596 -7.892 0.043 1.00 1.24 H ATOM 174 HD23 LEU A 14 3.034 -7.013 -0.479 1.00 1.14 H HETATM 175 N DBB A 15 -1.802 -3.381 -0.500 1.00 0.24 N HETATM 176 CA DBB A 15 -3.049 -3.789 -1.129 1.00 0.31 C HETATM 177 C DBB A 15 -4.225 -3.034 -0.540 1.00 0.21 C HETATM 178 O DBB A 15 -4.053 -1.935 -0.010 1.00 0.20 O HETATM 179 CB DBB A 15 -2.994 -3.545 -2.658 1.00 0.52 C HETATM 180 CG DBB A 15 -1.993 -4.509 -3.275 1.00 1.08 C HETATM 181 H DBB A 15 -1.451 -2.481 -0.681 1.00 0.28 H HETATM 182 HA DBB A 15 -3.184 -4.847 -0.958 1.00 0.40 H HETATM 183 HB2 DBB A 15 -3.968 -3.762 -3.071 1.00 0.51 H HETATM 184 HG1 DBB A 15 -1.566 -5.132 -2.503 1.00 1.37 H HETATM 185 HG2 DBB A 15 -1.205 -3.950 -3.762 1.00 1.71 H HETATM 186 HG3 DBB A 15 -2.493 -5.131 -4.004 1.00 1.62 H HETATM 187 N DHA A 16 -5.417 -3.618 -0.661 1.00 0.22 N HETATM 188 CA DHA A 16 -6.550 -2.987 -0.214 1.00 0.26 C HETATM 189 CB DHA A 16 -7.580 -2.827 -1.055 1.00 0.40 C HETATM 190 C DHA A 16 -6.654 -2.506 1.112 1.00 0.25 C HETATM 191 O DHA A 16 -7.418 -1.581 1.390 1.00 0.30 O HETATM 192 H DHA A 16 -5.434 -4.488 -1.124 1.00 0.28 H HETATM 193 HB1 DHA A 16 -7.509 -3.189 -2.069 1.00 0.45 H HETATM 194 HB2 DHA A 16 -8.482 -2.335 -0.719 1.00 0.51 H ATOM 195 N GLU A 17 -5.857 -3.074 2.007 1.00 0.25 N ATOM 196 CA GLU A 17 -5.827 -2.626 3.386 1.00 0.31 C ATOM 197 C GLU A 17 -5.421 -1.153 3.458 1.00 0.28 C ATOM 198 O GLU A 17 -6.046 -0.363 4.165 1.00 0.36 O ATOM 199 CB GLU A 17 -4.856 -3.489 4.200 1.00 0.38 C ATOM 200 CG GLU A 17 -4.829 -3.163 5.685 1.00 0.49 C ATOM 201 CD GLU A 17 -6.181 -3.323 6.348 1.00 1.43 C ATOM 202 OE1 GLU A 17 -6.792 -4.403 6.201 1.00 1.79 O ATOM 203 OE2 GLU A 17 -6.650 -2.365 6.997 1.00 2.36 O ATOM 204 H GLU A 17 -5.261 -3.806 1.724 1.00 0.26 H ATOM 205 HA GLU A 17 -6.822 -2.733 3.793 1.00 0.37 H ATOM 206 HB2 GLU A 17 -5.133 -4.526 4.090 1.00 0.40 H ATOM 207 HB3 GLU A 17 -3.858 -3.351 3.806 1.00 0.40 H ATOM 208 HG2 GLU A 17 -4.127 -3.824 6.171 1.00 0.85 H ATOM 209 HG3 GLU A 17 -4.504 -2.141 5.810 1.00 0.90 H ATOM 210 N CYS A 18 -4.455 -0.759 2.632 1.00 0.21 N ATOM 211 CA CYS A 18 -4.044 0.637 2.576 1.00 0.22 C ATOM 212 C CYS A 18 -3.961 1.155 1.142 1.00 0.24 C ATOM 213 O CYS A 18 -4.804 1.948 0.719 1.00 0.30 O ATOM 214 CB CYS A 18 -2.684 0.843 3.231 1.00 0.23 C ATOM 215 SG CYS A 18 -2.431 -0.014 4.804 1.00 0.27 S ATOM 216 H CYS A 18 -4.063 -1.403 2.005 1.00 0.19 H ATOM 217 HA CYS A 18 -4.780 1.218 3.112 1.00 0.28 H ATOM 218 HB2 CYS A 18 -1.940 0.502 2.538 1.00 0.25 H ATOM 219 HB3 CYS A 18 -2.538 1.897 3.394 1.00 0.29 H ATOM 220 N ILE A 19 -2.825 0.881 0.487 1.00 0.26 N ATOM 221 CA ILE A 19 -2.496 1.533 -0.772 1.00 0.34 C ATOM 222 C ILE A 19 -3.519 1.243 -1.871 1.00 0.40 C ATOM 223 O ILE A 19 -3.651 2.005 -2.824 1.00 0.56 O ATOM 224 CB ILE A 19 -1.094 1.152 -1.289 1.00 0.37 C ATOM 225 CG1 ILE A 19 -1.034 -0.316 -1.719 1.00 1.36 C ATOM 226 CG2 ILE A 19 -0.039 1.450 -0.235 1.00 1.21 C ATOM 227 CD1 ILE A 19 0.296 -0.720 -2.318 1.00 1.88 C ATOM 228 H ILE A 19 -2.124 0.366 0.938 1.00 0.28 H ATOM 229 HA ILE A 19 -2.486 2.586 -0.568 1.00 0.42 H ATOM 230 HB ILE A 19 -0.888 1.771 -2.141 1.00 1.17 H ATOM 231 HG12 ILE A 19 -1.213 -0.943 -0.859 1.00 2.01 H ATOM 232 HG13 ILE A 19 -1.801 -0.499 -2.458 1.00 1.86 H ATOM 233 HG21 ILE A 19 -0.210 2.434 0.179 1.00 1.77 H ATOM 234 HG22 ILE A 19 -0.100 0.715 0.554 1.00 1.82 H ATOM 235 HG23 ILE A 19 0.941 1.414 -0.686 1.00 1.59 H ATOM 236 HD11 ILE A 19 1.052 -0.007 -2.023 1.00 2.27 H ATOM 237 HD12 ILE A 19 0.567 -1.702 -1.961 1.00 2.43 H ATOM 238 HD13 ILE A 19 0.216 -0.735 -3.394 1.00 2.15 H HETATM 239 N TEE A 20 -4.174 0.099 -1.770 1.00 0.49 N HETATM 240 CB TEE A 20 -5.000 -1.561 -3.289 1.00 0.68 C HETATM 241 CA TEE A 20 -5.060 -0.263 -2.746 1.00 0.60 C HETATM 242 SG TEE A 20 -4.143 -3.008 -3.948 1.00 0.89 S HETATM 243 HN1 TEE A 20 -3.954 -0.465 -0.997 1.00 0.60 H HETATM 244 HB2 TEE A 20 -5.082 -2.421 -2.639 1.00 1.16 H HETATM 245 HA TEE A 20 -5.103 -1.166 -2.156 1.00 0.52 H TER 246 TEE A 20