ATOM 1 N CYS A 1 5.239 8.695 0.735 1.00 3.15 N ATOM 2 CA CYS A 1 4.110 8.268 -0.118 1.00 2.26 C ATOM 3 C CYS A 1 4.490 7.055 -0.959 1.00 1.98 C ATOM 4 O CYS A 1 5.654 6.900 -1.327 1.00 2.33 O ATOM 5 CB CYS A 1 3.674 9.432 -1.010 1.00 2.34 C ATOM 6 SG CYS A 1 2.332 8.994 -2.129 1.00 1.91 S ATOM 7 H1 CYS A 1 5.791 7.865 1.044 1.00 3.65 H ATOM 8 H2 CYS A 1 5.870 9.339 0.208 1.00 3.48 H ATOM 9 H3 CYS A 1 4.882 9.194 1.579 1.00 3.45 H ATOM 10 HA CYS A 1 3.288 7.995 0.528 1.00 2.29 H ATOM 11 HB2 CYS A 1 3.342 10.248 -0.384 1.00 2.87 H ATOM 12 HB3 CYS A 1 4.515 9.758 -1.601 1.00 2.72 H HETATM 13 N DBB A 2 3.530 6.159 -1.233 1.00 1.75 N HETATM 14 CA DBB A 2 2.133 6.298 -0.800 1.00 1.40 C HETATM 15 C DBB A 2 1.964 6.061 0.697 1.00 1.07 C HETATM 16 O DBB A 2 2.879 6.299 1.489 1.00 1.04 O HETATM 17 CB DBB A 2 1.542 7.677 -1.177 1.00 1.37 C HETATM 18 CG DBB A 2 0.842 7.601 -2.525 1.00 2.04 C HETATM 19 H DBB A 2 3.772 5.366 -1.761 1.00 2.09 H HETATM 20 HA DBB A 2 1.562 5.546 -1.320 1.00 1.56 H HETATM 21 HB2 DBB A 2 0.807 7.946 -0.433 1.00 1.20 H HETATM 22 HG1 DBB A 2 0.378 8.549 -2.746 1.00 2.44 H HETATM 23 HG2 DBB A 2 0.086 6.829 -2.495 1.00 2.43 H HETATM 24 HG3 DBB A 2 1.566 7.367 -3.291 1.00 2.55 H ATOM 25 N PHE A 3 0.806 5.537 1.072 1.00 0.92 N ATOM 26 CA PHE A 3 0.533 5.205 2.461 1.00 0.68 C ATOM 27 C PHE A 3 1.416 4.045 2.898 1.00 0.63 C ATOM 28 O PHE A 3 1.316 2.943 2.364 1.00 0.81 O ATOM 29 CB PHE A 3 -0.943 4.850 2.654 1.00 0.75 C ATOM 30 CG PHE A 3 -1.360 4.758 4.095 1.00 0.72 C ATOM 31 CD1 PHE A 3 -1.079 5.785 4.979 1.00 0.68 C ATOM 32 CD2 PHE A 3 -2.035 3.644 4.565 1.00 0.92 C ATOM 33 CE1 PHE A 3 -1.455 5.702 6.305 1.00 0.82 C ATOM 34 CE2 PHE A 3 -2.414 3.553 5.889 1.00 1.03 C ATOM 35 CZ PHE A 3 -2.136 4.590 6.757 1.00 0.98 C ATOM 36 H PHE A 3 0.133 5.318 0.387 1.00 1.06 H ATOM 37 HA PHE A 3 0.770 6.071 3.062 1.00 0.65 H ATOM 38 HB2 PHE A 3 -1.554 5.604 2.178 1.00 0.86 H ATOM 39 HB3 PHE A 3 -1.138 3.894 2.191 1.00 0.87 H ATOM 40 HD1 PHE A 3 -0.554 6.661 4.622 1.00 0.67 H ATOM 41 HD2 PHE A 3 -2.258 2.835 3.884 1.00 1.08 H ATOM 42 HE1 PHE A 3 -1.231 6.512 6.983 1.00 0.92 H ATOM 43 HE2 PHE A 3 -2.939 2.678 6.243 1.00 1.24 H ATOM 44 HZ PHE A 3 -2.440 4.527 7.792 1.00 1.15 H HETATM 45 N DBB A 4 2.357 4.339 3.773 1.00 0.58 N HETATM 46 CA DBB A 4 3.343 3.363 4.211 1.00 0.66 C HETATM 47 C DBB A 4 4.745 3.960 4.063 1.00 0.86 C HETATM 48 O DBB A 4 5.003 4.709 3.119 1.00 1.45 O HETATM 49 CB DBB A 4 3.101 2.922 5.682 1.00 0.60 C HETATM 50 CG DBB A 4 1.614 2.780 5.989 1.00 1.01 C HETATM 51 H DBB A 4 2.448 5.268 4.070 1.00 0.61 H HETATM 52 HA DBB A 4 3.263 2.492 3.565 1.00 0.76 H HETATM 53 HB2 DBB A 4 3.568 1.961 5.831 1.00 0.86 H HETATM 54 HG1 DBB A 4 1.490 2.247 6.919 1.00 1.36 H HETATM 55 HG2 DBB A 4 1.130 2.232 5.191 1.00 1.64 H HETATM 56 HG3 DBB A 4 1.170 3.761 6.075 1.00 1.60 H ATOM 57 N LEU A 5 5.624 3.695 5.021 1.00 0.75 N ATOM 58 CA LEU A 5 6.961 4.282 5.000 1.00 0.89 C ATOM 59 C LEU A 5 7.850 3.674 3.903 1.00 0.83 C ATOM 60 O LEU A 5 8.418 4.416 3.100 1.00 1.18 O ATOM 61 CB LEU A 5 7.630 4.156 6.371 1.00 1.24 C ATOM 62 CG LEU A 5 6.904 4.873 7.512 1.00 1.68 C ATOM 63 CD1 LEU A 5 7.624 4.637 8.827 1.00 2.45 C ATOM 64 CD2 LEU A 5 6.795 6.362 7.227 1.00 1.76 C ATOM 65 H LEU A 5 5.360 3.133 5.783 1.00 1.03 H ATOM 66 HA LEU A 5 6.841 5.332 4.782 1.00 1.33 H ATOM 67 HB2 LEU A 5 7.700 3.106 6.618 1.00 1.67 H ATOM 68 HB3 LEU A 5 8.629 4.559 6.299 1.00 1.67 H ATOM 69 HG LEU A 5 5.903 4.474 7.602 1.00 2.26 H ATOM 70 HD11 LEU A 5 8.232 3.747 8.748 1.00 2.78 H ATOM 71 HD12 LEU A 5 8.256 5.484 9.049 1.00 2.69 H ATOM 72 HD13 LEU A 5 6.899 4.507 9.617 1.00 3.10 H ATOM 73 HD21 LEU A 5 7.747 6.732 6.874 1.00 2.18 H ATOM 74 HD22 LEU A 5 6.041 6.531 6.473 1.00 2.25 H ATOM 75 HD23 LEU A 5 6.522 6.885 8.132 1.00 1.93 H ATOM 76 N PRO A 6 8.010 2.329 3.849 1.00 0.96 N ATOM 77 CA PRO A 6 8.857 1.685 2.838 1.00 1.54 C ATOM 78 C PRO A 6 8.369 1.956 1.418 1.00 2.01 C ATOM 79 O PRO A 6 7.164 2.049 1.174 1.00 1.95 O ATOM 80 CB PRO A 6 8.755 0.187 3.160 1.00 2.00 C ATOM 81 CG PRO A 6 7.525 0.053 3.988 1.00 1.83 C ATOM 82 CD PRO A 6 7.409 1.336 4.759 1.00 1.07 C ATOM 83 HA PRO A 6 9.887 2.004 2.925 1.00 1.54 H ATOM 84 HB2 PRO A 6 8.672 -0.376 2.242 1.00 2.42 H ATOM 85 HB3 PRO A 6 9.632 -0.128 3.704 1.00 2.23 H ATOM 86 HG2 PRO A 6 6.666 -0.083 3.348 1.00 2.24 H ATOM 87 HG3 PRO A 6 7.627 -0.784 4.663 1.00 2.17 H ATOM 88 HD2 PRO A 6 6.371 1.568 4.953 1.00 0.98 H ATOM 89 HD3 PRO A 6 7.964 1.277 5.685 1.00 1.27 H ATOM 90 N GLY A 7 9.308 2.105 0.496 1.00 2.70 N ATOM 91 CA GLY A 7 8.963 2.386 -0.883 1.00 3.34 C ATOM 92 C GLY A 7 9.649 1.446 -1.854 1.00 4.03 C ATOM 93 O GLY A 7 10.768 1.709 -2.294 1.00 4.79 O ATOM 94 H GLY A 7 10.254 2.034 0.759 1.00 2.84 H ATOM 95 HA2 GLY A 7 7.894 2.292 -1.000 1.00 3.07 H ATOM 96 HA3 GLY A 7 9.252 3.400 -1.115 1.00 3.76 H ATOM 97 N GLY A 8 8.990 0.347 -2.177 1.00 4.04 N ATOM 98 CA GLY A 8 9.550 -0.614 -3.105 1.00 4.78 C ATOM 99 C GLY A 8 8.661 -1.828 -3.240 1.00 4.38 C ATOM 100 O GLY A 8 7.469 -1.755 -2.945 1.00 4.63 O ATOM 101 H GLY A 8 8.101 0.189 -1.794 1.00 3.73 H ATOM 102 HA2 GLY A 8 9.663 -0.146 -4.072 1.00 5.48 H ATOM 103 HA3 GLY A 8 10.520 -0.927 -2.749 1.00 5.13 H ATOM 104 N GLY A 9 9.244 -2.949 -3.634 1.00 3.95 N ATOM 105 CA GLY A 9 8.490 -4.184 -3.733 1.00 3.48 C ATOM 106 C GLY A 9 8.190 -4.768 -2.371 1.00 2.20 C ATOM 107 O GLY A 9 9.042 -5.419 -1.765 1.00 2.33 O ATOM 108 H GLY A 9 10.210 -2.949 -3.827 1.00 4.09 H ATOM 109 HA2 GLY A 9 7.559 -3.987 -4.244 1.00 3.88 H ATOM 110 HA3 GLY A 9 9.058 -4.899 -4.302 1.00 3.89 H ATOM 111 N GLY A 10 7.027 -4.440 -1.839 1.00 1.34 N ATOM 112 CA GLY A 10 6.679 -4.860 -0.502 1.00 0.67 C ATOM 113 C GLY A 10 6.559 -3.675 0.423 1.00 0.58 C ATOM 114 O GLY A 10 7.499 -3.338 1.143 1.00 0.84 O ATOM 115 H GLY A 10 6.428 -3.832 -2.329 1.00 1.76 H ATOM 116 HA2 GLY A 10 5.734 -5.386 -0.530 1.00 1.29 H ATOM 117 HA3 GLY A 10 7.444 -5.524 -0.129 1.00 1.20 H ATOM 118 N VAL A 11 5.443 -2.977 0.326 1.00 0.40 N ATOM 119 CA VAL A 11 5.238 -1.761 1.096 1.00 0.36 C ATOM 120 C VAL A 11 4.215 -1.941 2.191 1.00 0.46 C ATOM 121 O VAL A 11 3.402 -2.868 2.181 1.00 1.11 O ATOM 122 CB VAL A 11 4.779 -0.576 0.215 1.00 0.43 C ATOM 123 CG1 VAL A 11 5.885 -0.155 -0.735 1.00 0.61 C ATOM 124 CG2 VAL A 11 3.515 -0.936 -0.558 1.00 0.55 C ATOM 125 H VAL A 11 4.771 -3.244 -0.338 1.00 0.59 H ATOM 126 HA VAL A 11 6.176 -1.489 1.559 1.00 0.45 H ATOM 127 HB VAL A 11 4.550 0.264 0.866 1.00 0.46 H ATOM 128 HG11 VAL A 11 6.387 -1.033 -1.114 1.00 1.24 H ATOM 129 HG12 VAL A 11 5.458 0.398 -1.559 1.00 1.14 H ATOM 130 HG13 VAL A 11 6.593 0.468 -0.209 1.00 1.25 H ATOM 131 HG21 VAL A 11 2.866 -1.530 0.068 1.00 1.19 H ATOM 132 HG22 VAL A 11 3.002 -0.031 -0.850 1.00 1.19 H ATOM 133 HG23 VAL A 11 3.781 -1.500 -1.440 1.00 1.14 H ATOM 134 N CYS A 12 4.213 -0.957 3.055 1.00 0.33 N ATOM 135 CA CYS A 12 3.224 -0.808 4.088 1.00 0.28 C ATOM 136 C CYS A 12 1.871 -0.499 3.452 1.00 0.27 C ATOM 137 O CYS A 12 1.814 0.178 2.428 1.00 0.54 O ATOM 138 CB CYS A 12 3.701 0.328 4.983 1.00 0.38 C ATOM 139 SG CYS A 12 2.408 1.259 5.816 1.00 0.40 S ATOM 140 H CYS A 12 4.840 -0.222 2.913 1.00 0.80 H ATOM 141 HA CYS A 12 3.164 -1.725 4.656 1.00 0.30 H ATOM 142 HB2 CYS A 12 4.356 -0.088 5.731 1.00 0.48 H ATOM 143 HB3 CYS A 12 4.271 1.018 4.379 1.00 0.44 H HETATM 144 N DBB A 13 0.806 -1.101 3.967 1.00 0.29 N HETATM 145 CA DBB A 13 -0.502 -0.957 3.345 1.00 0.29 C HETATM 146 C DBB A 13 -0.545 -1.719 2.030 1.00 0.29 C HETATM 147 O DBB A 13 -1.068 -1.225 1.031 1.00 0.29 O HETATM 148 CB DBB A 13 -1.647 -1.466 4.251 1.00 0.30 C HETATM 149 CG DBB A 13 -1.424 -1.042 5.695 1.00 0.42 C HETATM 150 H DBB A 13 0.921 -1.733 4.713 1.00 0.55 H HETATM 151 HA DBB A 13 -0.658 0.098 3.139 1.00 0.30 H HETATM 152 HB2 DBB A 13 -1.655 -2.545 4.214 1.00 0.41 H HETATM 153 HG1 DBB A 13 -0.564 -1.561 6.096 1.00 1.13 H HETATM 154 HG2 DBB A 13 -2.298 -1.288 6.281 1.00 1.03 H HETATM 155 HG3 DBB A 13 -1.250 0.024 5.736 1.00 0.99 H ATOM 156 N LEU A 14 0.043 -2.903 2.027 1.00 0.32 N ATOM 157 CA LEU A 14 0.148 -3.707 0.832 1.00 0.35 C ATOM 158 C LEU A 14 -1.200 -4.311 0.439 1.00 0.30 C ATOM 159 O LEU A 14 -1.585 -5.380 0.918 1.00 0.38 O ATOM 160 CB LEU A 14 1.178 -4.813 1.059 1.00 0.45 C ATOM 161 CG LEU A 14 1.210 -5.894 -0.014 1.00 0.49 C ATOM 162 CD1 LEU A 14 1.726 -5.336 -1.333 1.00 0.51 C ATOM 163 CD2 LEU A 14 2.050 -7.075 0.445 1.00 0.63 C ATOM 164 H LEU A 14 0.456 -3.234 2.848 1.00 0.35 H ATOM 165 HA LEU A 14 0.491 -3.068 0.032 1.00 0.38 H ATOM 166 HB2 LEU A 14 2.159 -4.359 1.112 1.00 0.50 H ATOM 167 HB3 LEU A 14 0.967 -5.284 2.007 1.00 0.47 H ATOM 168 HG LEU A 14 0.202 -6.238 -0.169 1.00 0.44 H ATOM 169 HD11 LEU A 14 1.281 -4.368 -1.513 1.00 1.15 H ATOM 170 HD12 LEU A 14 2.800 -5.236 -1.287 1.00 1.08 H ATOM 171 HD13 LEU A 14 1.462 -6.009 -2.137 1.00 1.13 H ATOM 172 HD21 LEU A 14 2.689 -6.768 1.260 1.00 1.14 H ATOM 173 HD22 LEU A 14 1.400 -7.871 0.776 1.00 1.25 H ATOM 174 HD23 LEU A 14 2.656 -7.425 -0.376 1.00 1.24 H HETATM 175 N DBB A 15 -1.905 -3.625 -0.447 1.00 0.24 N HETATM 176 CA DBB A 15 -3.162 -4.128 -0.974 1.00 0.31 C HETATM 177 C DBB A 15 -4.326 -3.256 -0.544 1.00 0.21 C HETATM 178 O DBB A 15 -4.124 -2.155 -0.025 1.00 0.20 O HETATM 179 CB DBB A 15 -3.113 -4.236 -2.514 1.00 0.52 C HETATM 180 CG DBB A 15 -2.339 -5.490 -2.886 1.00 1.08 C HETATM 181 H DBB A 15 -1.565 -2.758 -0.759 1.00 0.28 H HETATM 182 HA DBB A 15 -3.314 -5.121 -0.575 1.00 0.40 H HETATM 183 HB2 DBB A 15 -4.125 -4.344 -2.879 1.00 0.51 H HETATM 184 HG1 DBB A 15 -3.023 -6.232 -3.271 1.00 1.37 H HETATM 185 HG2 DBB A 15 -1.841 -5.880 -2.011 1.00 1.71 H HETATM 186 HG3 DBB A 15 -1.606 -5.250 -3.642 1.00 1.62 H HETATM 187 N DHA A 16 -5.534 -3.794 -0.678 1.00 0.22 N HETATM 188 CA DHA A 16 -6.653 -3.104 -0.289 1.00 0.26 C HETATM 189 CB DHA A 16 -7.630 -2.895 -1.173 1.00 0.40 C HETATM 190 C DHA A 16 -6.786 -2.609 1.029 1.00 0.25 C HETATM 191 O DHA A 16 -7.561 -1.686 1.281 1.00 0.30 O HETATM 192 H DHA A 16 -5.569 -4.706 -1.053 1.00 0.28 H HETATM 193 HB1 DHA A 16 -7.535 -3.271 -2.181 1.00 0.45 H HETATM 194 HB2 DHA A 16 -8.514 -2.349 -0.880 1.00 0.51 H ATOM 195 N GLU A 17 -5.997 -3.169 1.938 1.00 0.25 N ATOM 196 CA GLU A 17 -5.964 -2.716 3.320 1.00 0.31 C ATOM 197 C GLU A 17 -5.548 -1.246 3.391 1.00 0.28 C ATOM 198 O GLU A 17 -6.016 -0.497 4.251 1.00 0.36 O ATOM 199 CB GLU A 17 -4.983 -3.574 4.123 1.00 0.38 C ATOM 200 CG GLU A 17 -5.005 -3.313 5.619 1.00 0.49 C ATOM 201 CD GLU A 17 -6.298 -3.752 6.274 1.00 1.43 C ATOM 202 OE1 GLU A 17 -7.351 -3.131 6.014 1.00 2.36 O ATOM 203 OE2 GLU A 17 -6.269 -4.732 7.047 1.00 1.79 O ATOM 204 H GLU A 17 -5.392 -3.895 1.660 1.00 0.26 H ATOM 205 HA GLU A 17 -6.956 -2.824 3.733 1.00 0.37 H ATOM 206 HB2 GLU A 17 -5.219 -4.616 3.961 1.00 0.40 H ATOM 207 HB3 GLU A 17 -3.982 -3.384 3.764 1.00 0.40 H ATOM 208 HG2 GLU A 17 -4.189 -3.849 6.078 1.00 0.85 H ATOM 209 HG3 GLU A 17 -4.877 -2.253 5.790 1.00 0.90 H ATOM 210 N CYS A 18 -4.698 -0.829 2.458 1.00 0.21 N ATOM 211 CA CYS A 18 -4.242 0.551 2.407 1.00 0.22 C ATOM 212 C CYS A 18 -4.079 1.041 0.973 1.00 0.24 C ATOM 213 O CYS A 18 -4.895 1.817 0.473 1.00 0.30 O ATOM 214 CB CYS A 18 -2.893 0.701 3.089 1.00 0.23 C ATOM 215 SG CYS A 18 -2.732 -0.097 4.697 1.00 0.27 S ATOM 216 H CYS A 18 -4.401 -1.460 1.765 1.00 0.19 H ATOM 217 HA CYS A 18 -4.966 1.168 2.913 1.00 0.28 H ATOM 218 HB2 CYS A 18 -2.155 0.277 2.430 1.00 0.25 H ATOM 219 HB3 CYS A 18 -2.680 1.749 3.209 1.00 0.29 H ATOM 220 N ILE A 19 -2.900 0.763 0.413 1.00 0.26 N ATOM 221 CA ILE A 19 -2.482 1.363 -0.841 1.00 0.34 C ATOM 222 C ILE A 19 -3.383 0.916 -1.996 1.00 0.40 C ATOM 223 O ILE A 19 -3.642 1.674 -2.930 1.00 0.56 O ATOM 224 CB ILE A 19 -0.987 1.048 -1.144 1.00 0.37 C ATOM 225 CG1 ILE A 19 -0.314 2.209 -1.888 1.00 1.36 C ATOM 226 CG2 ILE A 19 -0.823 -0.250 -1.928 1.00 1.21 C ATOM 227 CD1 ILE A 19 -0.706 2.325 -3.341 1.00 1.88 C ATOM 228 H ILE A 19 -2.235 0.259 0.936 1.00 0.28 H ATOM 229 HA ILE A 19 -2.571 2.426 -0.713 1.00 0.42 H ATOM 230 HB ILE A 19 -0.488 0.918 -0.205 1.00 1.17 H ATOM 231 HG12 ILE A 19 -0.575 3.138 -1.403 1.00 2.01 H ATOM 232 HG13 ILE A 19 0.757 2.077 -1.845 1.00 1.86 H ATOM 233 HG21 ILE A 19 -1.795 -0.660 -2.156 1.00 1.59 H ATOM 234 HG22 ILE A 19 -0.292 -0.050 -2.846 1.00 1.77 H ATOM 235 HG23 ILE A 19 -0.263 -0.959 -1.336 1.00 1.82 H ATOM 236 HD11 ILE A 19 -1.664 1.850 -3.486 1.00 2.27 H ATOM 237 HD12 ILE A 19 -0.773 3.365 -3.617 1.00 2.43 H ATOM 238 HD13 ILE A 19 0.035 1.834 -3.950 1.00 2.15 H HETATM 239 N TEE A 20 -3.897 -0.300 -1.892 1.00 0.49 N HETATM 240 CB TEE A 20 -4.226 -1.830 -3.696 1.00 0.68 C HETATM 241 CA TEE A 20 -4.704 -0.790 -2.879 1.00 0.60 C HETATM 242 SG TEE A 20 -2.865 -3.012 -3.821 1.00 0.89 S HETATM 243 HN1 TEE A 20 -3.670 -0.807 -1.080 1.00 0.60 H HETATM 244 HB2 TEE A 20 -4.406 -1.807 -4.759 1.00 1.16 H HETATM 245 HA TEE A 20 -5.057 -1.706 -2.427 1.00 0.52 H TER 246 TEE A 20