ATOM 1 N CYS A 1 5.526 7.035 -0.862 1.00 3.15 N ATOM 2 CA CYS A 1 4.261 6.580 -1.477 1.00 2.26 C ATOM 3 C CYS A 1 4.368 5.127 -1.917 1.00 1.98 C ATOM 4 O CYS A 1 5.457 4.673 -2.273 1.00 2.33 O ATOM 5 CB CYS A 1 3.920 7.469 -2.670 1.00 2.34 C ATOM 6 SG CYS A 1 2.438 6.928 -3.535 1.00 1.91 S ATOM 7 H1 CYS A 1 5.839 6.343 -0.146 1.00 3.65 H ATOM 8 H2 CYS A 1 6.269 7.120 -1.589 1.00 3.48 H ATOM 9 H3 CYS A 1 5.393 7.960 -0.401 1.00 3.45 H ATOM 10 HA CYS A 1 3.476 6.663 -0.738 1.00 2.29 H ATOM 11 HB2 CYS A 1 3.764 8.480 -2.323 1.00 2.87 H ATOM 12 HB3 CYS A 1 4.745 7.455 -3.366 1.00 2.72 H HETATM 13 N DBB A 2 3.263 4.371 -1.863 1.00 1.75 N HETATM 14 CA DBB A 2 1.951 4.870 -1.423 1.00 1.40 C HETATM 15 C DBB A 2 1.904 5.092 0.091 1.00 1.07 C HETATM 16 O DBB A 2 2.930 5.343 0.726 1.00 1.04 O HETATM 17 CB DBB A 2 1.543 6.168 -2.162 1.00 1.37 C HETATM 18 CG DBB A 2 0.407 5.893 -3.136 1.00 2.04 C HETATM 19 H DBB A 2 3.333 3.433 -2.135 1.00 2.09 H HETATM 20 HA DBB A 2 1.224 4.111 -1.671 1.00 1.56 H HETATM 21 HB2 DBB A 2 1.193 6.879 -1.429 1.00 1.20 H HETATM 22 HG1 DBB A 2 -0.235 5.120 -2.736 1.00 2.44 H HETATM 23 HG2 DBB A 2 0.815 5.567 -4.082 1.00 2.43 H HETATM 24 HG3 DBB A 2 -0.168 6.796 -3.284 1.00 2.55 H ATOM 25 N PHE A 3 0.720 4.899 0.664 1.00 0.92 N ATOM 26 CA PHE A 3 0.540 4.968 2.110 1.00 0.68 C ATOM 27 C PHE A 3 1.351 3.876 2.794 1.00 0.63 C ATOM 28 O PHE A 3 1.051 2.695 2.657 1.00 0.81 O ATOM 29 CB PHE A 3 -0.943 4.826 2.468 1.00 0.75 C ATOM 30 CG PHE A 3 -1.209 4.838 3.947 1.00 0.72 C ATOM 31 CD1 PHE A 3 -0.857 5.932 4.720 1.00 0.68 C ATOM 32 CD2 PHE A 3 -1.811 3.753 4.561 1.00 0.92 C ATOM 33 CE1 PHE A 3 -1.102 5.940 6.079 1.00 0.82 C ATOM 34 CE2 PHE A 3 -2.055 3.756 5.920 1.00 1.03 C ATOM 35 CZ PHE A 3 -1.700 4.850 6.679 1.00 0.98 C ATOM 36 H PHE A 3 -0.034 4.624 0.109 1.00 1.06 H ATOM 37 HA PHE A 3 0.895 5.931 2.444 1.00 0.65 H ATOM 38 HB2 PHE A 3 -1.494 5.642 2.024 1.00 0.86 H ATOM 39 HB3 PHE A 3 -1.313 3.891 2.069 1.00 0.87 H ATOM 40 HD1 PHE A 3 -0.390 6.785 4.251 1.00 0.67 H ATOM 41 HD2 PHE A 3 -2.088 2.896 3.968 1.00 1.08 H ATOM 42 HE1 PHE A 3 -0.823 6.798 6.671 1.00 0.92 H ATOM 43 HE2 PHE A 3 -2.525 2.902 6.386 1.00 1.24 H ATOM 44 HZ PHE A 3 -1.889 4.855 7.742 1.00 1.15 H HETATM 45 N DBB A 4 2.433 4.275 3.436 1.00 0.58 N HETATM 46 CA DBB A 4 3.365 3.336 4.035 1.00 0.66 C HETATM 47 C DBB A 4 4.770 3.941 4.040 1.00 0.86 C HETATM 48 O DBB A 4 5.086 4.764 3.179 1.00 1.45 O HETATM 49 CB DBB A 4 2.942 2.936 5.474 1.00 0.60 C HETATM 50 CG DBB A 4 2.376 4.126 6.236 1.00 1.01 C HETATM 51 H DBB A 4 2.660 5.233 3.436 1.00 0.61 H HETATM 52 HA DBB A 4 3.377 2.442 3.417 1.00 0.76 H HETATM 53 HB2 DBB A 4 2.172 2.182 5.402 1.00 0.86 H HETATM 54 HG1 DBB A 4 3.088 4.936 6.219 1.00 1.36 H HETATM 55 HG2 DBB A 4 2.183 3.838 7.260 1.00 1.64 H HETATM 56 HG3 DBB A 4 1.456 4.446 5.772 1.00 1.60 H ATOM 57 N LEU A 5 5.607 3.552 5.000 1.00 0.75 N ATOM 58 CA LEU A 5 6.971 4.075 5.075 1.00 0.89 C ATOM 59 C LEU A 5 7.835 3.593 3.897 1.00 0.83 C ATOM 60 O LEU A 5 8.441 4.413 3.206 1.00 1.18 O ATOM 61 CB LEU A 5 7.632 3.702 6.408 1.00 1.24 C ATOM 62 CG LEU A 5 6.963 4.288 7.652 1.00 1.68 C ATOM 63 CD1 LEU A 5 7.650 3.785 8.910 1.00 2.45 C ATOM 64 CD2 LEU A 5 6.984 5.807 7.606 1.00 1.76 C ATOM 65 H LEU A 5 5.304 2.903 5.675 1.00 1.03 H ATOM 66 HA LEU A 5 6.901 5.153 5.019 1.00 1.33 H ATOM 67 HB2 LEU A 5 7.629 2.625 6.497 1.00 1.67 H ATOM 68 HB3 LEU A 5 8.656 4.042 6.384 1.00 1.67 H ATOM 69 HG LEU A 5 5.932 3.967 7.684 1.00 2.26 H ATOM 70 HD11 LEU A 5 8.377 3.034 8.646 1.00 2.69 H ATOM 71 HD12 LEU A 5 8.145 4.609 9.404 1.00 3.10 H ATOM 72 HD13 LEU A 5 6.914 3.358 9.575 1.00 2.78 H ATOM 73 HD21 LEU A 5 7.641 6.133 6.814 1.00 2.25 H ATOM 74 HD22 LEU A 5 5.985 6.175 7.420 1.00 1.93 H ATOM 75 HD23 LEU A 5 7.339 6.190 8.550 1.00 2.18 H ATOM 76 N PRO A 6 7.922 2.264 3.644 1.00 0.96 N ATOM 77 CA PRO A 6 8.733 1.734 2.541 1.00 1.54 C ATOM 78 C PRO A 6 8.203 2.156 1.172 1.00 2.01 C ATOM 79 O PRO A 6 7.007 2.393 1.005 1.00 1.95 O ATOM 80 CB PRO A 6 8.637 0.215 2.708 1.00 2.00 C ATOM 81 CG PRO A 6 7.396 -0.007 3.497 1.00 1.83 C ATOM 82 CD PRO A 6 7.258 1.184 4.398 1.00 1.07 C ATOM 83 HA PRO A 6 9.764 2.042 2.631 1.00 1.54 H ATOM 84 HB2 PRO A 6 8.576 -0.253 1.737 1.00 2.42 H ATOM 85 HB3 PRO A 6 9.508 -0.147 3.234 1.00 2.23 H ATOM 86 HG2 PRO A 6 6.548 -0.074 2.832 1.00 2.24 H ATOM 87 HG3 PRO A 6 7.489 -0.911 4.080 1.00 2.17 H ATOM 88 HD2 PRO A 6 6.215 1.412 4.564 1.00 0.98 H ATOM 89 HD3 PRO A 6 7.760 1.005 5.337 1.00 1.27 H ATOM 90 N GLY A 7 9.100 2.256 0.199 1.00 2.70 N ATOM 91 CA GLY A 7 8.709 2.647 -1.141 1.00 3.34 C ATOM 92 C GLY A 7 9.198 1.669 -2.191 1.00 4.03 C ATOM 93 O GLY A 7 9.485 2.057 -3.325 1.00 4.79 O ATOM 94 H GLY A 7 10.044 2.056 0.389 1.00 2.84 H ATOM 95 HA2 GLY A 7 7.630 2.701 -1.190 1.00 3.07 H ATOM 96 HA3 GLY A 7 9.117 3.623 -1.355 1.00 3.76 H ATOM 97 N GLY A 8 9.322 0.408 -1.806 1.00 4.04 N ATOM 98 CA GLY A 8 9.795 -0.610 -2.723 1.00 4.78 C ATOM 99 C GLY A 8 8.747 -1.667 -3.000 1.00 4.38 C ATOM 100 O GLY A 8 7.581 -1.346 -3.223 1.00 4.63 O ATOM 101 H GLY A 8 9.097 0.162 -0.882 1.00 3.73 H ATOM 102 HA2 GLY A 8 10.072 -0.140 -3.655 1.00 5.48 H ATOM 103 HA3 GLY A 8 10.667 -1.086 -2.298 1.00 5.13 H ATOM 104 N GLY A 9 9.168 -2.923 -3.000 1.00 3.95 N ATOM 105 CA GLY A 9 8.253 -4.021 -3.247 1.00 3.48 C ATOM 106 C GLY A 9 7.294 -4.248 -2.093 1.00 2.20 C ATOM 107 O GLY A 9 6.173 -3.735 -2.094 1.00 2.33 O ATOM 108 H GLY A 9 10.117 -3.109 -2.822 1.00 4.09 H ATOM 109 HA2 GLY A 9 7.683 -3.807 -4.138 1.00 3.88 H ATOM 110 HA3 GLY A 9 8.825 -4.924 -3.408 1.00 3.89 H ATOM 111 N GLY A 10 7.740 -5.012 -1.102 1.00 1.34 N ATOM 112 CA GLY A 10 6.925 -5.272 0.072 1.00 0.67 C ATOM 113 C GLY A 10 6.779 -4.043 0.945 1.00 0.58 C ATOM 114 O GLY A 10 7.652 -3.744 1.762 1.00 0.84 O ATOM 115 H GLY A 10 8.649 -5.383 -1.155 1.00 1.76 H ATOM 116 HA2 GLY A 10 5.946 -5.594 -0.245 1.00 1.29 H ATOM 117 HA3 GLY A 10 7.385 -6.059 0.651 1.00 1.20 H ATOM 118 N VAL A 11 5.720 -3.285 0.712 1.00 0.40 N ATOM 119 CA VAL A 11 5.516 -2.031 1.418 1.00 0.36 C ATOM 120 C VAL A 11 4.414 -2.126 2.444 1.00 0.46 C ATOM 121 O VAL A 11 3.792 -3.172 2.644 1.00 1.11 O ATOM 122 CB VAL A 11 5.174 -0.873 0.456 1.00 0.43 C ATOM 123 CG1 VAL A 11 6.366 -0.531 -0.417 1.00 0.61 C ATOM 124 CG2 VAL A 11 3.965 -1.224 -0.401 1.00 0.55 C ATOM 125 H VAL A 11 5.103 -3.535 -0.010 1.00 0.59 H ATOM 126 HA VAL A 11 6.431 -1.779 1.932 1.00 0.45 H ATOM 127 HB VAL A 11 4.926 0.003 1.050 1.00 0.46 H ATOM 128 HG11 VAL A 11 6.970 -1.414 -0.562 1.00 1.14 H ATOM 129 HG12 VAL A 11 6.019 -0.171 -1.374 1.00 1.25 H ATOM 130 HG13 VAL A 11 6.956 0.235 0.065 1.00 1.24 H ATOM 131 HG21 VAL A 11 3.260 -1.791 0.188 1.00 1.14 H ATOM 132 HG22 VAL A 11 3.495 -0.316 -0.750 1.00 1.19 H ATOM 133 HG23 VAL A 11 4.285 -1.814 -1.249 1.00 1.19 H ATOM 134 N CYS A 12 4.170 -0.991 3.055 1.00 0.33 N ATOM 135 CA CYS A 12 3.121 -0.821 4.019 1.00 0.28 C ATOM 136 C CYS A 12 1.820 -0.515 3.298 1.00 0.27 C ATOM 137 O CYS A 12 1.836 0.106 2.234 1.00 0.54 O ATOM 138 CB CYS A 12 3.549 0.311 4.945 1.00 0.38 C ATOM 139 SG CYS A 12 2.216 1.290 5.653 1.00 0.40 S ATOM 140 H CYS A 12 4.685 -0.201 2.791 1.00 0.80 H ATOM 141 HA CYS A 12 3.018 -1.736 4.585 1.00 0.30 H ATOM 142 HB2 CYS A 12 4.118 -0.118 5.753 1.00 0.48 H ATOM 143 HB3 CYS A 12 4.195 0.975 4.392 1.00 0.44 H HETATM 144 N DBB A 13 0.721 -1.056 3.803 1.00 0.29 N HETATM 145 CA DBB A 13 -0.572 -0.907 3.146 1.00 0.29 C HETATM 146 C DBB A 13 -0.556 -1.537 1.763 1.00 0.29 C HETATM 147 O DBB A 13 -1.227 -1.059 0.855 1.00 0.29 O HETATM 148 CB DBB A 13 -1.713 -1.552 3.959 1.00 0.30 C HETATM 149 CG DBB A 13 -1.551 -1.258 5.445 1.00 0.42 C HETATM 150 H DBB A 13 0.788 -1.614 4.610 1.00 0.55 H HETATM 151 HA DBB A 13 -0.772 0.154 3.037 1.00 0.30 H HETATM 152 HB2 DBB A 13 -1.657 -2.625 3.815 1.00 0.41 H HETATM 153 HG1 DBB A 13 -0.877 -1.980 5.883 1.00 1.13 H HETATM 154 HG2 DBB A 13 -2.514 -1.324 5.931 1.00 1.03 H HETATM 155 HG3 DBB A 13 -1.148 -0.262 5.574 1.00 0.99 H ATOM 156 N LEU A 14 0.207 -2.606 1.610 1.00 0.32 N ATOM 157 CA LEU A 14 0.357 -3.259 0.330 1.00 0.35 C ATOM 158 C LEU A 14 -0.908 -4.024 -0.056 1.00 0.30 C ATOM 159 O LEU A 14 -1.050 -5.212 0.238 1.00 0.38 O ATOM 160 CB LEU A 14 1.568 -4.193 0.380 1.00 0.45 C ATOM 161 CG LEU A 14 1.683 -5.163 -0.787 1.00 0.49 C ATOM 162 CD1 LEU A 14 1.945 -4.422 -2.090 1.00 0.51 C ATOM 163 CD2 LEU A 14 2.774 -6.192 -0.524 1.00 0.63 C ATOM 164 H LEU A 14 0.697 -2.964 2.382 1.00 0.35 H ATOM 165 HA LEU A 14 0.537 -2.494 -0.408 1.00 0.38 H ATOM 166 HB2 LEU A 14 2.460 -3.586 0.406 1.00 0.50 H ATOM 167 HB3 LEU A 14 1.516 -4.767 1.293 1.00 0.47 H ATOM 168 HG LEU A 14 0.743 -5.684 -0.878 1.00 0.44 H ATOM 169 HD11 LEU A 14 1.506 -3.436 -2.038 1.00 1.13 H ATOM 170 HD12 LEU A 14 3.009 -4.334 -2.245 1.00 1.15 H ATOM 171 HD13 LEU A 14 1.505 -4.971 -2.911 1.00 1.08 H ATOM 172 HD21 LEU A 14 2.672 -6.576 0.482 1.00 1.14 H ATOM 173 HD22 LEU A 14 2.680 -7.004 -1.231 1.00 1.25 H ATOM 174 HD23 LEU A 14 3.740 -5.727 -0.637 1.00 1.24 H HETATM 175 N DBB A 15 -1.830 -3.326 -0.699 1.00 0.24 N HETATM 176 CA DBB A 15 -3.067 -3.937 -1.154 1.00 0.31 C HETATM 177 C DBB A 15 -4.273 -3.211 -0.586 1.00 0.21 C HETATM 178 O DBB A 15 -4.148 -2.091 -0.085 1.00 0.20 O HETATM 179 CB DBB A 15 -3.150 -3.955 -2.696 1.00 0.52 C HETATM 180 CG DBB A 15 -2.333 -5.129 -3.208 1.00 1.08 C HETATM 181 H DBB A 15 -1.692 -2.363 -0.841 1.00 0.28 H HETATM 182 HA DBB A 15 -3.079 -4.960 -0.804 1.00 0.40 H HETATM 183 HB2 DBB A 15 -4.180 -4.113 -2.977 1.00 0.51 H HETATM 184 HG1 DBB A 15 -1.281 -4.897 -3.133 1.00 1.37 H HETATM 185 HG2 DBB A 15 -2.586 -5.320 -4.239 1.00 1.71 H HETATM 186 HG3 DBB A 15 -2.551 -6.005 -2.615 1.00 1.62 H HETATM 187 N DHA A 16 -5.422 -3.878 -0.622 1.00 0.22 N HETATM 188 CA DHA A 16 -6.578 -3.305 -0.151 1.00 0.26 C HETATM 189 CB DHA A 16 -7.639 -3.221 -0.964 1.00 0.40 C HETATM 190 C DHA A 16 -6.676 -2.797 1.169 1.00 0.25 C HETATM 191 O DHA A 16 -7.519 -1.941 1.454 1.00 0.30 O HETATM 192 H DHA A 16 -5.389 -4.790 -0.999 1.00 0.28 H HETATM 193 HB1 DHA A 16 -7.578 -3.603 -1.973 1.00 0.45 H HETATM 194 HB2 DHA A 16 -8.556 -2.775 -0.611 1.00 0.51 H ATOM 195 N GLU A 17 -5.820 -3.289 2.054 1.00 0.25 N ATOM 196 CA GLU A 17 -5.808 -2.850 3.442 1.00 0.31 C ATOM 197 C GLU A 17 -5.466 -1.362 3.538 1.00 0.28 C ATOM 198 O GLU A 17 -5.968 -0.654 4.413 1.00 0.36 O ATOM 199 CB GLU A 17 -4.809 -3.686 4.245 1.00 0.38 C ATOM 200 CG GLU A 17 -4.893 -3.473 5.746 1.00 0.49 C ATOM 201 CD GLU A 17 -3.960 -4.386 6.516 1.00 1.43 C ATOM 202 OE1 GLU A 17 -4.070 -5.623 6.367 1.00 1.79 O ATOM 203 OE2 GLU A 17 -3.098 -3.873 7.259 1.00 2.36 O ATOM 204 H GLU A 17 -5.178 -3.980 1.764 1.00 0.26 H ATOM 205 HA GLU A 17 -6.799 -3.005 3.846 1.00 0.37 H ATOM 206 HB2 GLU A 17 -4.991 -4.730 4.041 1.00 0.40 H ATOM 207 HB3 GLU A 17 -3.810 -3.435 3.923 1.00 0.40 H ATOM 208 HG2 GLU A 17 -4.634 -2.449 5.967 1.00 0.85 H ATOM 209 HG3 GLU A 17 -5.906 -3.665 6.065 1.00 0.90 H ATOM 210 N CYS A 18 -4.662 -0.873 2.601 1.00 0.21 N ATOM 211 CA CYS A 18 -4.325 0.544 2.573 1.00 0.22 C ATOM 212 C CYS A 18 -4.328 1.107 1.160 1.00 0.24 C ATOM 213 O CYS A 18 -5.222 1.873 0.798 1.00 0.30 O ATOM 214 CB CYS A 18 -2.954 0.800 3.170 1.00 0.23 C ATOM 215 SG CYS A 18 -2.581 -0.137 4.665 1.00 0.27 S ATOM 216 H CYS A 18 -4.333 -1.464 1.889 1.00 0.19 H ATOM 217 HA CYS A 18 -5.063 1.070 3.158 1.00 0.28 H ATOM 218 HB2 CYS A 18 -2.225 0.551 2.420 1.00 0.25 H ATOM 219 HB3 CYS A 18 -2.868 1.848 3.397 1.00 0.29 H ATOM 220 N ILE A 19 -3.201 0.927 0.464 1.00 0.26 N ATOM 221 CA ILE A 19 -2.968 1.629 -0.783 1.00 0.34 C ATOM 222 C ILE A 19 -3.925 1.175 -1.881 1.00 0.40 C ATOM 223 O ILE A 19 -4.199 1.912 -2.828 1.00 0.56 O ATOM 224 CB ILE A 19 -1.518 1.478 -1.293 1.00 0.37 C ATOM 225 CG1 ILE A 19 -1.243 0.057 -1.796 1.00 1.36 C ATOM 226 CG2 ILE A 19 -0.531 1.864 -0.205 1.00 1.21 C ATOM 227 CD1 ILE A 19 0.141 -0.126 -2.381 1.00 1.88 C ATOM 228 H ILE A 19 -2.451 0.446 0.877 1.00 0.28 H ATOM 229 HA ILE A 19 -3.127 2.667 -0.574 1.00 0.42 H ATOM 230 HB ILE A 19 -1.390 2.164 -2.108 1.00 1.17 H ATOM 231 HG12 ILE A 19 -1.348 -0.634 -0.973 1.00 2.01 H ATOM 232 HG13 ILE A 19 -1.963 -0.191 -2.562 1.00 1.86 H ATOM 233 HG21 ILE A 19 -1.055 1.971 0.733 1.00 1.82 H ATOM 234 HG22 ILE A 19 0.221 1.095 -0.112 1.00 1.59 H ATOM 235 HG23 ILE A 19 -0.058 2.801 -0.461 1.00 1.77 H ATOM 236 HD11 ILE A 19 0.727 0.761 -2.196 1.00 2.27 H ATOM 237 HD12 ILE A 19 0.616 -0.978 -1.917 1.00 2.43 H ATOM 238 HD13 ILE A 19 0.062 -0.290 -3.444 1.00 2.15 H HETATM 239 N TEE A 20 -4.343 -0.078 -1.789 1.00 0.49 N HETATM 240 CB TEE A 20 -4.586 -1.599 -3.619 1.00 0.68 C HETATM 241 CA TEE A 20 -5.131 -0.616 -2.768 1.00 0.60 C HETATM 242 SG TEE A 20 -3.193 -2.691 -3.992 1.00 0.89 S HETATM 243 HN1 TEE A 20 -4.010 -0.592 -1.023 1.00 0.60 H HETATM 244 HB2 TEE A 20 -4.611 -1.460 -4.690 1.00 1.16 H HETATM 245 HA TEE A 20 -5.268 -1.599 -2.341 1.00 0.52 H TER 246 TEE A 20