ATOM 1 N CYS A 1 4.122 7.736 -1.051 1.00 3.15 N ATOM 2 CA CYS A 1 2.861 7.093 -1.473 1.00 2.26 C ATOM 3 C CYS A 1 3.116 5.685 -1.995 1.00 1.98 C ATOM 4 O CYS A 1 4.184 5.419 -2.553 1.00 2.33 O ATOM 5 CB CYS A 1 2.193 7.951 -2.546 1.00 2.34 C ATOM 6 SG CYS A 1 0.660 7.237 -3.155 1.00 1.91 S ATOM 7 H1 CYS A 1 4.772 7.017 -0.663 1.00 3.48 H ATOM 8 H2 CYS A 1 4.581 8.200 -1.863 1.00 3.45 H ATOM 9 H3 CYS A 1 3.935 8.449 -0.318 1.00 3.65 H ATOM 10 HA CYS A 1 2.209 7.032 -0.615 1.00 2.29 H ATOM 11 HB2 CYS A 1 1.975 8.925 -2.130 1.00 2.87 H ATOM 12 HB3 CYS A 1 2.871 8.065 -3.377 1.00 2.72 H HETATM 13 N DBB A 2 2.163 4.761 -1.802 1.00 1.75 N HETATM 14 CA DBB A 2 0.877 5.030 -1.135 1.00 1.40 C HETATM 15 C DBB A 2 1.025 5.169 0.381 1.00 1.07 C HETATM 16 O DBB A 2 2.058 5.615 0.881 1.00 1.04 O HETATM 17 CB DBB A 2 0.174 6.288 -1.699 1.00 1.37 C HETATM 18 CG DBB A 2 -0.821 5.910 -2.782 1.00 2.04 C HETATM 19 H DBB A 2 2.330 3.851 -2.127 1.00 2.09 H HETATM 20 HA DBB A 2 0.236 4.182 -1.332 1.00 1.56 H HETATM 21 HB2 DBB A 2 -0.368 6.761 -0.895 1.00 1.20 H HETATM 22 HG1 DBB A 2 -0.290 5.521 -3.639 1.00 2.44 H HETATM 23 HG2 DBB A 2 -1.386 6.784 -3.072 1.00 2.43 H HETATM 24 HG3 DBB A 2 -1.495 5.157 -2.403 1.00 2.55 H ATOM 25 N PHE A 3 -0.011 4.755 1.103 1.00 0.92 N ATOM 26 CA PHE A 3 0.003 4.786 2.558 1.00 0.68 C ATOM 27 C PHE A 3 0.995 3.764 3.101 1.00 0.63 C ATOM 28 O PHE A 3 0.743 2.564 3.061 1.00 0.81 O ATOM 29 CB PHE A 3 -1.395 4.506 3.116 1.00 0.75 C ATOM 30 CG PHE A 3 -1.482 4.613 4.612 1.00 0.72 C ATOM 31 CD1 PHE A 3 -1.054 5.758 5.263 1.00 0.68 C ATOM 32 CD2 PHE A 3 -1.996 3.570 5.369 1.00 0.92 C ATOM 33 CE1 PHE A 3 -1.131 5.861 6.639 1.00 0.82 C ATOM 34 CE2 PHE A 3 -2.074 3.666 6.744 1.00 1.03 C ATOM 35 CZ PHE A 3 -1.642 4.804 7.382 1.00 0.98 C ATOM 36 H PHE A 3 -0.794 4.380 0.644 1.00 1.06 H ATOM 37 HA PHE A 3 0.315 5.775 2.865 1.00 0.65 H ATOM 38 HB2 PHE A 3 -2.092 5.216 2.694 1.00 0.86 H ATOM 39 HB3 PHE A 3 -1.693 3.506 2.834 1.00 0.87 H ATOM 40 HD1 PHE A 3 -0.653 6.576 4.684 1.00 0.67 H ATOM 41 HD2 PHE A 3 -2.336 2.673 4.873 1.00 1.08 H ATOM 42 HE1 PHE A 3 -0.794 6.761 7.134 1.00 0.92 H ATOM 43 HE2 PHE A 3 -2.474 2.846 7.321 1.00 1.24 H ATOM 44 HZ PHE A 3 -1.705 4.880 8.458 1.00 1.15 H HETATM 45 N DBB A 4 2.147 4.251 3.519 1.00 0.58 N HETATM 46 CA DBB A 4 3.237 3.408 3.985 1.00 0.66 C HETATM 47 C DBB A 4 4.560 4.119 3.704 1.00 0.86 C HETATM 48 O DBB A 4 4.645 4.890 2.747 1.00 1.45 O HETATM 49 CB DBB A 4 3.105 3.073 5.496 1.00 0.60 C HETATM 50 CG DBB A 4 2.455 4.217 6.260 1.00 1.01 C HETATM 51 H DBB A 4 2.301 5.222 3.452 1.00 0.61 H HETATM 52 HA DBB A 4 3.215 2.479 3.416 1.00 0.76 H HETATM 53 HB2 DBB A 4 2.480 2.200 5.597 1.00 0.86 H HETATM 54 HG1 DBB A 4 2.335 3.936 7.296 1.00 1.36 H HETATM 55 HG2 DBB A 4 1.485 4.429 5.830 1.00 1.64 H HETATM 56 HG3 DBB A 4 3.079 5.094 6.194 1.00 1.60 H ATOM 57 N LEU A 5 5.587 3.878 4.517 1.00 0.75 N ATOM 58 CA LEU A 5 6.886 4.508 4.295 1.00 0.89 C ATOM 59 C LEU A 5 7.467 4.097 2.937 1.00 0.83 C ATOM 60 O LEU A 5 7.636 4.946 2.061 1.00 1.18 O ATOM 61 CB LEU A 5 7.862 4.185 5.434 1.00 1.24 C ATOM 62 CG LEU A 5 7.694 5.018 6.711 1.00 1.68 C ATOM 63 CD1 LEU A 5 7.971 6.484 6.429 1.00 2.45 C ATOM 64 CD2 LEU A 5 6.306 4.848 7.312 1.00 1.76 C ATOM 65 H LEU A 5 5.479 3.262 5.275 1.00 1.03 H ATOM 66 HA LEU A 5 6.723 5.579 4.279 1.00 1.33 H ATOM 67 HB2 LEU A 5 7.741 3.144 5.694 1.00 1.67 H ATOM 68 HB3 LEU A 5 8.869 4.329 5.069 1.00 1.67 H ATOM 69 HG LEU A 5 8.411 4.677 7.438 1.00 2.26 H ATOM 70 HD11 LEU A 5 7.387 6.805 5.578 1.00 2.69 H ATOM 71 HD12 LEU A 5 7.701 7.074 7.292 1.00 3.10 H ATOM 72 HD13 LEU A 5 9.020 6.619 6.215 1.00 2.78 H ATOM 73 HD21 LEU A 5 5.998 3.817 7.218 1.00 2.18 H ATOM 74 HD22 LEU A 5 6.328 5.126 8.357 1.00 2.25 H ATOM 75 HD23 LEU A 5 5.606 5.482 6.785 1.00 1.93 H ATOM 76 N PRO A 6 7.666 2.788 2.680 1.00 0.96 N ATOM 77 CA PRO A 6 8.094 2.329 1.366 1.00 1.54 C ATOM 78 C PRO A 6 6.939 2.377 0.361 1.00 2.01 C ATOM 79 O PRO A 6 5.769 2.268 0.742 1.00 1.95 O ATOM 80 CB PRO A 6 8.543 0.893 1.628 1.00 2.00 C ATOM 81 CG PRO A 6 7.703 0.433 2.768 1.00 1.83 C ATOM 82 CD PRO A 6 7.382 1.656 3.589 1.00 1.07 C ATOM 83 HA PRO A 6 8.923 2.911 0.992 1.00 1.54 H ATOM 84 HB2 PRO A 6 8.375 0.292 0.746 1.00 2.42 H ATOM 85 HB3 PRO A 6 9.592 0.881 1.883 1.00 2.23 H ATOM 86 HG2 PRO A 6 6.793 -0.014 2.395 1.00 2.24 H ATOM 87 HG3 PRO A 6 8.253 -0.282 3.362 1.00 2.17 H ATOM 88 HD2 PRO A 6 6.341 1.651 3.876 1.00 0.98 H ATOM 89 HD3 PRO A 6 8.014 1.699 4.466 1.00 1.27 H ATOM 90 N GLY A 7 7.263 2.597 -0.906 1.00 2.70 N ATOM 91 CA GLY A 7 6.233 2.710 -1.925 1.00 3.34 C ATOM 92 C GLY A 7 6.544 1.903 -3.172 1.00 4.03 C ATOM 93 O GLY A 7 6.127 2.266 -4.273 1.00 4.79 O ATOM 94 H GLY A 7 8.208 2.720 -1.148 1.00 2.84 H ATOM 95 HA2 GLY A 7 5.299 2.364 -1.512 1.00 3.07 H ATOM 96 HA3 GLY A 7 6.129 3.750 -2.200 1.00 3.76 H ATOM 97 N GLY A 8 7.290 0.818 -3.009 1.00 4.04 N ATOM 98 CA GLY A 8 7.676 0.003 -4.146 1.00 4.78 C ATOM 99 C GLY A 8 6.913 -1.306 -4.224 1.00 4.38 C ATOM 100 O GLY A 8 5.858 -1.376 -4.855 1.00 4.63 O ATOM 101 H GLY A 8 7.610 0.585 -2.112 1.00 3.73 H ATOM 102 HA2 GLY A 8 7.499 0.565 -5.052 1.00 5.48 H ATOM 103 HA3 GLY A 8 8.732 -0.215 -4.074 1.00 5.13 H ATOM 104 N GLY A 9 7.446 -2.350 -3.602 1.00 3.95 N ATOM 105 CA GLY A 9 6.812 -3.654 -3.665 1.00 3.48 C ATOM 106 C GLY A 9 6.228 -4.079 -2.337 1.00 2.20 C ATOM 107 O GLY A 9 5.108 -3.691 -1.999 1.00 2.33 O ATOM 108 H GLY A 9 8.290 -2.241 -3.110 1.00 4.09 H ATOM 109 HA2 GLY A 9 6.022 -3.624 -4.401 1.00 3.88 H ATOM 110 HA3 GLY A 9 7.547 -4.383 -3.972 1.00 3.89 H ATOM 111 N GLY A 10 7.002 -4.833 -1.563 1.00 1.34 N ATOM 112 CA GLY A 10 6.563 -5.247 -0.242 1.00 0.67 C ATOM 113 C GLY A 10 6.542 -4.087 0.726 1.00 0.58 C ATOM 114 O GLY A 10 7.562 -3.756 1.333 1.00 0.84 O ATOM 115 H GLY A 10 7.904 -5.071 -1.874 1.00 1.76 H ATOM 116 HA2 GLY A 10 5.568 -5.661 -0.317 1.00 1.29 H ATOM 117 HA3 GLY A 10 7.233 -6.005 0.133 1.00 1.20 H ATOM 118 N VAL A 11 5.435 -3.368 0.738 1.00 0.40 N ATOM 119 CA VAL A 11 5.351 -2.126 1.479 1.00 0.36 C ATOM 120 C VAL A 11 4.262 -2.145 2.520 1.00 0.46 C ATOM 121 O VAL A 11 3.405 -3.028 2.554 1.00 1.11 O ATOM 122 CB VAL A 11 5.093 -0.928 0.542 1.00 0.43 C ATOM 123 CG1 VAL A 11 6.238 -0.779 -0.444 1.00 0.61 C ATOM 124 CG2 VAL A 11 3.772 -1.092 -0.197 1.00 0.55 C ATOM 125 H VAL A 11 4.705 -3.611 0.131 1.00 0.59 H ATOM 126 HA VAL A 11 6.295 -1.962 1.978 1.00 0.45 H ATOM 127 HB VAL A 11 5.032 -0.021 1.149 1.00 0.46 H ATOM 128 HG11 VAL A 11 6.718 -1.736 -0.585 1.00 1.25 H ATOM 129 HG12 VAL A 11 5.856 -0.426 -1.390 1.00 1.24 H ATOM 130 HG13 VAL A 11 6.955 -0.070 -0.059 1.00 1.14 H ATOM 131 HG21 VAL A 11 3.663 -2.116 -0.521 1.00 1.19 H ATOM 132 HG22 VAL A 11 2.956 -0.837 0.465 1.00 1.19 H ATOM 133 HG23 VAL A 11 3.755 -0.438 -1.057 1.00 1.14 H ATOM 134 N CYS A 12 4.237 -1.059 3.246 1.00 0.33 N ATOM 135 CA CYS A 12 3.178 -0.751 4.160 1.00 0.28 C ATOM 136 C CYS A 12 1.914 -0.433 3.372 1.00 0.27 C ATOM 137 O CYS A 12 1.978 0.259 2.353 1.00 0.54 O ATOM 138 CB CYS A 12 3.652 0.444 4.977 1.00 0.38 C ATOM 139 SG CYS A 12 2.365 1.442 5.738 1.00 0.40 S ATOM 140 H CYS A 12 4.894 -0.361 3.057 1.00 0.80 H ATOM 141 HA CYS A 12 3.009 -1.595 4.808 1.00 0.30 H ATOM 142 HB2 CYS A 12 4.299 0.078 5.758 1.00 0.48 H ATOM 143 HB3 CYS A 12 4.232 1.085 4.332 1.00 0.44 H HETATM 144 N DBB A 13 0.802 -1.032 3.770 1.00 0.29 N HETATM 145 CA DBB A 13 -0.457 -0.856 3.056 1.00 0.29 C HETATM 146 C DBB A 13 -0.409 -1.495 1.679 1.00 0.29 C HETATM 147 O DBB A 13 -1.038 -1.005 0.747 1.00 0.29 O HETATM 148 CB DBB A 13 -1.646 -1.458 3.831 1.00 0.30 C HETATM 149 CG DBB A 13 -1.452 -1.305 5.333 1.00 0.42 C HETATM 150 H DBB A 13 0.840 -1.658 4.526 1.00 0.55 H HETATM 151 HA DBB A 13 -0.626 0.208 2.930 1.00 0.30 H HETATM 152 HB2 DBB A 13 -1.696 -2.515 3.601 1.00 0.41 H HETATM 153 HG1 DBB A 13 -2.415 -1.241 5.817 1.00 1.13 H HETATM 154 HG2 DBB A 13 -0.888 -0.406 5.535 1.00 1.03 H HETATM 155 HG3 DBB A 13 -0.914 -2.159 5.716 1.00 0.99 H ATOM 156 N LEU A 14 0.317 -2.594 1.556 1.00 0.32 N ATOM 157 CA LEU A 14 0.440 -3.284 0.294 1.00 0.35 C ATOM 158 C LEU A 14 -0.845 -4.043 -0.048 1.00 0.30 C ATOM 159 O LEU A 14 -1.009 -5.214 0.299 1.00 0.38 O ATOM 160 CB LEU A 14 1.641 -4.230 0.352 1.00 0.45 C ATOM 161 CG LEU A 14 1.751 -5.210 -0.802 1.00 0.49 C ATOM 162 CD1 LEU A 14 1.893 -4.473 -2.125 1.00 0.51 C ATOM 163 CD2 LEU A 14 2.918 -6.159 -0.582 1.00 0.63 C ATOM 164 H LEU A 14 0.782 -2.957 2.337 1.00 0.35 H ATOM 165 HA LEU A 14 0.618 -2.542 -0.472 1.00 0.38 H ATOM 166 HB2 LEU A 14 2.540 -3.633 0.376 1.00 0.50 H ATOM 167 HB3 LEU A 14 1.580 -4.794 1.271 1.00 0.47 H ATOM 168 HG LEU A 14 0.844 -5.790 -0.835 1.00 0.44 H ATOM 169 HD11 LEU A 14 1.274 -3.587 -2.111 1.00 1.13 H ATOM 170 HD12 LEU A 14 2.926 -4.187 -2.269 1.00 1.15 H ATOM 171 HD13 LEU A 14 1.582 -5.119 -2.933 1.00 1.08 H ATOM 172 HD21 LEU A 14 2.975 -6.420 0.466 1.00 1.24 H ATOM 173 HD22 LEU A 14 2.772 -7.054 -1.169 1.00 1.14 H ATOM 174 HD23 LEU A 14 3.837 -5.678 -0.882 1.00 1.25 H HETATM 175 N DBB A 15 -1.772 -3.350 -0.695 1.00 0.24 N HETATM 176 CA DBB A 15 -3.041 -3.948 -1.095 1.00 0.31 C HETATM 177 C DBB A 15 -4.204 -3.193 -0.477 1.00 0.21 C HETATM 178 O DBB A 15 -4.034 -2.065 -0.007 1.00 0.20 O HETATM 179 CB DBB A 15 -3.220 -3.972 -2.639 1.00 0.52 C HETATM 180 CG DBB A 15 -1.948 -3.524 -3.342 1.00 1.08 C HETATM 181 H DBB A 15 -1.617 -2.395 -0.868 1.00 0.28 H HETATM 182 HA DBB A 15 -3.056 -4.968 -0.736 1.00 0.40 H HETATM 183 HB2 DBB A 15 -4.007 -3.285 -2.900 1.00 0.51 H HETATM 184 HG1 DBB A 15 -2.071 -3.631 -4.410 1.00 1.37 H HETATM 185 HG2 DBB A 15 -1.120 -4.132 -3.012 1.00 1.71 H HETATM 186 HG3 DBB A 15 -1.750 -2.490 -3.104 1.00 1.62 H HETATM 187 N DHA A 16 -5.382 -3.806 -0.509 1.00 0.22 N HETATM 188 CA DHA A 16 -6.504 -3.175 -0.040 1.00 0.26 C HETATM 189 CB DHA A 16 -7.560 -3.038 -0.845 1.00 0.40 C HETATM 190 C DHA A 16 -6.569 -2.657 1.273 1.00 0.25 C HETATM 191 O DHA A 16 -7.354 -1.752 1.551 1.00 0.30 O HETATM 192 H DHA A 16 -5.402 -4.700 -0.927 1.00 0.28 H HETATM 193 HB1 DHA A 16 -7.524 -3.426 -1.852 1.00 0.45 H HETATM 194 HB2 DHA A 16 -8.449 -2.540 -0.489 1.00 0.51 H ATOM 195 N GLU A 17 -5.713 -3.168 2.149 1.00 0.25 N ATOM 196 CA GLU A 17 -5.649 -2.687 3.519 1.00 0.31 C ATOM 197 C GLU A 17 -5.291 -1.202 3.544 1.00 0.28 C ATOM 198 O GLU A 17 -5.721 -0.465 4.432 1.00 0.36 O ATOM 199 CB GLU A 17 -4.616 -3.484 4.311 1.00 0.38 C ATOM 200 CG GLU A 17 -4.696 -3.282 5.813 1.00 0.49 C ATOM 201 CD GLU A 17 -5.999 -3.779 6.395 1.00 1.43 C ATOM 202 OE1 GLU A 17 -7.043 -3.138 6.163 1.00 2.36 O ATOM 203 OE2 GLU A 17 -5.986 -4.828 7.070 1.00 1.79 O ATOM 204 H GLU A 17 -5.087 -3.865 1.856 1.00 0.26 H ATOM 205 HA GLU A 17 -6.622 -2.819 3.968 1.00 0.37 H ATOM 206 HB2 GLU A 17 -4.754 -4.535 4.103 1.00 0.40 H ATOM 207 HB3 GLU A 17 -3.629 -3.190 3.986 1.00 0.40 H ATOM 208 HG2 GLU A 17 -3.884 -3.818 6.279 1.00 0.85 H ATOM 209 HG3 GLU A 17 -4.603 -2.228 6.025 1.00 0.90 H ATOM 210 N CYS A 18 -4.548 -0.757 2.533 1.00 0.21 N ATOM 211 CA CYS A 18 -4.194 0.649 2.417 1.00 0.22 C ATOM 212 C CYS A 18 -4.172 1.108 0.962 1.00 0.24 C ATOM 213 O CYS A 18 -5.040 1.863 0.528 1.00 0.30 O ATOM 214 CB CYS A 18 -2.819 0.928 3.014 1.00 0.23 C ATOM 215 SG CYS A 18 -2.431 0.013 4.522 1.00 0.27 S ATOM 216 H CYS A 18 -4.285 -1.379 1.819 1.00 0.19 H ATOM 217 HA CYS A 18 -4.933 1.224 2.956 1.00 0.28 H ATOM 218 HB2 CYS A 18 -2.085 0.679 2.269 1.00 0.25 H ATOM 219 HB3 CYS A 18 -2.745 1.980 3.227 1.00 0.29 H ATOM 220 N ILE A 19 -3.049 0.831 0.292 1.00 0.26 N ATOM 221 CA ILE A 19 -2.764 1.427 -1.002 1.00 0.34 C ATOM 222 C ILE A 19 -3.787 0.995 -2.065 1.00 0.40 C ATOM 223 O ILE A 19 -4.127 1.761 -2.967 1.00 0.56 O ATOM 224 CB ILE A 19 -1.314 1.106 -1.469 1.00 0.37 C ATOM 225 CG1 ILE A 19 -0.750 2.231 -2.344 1.00 1.36 C ATOM 226 CG2 ILE A 19 -1.238 -0.225 -2.206 1.00 1.21 C ATOM 227 CD1 ILE A 19 -1.213 2.197 -3.779 1.00 1.88 C ATOM 228 H ILE A 19 -2.331 0.344 0.751 1.00 0.28 H ATOM 229 HA ILE A 19 -2.828 2.492 -0.861 1.00 0.42 H ATOM 230 HB ILE A 19 -0.699 1.022 -0.593 1.00 1.17 H ATOM 231 HG12 ILE A 19 -1.049 3.181 -1.929 1.00 2.01 H ATOM 232 HG13 ILE A 19 0.329 2.169 -2.342 1.00 1.86 H ATOM 233 HG21 ILE A 19 -2.182 -0.420 -2.693 1.00 1.77 H ATOM 234 HG22 ILE A 19 -0.453 -0.180 -2.945 1.00 1.82 H ATOM 235 HG23 ILE A 19 -1.026 -1.014 -1.501 1.00 1.59 H ATOM 236 HD11 ILE A 19 -1.765 1.285 -3.947 1.00 2.15 H ATOM 237 HD12 ILE A 19 -1.849 3.046 -3.971 1.00 2.27 H ATOM 238 HD13 ILE A 19 -0.356 2.228 -4.436 1.00 2.43 H HETATM 239 N TEE A 20 -4.292 -0.224 -1.931 1.00 0.49 N HETATM 240 CB TEE A 20 -4.904 -1.832 -3.610 1.00 0.68 C HETATM 241 CA TEE A 20 -5.202 -0.688 -2.844 1.00 0.60 C HETATM 242 SG TEE A 20 -4.643 -3.618 -3.696 1.00 0.89 S HETATM 243 HN1 TEE A 20 -3.982 -0.751 -1.160 1.00 0.60 H HETATM 244 HB2 TEE A 20 -5.702 -2.390 -4.079 1.00 1.16 H HETATM 245 HA TEE A 20 -5.385 -1.549 -2.219 1.00 0.52 H TER 246 TEE A 20