ATOM 45 N ASP A 5 -8.034 0.946 -0.314 1.00 0.20 N ATOM 46 CA ASP A 5 -7.017 0.117 -0.932 1.00 0.25 C ATOM 47 C ASP A 5 -7.350 -0.205 -2.382 1.00 0.23 C ATOM 48 O ASP A 5 -8.482 -0.553 -2.715 1.00 0.26 O ATOM 49 CB ASP A 5 -6.844 -1.179 -0.141 1.00 0.32 C ATOM 50 CG ASP A 5 -8.113 -2.009 -0.106 1.00 0.40 C ATOM 51 OD1 ASP A 5 -9.203 -1.419 0.051 1.00 1.24 O ATOM 52 OD2 ASP A 5 -8.017 -3.247 -0.235 1.00 1.11 O ATOM 53 H ASP A 5 -8.954 0.626 -0.292 1.00 0.23 H ATOM 54 HA ASP A 5 -6.090 0.666 -0.905 1.00 0.33 H ATOM 55 HB2 ASP A 5 -6.063 -1.770 -0.595 1.00 0.30 H ATOM 56 HB3 ASP A 5 -6.565 -0.938 0.872 1.00 0.38 H ATOM 57 N TYR A 6 -6.339 -0.103 -3.231 1.00 0.19 N ATOM 58 CA TYR A 6 -6.487 -0.399 -4.652 1.00 0.20 C ATOM 59 C TYR A 6 -6.268 -1.890 -4.919 1.00 0.19 C ATOM 60 O TYR A 6 -6.516 -2.374 -6.023 1.00 0.23 O ATOM 61 CB TYR A 6 -5.494 0.430 -5.472 1.00 0.20 C ATOM 62 CG TYR A 6 -6.138 1.210 -6.596 1.00 0.41 C ATOM 63 CD1 TYR A 6 -6.958 2.299 -6.329 1.00 1.37 C ATOM 64 CD2 TYR A 6 -5.924 0.859 -7.923 1.00 1.24 C ATOM 65 CE1 TYR A 6 -7.548 3.016 -7.353 1.00 1.54 C ATOM 66 CE2 TYR A 6 -6.509 1.572 -8.952 1.00 1.33 C ATOM 67 CZ TYR A 6 -7.320 2.649 -8.662 1.00 0.94 C ATOM 68 OH TYR A 6 -7.904 3.361 -9.684 1.00 1.21 O ATOM 69 H TYR A 6 -5.465 0.167 -2.887 1.00 0.18 H ATOM 70 HA TYR A 6 -7.493 -0.136 -4.943 1.00 0.23 H ATOM 71 HB2 TYR A 6 -5.004 1.135 -4.821 1.00 0.30 H ATOM 72 HB3 TYR A 6 -4.752 -0.227 -5.905 1.00 0.25 H ATOM 73 HD1 TYR A 6 -7.134 2.585 -5.302 1.00 2.21 H ATOM 74 HD2 TYR A 6 -5.289 0.015 -8.147 1.00 2.12 H ATOM 75 HE1 TYR A 6 -8.182 3.860 -7.125 1.00 2.44 H ATOM 76 HE2 TYR A 6 -6.331 1.283 -9.977 1.00 2.18 H ATOM 77 HH TYR A 6 -7.326 4.082 -9.944 1.00 1.49 H ATOM 78 N LEU A 7 -5.799 -2.610 -3.901 1.00 0.18 N ATOM 79 CA LEU A 7 -5.544 -4.042 -4.022 1.00 0.19 C ATOM 80 C LEU A 7 -5.821 -4.744 -2.696 1.00 0.20 C ATOM 81 O LEU A 7 -6.131 -4.091 -1.700 1.00 0.20 O ATOM 82 CB LEU A 7 -4.099 -4.280 -4.462 1.00 0.18 C ATOM 83 CG LEU A 7 -3.876 -4.241 -5.974 1.00 0.21 C ATOM 84 CD1 LEU A 7 -2.512 -3.661 -6.288 1.00 0.24 C ATOM 85 CD2 LEU A 7 -4.018 -5.628 -6.586 1.00 0.21 C ATOM 86 H LEU A 7 -5.619 -2.168 -3.044 1.00 0.19 H ATOM 87 HA LEU A 7 -6.212 -4.436 -4.773 1.00 0.21 H ATOM 88 HB2 LEU A 7 -3.478 -3.530 -4.004 1.00 0.17 H ATOM 89 HB3 LEU A 7 -3.780 -5.233 -4.101 1.00 0.18 H ATOM 90 HG LEU A 7 -4.624 -3.603 -6.420 1.00 0.24 H ATOM 91 HD11 LEU A 7 -1.781 -4.085 -5.616 1.00 1.03 H ATOM 92 HD12 LEU A 7 -2.539 -2.589 -6.163 1.00 1.07 H ATOM 93 HD13 LEU A 7 -2.247 -3.899 -7.307 1.00 1.01 H ATOM 94 HD21 LEU A 7 -4.670 -5.576 -7.445 1.00 1.04 H ATOM 95 HD22 LEU A 7 -4.436 -6.303 -5.859 1.00 1.02 H ATOM 96 HD23 LEU A 7 -3.047 -5.987 -6.894 1.00 1.01 H ATOM 97 N PRO A 8 -5.705 -6.082 -2.652 1.00 0.21 N ATOM 98 CA PRO A 8 -5.935 -6.847 -1.442 1.00 0.23 C ATOM 99 C PRO A 8 -4.700 -6.900 -0.563 1.00 0.21 C ATOM 100 O PRO A 8 -3.602 -6.525 -0.975 1.00 0.18 O ATOM 101 CB PRO A 8 -6.309 -8.220 -1.961 1.00 0.26 C ATOM 102 CG PRO A 8 -5.505 -8.366 -3.193 1.00 0.25 C ATOM 103 CD PRO A 8 -5.312 -6.973 -3.764 1.00 0.22 C ATOM 104 HA PRO A 8 -6.757 -6.440 -0.871 1.00 0.25 H ATOM 105 HB2 PRO A 8 -6.054 -8.970 -1.226 1.00 0.26 H ATOM 106 HB3 PRO A 8 -7.367 -8.255 -2.172 1.00 0.29 H ATOM 107 HG2 PRO A 8 -4.549 -8.799 -2.937 1.00 0.23 H ATOM 108 HG3 PRO A 8 -6.030 -8.991 -3.890 1.00 0.28 H ATOM 109 HD2 PRO A 8 -4.280 -6.834 -4.018 1.00 0.20 H ATOM 110 HD3 PRO A 8 -5.930 -6.812 -4.633 1.00 0.23 H ATOM 111 N LYS A 9 -4.901 -7.356 0.653 1.00 0.23 N ATOM 112 CA LYS A 9 -3.826 -7.461 1.635 1.00 0.23 C ATOM 113 C LYS A 9 -2.630 -8.238 1.087 1.00 0.22 C ATOM 114 O LYS A 9 -1.514 -8.110 1.590 1.00 0.22 O ATOM 115 CB LYS A 9 -4.343 -8.136 2.907 1.00 0.26 C ATOM 116 CG LYS A 9 -5.627 -7.521 3.440 1.00 0.30 C ATOM 117 CD LYS A 9 -6.638 -8.587 3.830 1.00 1.00 C ATOM 118 CE LYS A 9 -6.577 -8.896 5.317 1.00 1.48 C ATOM 119 NZ LYS A 9 -7.663 -9.825 5.737 1.00 2.12 N ATOM 120 H LYS A 9 -5.803 -7.638 0.894 1.00 0.25 H ATOM 121 HA LYS A 9 -3.505 -6.460 1.880 1.00 0.22 H ATOM 122 HB2 LYS A 9 -4.526 -9.179 2.697 1.00 0.28 H ATOM 123 HB3 LYS A 9 -3.587 -8.059 3.673 1.00 0.27 H ATOM 124 HG2 LYS A 9 -5.395 -6.925 4.310 1.00 0.86 H ATOM 125 HG3 LYS A 9 -6.058 -6.891 2.674 1.00 0.79 H ATOM 126 HD2 LYS A 9 -7.630 -8.236 3.586 1.00 1.52 H ATOM 127 HD3 LYS A 9 -6.427 -9.490 3.274 1.00 1.72 H ATOM 128 HE2 LYS A 9 -5.623 -9.349 5.538 1.00 2.03 H ATOM 129 HE3 LYS A 9 -6.673 -7.971 5.867 1.00 1.89 H ATOM 130 HZ1 LYS A 9 -7.333 -10.430 6.516 1.00 2.47 H ATOM 131 HZ2 LYS A 9 -7.945 -10.429 4.939 1.00 2.52 H ATOM 132 HZ3 LYS A 9 -8.492 -9.284 6.058 1.00 2.60 H ATOM 133 N SER A 10 -2.868 -9.050 0.063 1.00 0.22 N ATOM 134 CA SER A 10 -1.809 -9.853 -0.536 1.00 0.23 C ATOM 135 C SER A 10 -0.915 -9.023 -1.459 1.00 0.22 C ATOM 136 O SER A 10 0.218 -9.414 -1.741 1.00 0.24 O ATOM 137 CB SER A 10 -2.414 -11.021 -1.318 1.00 0.27 C ATOM 138 OG SER A 10 -2.557 -12.166 -0.495 1.00 1.24 O ATOM 139 H SER A 10 -3.778 -9.122 -0.291 1.00 0.23 H ATOM 140 HA SER A 10 -1.204 -10.249 0.265 1.00 0.23 H ATOM 141 HB2 SER A 10 -3.387 -10.737 -1.690 1.00 1.04 H ATOM 142 HB3 SER A 10 -1.769 -11.267 -2.149 1.00 0.97 H ATOM 143 HG SER A 10 -2.579 -12.953 -1.044 1.00 1.69 H ATOM 144 N GLU A 11 -1.423 -7.891 -1.942 1.00 0.23 N ATOM 145 CA GLU A 11 -0.649 -7.044 -2.843 1.00 0.26 C ATOM 146 C GLU A 11 -0.011 -5.880 -2.111 1.00 0.26 C ATOM 147 O GLU A 11 1.119 -5.488 -2.404 1.00 0.30 O ATOM 148 CB GLU A 11 -1.567 -6.496 -3.930 1.00 0.31 C ATOM 149 CG GLU A 11 -1.454 -7.213 -5.262 1.00 0.38 C ATOM 150 CD GLU A 11 -0.676 -6.416 -6.291 1.00 0.53 C ATOM 151 OE1 GLU A 11 0.176 -5.597 -5.886 1.00 1.31 O ATOM 152 OE2 GLU A 11 -0.919 -6.609 -7.500 1.00 1.16 O ATOM 153 H GLU A 11 -2.336 -7.623 -1.701 1.00 0.22 H ATOM 154 HA GLU A 11 0.125 -7.645 -3.291 1.00 0.28 H ATOM 155 HB2 GLU A 11 -2.582 -6.587 -3.587 1.00 0.26 H ATOM 156 HB3 GLU A 11 -1.343 -5.449 -4.080 1.00 0.38 H ATOM 157 HG2 GLU A 11 -0.953 -8.158 -5.108 1.00 0.38 H ATOM 158 HG3 GLU A 11 -2.452 -7.392 -5.642 1.00 0.38 H ATOM 159 N CYS A 12 -0.742 -5.327 -1.163 1.00 0.26 N ATOM 160 CA CYS A 12 -0.253 -4.203 -0.392 1.00 0.30 C ATOM 161 C CYS A 12 0.188 -4.672 0.979 1.00 0.24 C ATOM 162 O CYS A 12 -0.632 -4.965 1.849 1.00 0.28 O ATOM 163 CB CYS A 12 -1.335 -3.135 -0.292 1.00 0.46 C ATOM 164 SG CYS A 12 -1.260 -1.896 -1.621 1.00 0.80 S ATOM 165 H CYS A 12 -1.637 -5.682 -0.980 1.00 0.24 H ATOM 166 HA CYS A 12 0.601 -3.792 -0.911 1.00 0.35 H ATOM 167 HB2 CYS A 12 -2.300 -3.614 -0.355 1.00 0.48 H ATOM 168 HB3 CYS A 12 -1.249 -2.617 0.654 1.00 0.45 H ATOM 169 N THR A 13 1.494 -4.762 1.154 1.00 0.22 N ATOM 170 CA THR A 13 2.065 -5.219 2.405 1.00 0.20 C ATOM 171 C THR A 13 2.730 -4.068 3.140 1.00 0.22 C ATOM 172 O THR A 13 3.319 -3.187 2.517 1.00 0.23 O ATOM 173 CB THR A 13 3.077 -6.338 2.126 1.00 0.19 C ATOM 174 OG1 THR A 13 3.911 -5.997 1.035 1.00 0.19 O ATOM 175 CG2 THR A 13 2.420 -7.663 1.793 1.00 0.21 C ATOM 176 H THR A 13 2.094 -4.523 0.413 1.00 0.28 H ATOM 177 HA THR A 13 1.265 -5.611 3.016 1.00 0.25 H ATOM 178 HB THR A 13 3.705 -6.479 2.997 1.00 0.24 H ATOM 179 HG1 THR A 13 3.408 -6.046 0.219 1.00 0.78 H ATOM 180 HG21 THR A 13 1.978 -7.609 0.803 1.00 1.03 H ATOM 181 HG22 THR A 13 1.650 -7.876 2.519 1.00 1.04 H ATOM 182 HG23 THR A 13 3.161 -8.448 1.812 1.00 1.04 H ATOM 183 N GLN A 14 2.645 -4.080 4.469 1.00 0.29 N ATOM 184 CA GLN A 14 3.262 -3.031 5.276 1.00 0.33 C ATOM 185 C GLN A 14 4.690 -2.795 4.799 1.00 0.28 C ATOM 186 O GLN A 14 5.212 -1.682 4.867 1.00 0.31 O ATOM 187 CB GLN A 14 3.239 -3.416 6.755 1.00 0.42 C ATOM 188 CG GLN A 14 1.873 -3.885 7.238 1.00 0.72 C ATOM 189 CD GLN A 14 0.754 -2.934 6.848 1.00 0.88 C ATOM 190 OE1 GLN A 14 0.546 -1.908 7.495 1.00 1.81 O ATOM 191 NE2 GLN A 14 0.026 -3.271 5.786 1.00 0.77 N ATOM 192 H GLN A 14 2.169 -4.812 4.914 1.00 0.34 H ATOM 193 HA GLN A 14 2.693 -2.123 5.135 1.00 0.35 H ATOM 194 HB2 GLN A 14 3.949 -4.213 6.919 1.00 0.67 H ATOM 195 HB3 GLN A 14 3.531 -2.559 7.344 1.00 0.49 H ATOM 196 HG2 GLN A 14 1.667 -4.854 6.809 1.00 1.40 H ATOM 197 HG3 GLN A 14 1.897 -3.967 8.315 1.00 1.41 H ATOM 198 HE21 GLN A 14 0.245 -4.102 5.315 1.00 0.91 H ATOM 199 HE22 GLN A 14 -0.702 -2.672 5.516 1.00 1.26 H ATOM 200 N PHE A 15 5.293 -3.857 4.276 1.00 0.25 N ATOM 201 CA PHE A 15 6.637 -3.798 3.732 1.00 0.26 C ATOM 202 C PHE A 15 6.702 -2.814 2.570 1.00 0.22 C ATOM 203 O PHE A 15 7.649 -2.038 2.449 1.00 0.24 O ATOM 204 CB PHE A 15 7.058 -5.193 3.268 1.00 0.29 C ATOM 205 CG PHE A 15 7.980 -5.890 4.225 1.00 0.37 C ATOM 206 CD1 PHE A 15 9.329 -5.578 4.248 1.00 1.14 C ATOM 207 CD2 PHE A 15 7.502 -6.851 5.101 1.00 1.25 C ATOM 208 CE1 PHE A 15 10.186 -6.211 5.124 1.00 1.17 C ATOM 209 CE2 PHE A 15 8.355 -7.490 5.981 1.00 1.29 C ATOM 210 CZ PHE A 15 9.700 -7.169 5.993 1.00 0.52 C ATOM 211 H PHE A 15 4.804 -4.705 4.229 1.00 0.26 H ATOM 212 HA PHE A 15 7.303 -3.467 4.514 1.00 0.31 H ATOM 213 HB2 PHE A 15 6.174 -5.804 3.162 1.00 0.27 H ATOM 214 HB3 PHE A 15 7.548 -5.121 2.313 1.00 0.29 H ATOM 215 HD1 PHE A 15 9.710 -4.829 3.569 1.00 2.00 H ATOM 216 HD2 PHE A 15 6.451 -7.102 5.091 1.00 2.10 H ATOM 217 HE1 PHE A 15 11.236 -5.958 5.129 1.00 2.01 H ATOM 218 HE2 PHE A 15 7.972 -8.238 6.659 1.00 2.15 H ATOM 219 HZ PHE A 15 10.369 -7.666 6.680 1.00 0.58 H ATOM 220 N ARG A 16 5.682 -2.853 1.719 1.00 0.19 N ATOM 221 CA ARG A 16 5.606 -1.970 0.562 1.00 0.20 C ATOM 222 C ARG A 16 5.769 -0.513 0.967 1.00 0.17 C ATOM 223 O ARG A 16 6.553 0.214 0.369 1.00 0.19 O ATOM 224 CB ARG A 16 4.274 -2.169 -0.165 1.00 0.32 C ATOM 225 CG ARG A 16 4.070 -3.580 -0.672 1.00 0.24 C ATOM 226 CD ARG A 16 5.023 -3.912 -1.808 1.00 0.40 C ATOM 227 NE ARG A 16 4.652 -5.152 -2.487 1.00 0.78 N ATOM 228 CZ ARG A 16 5.285 -5.631 -3.555 1.00 0.89 C ATOM 229 NH1 ARG A 16 6.318 -4.976 -4.071 1.00 1.49 N ATOM 230 NH2 ARG A 16 4.885 -6.768 -4.108 1.00 1.39 N ATOM 231 H ARG A 16 4.958 -3.495 1.876 1.00 0.18 H ATOM 232 HA ARG A 16 6.411 -2.227 -0.107 1.00 0.26 H ATOM 233 HB2 ARG A 16 3.467 -1.935 0.510 1.00 0.54 H ATOM 234 HB3 ARG A 16 4.229 -1.503 -1.005 1.00 0.47 H ATOM 235 HG2 ARG A 16 4.243 -4.265 0.140 1.00 0.23 H ATOM 236 HG3 ARG A 16 3.052 -3.678 -1.022 1.00 0.37 H ATOM 237 HD2 ARG A 16 5.009 -3.103 -2.523 1.00 0.87 H ATOM 238 HD3 ARG A 16 6.019 -4.018 -1.405 1.00 0.69 H ATOM 239 HE ARG A 16 3.892 -5.655 -2.127 1.00 1.52 H ATOM 240 HH11 ARG A 16 6.625 -4.119 -3.659 1.00 1.80 H ATOM 241 HH12 ARG A 16 6.790 -5.341 -4.874 1.00 1.98 H ATOM 242 HH21 ARG A 16 4.107 -7.265 -3.723 1.00 1.96 H ATOM 243 HH22 ARG A 16 5.360 -7.128 -4.911 1.00 1.54 H ATOM 244 N CYS A 17 5.032 -0.089 1.983 1.00 0.24 N ATOM 245 CA CYS A 17 5.119 1.289 2.445 1.00 0.33 C ATOM 246 C CYS A 17 6.454 1.562 3.125 1.00 0.34 C ATOM 247 O CYS A 17 6.888 2.707 3.233 1.00 0.45 O ATOM 248 CB CYS A 17 3.973 1.613 3.393 1.00 0.48 C ATOM 249 SG CYS A 17 2.432 2.091 2.550 1.00 0.58 S ATOM 250 H CYS A 17 4.421 -0.711 2.430 1.00 0.27 H ATOM 251 HA CYS A 17 5.045 1.922 1.581 1.00 0.36 H ATOM 252 HB2 CYS A 17 3.762 0.748 4.001 1.00 0.92 H ATOM 253 HB3 CYS A 17 4.272 2.430 4.027 1.00 0.83 H ATOM 254 N ARG A 18 7.099 0.506 3.586 1.00 0.30 N ATOM 255 CA ARG A 18 8.387 0.636 4.254 1.00 0.40 C ATOM 256 C ARG A 18 9.458 1.119 3.309 1.00 0.41 C ATOM 257 O ARG A 18 10.252 2.005 3.625 1.00 0.51 O ATOM 258 CB ARG A 18 8.854 -0.723 4.781 1.00 0.45 C ATOM 259 CG ARG A 18 9.285 -0.700 6.238 1.00 0.60 C ATOM 260 CD ARG A 18 10.680 -0.116 6.399 1.00 1.08 C ATOM 261 NE ARG A 18 11.633 -1.103 6.902 1.00 1.48 N ATOM 262 CZ ARG A 18 11.742 -1.442 8.185 1.00 2.14 C ATOM 263 NH1 ARG A 18 10.955 -0.883 9.096 1.00 2.62 N ATOM 264 NH2 ARG A 18 12.639 -2.345 8.558 1.00 2.87 N ATOM 265 H ARG A 18 6.698 -0.379 3.480 1.00 0.26 H ATOM 266 HA ARG A 18 8.292 1.316 5.067 1.00 0.48 H ATOM 267 HB2 ARG A 18 8.049 -1.435 4.673 1.00 0.57 H ATOM 268 HB3 ARG A 18 9.707 -1.053 4.175 1.00 0.57 H ATOM 269 HG2 ARG A 18 8.587 -0.099 6.801 1.00 1.04 H ATOM 270 HG3 ARG A 18 9.281 -1.711 6.620 1.00 1.01 H ATOM 271 HD2 ARG A 18 11.021 0.242 5.439 1.00 1.66 H ATOM 272 HD3 ARG A 18 10.632 0.711 7.093 1.00 1.70 H ATOM 273 HE ARG A 18 12.224 -1.533 6.251 1.00 1.87 H ATOM 274 HH11 ARG A 18 10.275 -0.202 8.822 1.00 2.57 H ATOM 275 HH12 ARG A 18 11.041 -1.142 10.058 1.00 3.34 H ATOM 276 HH21 ARG A 18 13.233 -2.770 7.875 1.00 3.09 H ATOM 277 HH22 ARG A 18 12.721 -2.600 9.521 1.00 3.44 H ATOM 278 N THR A 19 9.516 0.448 2.186 1.00 0.36 N ATOM 279 CA THR A 19 10.535 0.693 1.198 1.00 0.41 C ATOM 280 C THR A 19 9.990 1.204 -0.142 1.00 0.38 C ATOM 281 O THR A 19 10.679 1.933 -0.856 1.00 0.59 O ATOM 282 CB THR A 19 11.285 -0.620 1.056 1.00 0.48 C ATOM 283 OG1 THR A 19 12.217 -0.585 -0.010 1.00 0.56 O ATOM 284 CG2 THR A 19 10.358 -1.796 0.852 1.00 0.46 C ATOM 285 H THR A 19 8.884 -0.286 2.043 1.00 0.31 H ATOM 286 HA THR A 19 11.213 1.430 1.598 1.00 0.48 H ATOM 287 HB THR A 19 11.813 -0.800 1.989 1.00 0.55 H ATOM 288 HG1 THR A 19 12.810 0.160 0.108 1.00 1.06 H ATOM 289 HG21 THR A 19 9.722 -1.895 1.727 1.00 1.13 H ATOM 290 HG22 THR A 19 10.938 -2.697 0.723 1.00 1.04 H ATOM 291 HG23 THR A 19 9.746 -1.627 -0.019 1.00 1.15 H ATOM 292 N SER A 20 8.768 0.808 -0.491 1.00 0.33 N ATOM 293 CA SER A 20 8.161 1.223 -1.760 1.00 0.32 C ATOM 294 C SER A 20 7.138 2.344 -1.568 1.00 0.28 C ATOM 295 O SER A 20 6.151 2.184 -0.852 1.00 0.42 O ATOM 296 CB SER A 20 7.494 0.026 -2.439 1.00 0.35 C ATOM 297 OG SER A 20 8.289 -1.141 -2.314 1.00 0.73 O ATOM 298 H SER A 20 8.267 0.217 0.108 1.00 0.47 H ATOM 299 HA SER A 20 8.953 1.586 -2.398 1.00 0.40 H ATOM 300 HB2 SER A 20 6.535 -0.158 -1.979 1.00 0.64 H ATOM 301 HB3 SER A 20 7.355 0.241 -3.489 1.00 0.58 H ATOM 302 HG SER A 20 7.864 -1.755 -1.712 1.00 0.97 H ATOM 303 N MET A 21 7.378 3.477 -2.223 1.00 0.27 N ATOM 304 CA MET A 21 6.480 4.627 -2.131 1.00 0.25 C ATOM 305 C MET A 21 5.251 4.455 -3.025 1.00 0.25 C ATOM 306 O MET A 21 4.149 4.873 -2.672 1.00 0.38 O ATOM 307 CB MET A 21 7.223 5.907 -2.525 1.00 0.35 C ATOM 308 CG MET A 21 7.823 6.653 -1.345 1.00 0.42 C ATOM 309 SD MET A 21 9.334 7.536 -1.779 1.00 0.95 S ATOM 310 CE MET A 21 10.327 6.203 -2.446 1.00 1.66 C ATOM 311 H MET A 21 8.179 3.542 -2.784 1.00 0.40 H ATOM 312 HA MET A 21 6.156 4.714 -1.105 1.00 0.26 H ATOM 313 HB2 MET A 21 8.021 5.650 -3.205 1.00 0.43 H ATOM 314 HB3 MET A 21 6.534 6.569 -3.028 1.00 0.42 H ATOM 315 HG2 MET A 21 7.099 7.366 -0.981 1.00 0.66 H ATOM 316 HG3 MET A 21 8.050 5.943 -0.566 1.00 0.42 H ATOM 317 HE1 MET A 21 10.109 5.290 -1.912 1.00 2.14 H ATOM 318 HE2 MET A 21 11.374 6.443 -2.335 1.00 2.17 H ATOM 319 HE3 MET A 21 10.097 6.072 -3.493 1.00 2.19 H ATOM 320 N LYS A 22 5.455 3.855 -4.192 1.00 0.28 N ATOM 321 CA LYS A 22 4.377 3.642 -5.156 1.00 0.35 C ATOM 322 C LYS A 22 3.171 2.934 -4.536 1.00 0.32 C ATOM 323 O LYS A 22 2.042 3.413 -4.630 1.00 0.47 O ATOM 324 CB LYS A 22 4.899 2.828 -6.342 1.00 0.45 C ATOM 325 CG LYS A 22 3.967 2.826 -7.542 1.00 0.58 C ATOM 326 CD LYS A 22 4.153 4.072 -8.395 1.00 1.33 C ATOM 327 CE LYS A 22 4.084 3.748 -9.879 1.00 1.62 C ATOM 328 NZ LYS A 22 5.162 4.431 -10.647 1.00 2.35 N ATOM 329 H LYS A 22 6.361 3.558 -4.420 1.00 0.37 H ATOM 330 HA LYS A 22 4.062 4.610 -5.514 1.00 0.39 H ATOM 331 HB2 LYS A 22 5.849 3.235 -6.653 1.00 0.48 H ATOM 332 HB3 LYS A 22 5.043 1.805 -6.025 1.00 0.47 H ATOM 333 HG2 LYS A 22 4.174 1.956 -8.146 1.00 1.38 H ATOM 334 HG3 LYS A 22 2.946 2.789 -7.193 1.00 1.13 H ATOM 335 HD2 LYS A 22 3.375 4.780 -8.155 1.00 1.94 H ATOM 336 HD3 LYS A 22 5.118 4.506 -8.174 1.00 2.10 H ATOM 337 HE2 LYS A 22 4.184 2.681 -10.008 1.00 1.80 H ATOM 338 HE3 LYS A 22 3.125 4.068 -10.260 1.00 2.10 H ATOM 339 HZ1 LYS A 22 4.875 4.546 -11.640 1.00 2.86 H ATOM 340 HZ2 LYS A 22 6.036 3.869 -10.613 1.00 2.67 H ATOM 341 HZ3 LYS A 22 5.351 5.369 -10.240 1.00 2.77 H ATOM 342 N TYR A 23 3.415 1.781 -3.926 1.00 0.24 N ATOM 343 CA TYR A 23 2.349 0.987 -3.315 1.00 0.23 C ATOM 344 C TYR A 23 1.580 1.760 -2.250 1.00 0.25 C ATOM 345 O TYR A 23 0.420 1.459 -1.968 1.00 0.33 O ATOM 346 CB TYR A 23 2.937 -0.267 -2.677 1.00 0.25 C ATOM 347 CG TYR A 23 3.232 -1.366 -3.662 1.00 0.25 C ATOM 348 CD1 TYR A 23 3.981 -1.116 -4.800 1.00 1.26 C ATOM 349 CD2 TYR A 23 2.767 -2.654 -3.448 1.00 1.16 C ATOM 350 CE1 TYR A 23 4.259 -2.123 -5.705 1.00 1.26 C ATOM 351 CE2 TYR A 23 3.039 -3.667 -4.343 1.00 1.18 C ATOM 352 CZ TYR A 23 3.786 -3.398 -5.472 1.00 0.36 C ATOM 353 OH TYR A 23 4.060 -4.405 -6.369 1.00 0.44 O ATOM 354 H TYR A 23 4.334 1.444 -3.898 1.00 0.30 H ATOM 355 HA TYR A 23 1.669 0.692 -4.095 1.00 0.26 H ATOM 356 HB2 TYR A 23 3.860 -0.009 -2.183 1.00 0.29 H ATOM 357 HB3 TYR A 23 2.239 -0.652 -1.948 1.00 0.27 H ATOM 358 HD1 TYR A 23 4.348 -0.114 -4.975 1.00 2.17 H ATOM 359 HD2 TYR A 23 2.181 -2.860 -2.565 1.00 2.06 H ATOM 360 HE1 TYR A 23 4.844 -1.910 -6.587 1.00 2.17 H ATOM 361 HE2 TYR A 23 2.668 -4.663 -4.157 1.00 2.10 H ATOM 362 HH TYR A 23 3.248 -4.679 -6.802 1.00 0.83 H ATOM 363 N ARG A 24 2.243 2.721 -1.635 1.00 0.25 N ATOM 364 CA ARG A 24 1.631 3.506 -0.561 1.00 0.29 C ATOM 365 C ARG A 24 0.581 4.487 -1.069 1.00 0.31 C ATOM 366 O ARG A 24 -0.581 4.432 -0.672 1.00 0.32 O ATOM 367 CB ARG A 24 2.701 4.288 0.206 1.00 0.35 C ATOM 368 CG ARG A 24 4.075 3.643 0.191 1.00 0.36 C ATOM 369 CD ARG A 24 5.012 4.312 1.182 1.00 0.31 C ATOM 370 NE ARG A 24 6.381 3.814 1.061 1.00 0.36 N ATOM 371 CZ ARG A 24 7.463 4.537 1.349 1.00 0.39 C ATOM 372 NH1 ARG A 24 7.344 5.785 1.787 1.00 0.38 N ATOM 373 NH2 ARG A 24 8.669 4.007 1.207 1.00 0.47 N ATOM 374 H ARG A 24 3.175 2.889 -1.888 1.00 0.28 H ATOM 375 HA ARG A 24 1.155 2.818 0.119 1.00 0.30 H ATOM 376 HB2 ARG A 24 2.790 5.268 -0.232 1.00 0.49 H ATOM 377 HB3 ARG A 24 2.387 4.392 1.234 1.00 0.61 H ATOM 378 HG2 ARG A 24 3.974 2.602 0.446 1.00 0.65 H ATOM 379 HG3 ARG A 24 4.492 3.733 -0.799 1.00 0.54 H ATOM 380 HD2 ARG A 24 5.007 5.376 0.998 1.00 0.33 H ATOM 381 HD3 ARG A 24 4.656 4.119 2.183 1.00 0.42 H ATOM 382 HE ARG A 24 6.502 2.889 0.747 1.00 0.40 H ATOM 383 HH11 ARG A 24 6.439 6.191 1.905 1.00 0.36 H ATOM 384 HH12 ARG A 24 8.162 6.319 2.000 1.00 0.42 H ATOM 385 HH21 ARG A 24 8.765 3.066 0.884 1.00 0.52 H ATOM 386 HH22 ARG A 24 9.482 4.547 1.422 1.00 0.50 H ATOM 387 N LEU A 25 1.008 5.408 -1.914 1.00 0.32 N ATOM 388 CA LEU A 25 0.119 6.433 -2.441 1.00 0.37 C ATOM 389 C LEU A 25 -0.491 6.049 -3.783 1.00 0.36 C ATOM 390 O LEU A 25 -1.656 6.342 -4.055 1.00 0.39 O ATOM 391 CB LEU A 25 0.894 7.740 -2.583 1.00 0.42 C ATOM 392 CG LEU A 25 1.806 8.100 -1.396 1.00 0.43 C ATOM 393 CD1 LEU A 25 1.208 7.630 -0.071 1.00 0.42 C ATOM 394 CD2 LEU A 25 3.199 7.514 -1.591 1.00 0.42 C ATOM 395 H LEU A 25 1.953 5.419 -2.169 1.00 0.32 H ATOM 396 HA LEU A 25 -0.678 6.579 -1.728 1.00 0.39 H ATOM 397 HB2 LEU A 25 1.507 7.667 -3.475 1.00 0.42 H ATOM 398 HB3 LEU A 25 0.185 8.542 -2.721 1.00 0.45 H ATOM 399 HG LEU A 25 1.904 9.175 -1.348 1.00 0.47 H ATOM 400 HD11 LEU A 25 1.379 8.380 0.687 1.00 1.09 H ATOM 401 HD12 LEU A 25 1.678 6.703 0.232 1.00 1.08 H ATOM 402 HD13 LEU A 25 0.147 7.472 -0.188 1.00 1.09 H ATOM 403 HD21 LEU A 25 3.906 8.314 -1.748 1.00 1.04 H ATOM 404 HD22 LEU A 25 3.199 6.861 -2.450 1.00 1.13 H ATOM 405 HD23 LEU A 25 3.482 6.952 -0.711 1.00 1.06 H ATOM 406 N ASN A 26 0.313 5.432 -4.632 1.00 0.34 N ATOM 407 CA ASN A 26 -0.128 5.050 -5.967 1.00 0.36 C ATOM 408 C ASN A 26 -1.115 3.881 -5.955 1.00 0.32 C ATOM 409 O ASN A 26 -2.062 3.864 -6.741 1.00 0.38 O ATOM 410 CB ASN A 26 1.090 4.707 -6.816 1.00 0.37 C ATOM 411 CG ASN A 26 0.898 5.060 -8.278 1.00 0.54 C ATOM 412 OD1 ASN A 26 0.703 4.183 -9.120 1.00 1.22 O ATOM 413 ND2 ASN A 26 0.955 6.350 -8.589 1.00 1.28 N ATOM 414 H ASN A 26 1.240 5.255 -4.366 1.00 0.32 H ATOM 415 HA ASN A 26 -0.618 5.906 -6.403 1.00 0.42 H ATOM 416 HB2 ASN A 26 1.941 5.259 -6.438 1.00 0.36 H ATOM 417 HB3 ASN A 26 1.287 3.649 -6.739 1.00 0.34 H ATOM 418 HD21 ASN A 26 1.115 6.993 -7.867 1.00 1.98 H ATOM 419 HD22 ASN A 26 0.835 6.606 -9.527 1.00 1.37 H ATOM 420 N LEU A 27 -0.903 2.906 -5.075 1.00 0.27 N ATOM 421 CA LEU A 27 -1.802 1.753 -5.007 1.00 0.27 C ATOM 422 C LEU A 27 -2.788 1.884 -3.842 1.00 0.25 C ATOM 423 O LEU A 27 -3.755 2.640 -3.938 1.00 0.28 O ATOM 424 CB LEU A 27 -1.009 0.446 -4.916 1.00 0.29 C ATOM 425 CG LEU A 27 -0.778 -0.258 -6.252 1.00 0.63 C ATOM 426 CD1 LEU A 27 0.171 0.546 -7.125 1.00 0.91 C ATOM 427 CD2 LEU A 27 -0.242 -1.662 -6.025 1.00 1.05 C ATOM 428 H LEU A 27 -0.134 2.958 -4.469 1.00 0.27 H ATOM 429 HA LEU A 27 -2.373 1.741 -5.925 1.00 0.32 H ATOM 430 HB2 LEU A 27 -0.051 0.661 -4.472 1.00 0.49 H ATOM 431 HB3 LEU A 27 -1.543 -0.233 -4.270 1.00 0.63 H ATOM 432 HG LEU A 27 -1.720 -0.340 -6.775 1.00 0.93 H ATOM 433 HD11 LEU A 27 0.912 1.026 -6.503 1.00 1.50 H ATOM 434 HD12 LEU A 27 -0.387 1.297 -7.665 1.00 1.21 H ATOM 435 HD13 LEU A 27 0.661 -0.113 -7.826 1.00 1.49 H ATOM 436 HD21 LEU A 27 0.793 -1.608 -5.721 1.00 1.42 H ATOM 437 HD22 LEU A 27 -0.320 -2.230 -6.940 1.00 1.50 H ATOM 438 HD23 LEU A 27 -0.820 -2.146 -5.251 1.00 1.69 H ATOM 439 N CYS A 28 -2.560 1.155 -2.746 1.00 0.25 N ATOM 440 CA CYS A 28 -3.469 1.229 -1.607 1.00 0.23 C ATOM 441 C CYS A 28 -2.962 2.220 -0.578 1.00 0.22 C ATOM 442 O CYS A 28 -1.757 2.360 -0.372 1.00 0.22 O ATOM 443 CB CYS A 28 -3.616 -0.149 -0.953 1.00 0.25 C ATOM 444 SG CYS A 28 -3.211 -1.550 -2.042 1.00 0.50 S ATOM 445 H CYS A 28 -1.781 0.565 -2.703 1.00 0.29 H ATOM 446 HA CYS A 28 -4.433 1.555 -1.962 1.00 0.25 H ATOM 447 HB2 CYS A 28 -2.957 -0.203 -0.099 1.00 0.40 H ATOM 448 HB3 CYS A 28 -4.631 -0.276 -0.619 1.00 0.26 H ATOM 449 N LYS A 29 -3.894 2.886 0.083 1.00 0.24 N ATOM 450 CA LYS A 29 -3.554 3.848 1.112 1.00 0.27 C ATOM 451 C LYS A 29 -3.295 3.161 2.446 1.00 0.27 C ATOM 452 O LYS A 29 -2.220 3.277 3.024 1.00 0.30 O ATOM 453 CB LYS A 29 -4.675 4.877 1.255 1.00 0.33 C ATOM 454 CG LYS A 29 -4.996 5.604 -0.041 1.00 0.31 C ATOM 455 CD LYS A 29 -5.021 7.112 0.153 1.00 0.81 C ATOM 456 CE LYS A 29 -3.623 7.705 0.090 1.00 0.97 C ATOM 457 NZ LYS A 29 -3.592 9.111 0.579 1.00 1.30 N ATOM 458 H LYS A 29 -4.836 2.710 -0.115 1.00 0.26 H ATOM 459 HA LYS A 29 -2.653 4.356 0.804 1.00 0.27 H ATOM 460 HB2 LYS A 29 -5.569 4.373 1.591 1.00 0.39 H ATOM 461 HB3 LYS A 29 -4.385 5.610 1.994 1.00 0.39 H ATOM 462 HG2 LYS A 29 -4.243 5.358 -0.776 1.00 0.44 H ATOM 463 HG3 LYS A 29 -5.964 5.279 -0.394 1.00 0.56 H ATOM 464 HD2 LYS A 29 -5.625 7.556 -0.624 1.00 1.21 H ATOM 465 HD3 LYS A 29 -5.454 7.334 1.118 1.00 1.28 H ATOM 466 HE2 LYS A 29 -2.964 7.106 0.701 1.00 1.60 H ATOM 467 HE3 LYS A 29 -3.282 7.681 -0.935 1.00 1.31 H ATOM 468 HZ1 LYS A 29 -3.791 9.766 -0.204 1.00 1.81 H ATOM 469 HZ2 LYS A 29 -2.655 9.332 0.972 1.00 1.53 H ATOM 470 HZ3 LYS A 29 -4.308 9.247 1.322 1.00 1.88 H ATOM 471 N LYS A 30 -4.310 2.460 2.932 1.00 0.27 N ATOM 472 CA LYS A 30 -4.230 1.770 4.213 1.00 0.31 C ATOM 473 C LYS A 30 -3.555 0.405 4.119 1.00 0.29 C ATOM 474 O LYS A 30 -2.613 0.123 4.856 1.00 0.31 O ATOM 475 CB LYS A 30 -5.631 1.604 4.798 1.00 0.36 C ATOM 476 CG LYS A 30 -5.666 0.726 6.035 1.00 0.46 C ATOM 477 CD LYS A 30 -5.209 1.485 7.267 1.00 0.57 C ATOM 478 CE LYS A 30 -6.382 2.096 8.016 1.00 1.03 C ATOM 479 NZ LYS A 30 -7.211 1.060 8.693 1.00 1.66 N ATOM 480 H LYS A 30 -5.147 2.421 2.425 1.00 0.26 H ATOM 481 HA LYS A 30 -3.653 2.391 4.881 1.00 0.35 H ATOM 482 HB2 LYS A 30 -6.018 2.577 5.060 1.00 0.41 H ATOM 483 HB3 LYS A 30 -6.269 1.160 4.049 1.00 0.33 H ATOM 484 HG2 LYS A 30 -6.674 0.377 6.190 1.00 0.47 H ATOM 485 HG3 LYS A 30 -5.008 -0.117 5.878 1.00 0.48 H ATOM 486 HD2 LYS A 30 -4.690 0.803 7.924 1.00 0.73 H ATOM 487 HD3 LYS A 30 -4.537 2.274 6.960 1.00 0.87 H ATOM 488 HE2 LYS A 30 -6.002 2.781 8.758 1.00 1.61 H ATOM 489 HE3 LYS A 30 -6.999 2.636 7.312 1.00 1.65 H ATOM 490 HZ1 LYS A 30 -6.700 0.674 9.512 1.00 2.20 H ATOM 491 HZ2 LYS A 30 -7.423 0.285 8.034 1.00 2.11 H ATOM 492 HZ3 LYS A 30 -8.106 1.477 9.020 1.00 2.11 H ATOM 493 N THR A 31 -4.073 -0.459 3.253 1.00 0.28 N ATOM 494 CA THR A 31 -3.540 -1.814 3.117 1.00 0.32 C ATOM 495 C THR A 31 -2.016 -1.831 3.051 1.00 0.30 C ATOM 496 O THR A 31 -1.377 -2.773 3.519 1.00 0.37 O ATOM 497 CB THR A 31 -4.118 -2.498 1.883 1.00 0.33 C ATOM 498 OG1 THR A 31 -5.533 -2.536 1.946 1.00 0.44 O ATOM 499 CG2 THR A 31 -3.627 -3.916 1.718 1.00 0.54 C ATOM 500 H THR A 31 -4.850 -0.192 2.715 1.00 0.28 H ATOM 501 HA THR A 31 -3.847 -2.369 3.991 1.00 0.36 H ATOM 502 HB THR A 31 -3.829 -1.941 1.003 1.00 0.27 H ATOM 503 HG1 THR A 31 -5.806 -3.085 2.684 1.00 1.01 H ATOM 504 HG21 THR A 31 -4.143 -4.557 2.417 1.00 1.19 H ATOM 505 HG22 THR A 31 -2.565 -3.952 1.915 1.00 1.16 H ATOM 506 HG23 THR A 31 -3.821 -4.250 0.711 1.00 1.18 H ATOM 507 N CYS A 32 -1.441 -0.793 2.467 1.00 0.24 N ATOM 508 CA CYS A 32 0.016 -0.708 2.343 1.00 0.26 C ATOM 509 C CYS A 32 0.661 -0.275 3.660 1.00 0.24 C ATOM 510 O CYS A 32 1.869 -0.420 3.845 1.00 0.26 O ATOM 511 CB CYS A 32 0.406 0.263 1.223 1.00 0.31 C ATOM 512 SG CYS A 32 2.188 0.646 1.145 1.00 0.89 S ATOM 513 H CYS A 32 -2.006 -0.074 2.111 1.00 0.22 H ATOM 514 HA CYS A 32 0.380 -1.693 2.091 1.00 0.31 H ATOM 515 HB2 CYS A 32 0.127 -0.167 0.274 1.00 0.47 H ATOM 516 HB3 CYS A 32 -0.125 1.192 1.360 1.00 0.43 H ATOM 517 N GLY A 33 -0.148 0.250 4.570 1.00 0.24 N ATOM 518 CA GLY A 33 0.364 0.693 5.854 1.00 0.29 C ATOM 519 C GLY A 33 0.793 2.149 5.844 1.00 0.35 C ATOM 520 O GLY A 33 1.911 2.477 6.241 1.00 0.46 O ATOM 521 H GLY A 33 -1.102 0.337 4.369 1.00 0.24 H ATOM 522 HA2 GLY A 33 -0.407 0.562 6.600 1.00 0.35 H ATOM 523 HA3 GLY A 33 1.213 0.081 6.120 1.00 0.29 H ATOM 524 N THR A 34 -0.103 3.023 5.393 1.00 0.34 N ATOM 525 CA THR A 34 0.183 4.457 5.337 1.00 0.44 C ATOM 526 C THR A 34 -1.093 5.291 5.468 1.00 0.52 C ATOM 527 O THR A 34 -1.062 6.404 5.991 1.00 0.68 O ATOM 528 CB THR A 34 0.904 4.817 4.033 1.00 0.51 C ATOM 529 OG1 THR A 34 1.257 6.189 4.021 1.00 1.06 O ATOM 530 CG2 THR A 34 0.081 4.549 2.793 1.00 0.54 C ATOM 531 H THR A 34 -0.975 2.696 5.096 1.00 0.32 H ATOM 532 HA THR A 34 0.832 4.692 6.167 1.00 0.50 H ATOM 533 HB THR A 34 1.809 4.237 3.960 1.00 0.78 H ATOM 534 HG1 THR A 34 1.840 6.363 3.279 1.00 1.39 H ATOM 535 HG21 THR A 34 -0.892 5.005 2.903 1.00 1.16 H ATOM 536 HG22 THR A 34 -0.033 3.481 2.659 1.00 1.26 H ATOM 537 HG23 THR A 34 0.580 4.968 1.932 1.00 1.18 H ATOM 538 N CYS A 35 -2.212 4.754 4.985 1.00 0.49 N ATOM 539 CA CYS A 35 -3.487 5.458 5.045 1.00 0.62 C ATOM 540 C CYS A 35 -3.436 6.743 4.222 1.00 0.95 C ATOM 541 O CYS A 35 -2.814 6.724 3.139 1.00 1.71 O ATOM 542 CB CYS A 35 -3.853 5.775 6.496 1.00 1.04 C ATOM 543 SG CYS A 35 -5.549 6.409 6.717 1.00 1.59 S ATOM 544 OXT CYS A 35 -4.015 7.757 4.665 1.00 1.64 O ATOM 545 H CYS A 35 -2.180 3.866 4.573 1.00 0.43 H ATOM 546 HA CYS A 35 -4.241 4.808 4.628 1.00 1.30 H ATOM 547 HB2 CYS A 35 -3.759 4.877 7.088 1.00 1.71 H ATOM 548 HB3 CYS A 35 -3.170 6.522 6.873 1.00 1.53 H