ATOM 45 N ASP A 5 -7.979 0.463 -0.359 1.00 0.20 N ATOM 46 CA ASP A 5 -6.904 -0.315 -0.943 1.00 0.25 C ATOM 47 C ASP A 5 -7.141 -0.546 -2.430 1.00 0.23 C ATOM 48 O ASP A 5 -8.181 -1.067 -2.834 1.00 0.26 O ATOM 49 CB ASP A 5 -6.783 -1.654 -0.217 1.00 0.32 C ATOM 50 CG ASP A 5 -8.017 -2.518 -0.383 1.00 0.40 C ATOM 51 OD1 ASP A 5 -9.115 -1.955 -0.577 1.00 1.11 O ATOM 52 OD2 ASP A 5 -7.886 -3.759 -0.320 1.00 1.24 O ATOM 53 H ASP A 5 -8.846 0.042 -0.235 1.00 0.23 H ATOM 54 HA ASP A 5 -5.986 0.239 -0.815 1.00 0.33 H ATOM 55 HB2 ASP A 5 -5.934 -2.194 -0.603 1.00 0.30 H ATOM 56 HB3 ASP A 5 -6.638 -1.466 0.834 1.00 0.38 H ATOM 57 N TYR A 6 -6.163 -0.159 -3.234 1.00 0.19 N ATOM 58 CA TYR A 6 -6.242 -0.321 -4.682 1.00 0.20 C ATOM 59 C TYR A 6 -6.044 -1.780 -5.091 1.00 0.19 C ATOM 60 O TYR A 6 -6.164 -2.121 -6.266 1.00 0.23 O ATOM 61 CB TYR A 6 -5.183 0.549 -5.367 1.00 0.20 C ATOM 62 CG TYR A 6 -5.658 1.181 -6.656 1.00 0.41 C ATOM 63 CD1 TYR A 6 -5.773 0.431 -7.820 1.00 1.24 C ATOM 64 CD2 TYR A 6 -5.992 2.528 -6.709 1.00 1.37 C ATOM 65 CE1 TYR A 6 -6.206 1.006 -9.000 1.00 1.33 C ATOM 66 CE2 TYR A 6 -6.427 3.110 -7.884 1.00 1.54 C ATOM 67 CZ TYR A 6 -6.532 2.345 -9.026 1.00 0.94 C ATOM 68 OH TYR A 6 -6.964 2.921 -10.199 1.00 1.21 O ATOM 69 H TYR A 6 -5.365 0.244 -2.841 1.00 0.18 H ATOM 70 HA TYR A 6 -7.221 0.002 -5.001 1.00 0.23 H ATOM 71 HB2 TYR A 6 -4.895 1.344 -4.697 1.00 0.30 H ATOM 72 HB3 TYR A 6 -4.314 -0.058 -5.592 1.00 0.25 H ATOM 73 HD1 TYR A 6 -5.517 -0.618 -7.796 1.00 2.12 H ATOM 74 HD2 TYR A 6 -5.908 3.125 -5.813 1.00 2.21 H ATOM 75 HE1 TYR A 6 -6.289 0.406 -9.894 1.00 2.18 H ATOM 76 HE2 TYR A 6 -6.682 4.160 -7.905 1.00 2.44 H ATOM 77 HH TYR A 6 -7.762 3.428 -10.032 1.00 1.49 H ATOM 78 N LEU A 7 -5.732 -2.634 -4.118 1.00 0.18 N ATOM 79 CA LEU A 7 -5.503 -4.049 -4.383 1.00 0.19 C ATOM 80 C LEU A 7 -5.760 -4.882 -3.133 1.00 0.20 C ATOM 81 O LEU A 7 -6.024 -4.341 -2.059 1.00 0.20 O ATOM 82 CB LEU A 7 -4.062 -4.265 -4.843 1.00 0.18 C ATOM 83 CG LEU A 7 -3.799 -4.035 -6.330 1.00 0.21 C ATOM 84 CD1 LEU A 7 -2.402 -3.474 -6.529 1.00 0.24 C ATOM 85 CD2 LEU A 7 -3.976 -5.333 -7.106 1.00 0.21 C ATOM 86 H LEU A 7 -5.647 -2.304 -3.200 1.00 0.19 H ATOM 87 HA LEU A 7 -6.177 -4.363 -5.165 1.00 0.21 H ATOM 88 HB2 LEU A 7 -3.429 -3.601 -4.282 1.00 0.17 H ATOM 89 HB3 LEU A 7 -3.780 -5.272 -4.608 1.00 0.18 H ATOM 90 HG LEU A 7 -4.506 -3.315 -6.711 1.00 0.24 H ATOM 91 HD11 LEU A 7 -2.455 -2.399 -6.619 1.00 1.03 H ATOM 92 HD12 LEU A 7 -1.969 -3.892 -7.425 1.00 1.07 H ATOM 93 HD13 LEU A 7 -1.790 -3.733 -5.677 1.00 1.01 H ATOM 94 HD21 LEU A 7 -3.128 -5.483 -7.758 1.00 1.04 H ATOM 95 HD22 LEU A 7 -4.879 -5.279 -7.696 1.00 1.02 H ATOM 96 HD23 LEU A 7 -4.048 -6.160 -6.414 1.00 1.01 H ATOM 97 N PRO A 8 -5.675 -6.218 -3.252 1.00 0.21 N ATOM 98 CA PRO A 8 -5.886 -7.134 -2.134 1.00 0.23 C ATOM 99 C PRO A 8 -4.971 -6.869 -0.968 1.00 0.21 C ATOM 100 O PRO A 8 -3.994 -6.126 -1.061 1.00 0.18 O ATOM 101 CB PRO A 8 -5.588 -8.507 -2.712 1.00 0.26 C ATOM 102 CG PRO A 8 -5.871 -8.339 -4.144 1.00 0.25 C ATOM 103 CD PRO A 8 -5.361 -6.964 -4.481 1.00 0.22 C ATOM 104 HA PRO A 8 -6.910 -7.105 -1.794 1.00 0.25 H ATOM 105 HB2 PRO A 8 -4.554 -8.763 -2.534 1.00 0.26 H ATOM 106 HB3 PRO A 8 -6.236 -9.244 -2.263 1.00 0.29 H ATOM 107 HG2 PRO A 8 -5.350 -9.094 -4.702 1.00 0.23 H ATOM 108 HG3 PRO A 8 -6.935 -8.398 -4.303 1.00 0.28 H ATOM 109 HD2 PRO A 8 -4.296 -6.989 -4.659 1.00 0.20 H ATOM 110 HD3 PRO A 8 -5.880 -6.552 -5.331 1.00 0.23 H ATOM 111 N LYS A 9 -5.311 -7.503 0.125 1.00 0.23 N ATOM 112 CA LYS A 9 -4.545 -7.383 1.358 1.00 0.23 C ATOM 113 C LYS A 9 -3.104 -7.850 1.156 1.00 0.22 C ATOM 114 O LYS A 9 -2.218 -7.515 1.943 1.00 0.22 O ATOM 115 CB LYS A 9 -5.204 -8.198 2.472 1.00 0.26 C ATOM 116 CG LYS A 9 -6.670 -7.859 2.689 1.00 0.30 C ATOM 117 CD LYS A 9 -6.834 -6.661 3.610 1.00 1.00 C ATOM 118 CE LYS A 9 -8.095 -6.773 4.451 1.00 1.48 C ATOM 119 NZ LYS A 9 -8.802 -5.468 4.568 1.00 2.12 N ATOM 120 H LYS A 9 -6.100 -8.089 0.089 1.00 0.25 H ATOM 121 HA LYS A 9 -4.538 -6.342 1.643 1.00 0.22 H ATOM 122 HB2 LYS A 9 -5.133 -9.247 2.225 1.00 0.28 H ATOM 123 HB3 LYS A 9 -4.674 -8.019 3.395 1.00 0.27 H ATOM 124 HG2 LYS A 9 -7.122 -7.632 1.736 1.00 0.86 H ATOM 125 HG3 LYS A 9 -7.165 -8.712 3.131 1.00 0.79 H ATOM 126 HD2 LYS A 9 -5.979 -6.605 4.268 1.00 1.52 H ATOM 127 HD3 LYS A 9 -6.889 -5.764 3.011 1.00 1.72 H ATOM 128 HE2 LYS A 9 -8.758 -7.491 3.991 1.00 2.03 H ATOM 129 HE3 LYS A 9 -7.825 -7.116 5.439 1.00 1.89 H ATOM 130 HZ1 LYS A 9 -8.466 -4.953 5.407 1.00 2.47 H ATOM 131 HZ2 LYS A 9 -9.827 -5.623 4.658 1.00 2.52 H ATOM 132 HZ3 LYS A 9 -8.623 -4.887 3.724 1.00 2.60 H ATOM 133 N SER A 10 -2.878 -8.635 0.105 1.00 0.22 N ATOM 134 CA SER A 10 -1.549 -9.159 -0.191 1.00 0.23 C ATOM 135 C SER A 10 -0.709 -8.174 -1.006 1.00 0.22 C ATOM 136 O SER A 10 0.490 -8.032 -0.768 1.00 0.24 O ATOM 137 CB SER A 10 -1.663 -10.485 -0.945 1.00 0.27 C ATOM 138 OG SER A 10 -2.428 -11.426 -0.211 1.00 1.24 O ATOM 139 H SER A 10 -3.625 -8.877 -0.481 1.00 0.23 H ATOM 140 HA SER A 10 -1.051 -9.339 0.750 1.00 0.23 H ATOM 141 HB2 SER A 10 -2.142 -10.315 -1.897 1.00 1.04 H ATOM 142 HB3 SER A 10 -0.674 -10.890 -1.107 1.00 0.97 H ATOM 143 HG SER A 10 -1.890 -11.796 0.493 1.00 1.69 H ATOM 144 N GLU A 11 -1.329 -7.514 -1.981 1.00 0.23 N ATOM 145 CA GLU A 11 -0.614 -6.570 -2.834 1.00 0.26 C ATOM 146 C GLU A 11 -0.023 -5.426 -2.037 1.00 0.26 C ATOM 147 O GLU A 11 1.084 -4.965 -2.314 1.00 0.30 O ATOM 148 CB GLU A 11 -1.569 -5.994 -3.869 1.00 0.31 C ATOM 149 CG GLU A 11 -1.323 -6.501 -5.276 1.00 0.38 C ATOM 150 CD GLU A 11 -0.323 -5.656 -6.041 1.00 0.53 C ATOM 151 OE1 GLU A 11 0.463 -4.934 -5.392 1.00 1.31 O ATOM 152 OE2 GLU A 11 -0.326 -5.716 -7.288 1.00 1.16 O ATOM 153 H GLU A 11 -2.283 -7.674 -2.145 1.00 0.22 H ATOM 154 HA GLU A 11 0.180 -7.100 -3.333 1.00 0.28 H ATOM 155 HB2 GLU A 11 -2.577 -6.258 -3.587 1.00 0.26 H ATOM 156 HB3 GLU A 11 -1.474 -4.911 -3.866 1.00 0.38 H ATOM 157 HG2 GLU A 11 -0.948 -7.512 -5.220 1.00 0.38 H ATOM 158 HG3 GLU A 11 -2.262 -6.496 -5.807 1.00 0.38 H ATOM 159 N CYS A 12 -0.767 -4.972 -1.050 1.00 0.26 N ATOM 160 CA CYS A 12 -0.311 -3.877 -0.214 1.00 0.30 C ATOM 161 C CYS A 12 0.133 -4.412 1.132 1.00 0.24 C ATOM 162 O CYS A 12 -0.681 -4.752 1.990 1.00 0.28 O ATOM 163 CB CYS A 12 -1.394 -2.801 -0.062 1.00 0.46 C ATOM 164 SG CYS A 12 -3.059 -3.297 -0.613 1.00 0.80 S ATOM 165 H CYS A 12 -1.639 -5.383 -0.880 1.00 0.24 H ATOM 166 HA CYS A 12 0.548 -3.437 -0.701 1.00 0.35 H ATOM 167 HB2 CYS A 12 -1.464 -2.502 0.977 1.00 0.48 H ATOM 168 HB3 CYS A 12 -1.104 -1.947 -0.655 1.00 0.45 H ATOM 169 N THR A 13 1.440 -4.505 1.290 1.00 0.22 N ATOM 170 CA THR A 13 2.031 -5.022 2.507 1.00 0.20 C ATOM 171 C THR A 13 2.770 -3.922 3.246 1.00 0.22 C ATOM 172 O THR A 13 3.307 -3.005 2.625 1.00 0.23 O ATOM 173 CB THR A 13 2.998 -6.157 2.154 1.00 0.19 C ATOM 174 OG1 THR A 13 3.821 -5.786 1.066 1.00 0.19 O ATOM 175 CG2 THR A 13 2.292 -7.441 1.768 1.00 0.21 C ATOM 176 H THR A 13 2.029 -4.232 0.553 1.00 0.28 H ATOM 177 HA THR A 13 1.242 -5.406 3.134 1.00 0.25 H ATOM 178 HB THR A 13 3.638 -6.362 3.002 1.00 0.24 H ATOM 179 HG1 THR A 13 4.726 -6.050 1.244 1.00 0.78 H ATOM 180 HG21 THR A 13 2.997 -8.258 1.783 1.00 1.03 H ATOM 181 HG22 THR A 13 1.879 -7.339 0.772 1.00 1.04 H ATOM 182 HG23 THR A 13 1.495 -7.639 2.469 1.00 1.04 H ATOM 183 N GLN A 14 2.825 -4.026 4.572 1.00 0.29 N ATOM 184 CA GLN A 14 3.540 -3.040 5.374 1.00 0.33 C ATOM 185 C GLN A 14 4.920 -2.806 4.766 1.00 0.28 C ATOM 186 O GLN A 14 5.505 -1.731 4.894 1.00 0.31 O ATOM 187 CB GLN A 14 3.658 -3.516 6.823 1.00 0.42 C ATOM 188 CG GLN A 14 2.342 -4.011 7.407 1.00 0.72 C ATOM 189 CD GLN A 14 1.198 -3.036 7.190 1.00 0.88 C ATOM 190 OE1 GLN A 14 1.102 -2.016 7.872 1.00 1.81 O ATOM 191 NE2 GLN A 14 0.323 -3.345 6.237 1.00 0.77 N ATOM 192 H GLN A 14 2.398 -4.789 5.014 1.00 0.34 H ATOM 193 HA GLN A 14 2.983 -2.116 5.344 1.00 0.35 H ATOM 194 HB2 GLN A 14 4.375 -4.323 6.868 1.00 0.67 H ATOM 195 HB3 GLN A 14 4.012 -2.697 7.432 1.00 0.49 H ATOM 196 HG2 GLN A 14 2.086 -4.951 6.940 1.00 1.40 H ATOM 197 HG3 GLN A 14 2.470 -4.162 8.469 1.00 1.41 H ATOM 198 HE21 GLN A 14 0.458 -4.174 5.732 1.00 0.91 H ATOM 199 HE22 GLN A 14 -0.424 -2.730 6.078 1.00 1.26 H ATOM 200 N PHE A 15 5.406 -3.831 4.071 1.00 0.25 N ATOM 201 CA PHE A 15 6.684 -3.783 3.390 1.00 0.26 C ATOM 202 C PHE A 15 6.644 -2.764 2.249 1.00 0.22 C ATOM 203 O PHE A 15 7.456 -1.842 2.201 1.00 0.24 O ATOM 204 CB PHE A 15 7.013 -5.176 2.851 1.00 0.29 C ATOM 205 CG PHE A 15 7.989 -5.937 3.700 1.00 0.37 C ATOM 206 CD1 PHE A 15 9.317 -5.547 3.777 1.00 1.14 C ATOM 207 CD2 PHE A 15 7.577 -7.045 4.424 1.00 1.25 C ATOM 208 CE1 PHE A 15 10.215 -6.248 4.559 1.00 1.17 C ATOM 209 CE2 PHE A 15 8.471 -7.750 5.208 1.00 1.29 C ATOM 210 CZ PHE A 15 9.791 -7.351 5.275 1.00 0.52 C ATOM 211 H PHE A 15 4.871 -4.648 3.998 1.00 0.26 H ATOM 212 HA PHE A 15 7.438 -3.489 4.104 1.00 0.31 H ATOM 213 HB2 PHE A 15 6.102 -5.753 2.803 1.00 0.27 H ATOM 214 HB3 PHE A 15 7.421 -5.088 1.860 1.00 0.29 H ATOM 215 HD1 PHE A 15 9.649 -4.685 3.218 1.00 2.00 H ATOM 216 HD2 PHE A 15 6.545 -7.358 4.372 1.00 2.10 H ATOM 217 HE1 PHE A 15 11.247 -5.934 4.610 1.00 2.01 H ATOM 218 HE2 PHE A 15 8.137 -8.612 5.766 1.00 2.15 H ATOM 219 HZ PHE A 15 10.491 -7.900 5.888 1.00 0.58 H ATOM 220 N ARG A 16 5.684 -2.933 1.337 1.00 0.19 N ATOM 221 CA ARG A 16 5.530 -2.024 0.198 1.00 0.20 C ATOM 222 C ARG A 16 5.500 -0.574 0.654 1.00 0.17 C ATOM 223 O ARG A 16 6.249 0.262 0.151 1.00 0.19 O ATOM 224 CB ARG A 16 4.247 -2.341 -0.572 1.00 0.32 C ATOM 225 CG ARG A 16 4.188 -3.759 -1.103 1.00 0.24 C ATOM 226 CD ARG A 16 5.110 -3.948 -2.297 1.00 0.40 C ATOM 227 NE ARG A 16 6.431 -4.430 -1.897 1.00 0.78 N ATOM 228 CZ ARG A 16 7.469 -4.520 -2.725 1.00 0.89 C ATOM 229 NH1 ARG A 16 7.346 -4.164 -3.998 1.00 1.49 N ATOM 230 NH2 ARG A 16 8.635 -4.967 -2.279 1.00 1.39 N ATOM 231 H ARG A 16 5.062 -3.683 1.435 1.00 0.18 H ATOM 232 HA ARG A 16 6.377 -2.160 -0.456 1.00 0.26 H ATOM 233 HB2 ARG A 16 3.402 -2.193 0.083 1.00 0.54 H ATOM 234 HB3 ARG A 16 4.164 -1.665 -1.407 1.00 0.47 H ATOM 235 HG2 ARG A 16 4.488 -4.434 -0.321 1.00 0.23 H ATOM 236 HG3 ARG A 16 3.173 -3.975 -1.402 1.00 0.37 H ATOM 237 HD2 ARG A 16 4.665 -4.664 -2.971 1.00 0.87 H ATOM 238 HD3 ARG A 16 5.222 -3.000 -2.803 1.00 0.69 H ATOM 239 HE ARG A 16 6.550 -4.700 -0.963 1.00 1.52 H ATOM 240 HH11 ARG A 16 6.469 -3.826 -4.341 1.00 1.80 H ATOM 241 HH12 ARG A 16 8.130 -4.234 -4.614 1.00 1.98 H ATOM 242 HH21 ARG A 16 8.734 -5.236 -1.321 1.00 1.96 H ATOM 243 HH22 ARG A 16 9.416 -5.035 -2.901 1.00 1.54 H ATOM 244 N CYS A 17 4.634 -0.280 1.612 1.00 0.24 N ATOM 245 CA CYS A 17 4.519 1.071 2.133 1.00 0.33 C ATOM 246 C CYS A 17 5.806 1.487 2.853 1.00 0.34 C ATOM 247 O CYS A 17 5.989 2.656 3.189 1.00 0.45 O ATOM 248 CB CYS A 17 3.316 1.178 3.069 1.00 0.48 C ATOM 249 SG CYS A 17 2.274 2.645 2.777 1.00 0.58 S ATOM 250 H CYS A 17 4.063 -0.987 1.979 1.00 0.27 H ATOM 251 HA CYS A 17 4.364 1.729 1.297 1.00 0.36 H ATOM 252 HB2 CYS A 17 2.703 0.308 2.946 1.00 0.92 H ATOM 253 HB3 CYS A 17 3.667 1.225 4.088 1.00 0.83 H ATOM 254 N ARG A 18 6.695 0.520 3.087 1.00 0.30 N ATOM 255 CA ARG A 18 7.960 0.787 3.764 1.00 0.40 C ATOM 256 C ARG A 18 9.045 1.210 2.803 1.00 0.41 C ATOM 257 O ARG A 18 9.787 2.161 3.042 1.00 0.51 O ATOM 258 CB ARG A 18 8.465 -0.481 4.457 1.00 0.45 C ATOM 259 CG ARG A 18 8.802 -0.284 5.925 1.00 0.60 C ATOM 260 CD ARG A 18 9.899 0.752 6.110 1.00 1.08 C ATOM 261 NE ARG A 18 10.429 0.752 7.472 1.00 1.48 N ATOM 262 CZ ARG A 18 11.513 1.429 7.845 1.00 2.14 C ATOM 263 NH1 ARG A 18 12.184 2.159 6.963 1.00 2.62 N ATOM 264 NH2 ARG A 18 11.928 1.376 9.104 1.00 2.87 N ATOM 265 H ARG A 18 6.496 -0.393 2.802 1.00 0.26 H ATOM 266 HA ARG A 18 7.812 1.548 4.490 1.00 0.48 H ATOM 267 HB2 ARG A 18 7.706 -1.245 4.381 1.00 0.57 H ATOM 268 HB3 ARG A 18 9.369 -0.822 3.939 1.00 0.57 H ATOM 269 HG2 ARG A 18 7.917 0.047 6.448 1.00 1.04 H ATOM 270 HG3 ARG A 18 9.135 -1.226 6.337 1.00 1.01 H ATOM 271 HD2 ARG A 18 10.703 0.532 5.422 1.00 1.66 H ATOM 272 HD3 ARG A 18 9.495 1.729 5.890 1.00 1.70 H ATOM 273 HE ARG A 18 9.952 0.221 8.143 1.00 1.87 H ATOM 274 HH11 ARG A 18 11.877 2.204 6.013 1.00 2.57 H ATOM 275 HH12 ARG A 18 12.997 2.666 7.250 1.00 3.34 H ATOM 276 HH21 ARG A 18 11.426 0.827 9.773 1.00 3.09 H ATOM 277 HH22 ARG A 18 12.742 1.884 9.384 1.00 3.44 H ATOM 278 N THR A 19 9.176 0.420 1.766 1.00 0.36 N ATOM 279 CA THR A 19 10.222 0.602 0.792 1.00 0.41 C ATOM 280 C THR A 19 9.698 0.941 -0.606 1.00 0.38 C ATOM 281 O THR A 19 10.360 1.645 -1.368 1.00 0.59 O ATOM 282 CB THR A 19 11.023 -0.686 0.807 1.00 0.48 C ATOM 283 OG1 THR A 19 12.007 -0.710 -0.212 1.00 0.56 O ATOM 284 CG2 THR A 19 10.147 -1.907 0.664 1.00 0.46 C ATOM 285 H THR A 19 8.583 -0.355 1.686 1.00 0.31 H ATOM 286 HA THR A 19 10.856 1.405 1.129 1.00 0.48 H ATOM 287 HB THR A 19 11.508 -0.762 1.777 1.00 0.55 H ATOM 288 HG1 THR A 19 12.711 -0.097 0.008 1.00 1.06 H ATOM 289 HG21 THR A 19 10.760 -2.794 0.635 1.00 1.13 H ATOM 290 HG22 THR A 19 9.569 -1.832 -0.244 1.00 1.04 H ATOM 291 HG23 THR A 19 9.478 -1.956 1.517 1.00 1.15 H ATOM 292 N SER A 20 8.516 0.434 -0.943 1.00 0.33 N ATOM 293 CA SER A 20 7.924 0.686 -2.256 1.00 0.32 C ATOM 294 C SER A 20 7.126 1.989 -2.265 1.00 0.28 C ATOM 295 O SER A 20 5.911 1.980 -2.079 1.00 0.42 O ATOM 296 CB SER A 20 7.019 -0.480 -2.660 1.00 0.35 C ATOM 297 OG SER A 20 6.473 -0.279 -3.952 1.00 0.73 O ATOM 298 H SER A 20 8.034 -0.126 -0.300 1.00 0.47 H ATOM 299 HA SER A 20 8.728 0.768 -2.971 1.00 0.40 H ATOM 300 HB2 SER A 20 7.595 -1.394 -2.665 1.00 0.64 H ATOM 301 HB3 SER A 20 6.211 -0.568 -1.950 1.00 0.58 H ATOM 302 HG SER A 20 6.385 -1.125 -4.398 1.00 0.97 H ATOM 303 N MET A 21 7.823 3.104 -2.484 1.00 0.27 N ATOM 304 CA MET A 21 7.192 4.427 -2.517 1.00 0.25 C ATOM 305 C MET A 21 5.929 4.442 -3.377 1.00 0.25 C ATOM 306 O MET A 21 4.896 4.971 -2.965 1.00 0.38 O ATOM 307 CB MET A 21 8.183 5.472 -3.037 1.00 0.35 C ATOM 308 CG MET A 21 8.829 6.298 -1.936 1.00 0.42 C ATOM 309 SD MET A 21 10.631 6.284 -2.019 1.00 0.95 S ATOM 310 CE MET A 21 11.045 5.935 -0.312 1.00 1.66 C ATOM 311 H MET A 21 8.790 3.038 -2.627 1.00 0.40 H ATOM 312 HA MET A 21 6.919 4.685 -1.505 1.00 0.26 H ATOM 313 HB2 MET A 21 8.963 4.967 -3.587 1.00 0.43 H ATOM 314 HB3 MET A 21 7.664 6.145 -3.704 1.00 0.42 H ATOM 315 HG2 MET A 21 8.489 7.318 -2.025 1.00 0.66 H ATOM 316 HG3 MET A 21 8.522 5.899 -0.980 1.00 0.42 H ATOM 317 HE1 MET A 21 11.903 6.522 -0.022 1.00 2.14 H ATOM 318 HE2 MET A 21 11.275 4.885 -0.205 1.00 2.17 H ATOM 319 HE3 MET A 21 10.206 6.185 0.320 1.00 2.19 H ATOM 320 N LYS A 22 6.014 3.870 -4.570 1.00 0.28 N ATOM 321 CA LYS A 22 4.872 3.834 -5.477 1.00 0.35 C ATOM 322 C LYS A 22 3.676 3.144 -4.826 1.00 0.32 C ATOM 323 O LYS A 22 2.597 3.723 -4.711 1.00 0.47 O ATOM 324 CB LYS A 22 5.246 3.114 -6.773 1.00 0.45 C ATOM 325 CG LYS A 22 4.142 3.130 -7.820 1.00 0.58 C ATOM 326 CD LYS A 22 3.515 1.755 -7.999 1.00 1.33 C ATOM 327 CE LYS A 22 3.631 1.270 -9.436 1.00 1.62 C ATOM 328 NZ LYS A 22 2.421 0.519 -9.868 1.00 2.35 N ATOM 329 H LYS A 22 6.863 3.469 -4.852 1.00 0.37 H ATOM 330 HA LYS A 22 4.601 4.854 -5.708 1.00 0.39 H ATOM 331 HB2 LYS A 22 6.119 3.589 -7.196 1.00 0.48 H ATOM 332 HB3 LYS A 22 5.483 2.086 -6.544 1.00 0.47 H ATOM 333 HG2 LYS A 22 3.376 3.824 -7.508 1.00 1.38 H ATOM 334 HG3 LYS A 22 4.560 3.453 -8.763 1.00 1.13 H ATOM 335 HD2 LYS A 22 4.018 1.052 -7.353 1.00 1.94 H ATOM 336 HD3 LYS A 22 2.470 1.809 -7.731 1.00 2.10 H ATOM 337 HE2 LYS A 22 3.762 2.126 -10.082 1.00 1.80 H ATOM 338 HE3 LYS A 22 4.493 0.624 -9.516 1.00 2.10 H ATOM 339 HZ1 LYS A 22 1.602 0.797 -9.290 1.00 2.86 H ATOM 340 HZ2 LYS A 22 2.576 -0.503 -9.760 1.00 2.67 H ATOM 341 HZ3 LYS A 22 2.212 0.722 -10.867 1.00 2.77 H ATOM 342 N TYR A 23 3.876 1.901 -4.411 1.00 0.24 N ATOM 343 CA TYR A 23 2.820 1.114 -3.780 1.00 0.23 C ATOM 344 C TYR A 23 2.140 1.864 -2.640 1.00 0.25 C ATOM 345 O TYR A 23 0.915 1.862 -2.523 1.00 0.33 O ATOM 346 CB TYR A 23 3.398 -0.190 -3.234 1.00 0.25 C ATOM 347 CG TYR A 23 3.522 -1.280 -4.267 1.00 0.25 C ATOM 348 CD1 TYR A 23 4.077 -1.018 -5.509 1.00 1.16 C ATOM 349 CD2 TYR A 23 3.084 -2.568 -3.997 1.00 1.26 C ATOM 350 CE1 TYR A 23 4.193 -2.014 -6.461 1.00 1.18 C ATOM 351 CE2 TYR A 23 3.196 -3.570 -4.940 1.00 1.26 C ATOM 352 CZ TYR A 23 3.751 -3.289 -6.171 1.00 0.36 C ATOM 353 OH TYR A 23 3.865 -4.284 -7.114 1.00 0.44 O ATOM 354 H TYR A 23 4.759 1.496 -4.536 1.00 0.30 H ATOM 355 HA TYR A 23 2.085 0.880 -4.533 1.00 0.26 H ATOM 356 HB2 TYR A 23 4.384 0.001 -2.836 1.00 0.29 H ATOM 357 HB3 TYR A 23 2.761 -0.554 -2.441 1.00 0.27 H ATOM 358 HD1 TYR A 23 4.421 -0.018 -5.727 1.00 2.06 H ATOM 359 HD2 TYR A 23 2.650 -2.782 -3.032 1.00 2.17 H ATOM 360 HE1 TYR A 23 4.628 -1.792 -7.424 1.00 2.10 H ATOM 361 HE2 TYR A 23 2.850 -4.567 -4.710 1.00 2.17 H ATOM 362 HH TYR A 23 4.524 -4.921 -6.830 1.00 0.83 H ATOM 363 N ARG A 24 2.947 2.464 -1.778 1.00 0.25 N ATOM 364 CA ARG A 24 2.427 3.179 -0.607 1.00 0.29 C ATOM 365 C ARG A 24 1.243 4.083 -0.942 1.00 0.31 C ATOM 366 O ARG A 24 0.147 3.918 -0.407 1.00 0.32 O ATOM 367 CB ARG A 24 3.510 4.065 0.024 1.00 0.35 C ATOM 368 CG ARG A 24 4.934 3.575 -0.149 1.00 0.36 C ATOM 369 CD ARG A 24 5.871 4.302 0.799 1.00 0.31 C ATOM 370 NE ARG A 24 7.223 3.752 0.781 1.00 0.36 N ATOM 371 CZ ARG A 24 8.296 4.429 1.191 1.00 0.39 C ATOM 372 NH1 ARG A 24 8.169 5.666 1.658 1.00 0.38 N ATOM 373 NH2 ARG A 24 9.496 3.871 1.139 1.00 0.47 N ATOM 374 H ARG A 24 3.915 2.396 -1.912 1.00 0.28 H ATOM 375 HA ARG A 24 2.113 2.443 0.116 1.00 0.30 H ATOM 376 HB2 ARG A 24 3.448 5.044 -0.421 1.00 0.49 H ATOM 377 HB3 ARG A 24 3.313 4.156 1.079 1.00 0.61 H ATOM 378 HG2 ARG A 24 4.975 2.518 0.050 1.00 0.65 H ATOM 379 HG3 ARG A 24 5.244 3.766 -1.161 1.00 0.54 H ATOM 380 HD2 ARG A 24 5.914 5.341 0.509 1.00 0.33 H ATOM 381 HD3 ARG A 24 5.474 4.228 1.800 1.00 0.42 H ATOM 382 HE ARG A 24 7.339 2.834 0.446 1.00 0.40 H ATOM 383 HH11 ARG A 24 7.267 6.095 1.704 1.00 0.36 H ATOM 384 HH12 ARG A 24 8.977 6.170 1.964 1.00 0.42 H ATOM 385 HH21 ARG A 24 9.599 2.943 0.791 1.00 0.52 H ATOM 386 HH22 ARG A 24 10.298 4.380 1.452 1.00 0.50 H ATOM 387 N LEU A 25 1.495 5.066 -1.790 1.00 0.32 N ATOM 388 CA LEU A 25 0.481 6.045 -2.167 1.00 0.37 C ATOM 389 C LEU A 25 -0.251 5.694 -3.454 1.00 0.36 C ATOM 390 O LEU A 25 -1.449 5.943 -3.588 1.00 0.39 O ATOM 391 CB LEU A 25 1.147 7.408 -2.316 1.00 0.42 C ATOM 392 CG LEU A 25 2.121 7.786 -1.188 1.00 0.43 C ATOM 393 CD1 LEU A 25 1.693 7.172 0.146 1.00 0.42 C ATOM 394 CD2 LEU A 25 3.541 7.362 -1.542 1.00 0.42 C ATOM 395 H LEU A 25 2.402 5.160 -2.149 1.00 0.32 H ATOM 396 HA LEU A 25 -0.239 6.101 -1.364 1.00 0.39 H ATOM 397 HB2 LEU A 25 1.689 7.410 -3.256 1.00 0.42 H ATOM 398 HB3 LEU A 25 0.374 8.160 -2.364 1.00 0.45 H ATOM 399 HG LEU A 25 2.116 8.858 -1.074 1.00 0.47 H ATOM 400 HD11 LEU A 25 0.617 7.195 0.225 1.00 1.09 H ATOM 401 HD12 LEU A 25 2.124 7.738 0.959 1.00 1.08 H ATOM 402 HD13 LEU A 25 2.036 6.148 0.204 1.00 1.09 H ATOM 403 HD21 LEU A 25 3.993 6.868 -0.694 1.00 1.04 H ATOM 404 HD22 LEU A 25 4.123 8.235 -1.800 1.00 1.13 H ATOM 405 HD23 LEU A 25 3.519 6.685 -2.383 1.00 1.06 H ATOM 406 N ASN A 26 0.485 5.163 -4.413 1.00 0.34 N ATOM 407 CA ASN A 26 -0.080 4.832 -5.714 1.00 0.36 C ATOM 408 C ASN A 26 -1.023 3.636 -5.646 1.00 0.32 C ATOM 409 O ASN A 26 -2.057 3.623 -6.314 1.00 0.38 O ATOM 410 CB ASN A 26 1.049 4.567 -6.701 1.00 0.37 C ATOM 411 CG ASN A 26 0.657 4.874 -8.133 1.00 0.54 C ATOM 412 OD1 ASN A 26 0.363 3.970 -8.916 1.00 1.22 O ATOM 413 ND2 ASN A 26 0.653 6.155 -8.484 1.00 1.28 N ATOM 414 H ASN A 26 1.443 5.025 -4.257 1.00 0.32 H ATOM 415 HA ASN A 26 -0.640 5.690 -6.054 1.00 0.42 H ATOM 416 HB2 ASN A 26 1.893 5.190 -6.434 1.00 0.36 H ATOM 417 HB3 ASN A 26 1.338 3.528 -6.637 1.00 0.34 H ATOM 418 HD21 ASN A 26 0.900 6.821 -7.809 1.00 1.98 H ATOM 419 HD22 ASN A 26 0.404 6.381 -9.405 1.00 1.37 H ATOM 420 N LEU A 27 -0.686 2.639 -4.836 1.00 0.27 N ATOM 421 CA LEU A 27 -1.545 1.468 -4.704 1.00 0.27 C ATOM 422 C LEU A 27 -2.530 1.659 -3.548 1.00 0.25 C ATOM 423 O LEU A 27 -3.413 2.512 -3.634 1.00 0.28 O ATOM 424 CB LEU A 27 -0.714 0.194 -4.540 1.00 0.29 C ATOM 425 CG LEU A 27 -0.448 -0.560 -5.841 1.00 0.63 C ATOM 426 CD1 LEU A 27 0.604 0.156 -6.669 1.00 0.91 C ATOM 427 CD2 LEU A 27 -0.025 -1.986 -5.542 1.00 1.05 C ATOM 428 H LEU A 27 0.142 2.697 -4.315 1.00 0.27 H ATOM 429 HA LEU A 27 -2.116 1.390 -5.619 1.00 0.32 H ATOM 430 HB2 LEU A 27 0.233 0.456 -4.095 1.00 0.49 H ATOM 431 HB3 LEU A 27 -1.237 -0.472 -3.873 1.00 0.63 H ATOM 432 HG LEU A 27 -1.360 -0.596 -6.420 1.00 0.93 H ATOM 433 HD11 LEU A 27 1.579 -0.016 -6.240 1.00 1.50 H ATOM 434 HD12 LEU A 27 0.395 1.216 -6.675 1.00 1.21 H ATOM 435 HD13 LEU A 27 0.583 -0.220 -7.681 1.00 1.49 H ATOM 436 HD21 LEU A 27 0.991 -1.992 -5.178 1.00 1.42 H ATOM 437 HD22 LEU A 27 -0.089 -2.577 -6.444 1.00 1.50 H ATOM 438 HD23 LEU A 27 -0.681 -2.402 -4.791 1.00 1.69 H ATOM 439 N CYS A 28 -2.399 0.886 -2.466 1.00 0.25 N ATOM 440 CA CYS A 28 -3.317 1.037 -1.345 1.00 0.23 C ATOM 441 C CYS A 28 -2.819 2.100 -0.380 1.00 0.22 C ATOM 442 O CYS A 28 -1.617 2.257 -0.172 1.00 0.22 O ATOM 443 CB CYS A 28 -3.470 -0.298 -0.619 1.00 0.25 C ATOM 444 SG CYS A 28 -3.660 -1.723 -1.737 1.00 0.50 S ATOM 445 H CYS A 28 -1.687 0.217 -2.421 1.00 0.29 H ATOM 446 HA CYS A 28 -4.277 1.339 -1.731 1.00 0.25 H ATOM 447 HB2 CYS A 28 -2.593 -0.471 -0.012 1.00 0.40 H ATOM 448 HB3 CYS A 28 -4.340 -0.258 0.018 1.00 0.26 H ATOM 449 N LYS A 29 -3.761 2.815 0.217 1.00 0.24 N ATOM 450 CA LYS A 29 -3.440 3.857 1.177 1.00 0.27 C ATOM 451 C LYS A 29 -3.214 3.286 2.566 1.00 0.27 C ATOM 452 O LYS A 29 -2.161 3.463 3.165 1.00 0.30 O ATOM 453 CB LYS A 29 -4.551 4.906 1.214 1.00 0.33 C ATOM 454 CG LYS A 29 -4.456 5.924 0.090 1.00 0.31 C ATOM 455 CD LYS A 29 -3.538 7.078 0.459 1.00 0.81 C ATOM 456 CE LYS A 29 -4.178 7.990 1.493 1.00 0.97 C ATOM 457 NZ LYS A 29 -3.714 9.398 1.354 1.00 1.30 N ATOM 458 H LYS A 29 -4.698 2.624 0.018 1.00 0.26 H ATOM 459 HA LYS A 29 -2.528 4.333 0.850 1.00 0.27 H ATOM 460 HB2 LYS A 29 -5.506 4.407 1.141 1.00 0.39 H ATOM 461 HB3 LYS A 29 -4.501 5.435 2.155 1.00 0.39 H ATOM 462 HG2 LYS A 29 -4.065 5.435 -0.792 1.00 0.44 H ATOM 463 HG3 LYS A 29 -5.442 6.311 -0.118 1.00 0.56 H ATOM 464 HD2 LYS A 29 -2.621 6.679 0.866 1.00 1.21 H ATOM 465 HD3 LYS A 29 -3.321 7.651 -0.430 1.00 1.28 H ATOM 466 HE2 LYS A 29 -5.250 7.960 1.367 1.00 1.60 H ATOM 467 HE3 LYS A 29 -3.922 7.631 2.479 1.00 1.31 H ATOM 468 HZ1 LYS A 29 -4.407 9.951 0.810 1.00 1.81 H ATOM 469 HZ2 LYS A 29 -2.800 9.426 0.860 1.00 1.53 H ATOM 470 HZ3 LYS A 29 -3.601 9.831 2.293 1.00 1.88 H ATOM 471 N LYS A 30 -4.240 2.625 3.080 1.00 0.27 N ATOM 472 CA LYS A 30 -4.195 2.048 4.415 1.00 0.31 C ATOM 473 C LYS A 30 -3.526 0.681 4.451 1.00 0.29 C ATOM 474 O LYS A 30 -2.613 0.451 5.240 1.00 0.31 O ATOM 475 CB LYS A 30 -5.610 1.925 4.973 1.00 0.36 C ATOM 476 CG LYS A 30 -5.674 1.167 6.287 1.00 0.46 C ATOM 477 CD LYS A 30 -5.292 2.054 7.457 1.00 0.57 C ATOM 478 CE LYS A 30 -5.926 1.575 8.754 1.00 1.03 C ATOM 479 NZ LYS A 30 -4.943 1.539 9.872 1.00 1.66 N ATOM 480 H LYS A 30 -5.063 2.540 2.553 1.00 0.26 H ATOM 481 HA LYS A 30 -3.636 2.722 5.045 1.00 0.35 H ATOM 482 HB2 LYS A 30 -6.011 2.914 5.130 1.00 0.41 H ATOM 483 HB3 LYS A 30 -6.222 1.405 4.251 1.00 0.33 H ATOM 484 HG2 LYS A 30 -6.677 0.801 6.433 1.00 0.47 H ATOM 485 HG3 LYS A 30 -4.985 0.334 6.239 1.00 0.48 H ATOM 486 HD2 LYS A 30 -4.218 2.043 7.567 1.00 0.73 H ATOM 487 HD3 LYS A 30 -5.624 3.061 7.253 1.00 0.87 H ATOM 488 HE2 LYS A 30 -6.731 2.245 9.016 1.00 1.61 H ATOM 489 HE3 LYS A 30 -6.321 0.581 8.602 1.00 1.65 H ATOM 490 HZ1 LYS A 30 -4.357 2.398 9.861 1.00 2.20 H ATOM 491 HZ2 LYS A 30 -4.324 0.709 9.778 1.00 2.11 H ATOM 492 HZ3 LYS A 30 -5.441 1.484 10.784 1.00 2.11 H ATOM 493 N THR A 31 -4.029 -0.240 3.640 1.00 0.28 N ATOM 494 CA THR A 31 -3.515 -1.606 3.628 1.00 0.32 C ATOM 495 C THR A 31 -1.989 -1.661 3.629 1.00 0.30 C ATOM 496 O THR A 31 -1.402 -2.579 4.202 1.00 0.37 O ATOM 497 CB THR A 31 -4.062 -2.380 2.435 1.00 0.33 C ATOM 498 OG1 THR A 31 -5.478 -2.431 2.470 1.00 0.44 O ATOM 499 CG2 THR A 31 -3.553 -3.801 2.386 1.00 0.54 C ATOM 500 H THR A 31 -4.789 -0.007 3.063 1.00 0.28 H ATOM 501 HA THR A 31 -3.866 -2.085 4.530 1.00 0.36 H ATOM 502 HB THR A 31 -3.758 -1.886 1.524 1.00 0.27 H ATOM 503 HG1 THR A 31 -5.827 -1.558 2.661 1.00 1.01 H ATOM 504 HG21 THR A 31 -2.576 -3.814 1.931 1.00 1.19 H ATOM 505 HG22 THR A 31 -4.231 -4.406 1.805 1.00 1.16 H ATOM 506 HG23 THR A 31 -3.486 -4.193 3.391 1.00 1.18 H ATOM 507 N CYS A 32 -1.346 -0.691 2.994 1.00 0.24 N ATOM 508 CA CYS A 32 0.123 -0.682 2.956 1.00 0.26 C ATOM 509 C CYS A 32 0.697 -0.201 4.289 1.00 0.24 C ATOM 510 O CYS A 32 1.868 -0.418 4.590 1.00 0.26 O ATOM 511 CB CYS A 32 0.648 0.194 1.808 1.00 0.31 C ATOM 512 SG CYS A 32 0.469 1.982 2.086 1.00 0.89 S ATOM 513 H CYS A 32 -1.863 0.024 2.554 1.00 0.22 H ATOM 514 HA CYS A 32 0.448 -1.699 2.792 1.00 0.31 H ATOM 515 HB2 CYS A 32 1.693 -0.006 1.658 1.00 0.47 H ATOM 516 HB3 CYS A 32 0.112 -0.051 0.903 1.00 0.43 H ATOM 517 N GLY A 33 -0.145 0.427 5.095 1.00 0.24 N ATOM 518 CA GLY A 33 0.290 0.909 6.395 1.00 0.29 C ATOM 519 C GLY A 33 0.824 2.334 6.367 1.00 0.35 C ATOM 520 O GLY A 33 2.010 2.563 6.602 1.00 0.46 O ATOM 521 H GLY A 33 -1.074 0.552 4.810 1.00 0.24 H ATOM 522 HA2 GLY A 33 -0.547 0.869 7.076 1.00 0.35 H ATOM 523 HA3 GLY A 33 1.067 0.255 6.764 1.00 0.29 H ATOM 524 N THR A 34 -0.059 3.293 6.098 1.00 0.34 N ATOM 525 CA THR A 34 0.319 4.707 6.063 1.00 0.44 C ATOM 526 C THR A 34 -0.901 5.598 6.290 1.00 0.52 C ATOM 527 O THR A 34 -0.802 6.650 6.921 1.00 0.68 O ATOM 528 CB THR A 34 0.981 5.076 4.731 1.00 0.51 C ATOM 529 OG1 THR A 34 1.248 6.466 4.673 1.00 1.06 O ATOM 530 CG2 THR A 34 0.138 4.725 3.532 1.00 0.54 C ATOM 531 H THR A 34 -0.992 3.044 5.936 1.00 0.32 H ATOM 532 HA THR A 34 1.024 4.878 6.863 1.00 0.50 H ATOM 533 HB THR A 34 1.917 4.548 4.640 1.00 0.78 H ATOM 534 HG1 THR A 34 1.914 6.636 4.003 1.00 1.39 H ATOM 535 HG21 THR A 34 0.741 4.779 2.636 1.00 1.16 H ATOM 536 HG22 THR A 34 -0.688 5.415 3.454 1.00 1.26 H ATOM 537 HG23 THR A 34 -0.238 3.722 3.649 1.00 1.18 H ATOM 538 N CYS A 35 -2.051 5.171 5.771 1.00 0.49 N ATOM 539 CA CYS A 35 -3.287 5.933 5.917 1.00 0.62 C ATOM 540 C CYS A 35 -3.564 6.255 7.383 1.00 0.95 C ATOM 541 O CYS A 35 -2.838 5.728 8.252 1.00 1.71 O ATOM 542 CB CYS A 35 -4.464 5.154 5.325 1.00 1.04 C ATOM 543 SG CYS A 35 -5.882 6.196 4.852 1.00 1.59 S ATOM 544 OXT CYS A 35 -4.505 7.032 7.650 1.00 1.64 O ATOM 545 H CYS A 35 -2.070 4.324 5.276 1.00 0.43 H ATOM 546 HA CYS A 35 -3.172 6.858 5.373 1.00 1.30 H ATOM 547 HB2 CYS A 35 -4.131 4.632 4.441 1.00 1.71 H ATOM 548 HB3 CYS A 35 -4.812 4.435 6.052 1.00 1.53 H