ATOM 45 N ASP A 5 -7.919 0.768 -0.628 1.00 0.20 N ATOM 46 CA ASP A 5 -6.813 0.030 -1.214 1.00 0.25 C ATOM 47 C ASP A 5 -7.105 -0.375 -2.651 1.00 0.23 C ATOM 48 O ASP A 5 -8.163 -0.925 -2.957 1.00 0.26 O ATOM 49 CB ASP A 5 -6.502 -1.211 -0.378 1.00 0.32 C ATOM 50 CG ASP A 5 -7.667 -2.179 -0.324 1.00 0.40 C ATOM 51 OD1 ASP A 5 -8.809 -1.751 -0.596 1.00 1.24 O ATOM 52 OD2 ASP A 5 -7.439 -3.366 -0.010 1.00 1.11 O ATOM 53 H ASP A 5 -8.801 0.352 -0.594 1.00 0.23 H ATOM 54 HA ASP A 5 -5.953 0.678 -1.209 1.00 0.33 H ATOM 55 HB2 ASP A 5 -5.653 -1.722 -0.805 1.00 0.30 H ATOM 56 HB3 ASP A 5 -6.265 -0.904 0.628 1.00 0.38 H ATOM 57 N TYR A 6 -6.146 -0.105 -3.523 1.00 0.19 N ATOM 58 CA TYR A 6 -6.268 -0.441 -4.936 1.00 0.20 C ATOM 59 C TYR A 6 -6.060 -1.940 -5.168 1.00 0.19 C ATOM 60 O TYR A 6 -6.322 -2.446 -6.258 1.00 0.23 O ATOM 61 CB TYR A 6 -5.251 0.358 -5.756 1.00 0.20 C ATOM 62 CG TYR A 6 -5.873 1.156 -6.880 1.00 0.41 C ATOM 63 CD1 TYR A 6 -6.884 2.074 -6.628 1.00 1.37 C ATOM 64 CD2 TYR A 6 -5.448 0.990 -8.192 1.00 1.24 C ATOM 65 CE1 TYR A 6 -7.455 2.805 -7.652 1.00 1.54 C ATOM 66 CE2 TYR A 6 -6.014 1.718 -9.221 1.00 1.33 C ATOM 67 CZ TYR A 6 -7.017 2.624 -8.946 1.00 0.94 C ATOM 68 OH TYR A 6 -7.582 3.350 -9.969 1.00 1.21 O ATOM 69 H TYR A 6 -5.331 0.329 -3.204 1.00 0.18 H ATOM 70 HA TYR A 6 -7.264 -0.174 -5.256 1.00 0.23 H ATOM 71 HB2 TYR A 6 -4.739 1.050 -5.104 1.00 0.30 H ATOM 72 HB3 TYR A 6 -4.529 -0.321 -6.188 1.00 0.25 H ATOM 73 HD1 TYR A 6 -7.225 2.215 -5.612 1.00 2.21 H ATOM 74 HD2 TYR A 6 -4.663 0.280 -8.404 1.00 2.12 H ATOM 75 HE1 TYR A 6 -8.240 3.515 -7.436 1.00 2.44 H ATOM 76 HE2 TYR A 6 -5.670 1.575 -10.235 1.00 2.18 H ATOM 77 HH TYR A 6 -6.990 4.062 -10.222 1.00 1.49 H ATOM 78 N LEU A 7 -5.585 -2.645 -4.141 1.00 0.18 N ATOM 79 CA LEU A 7 -5.343 -4.081 -4.247 1.00 0.19 C ATOM 80 C LEU A 7 -5.747 -4.796 -2.963 1.00 0.20 C ATOM 81 O LEU A 7 -6.134 -4.154 -1.987 1.00 0.20 O ATOM 82 CB LEU A 7 -3.871 -4.342 -4.565 1.00 0.18 C ATOM 83 CG LEU A 7 -3.531 -4.311 -6.054 1.00 0.21 C ATOM 84 CD1 LEU A 7 -2.113 -3.816 -6.265 1.00 0.24 C ATOM 85 CD2 LEU A 7 -3.719 -5.686 -6.680 1.00 0.21 C ATOM 86 H LEU A 7 -5.391 -2.190 -3.293 1.00 0.19 H ATOM 87 HA LEU A 7 -5.949 -4.458 -5.058 1.00 0.21 H ATOM 88 HB2 LEU A 7 -3.276 -3.602 -4.059 1.00 0.17 H ATOM 89 HB3 LEU A 7 -3.598 -5.299 -4.178 1.00 0.18 H ATOM 90 HG LEU A 7 -4.203 -3.628 -6.550 1.00 0.24 H ATOM 91 HD11 LEU A 7 -1.666 -4.349 -7.090 1.00 1.03 H ATOM 92 HD12 LEU A 7 -1.536 -3.991 -5.369 1.00 1.07 H ATOM 93 HD13 LEU A 7 -2.129 -2.759 -6.484 1.00 1.01 H ATOM 94 HD21 LEU A 7 -2.941 -5.859 -7.409 1.00 1.04 H ATOM 95 HD22 LEU A 7 -4.683 -5.731 -7.165 1.00 1.02 H ATOM 96 HD23 LEU A 7 -3.668 -6.441 -5.913 1.00 1.01 H ATOM 97 N PRO A 8 -5.658 -6.138 -2.935 1.00 0.21 N ATOM 98 CA PRO A 8 -6.008 -6.921 -1.764 1.00 0.23 C ATOM 99 C PRO A 8 -4.862 -7.008 -0.772 1.00 0.21 C ATOM 100 O PRO A 8 -3.726 -6.641 -1.070 1.00 0.18 O ATOM 101 CB PRO A 8 -6.349 -8.279 -2.341 1.00 0.26 C ATOM 102 CG PRO A 8 -5.431 -8.415 -3.491 1.00 0.25 C ATOM 103 CD PRO A 8 -5.188 -7.017 -4.029 1.00 0.22 C ATOM 104 HA PRO A 8 -6.876 -6.512 -1.267 1.00 0.25 H ATOM 105 HB2 PRO A 8 -6.176 -9.045 -1.599 1.00 0.26 H ATOM 106 HB3 PRO A 8 -7.382 -8.296 -2.655 1.00 0.29 H ATOM 107 HG2 PRO A 8 -4.503 -8.849 -3.149 1.00 0.23 H ATOM 108 HG3 PRO A 8 -5.885 -9.035 -4.241 1.00 0.28 H ATOM 109 HD2 PRO A 8 -4.141 -6.881 -4.204 1.00 0.20 H ATOM 110 HD3 PRO A 8 -5.739 -6.841 -4.939 1.00 0.23 H ATOM 111 N LYS A 9 -5.187 -7.482 0.411 1.00 0.23 N ATOM 112 CA LYS A 9 -4.215 -7.619 1.494 1.00 0.23 C ATOM 113 C LYS A 9 -2.975 -8.398 1.058 1.00 0.22 C ATOM 114 O LYS A 9 -1.916 -8.286 1.675 1.00 0.22 O ATOM 115 CB LYS A 9 -4.863 -8.311 2.695 1.00 0.26 C ATOM 116 CG LYS A 9 -6.191 -7.696 3.109 1.00 0.30 C ATOM 117 CD LYS A 9 -6.076 -6.948 4.428 1.00 1.00 C ATOM 118 CE LYS A 9 -7.320 -6.122 4.710 1.00 1.48 C ATOM 119 NZ LYS A 9 -7.654 -6.096 6.161 1.00 2.12 N ATOM 120 H LYS A 9 -6.112 -7.752 0.559 1.00 0.25 H ATOM 121 HA LYS A 9 -3.912 -6.626 1.790 1.00 0.22 H ATOM 122 HB2 LYS A 9 -5.034 -9.349 2.447 1.00 0.28 H ATOM 123 HB3 LYS A 9 -4.187 -8.257 3.535 1.00 0.27 H ATOM 124 HG2 LYS A 9 -6.511 -7.005 2.343 1.00 0.86 H ATOM 125 HG3 LYS A 9 -6.924 -8.483 3.215 1.00 0.79 H ATOM 126 HD2 LYS A 9 -5.942 -7.663 5.226 1.00 1.52 H ATOM 127 HD3 LYS A 9 -5.220 -6.290 4.384 1.00 1.72 H ATOM 128 HE2 LYS A 9 -7.151 -5.112 4.371 1.00 2.03 H ATOM 129 HE3 LYS A 9 -8.151 -6.549 4.166 1.00 1.89 H ATOM 130 HZ1 LYS A 9 -8.684 -6.161 6.293 1.00 2.47 H ATOM 131 HZ2 LYS A 9 -7.317 -5.210 6.589 1.00 2.52 H ATOM 132 HZ3 LYS A 9 -7.202 -6.896 6.647 1.00 2.60 H ATOM 133 N SER A 10 -3.112 -9.197 0.006 1.00 0.22 N ATOM 134 CA SER A 10 -1.999 -10.002 -0.488 1.00 0.23 C ATOM 135 C SER A 10 -1.031 -9.182 -1.343 1.00 0.22 C ATOM 136 O SER A 10 0.112 -9.590 -1.551 1.00 0.24 O ATOM 137 CB SER A 10 -2.527 -11.187 -1.299 1.00 0.27 C ATOM 138 OG SER A 10 -1.777 -12.360 -1.036 1.00 1.24 O ATOM 139 H SER A 10 -3.981 -9.259 -0.441 1.00 0.23 H ATOM 140 HA SER A 10 -1.464 -10.381 0.369 1.00 0.23 H ATOM 141 HB2 SER A 10 -3.559 -11.369 -1.037 1.00 1.04 H ATOM 142 HB3 SER A 10 -2.459 -10.959 -2.353 1.00 0.97 H ATOM 143 HG SER A 10 -1.449 -12.723 -1.863 1.00 1.69 H ATOM 144 N GLU A 11 -1.486 -8.040 -1.851 1.00 0.23 N ATOM 145 CA GLU A 11 -0.643 -7.199 -2.693 1.00 0.26 C ATOM 146 C GLU A 11 -0.043 -6.048 -1.910 1.00 0.26 C ATOM 147 O GLU A 11 1.103 -5.658 -2.130 1.00 0.30 O ATOM 148 CB GLU A 11 -1.482 -6.631 -3.829 1.00 0.31 C ATOM 149 CG GLU A 11 -1.233 -7.284 -5.177 1.00 0.38 C ATOM 150 CD GLU A 11 -0.529 -6.362 -6.153 1.00 0.53 C ATOM 151 OE1 GLU A 11 0.279 -5.524 -5.700 1.00 1.16 O ATOM 152 OE2 GLU A 11 -0.784 -6.479 -7.370 1.00 1.31 O ATOM 153 H GLU A 11 -2.409 -7.758 -1.670 1.00 0.22 H ATOM 154 HA GLU A 11 0.151 -7.806 -3.095 1.00 0.28 H ATOM 155 HB2 GLU A 11 -2.518 -6.768 -3.578 1.00 0.26 H ATOM 156 HB3 GLU A 11 -1.283 -5.570 -3.914 1.00 0.38 H ATOM 157 HG2 GLU A 11 -0.623 -8.163 -5.030 1.00 0.38 H ATOM 158 HG3 GLU A 11 -2.187 -7.574 -5.599 1.00 0.38 H ATOM 159 N CYS A 12 -0.835 -5.500 -1.011 1.00 0.26 N ATOM 160 CA CYS A 12 -0.401 -4.380 -0.205 1.00 0.30 C ATOM 161 C CYS A 12 0.075 -4.855 1.154 1.00 0.24 C ATOM 162 O CYS A 12 -0.712 -5.316 1.981 1.00 0.28 O ATOM 163 CB CYS A 12 -1.542 -3.383 -0.071 1.00 0.46 C ATOM 164 SG CYS A 12 -1.560 -2.117 -1.361 1.00 0.80 S ATOM 165 H CYS A 12 -1.743 -5.851 -0.895 1.00 0.24 H ATOM 166 HA CYS A 12 0.422 -3.904 -0.715 1.00 0.35 H ATOM 167 HB2 CYS A 12 -2.477 -3.913 -0.137 1.00 0.48 H ATOM 168 HB3 CYS A 12 -1.476 -2.872 0.886 1.00 0.45 H ATOM 169 N THR A 13 1.376 -4.751 1.367 1.00 0.22 N ATOM 170 CA THR A 13 1.983 -5.179 2.613 1.00 0.20 C ATOM 171 C THR A 13 2.675 -4.008 3.292 1.00 0.22 C ATOM 172 O THR A 13 3.261 -3.158 2.623 1.00 0.23 O ATOM 173 CB THR A 13 2.984 -6.308 2.335 1.00 0.19 C ATOM 174 OG1 THR A 13 3.813 -5.984 1.235 1.00 0.19 O ATOM 175 CG2 THR A 13 2.315 -7.631 2.017 1.00 0.21 C ATOM 176 H THR A 13 1.948 -4.379 0.660 1.00 0.28 H ATOM 177 HA THR A 13 1.201 -5.550 3.259 1.00 0.25 H ATOM 178 HB THR A 13 3.617 -6.448 3.201 1.00 0.24 H ATOM 179 HG1 THR A 13 3.300 -6.018 0.424 1.00 0.78 H ATOM 180 HG21 THR A 13 1.900 -7.595 1.015 1.00 1.03 H ATOM 181 HG22 THR A 13 1.522 -7.813 2.728 1.00 1.04 H ATOM 182 HG23 THR A 13 3.042 -8.426 2.077 1.00 1.04 H ATOM 183 N GLN A 14 2.616 -3.966 4.621 1.00 0.29 N ATOM 184 CA GLN A 14 3.260 -2.891 5.373 1.00 0.33 C ATOM 185 C GLN A 14 4.686 -2.697 4.870 1.00 0.28 C ATOM 186 O GLN A 14 5.228 -1.592 4.893 1.00 0.31 O ATOM 187 CB GLN A 14 3.251 -3.206 6.869 1.00 0.42 C ATOM 188 CG GLN A 14 1.883 -3.038 7.512 1.00 0.72 C ATOM 189 CD GLN A 14 0.941 -4.185 7.195 1.00 0.88 C ATOM 190 OE1 GLN A 14 0.935 -5.205 7.885 1.00 1.81 O ATOM 191 NE2 GLN A 14 0.138 -4.027 6.146 1.00 0.77 N ATOM 192 H GLN A 14 2.142 -4.674 5.104 1.00 0.34 H ATOM 193 HA GLN A 14 2.703 -1.983 5.197 1.00 0.35 H ATOM 194 HB2 GLN A 14 3.571 -4.228 7.012 1.00 0.67 H ATOM 195 HB3 GLN A 14 3.945 -2.547 7.369 1.00 0.49 H ATOM 196 HG2 GLN A 14 2.008 -2.980 8.583 1.00 1.40 H ATOM 197 HG3 GLN A 14 1.442 -2.120 7.152 1.00 1.41 H ATOM 198 HE21 GLN A 14 0.194 -3.190 5.639 1.00 0.91 H ATOM 199 HE22 GLN A 14 -0.479 -4.755 5.922 1.00 1.26 H ATOM 200 N PHE A 15 5.265 -3.787 4.380 1.00 0.25 N ATOM 201 CA PHE A 15 6.605 -3.773 3.821 1.00 0.26 C ATOM 202 C PHE A 15 6.687 -2.830 2.627 1.00 0.22 C ATOM 203 O PHE A 15 7.686 -2.139 2.433 1.00 0.24 O ATOM 204 CB PHE A 15 6.993 -5.191 3.399 1.00 0.29 C ATOM 205 CG PHE A 15 7.914 -5.875 4.366 1.00 0.37 C ATOM 206 CD1 PHE A 15 9.265 -5.573 4.374 1.00 1.25 C ATOM 207 CD2 PHE A 15 7.434 -6.815 5.263 1.00 1.14 C ATOM 208 CE1 PHE A 15 10.123 -6.194 5.257 1.00 1.29 C ATOM 209 CE2 PHE A 15 8.289 -7.442 6.150 1.00 1.17 C ATOM 210 CZ PHE A 15 9.635 -7.131 6.148 1.00 0.52 C ATOM 211 H PHE A 15 4.762 -4.628 4.372 1.00 0.26 H ATOM 212 HA PHE A 15 7.285 -3.434 4.587 1.00 0.31 H ATOM 213 HB2 PHE A 15 6.095 -5.788 3.326 1.00 0.27 H ATOM 214 HB3 PHE A 15 7.470 -5.161 2.435 1.00 0.29 H ATOM 215 HD1 PHE A 15 9.648 -4.840 3.678 1.00 2.10 H ATOM 216 HD2 PHE A 15 6.382 -7.058 5.264 1.00 2.00 H ATOM 217 HE1 PHE A 15 11.175 -5.947 5.251 1.00 2.15 H ATOM 218 HE2 PHE A 15 7.904 -8.174 6.846 1.00 2.01 H ATOM 219 HZ PHE A 15 10.305 -7.619 6.840 1.00 0.58 H ATOM 220 N ARG A 16 5.627 -2.810 1.829 1.00 0.19 N ATOM 221 CA ARG A 16 5.567 -1.959 0.648 1.00 0.20 C ATOM 222 C ARG A 16 5.772 -0.495 1.009 1.00 0.17 C ATOM 223 O ARG A 16 6.558 0.196 0.371 1.00 0.19 O ATOM 224 CB ARG A 16 4.232 -2.152 -0.074 1.00 0.32 C ATOM 225 CG ARG A 16 3.943 -3.596 -0.425 1.00 0.24 C ATOM 226 CD ARG A 16 4.888 -4.116 -1.497 1.00 0.40 C ATOM 227 NE ARG A 16 5.951 -4.945 -0.934 1.00 0.78 N ATOM 228 CZ ARG A 16 6.648 -5.837 -1.635 1.00 0.89 C ATOM 229 NH1 ARG A 16 6.404 -6.014 -2.928 1.00 1.49 N ATOM 230 NH2 ARG A 16 7.593 -6.553 -1.042 1.00 1.39 N ATOM 231 H ARG A 16 4.863 -3.386 2.040 1.00 0.18 H ATOM 232 HA ARG A 16 6.366 -2.256 -0.013 1.00 0.26 H ATOM 233 HB2 ARG A 16 3.435 -1.795 0.557 1.00 0.54 H ATOM 234 HB3 ARG A 16 4.237 -1.583 -0.984 1.00 0.47 H ATOM 235 HG2 ARG A 16 4.060 -4.195 0.461 1.00 0.23 H ATOM 236 HG3 ARG A 16 2.927 -3.670 -0.783 1.00 0.37 H ATOM 237 HD2 ARG A 16 4.321 -4.706 -2.201 1.00 0.87 H ATOM 238 HD3 ARG A 16 5.331 -3.274 -2.008 1.00 0.69 H ATOM 239 HE ARG A 16 6.155 -4.833 0.018 1.00 1.52 H ATOM 240 HH11 ARG A 16 5.694 -5.477 -3.382 1.00 1.80 H ATOM 241 HH12 ARG A 16 6.931 -6.686 -3.448 1.00 1.98 H ATOM 242 HH21 ARG A 16 7.782 -6.423 -0.069 1.00 1.96 H ATOM 243 HH22 ARG A 16 8.116 -7.224 -1.568 1.00 1.54 H ATOM 244 N CYS A 17 5.072 -0.021 2.032 1.00 0.24 N ATOM 245 CA CYS A 17 5.209 1.369 2.448 1.00 0.33 C ATOM 246 C CYS A 17 6.569 1.623 3.083 1.00 0.34 C ATOM 247 O CYS A 17 7.052 2.752 3.114 1.00 0.45 O ATOM 248 CB CYS A 17 4.102 1.758 3.420 1.00 0.48 C ATOM 249 SG CYS A 17 2.544 2.238 2.613 1.00 0.58 S ATOM 250 H CYS A 17 4.458 -0.614 2.515 1.00 0.27 H ATOM 251 HA CYS A 17 5.127 1.977 1.567 1.00 0.36 H ATOM 252 HB2 CYS A 17 3.892 0.925 4.072 1.00 0.92 H ATOM 253 HB3 CYS A 17 4.440 2.595 4.008 1.00 0.83 H ATOM 254 N ARG A 18 7.180 0.569 3.595 1.00 0.30 N ATOM 255 CA ARG A 18 8.487 0.686 4.231 1.00 0.40 C ATOM 256 C ARG A 18 9.548 1.122 3.253 1.00 0.41 C ATOM 257 O ARG A 18 10.365 1.999 3.530 1.00 0.51 O ATOM 258 CB ARG A 18 8.934 -0.669 4.781 1.00 0.45 C ATOM 259 CG ARG A 18 9.356 -0.629 6.241 1.00 0.60 C ATOM 260 CD ARG A 18 10.601 0.221 6.437 1.00 1.08 C ATOM 261 NE ARG A 18 10.697 0.747 7.796 1.00 1.48 N ATOM 262 CZ ARG A 18 10.976 0.000 8.863 1.00 2.14 C ATOM 263 NH1 ARG A 18 11.186 -1.304 8.732 1.00 2.62 N ATOM 264 NH2 ARG A 18 11.044 0.559 10.064 1.00 2.87 N ATOM 265 H ARG A 18 6.741 -0.303 3.552 1.00 0.26 H ATOM 266 HA ARG A 18 8.425 1.388 5.028 1.00 0.48 H ATOM 267 HB2 ARG A 18 8.121 -1.373 4.680 1.00 0.57 H ATOM 268 HB3 ARG A 18 9.787 -1.019 4.186 1.00 0.57 H ATOM 269 HG2 ARG A 18 8.551 -0.210 6.827 1.00 1.04 H ATOM 270 HG3 ARG A 18 9.561 -1.636 6.574 1.00 1.01 H ATOM 271 HD2 ARG A 18 11.471 -0.386 6.234 1.00 1.66 H ATOM 272 HD3 ARG A 18 10.571 1.047 5.742 1.00 1.70 H ATOM 273 HE ARG A 18 10.546 1.707 7.922 1.00 1.87 H ATOM 274 HH11 ARG A 18 11.136 -1.731 7.829 1.00 2.57 H ATOM 275 HH12 ARG A 18 11.395 -1.859 9.537 1.00 3.34 H ATOM 276 HH21 ARG A 18 10.886 1.541 10.168 1.00 3.09 H ATOM 277 HH22 ARG A 18 11.253 -0.002 10.864 1.00 3.44 H ATOM 278 N THR A 19 9.573 0.422 2.146 1.00 0.36 N ATOM 279 CA THR A 19 10.580 0.623 1.137 1.00 0.41 C ATOM 280 C THR A 19 10.024 1.109 -0.208 1.00 0.38 C ATOM 281 O THR A 19 10.706 1.825 -0.941 1.00 0.59 O ATOM 282 CB THR A 19 11.307 -0.705 1.019 1.00 0.48 C ATOM 283 OG1 THR A 19 12.216 -0.716 -0.067 1.00 0.56 O ATOM 284 CG2 THR A 19 10.359 -1.872 0.870 1.00 0.46 C ATOM 285 H THR A 19 8.925 -0.304 2.032 1.00 0.31 H ATOM 286 HA THR A 19 11.275 1.360 1.507 1.00 0.48 H ATOM 287 HB THR A 19 11.852 -0.864 1.946 1.00 0.55 H ATOM 288 HG1 THR A 19 13.100 -0.521 0.253 1.00 1.06 H ATOM 289 HG21 THR A 19 9.716 -1.708 0.019 1.00 1.13 H ATOM 290 HG22 THR A 19 9.757 -1.949 1.770 1.00 1.04 H ATOM 291 HG23 THR A 19 10.922 -2.782 0.733 1.00 1.15 H ATOM 292 N SER A 20 8.799 0.706 -0.540 1.00 0.33 N ATOM 293 CA SER A 20 8.184 1.097 -1.812 1.00 0.32 C ATOM 294 C SER A 20 7.184 2.242 -1.639 1.00 0.28 C ATOM 295 O SER A 20 6.196 2.116 -0.918 1.00 0.42 O ATOM 296 CB SER A 20 7.486 -0.106 -2.450 1.00 0.35 C ATOM 297 OG SER A 20 7.509 -0.018 -3.864 1.00 0.73 O ATOM 298 H SER A 20 8.303 0.125 0.074 1.00 0.47 H ATOM 299 HA SER A 20 8.974 1.427 -2.470 1.00 0.40 H ATOM 300 HB2 SER A 20 7.990 -1.012 -2.150 1.00 0.64 H ATOM 301 HB3 SER A 20 6.458 -0.140 -2.120 1.00 0.58 H ATOM 302 HG SER A 20 7.194 -0.843 -4.241 1.00 0.97 H ATOM 303 N MET A 21 7.448 3.359 -2.313 1.00 0.27 N ATOM 304 CA MET A 21 6.574 4.530 -2.239 1.00 0.25 C ATOM 305 C MET A 21 5.338 4.371 -3.125 1.00 0.25 C ATOM 306 O MET A 21 4.242 4.792 -2.758 1.00 0.38 O ATOM 307 CB MET A 21 7.343 5.789 -2.650 1.00 0.35 C ATOM 308 CG MET A 21 7.821 6.623 -1.473 1.00 0.42 C ATOM 309 SD MET A 21 6.491 7.569 -0.707 1.00 0.95 S ATOM 310 CE MET A 21 6.699 9.157 -1.511 1.00 1.66 C ATOM 311 H MET A 21 8.249 3.398 -2.877 1.00 0.40 H ATOM 312 HA MET A 21 6.253 4.637 -1.215 1.00 0.26 H ATOM 313 HB2 MET A 21 8.205 5.496 -3.229 1.00 0.43 H ATOM 314 HB3 MET A 21 6.702 6.406 -3.262 1.00 0.42 H ATOM 315 HG2 MET A 21 8.248 5.964 -0.732 1.00 0.66 H ATOM 316 HG3 MET A 21 8.578 7.310 -1.821 1.00 0.42 H ATOM 317 HE1 MET A 21 7.519 9.101 -2.211 1.00 2.14 H ATOM 318 HE2 MET A 21 6.910 9.911 -0.768 1.00 2.17 H ATOM 319 HE3 MET A 21 5.792 9.415 -2.038 1.00 2.19 H ATOM 320 N LYS A 22 5.523 3.777 -4.298 1.00 0.28 N ATOM 321 CA LYS A 22 4.426 3.581 -5.244 1.00 0.35 C ATOM 322 C LYS A 22 3.240 2.859 -4.603 1.00 0.32 C ATOM 323 O LYS A 22 2.106 3.332 -4.666 1.00 0.47 O ATOM 324 CB LYS A 22 4.916 2.792 -6.459 1.00 0.45 C ATOM 325 CG LYS A 22 4.235 3.190 -7.759 1.00 0.58 C ATOM 326 CD LYS A 22 3.268 2.116 -8.236 1.00 1.33 C ATOM 327 CE LYS A 22 3.951 1.121 -9.160 1.00 1.62 C ATOM 328 NZ LYS A 22 3.568 1.331 -10.583 1.00 2.35 N ATOM 329 H LYS A 22 6.422 3.473 -4.542 1.00 0.37 H ATOM 330 HA LYS A 22 4.099 4.556 -5.573 1.00 0.39 H ATOM 331 HB2 LYS A 22 5.978 2.950 -6.572 1.00 0.48 H ATOM 332 HB3 LYS A 22 4.734 1.741 -6.288 1.00 0.47 H ATOM 333 HG2 LYS A 22 3.687 4.107 -7.600 1.00 1.38 H ATOM 334 HG3 LYS A 22 4.989 3.345 -8.516 1.00 1.13 H ATOM 335 HD2 LYS A 22 2.881 1.588 -7.378 1.00 1.94 H ATOM 336 HD3 LYS A 22 2.455 2.589 -8.767 1.00 2.10 H ATOM 337 HE2 LYS A 22 5.021 1.234 -9.064 1.00 1.80 H ATOM 338 HE3 LYS A 22 3.668 0.121 -8.864 1.00 2.10 H ATOM 339 HZ1 LYS A 22 3.994 0.594 -11.181 1.00 2.86 H ATOM 340 HZ2 LYS A 22 3.902 2.261 -10.910 1.00 2.67 H ATOM 341 HZ3 LYS A 22 2.534 1.291 -10.685 1.00 2.77 H ATOM 342 N TYR A 23 3.507 1.707 -4.004 1.00 0.24 N ATOM 343 CA TYR A 23 2.462 0.906 -3.369 1.00 0.23 C ATOM 344 C TYR A 23 1.686 1.697 -2.323 1.00 0.25 C ATOM 345 O TYR A 23 0.540 1.377 -2.011 1.00 0.33 O ATOM 346 CB TYR A 23 3.077 -0.318 -2.699 1.00 0.25 C ATOM 347 CG TYR A 23 3.397 -1.438 -3.653 1.00 0.25 C ATOM 348 CD1 TYR A 23 4.096 -1.196 -4.825 1.00 1.16 C ATOM 349 CD2 TYR A 23 3.002 -2.736 -3.377 1.00 1.26 C ATOM 350 CE1 TYR A 23 4.394 -2.223 -5.700 1.00 1.18 C ATOM 351 CE2 TYR A 23 3.294 -3.769 -4.242 1.00 1.26 C ATOM 352 CZ TYR A 23 3.991 -3.509 -5.404 1.00 0.36 C ATOM 353 OH TYR A 23 4.285 -4.537 -6.271 1.00 0.44 O ATOM 354 H TYR A 23 4.429 1.378 -3.997 1.00 0.30 H ATOM 355 HA TYR A 23 1.782 0.577 -4.137 1.00 0.26 H ATOM 356 HB2 TYR A 23 3.995 -0.028 -2.211 1.00 0.29 H ATOM 357 HB3 TYR A 23 2.388 -0.698 -1.959 1.00 0.27 H ATOM 358 HD1 TYR A 23 4.408 -0.186 -5.049 1.00 2.06 H ATOM 359 HD2 TYR A 23 2.455 -2.935 -2.469 1.00 2.17 H ATOM 360 HE1 TYR A 23 4.940 -2.018 -6.609 1.00 2.10 H ATOM 361 HE2 TYR A 23 2.978 -4.773 -4.005 1.00 2.17 H ATOM 362 HH TYR A 23 5.235 -4.673 -6.297 1.00 0.83 H ATOM 363 N ARG A 24 2.331 2.705 -1.760 1.00 0.25 N ATOM 364 CA ARG A 24 1.712 3.518 -0.712 1.00 0.29 C ATOM 365 C ARG A 24 0.693 4.508 -1.265 1.00 0.31 C ATOM 366 O ARG A 24 -0.479 4.484 -0.893 1.00 0.32 O ATOM 367 CB ARG A 24 2.780 4.292 0.068 1.00 0.35 C ATOM 368 CG ARG A 24 4.144 3.624 0.091 1.00 0.36 C ATOM 369 CD ARG A 24 5.096 4.336 1.039 1.00 0.31 C ATOM 370 NE ARG A 24 6.460 3.819 0.933 1.00 0.36 N ATOM 371 CZ ARG A 24 7.551 4.545 1.177 1.00 0.39 C ATOM 372 NH1 ARG A 24 7.446 5.813 1.559 1.00 0.38 N ATOM 373 NH2 ARG A 24 8.751 3.998 1.047 1.00 0.47 N ATOM 374 H ARG A 24 3.252 2.890 -2.037 1.00 0.28 H ATOM 375 HA ARG A 24 1.206 2.850 -0.034 1.00 0.30 H ATOM 376 HB2 ARG A 24 2.895 5.265 -0.378 1.00 0.49 H ATOM 377 HB3 ARG A 24 2.446 4.412 1.088 1.00 0.61 H ATOM 378 HG2 ARG A 24 4.026 2.602 0.410 1.00 0.65 H ATOM 379 HG3 ARG A 24 4.561 3.646 -0.903 1.00 0.54 H ATOM 380 HD2 ARG A 24 5.099 5.388 0.799 1.00 0.33 H ATOM 381 HD3 ARG A 24 4.745 4.199 2.051 1.00 0.42 H ATOM 382 HE ARG A 24 6.569 2.879 0.663 1.00 0.40 H ATOM 383 HH11 ARG A 24 6.546 6.232 1.667 1.00 0.36 H ATOM 384 HH12 ARG A 24 8.271 6.349 1.739 1.00 0.42 H ATOM 385 HH21 ARG A 24 8.837 3.043 0.767 1.00 0.52 H ATOM 386 HH22 ARG A 24 9.570 4.542 1.230 1.00 0.50 H ATOM 387 N LEU A 25 1.154 5.401 -2.123 1.00 0.32 N ATOM 388 CA LEU A 25 0.294 6.428 -2.695 1.00 0.37 C ATOM 389 C LEU A 25 -0.297 6.013 -4.037 1.00 0.36 C ATOM 390 O LEU A 25 -1.445 6.330 -4.347 1.00 0.39 O ATOM 391 CB LEU A 25 1.096 7.715 -2.865 1.00 0.42 C ATOM 392 CG LEU A 25 2.006 8.091 -1.681 1.00 0.43 C ATOM 393 CD1 LEU A 25 1.386 7.678 -0.348 1.00 0.42 C ATOM 394 CD2 LEU A 25 3.386 7.465 -1.844 1.00 0.42 C ATOM 395 H LEU A 25 2.104 5.388 -2.360 1.00 0.32 H ATOM 396 HA LEU A 25 -0.514 6.610 -2.002 1.00 0.39 H ATOM 397 HB2 LEU A 25 1.715 7.605 -3.750 1.00 0.42 H ATOM 398 HB3 LEU A 25 0.404 8.527 -3.031 1.00 0.45 H ATOM 399 HG LEU A 25 2.130 9.163 -1.667 1.00 0.47 H ATOM 400 HD11 LEU A 25 1.552 8.457 0.382 1.00 1.09 H ATOM 401 HD12 LEU A 25 1.843 6.761 -0.002 1.00 1.08 H ATOM 402 HD13 LEU A 25 0.325 7.525 -0.474 1.00 1.09 H ATOM 403 HD21 LEU A 25 3.630 6.892 -0.961 1.00 1.04 H ATOM 404 HD22 LEU A 25 4.120 8.245 -1.979 1.00 1.13 H ATOM 405 HD23 LEU A 25 3.389 6.817 -2.707 1.00 1.06 H ATOM 406 N ASN A 26 0.507 5.340 -4.843 1.00 0.34 N ATOM 407 CA ASN A 26 0.084 4.920 -6.172 1.00 0.36 C ATOM 408 C ASN A 26 -0.938 3.782 -6.135 1.00 0.32 C ATOM 409 O ASN A 26 -1.875 3.764 -6.933 1.00 0.38 O ATOM 410 CB ASN A 26 1.307 4.509 -6.981 1.00 0.37 C ATOM 411 CG ASN A 26 1.125 4.742 -8.469 1.00 0.54 C ATOM 412 OD1 ASN A 26 0.121 4.336 -9.054 1.00 1.22 O ATOM 413 ND2 ASN A 26 2.099 5.398 -9.089 1.00 1.28 N ATOM 414 H ASN A 26 1.421 5.144 -4.549 1.00 0.32 H ATOM 415 HA ASN A 26 -0.373 5.773 -6.652 1.00 0.42 H ATOM 416 HB2 ASN A 26 2.155 5.090 -6.643 1.00 0.36 H ATOM 417 HB3 ASN A 26 1.504 3.460 -6.817 1.00 0.34 H ATOM 418 HD21 ASN A 26 2.869 5.692 -8.559 1.00 1.98 H ATOM 419 HD22 ASN A 26 2.007 5.563 -10.050 1.00 1.37 H ATOM 420 N LEU A 27 -0.769 2.838 -5.214 1.00 0.27 N ATOM 421 CA LEU A 27 -1.703 1.717 -5.109 1.00 0.27 C ATOM 422 C LEU A 27 -2.710 1.951 -3.978 1.00 0.25 C ATOM 423 O LEU A 27 -3.575 2.819 -4.093 1.00 0.28 O ATOM 424 CB LEU A 27 -0.949 0.397 -4.915 1.00 0.29 C ATOM 425 CG LEU A 27 -0.525 -0.301 -6.207 1.00 0.63 C ATOM 426 CD1 LEU A 27 0.503 0.531 -6.954 1.00 0.91 C ATOM 427 CD2 LEU A 27 0.025 -1.686 -5.904 1.00 1.05 C ATOM 428 H LEU A 27 -0.008 2.894 -4.599 1.00 0.27 H ATOM 429 HA LEU A 27 -2.249 1.667 -6.041 1.00 0.32 H ATOM 430 HB2 LEU A 27 -0.067 0.592 -4.326 1.00 0.49 H ATOM 431 HB3 LEU A 27 -1.586 -0.280 -4.366 1.00 0.63 H ATOM 432 HG LEU A 27 -1.388 -0.417 -6.846 1.00 0.93 H ATOM 433 HD11 LEU A 27 1.359 0.702 -6.319 1.00 1.50 H ATOM 434 HD12 LEU A 27 0.064 1.479 -7.231 1.00 1.21 H ATOM 435 HD13 LEU A 27 0.813 0.005 -7.844 1.00 1.49 H ATOM 436 HD21 LEU A 27 1.029 -1.599 -5.518 1.00 1.42 H ATOM 437 HD22 LEU A 27 0.036 -2.275 -6.809 1.00 1.50 H ATOM 438 HD23 LEU A 27 -0.603 -2.168 -5.168 1.00 1.69 H ATOM 439 N CYS A 28 -2.607 1.189 -2.886 1.00 0.25 N ATOM 440 CA CYS A 28 -3.524 1.350 -1.769 1.00 0.23 C ATOM 441 C CYS A 28 -2.997 2.385 -0.791 1.00 0.22 C ATOM 442 O CYS A 28 -1.789 2.519 -0.600 1.00 0.22 O ATOM 443 CB CYS A 28 -3.664 0.025 -1.051 1.00 0.25 C ATOM 444 SG CYS A 28 -2.108 -0.499 -0.296 1.00 0.50 S ATOM 445 H CYS A 28 -1.905 0.506 -2.827 1.00 0.29 H ATOM 446 HA CYS A 28 -4.485 1.661 -2.139 1.00 0.25 H ATOM 447 HB2 CYS A 28 -4.403 0.116 -0.268 1.00 0.40 H ATOM 448 HB3 CYS A 28 -3.968 -0.736 -1.753 1.00 0.26 H ATOM 449 N LYS A 29 -3.910 3.091 -0.157 1.00 0.24 N ATOM 450 CA LYS A 29 -3.555 4.097 0.824 1.00 0.27 C ATOM 451 C LYS A 29 -3.297 3.476 2.193 1.00 0.27 C ATOM 452 O LYS A 29 -2.231 3.639 2.776 1.00 0.30 O ATOM 453 CB LYS A 29 -4.659 5.147 0.915 1.00 0.33 C ATOM 454 CG LYS A 29 -4.766 6.016 -0.329 1.00 0.31 C ATOM 455 CD LYS A 29 -4.246 7.424 -0.078 1.00 0.81 C ATOM 456 CE LYS A 29 -2.895 7.649 -0.740 1.00 0.97 C ATOM 457 NZ LYS A 29 -3.006 8.511 -1.949 1.00 1.30 N ATOM 458 H LYS A 29 -4.852 2.912 -0.335 1.00 0.26 H ATOM 459 HA LYS A 29 -2.649 4.576 0.488 1.00 0.27 H ATOM 460 HB2 LYS A 29 -5.604 4.644 1.058 1.00 0.39 H ATOM 461 HB3 LYS A 29 -4.467 5.786 1.764 1.00 0.39 H ATOM 462 HG2 LYS A 29 -4.185 5.564 -1.122 1.00 0.44 H ATOM 463 HG3 LYS A 29 -5.802 6.073 -0.628 1.00 0.56 H ATOM 464 HD2 LYS A 29 -4.953 8.135 -0.478 1.00 1.21 H ATOM 465 HD3 LYS A 29 -4.144 7.576 0.987 1.00 1.28 H ATOM 466 HE2 LYS A 29 -2.235 8.124 -0.030 1.00 1.60 H ATOM 467 HE3 LYS A 29 -2.485 6.691 -1.027 1.00 1.31 H ATOM 468 HZ1 LYS A 29 -2.092 8.552 -2.444 1.00 1.81 H ATOM 469 HZ2 LYS A 29 -3.283 9.475 -1.676 1.00 1.53 H ATOM 470 HZ3 LYS A 29 -3.723 8.127 -2.598 1.00 1.88 H ATOM 471 N LYS A 30 -4.309 2.796 2.713 1.00 0.27 N ATOM 472 CA LYS A 30 -4.234 2.183 4.034 1.00 0.31 C ATOM 473 C LYS A 30 -3.559 0.811 4.049 1.00 0.29 C ATOM 474 O LYS A 30 -2.642 0.580 4.834 1.00 0.31 O ATOM 475 CB LYS A 30 -5.638 2.060 4.621 1.00 0.36 C ATOM 476 CG LYS A 30 -5.696 1.229 5.892 1.00 0.46 C ATOM 477 CD LYS A 30 -5.196 2.012 7.092 1.00 0.57 C ATOM 478 CE LYS A 30 -6.218 3.037 7.555 1.00 1.03 C ATOM 479 NZ LYS A 30 -7.336 2.405 8.308 1.00 1.66 N ATOM 480 H LYS A 30 -5.146 2.729 2.207 1.00 0.26 H ATOM 481 HA LYS A 30 -3.663 2.846 4.663 1.00 0.35 H ATOM 482 HB2 LYS A 30 -6.012 3.048 4.843 1.00 0.41 H ATOM 483 HB3 LYS A 30 -6.280 1.598 3.886 1.00 0.33 H ATOM 484 HG2 LYS A 30 -6.716 0.928 6.069 1.00 0.47 H ATOM 485 HG3 LYS A 30 -5.075 0.355 5.762 1.00 0.48 H ATOM 486 HD2 LYS A 30 -4.999 1.323 7.899 1.00 0.73 H ATOM 487 HD3 LYS A 30 -4.283 2.521 6.820 1.00 0.87 H ATOM 488 HE2 LYS A 30 -5.725 3.754 8.194 1.00 1.61 H ATOM 489 HE3 LYS A 30 -6.619 3.543 6.689 1.00 1.65 H ATOM 490 HZ1 LYS A 30 -8.140 2.227 7.673 1.00 2.20 H ATOM 491 HZ2 LYS A 30 -7.649 3.032 9.077 1.00 2.11 H ATOM 492 HZ3 LYS A 30 -7.025 1.501 8.718 1.00 2.11 H ATOM 493 N THR A 31 -4.057 -0.117 3.238 1.00 0.28 N ATOM 494 CA THR A 31 -3.529 -1.479 3.233 1.00 0.32 C ATOM 495 C THR A 31 -2.008 -1.520 3.154 1.00 0.30 C ATOM 496 O THR A 31 -1.379 -2.439 3.677 1.00 0.37 O ATOM 497 CB THR A 31 -4.130 -2.290 2.094 1.00 0.33 C ATOM 498 OG1 THR A 31 -5.545 -2.288 2.167 1.00 0.44 O ATOM 499 CG2 THR A 31 -3.672 -3.727 2.108 1.00 0.54 C ATOM 500 H THR A 31 -4.820 0.104 2.661 1.00 0.28 H ATOM 501 HA THR A 31 -3.826 -1.936 4.165 1.00 0.36 H ATOM 502 HB THR A 31 -3.834 -1.855 1.152 1.00 0.27 H ATOM 503 HG1 THR A 31 -5.904 -2.814 1.448 1.00 1.01 H ATOM 504 HG21 THR A 31 -4.169 -4.252 2.908 1.00 1.19 H ATOM 505 HG22 THR A 31 -2.602 -3.760 2.269 1.00 1.16 H ATOM 506 HG23 THR A 31 -3.913 -4.191 1.166 1.00 1.18 H ATOM 507 N CYS A 32 -1.420 -0.532 2.506 1.00 0.24 N ATOM 508 CA CYS A 32 0.040 -0.486 2.380 1.00 0.26 C ATOM 509 C CYS A 32 0.676 -0.083 3.706 1.00 0.24 C ATOM 510 O CYS A 32 1.877 -0.256 3.915 1.00 0.26 O ATOM 511 CB CYS A 32 0.478 0.474 1.267 1.00 0.31 C ATOM 512 SG CYS A 32 2.271 0.794 1.215 1.00 0.89 S ATOM 513 H CYS A 32 -1.977 0.179 2.112 1.00 0.22 H ATOM 514 HA CYS A 32 0.375 -1.483 2.131 1.00 0.31 H ATOM 515 HB2 CYS A 32 0.206 0.052 0.314 1.00 0.47 H ATOM 516 HB3 CYS A 32 -0.024 1.420 1.396 1.00 0.43 H ATOM 517 N GLY A 33 -0.148 0.442 4.602 1.00 0.24 N ATOM 518 CA GLY A 33 0.331 0.854 5.909 1.00 0.29 C ATOM 519 C GLY A 33 0.847 2.283 5.942 1.00 0.35 C ATOM 520 O GLY A 33 1.907 2.548 6.509 1.00 0.46 O ATOM 521 H GLY A 33 -1.096 0.536 4.374 1.00 0.24 H ATOM 522 HA2 GLY A 33 -0.479 0.764 6.617 1.00 0.35 H ATOM 523 HA3 GLY A 33 1.128 0.190 6.210 1.00 0.29 H ATOM 524 N THR A 34 0.099 3.210 5.346 1.00 0.34 N ATOM 525 CA THR A 34 0.503 4.616 5.334 1.00 0.44 C ATOM 526 C THR A 34 -0.656 5.537 5.711 1.00 0.52 C ATOM 527 O THR A 34 -0.445 6.596 6.304 1.00 0.68 O ATOM 528 CB THR A 34 1.064 5.017 3.968 1.00 0.51 C ATOM 529 OG1 THR A 34 1.308 6.411 3.917 1.00 1.06 O ATOM 530 CG2 THR A 34 0.159 4.671 2.809 1.00 0.54 C ATOM 531 H THR A 34 -0.740 2.946 4.916 1.00 0.32 H ATOM 532 HA THR A 34 1.282 4.734 6.073 1.00 0.50 H ATOM 533 HB THR A 34 1.997 4.507 3.816 1.00 0.78 H ATOM 534 HG1 THR A 34 0.473 6.883 3.931 1.00 1.39 H ATOM 535 HG21 THR A 34 -0.762 5.229 2.893 1.00 1.16 H ATOM 536 HG22 THR A 34 -0.056 3.613 2.823 1.00 1.26 H ATOM 537 HG23 THR A 34 0.650 4.926 1.881 1.00 1.18 H ATOM 538 N CYS A 35 -1.878 5.136 5.370 1.00 0.49 N ATOM 539 CA CYS A 35 -3.059 5.943 5.685 1.00 0.62 C ATOM 540 C CYS A 35 -3.060 6.354 7.156 1.00 0.95 C ATOM 541 O CYS A 35 -2.867 7.556 7.434 1.00 1.71 O ATOM 542 CB CYS A 35 -4.342 5.173 5.356 1.00 1.04 C ATOM 543 SG CYS A 35 -5.876 5.992 5.913 1.00 1.59 S ATOM 544 OXT CYS A 35 -3.253 5.469 8.016 1.00 1.64 O ATOM 545 H CYS A 35 -1.989 4.283 4.899 1.00 0.43 H ATOM 546 HA CYS A 35 -3.020 6.835 5.076 1.00 1.30 H ATOM 547 HB2 CYS A 35 -4.411 5.043 4.287 1.00 1.71 H ATOM 548 HB3 CYS A 35 -4.299 4.203 5.828 1.00 1.53 H