ATOM 1 N MET A 1 11.159 6.155 15.120 1.00 10.15 N ATOM 2 CA MET A 1 10.862 5.001 14.233 1.00 9.29 C ATOM 3 C MET A 1 9.369 4.907 13.935 1.00 8.34 C ATOM 4 O MET A 1 8.968 4.676 12.795 1.00 7.76 O ATOM 5 CB MET A 1 11.343 3.701 14.882 1.00 9.20 C ATOM 6 CG MET A 1 12.837 3.678 15.163 1.00 10.16 C ATOM 7 SD MET A 1 13.827 3.864 13.668 1.00 10.60 S ATOM 8 CE MET A 1 15.483 3.789 14.348 1.00 10.46 C ATOM 9 H1 MET A 1 12.185 6.241 15.264 1.00 10.56 H ATOM 10 HA MET A 1 11.392 5.146 13.303 1.00 9.52 H ATOM 11 HB2 MET A 1 10.820 3.565 15.817 1.00 9.03 H ATOM 12 HB3 MET A 1 11.109 2.876 14.226 1.00 8.69 H ATOM 13 HG2 MET A 1 13.075 4.486 15.838 1.00 10.55 H ATOM 14 HG3 MET A 1 13.086 2.736 15.629 1.00 10.39 H ATOM 15 HE1 MET A 1 16.204 3.888 13.550 1.00 10.46 H ATOM 16 HE2 MET A 1 15.625 2.841 14.846 1.00 10.67 H ATOM 17 HE3 MET A 1 15.617 4.592 15.057 1.00 10.40 H ATOM 18 N ASP A 2 8.548 5.093 14.964 1.00 8.30 N ATOM 19 CA ASP A 2 7.100 5.023 14.808 1.00 7.59 C ATOM 20 C ASP A 2 6.611 6.037 13.777 1.00 7.57 C ATOM 21 O ASP A 2 5.847 5.698 12.867 1.00 6.80 O ATOM 22 CB ASP A 2 6.415 5.274 16.154 1.00 7.98 C ATOM 23 CG ASP A 2 4.906 5.169 16.067 1.00 8.24 C ATOM 24 OD1 ASP A 2 4.376 4.056 16.263 1.00 8.51 O ATOM 25 OD2 ASP A 2 4.254 6.201 15.804 1.00 8.43 O1- ATOM 26 H ASP A 2 8.925 5.279 15.849 1.00 8.83 H ATOM 27 HA ASP A 2 6.850 4.030 14.467 1.00 6.93 H ATOM 28 HB2 ASP A 2 6.766 4.546 16.870 1.00 8.18 H ATOM 29 HB3 ASP A 2 6.670 6.265 16.501 1.00 8.15 H ATOM 30 N TRP A 3 7.065 7.280 13.912 1.00 8.50 N ATOM 31 CA TRP A 3 6.666 8.334 12.985 1.00 8.71 C ATOM 32 C TRP A 3 7.230 8.064 11.597 1.00 8.22 C ATOM 33 O TRP A 3 6.636 8.452 10.592 1.00 7.87 O ATOM 34 CB TRP A 3 7.114 9.714 13.484 1.00 9.94 C ATOM 35 CG TRP A 3 8.382 9.687 14.279 1.00 10.24 C ATOM 36 CD1 TRP A 3 9.581 9.167 13.891 1.00 10.46 C ATOM 37 CD2 TRP A 3 8.574 10.199 15.603 1.00 10.62 C ATOM 38 NE1 TRP A 3 10.505 9.317 14.894 1.00 10.93 N ATOM 39 CE2 TRP A 3 9.913 9.951 15.954 1.00 11.03 C ATOM 40 CE3 TRP A 3 7.744 10.843 16.524 1.00 10.86 C ATOM 41 CZ2 TRP A 3 10.441 10.323 17.188 1.00 11.64 C ATOM 42 CZ3 TRP A 3 8.269 11.213 17.749 1.00 11.49 C ATOM 43 CH2 TRP A 3 9.607 10.953 18.071 1.00 11.85 C ATOM 44 H TRP A 3 7.688 7.487 14.642 1.00 9.10 H ATOM 45 HA TRP A 3 5.587 8.320 12.924 1.00 8.45 H ATOM 46 HB2 TRP A 3 7.270 10.362 12.634 1.00 10.31 H ATOM 47 HB3 TRP A 3 6.337 10.132 14.108 1.00 10.46 H ATOM 48 HD1 TRP A 3 9.761 8.702 12.933 1.00 10.44 H ATOM 49 HE1 TRP A 3 11.435 9.020 14.855 1.00 11.27 H ATOM 50 HE3 TRP A 3 6.710 11.052 16.294 1.00 10.72 H ATOM 51 HZ2 TRP A 3 11.471 10.130 17.451 1.00 12.08 H ATOM 52 HZ3 TRP A 3 7.642 11.712 18.473 1.00 11.84 H ATOM 53 HH2 TRP A 3 9.974 11.259 19.039 1.00 12.45 H ATOM 54 N ARG A 4 8.377 7.392 11.548 1.00 8.33 N ATOM 55 CA ARG A 4 9.014 7.059 10.280 1.00 8.12 C ATOM 56 C ARG A 4 8.211 5.988 9.549 1.00 6.96 C ATOM 57 O ARG A 4 8.021 6.054 8.332 1.00 6.66 O ATOM 58 CB ARG A 4 10.446 6.573 10.513 1.00 8.77 C ATOM 59 CG ARG A 4 11.183 6.213 9.234 1.00 9.20 C ATOM 60 CD ARG A 4 11.294 7.407 8.300 1.00 9.68 C ATOM 61 NE ARG A 4 11.999 7.073 7.065 1.00 10.56 N ATOM 62 CZ ARG A 4 12.221 7.941 6.080 1.00 11.36 C ATOM 63 NH1 ARG A 4 11.796 9.194 6.182 1.00 11.43 N1+ ATOM 64 NH2 ARG A 4 12.870 7.555 4.990 1.00 12.22 N ATOM 65 H ARG A 4 8.803 7.111 12.384 1.00 8.65 H ATOM 66 HA ARG A 4 9.038 7.952 9.674 1.00 8.48 H ATOM 67 HB2 ARG A 4 11.001 7.351 11.016 1.00 9.38 H ATOM 68 HB3 ARG A 4 10.418 5.697 11.145 1.00 8.49 H ATOM 69 HG2 ARG A 4 12.176 5.872 9.485 1.00 9.47 H ATOM 70 HG3 ARG A 4 10.646 5.422 8.731 1.00 9.13 H ATOM 71 HD2 ARG A 4 10.300 7.749 8.054 1.00 9.61 H ATOM 72 HD3 ARG A 4 11.830 8.196 8.808 1.00 9.64 H ATOM 73 HE ARG A 4 12.324 6.154 6.963 1.00 10.66 H ATOM 74 HH11 ARG A 4 11.305 9.492 7.001 1.00 10.90 H ATOM 75 HH12 ARG A 4 11.966 9.841 5.438 1.00 12.11 H ATOM 76 HH21 ARG A 4 13.193 6.612 4.909 1.00 12.30 H ATOM 77 HH22 ARG A 4 13.037 8.206 4.250 1.00 12.86 H ATOM 78 N HIS A 5 7.732 5.004 10.304 1.00 6.40 N ATOM 79 CA HIS A 5 6.944 3.923 9.731 1.00 5.38 C ATOM 80 C HIS A 5 5.644 4.473 9.148 1.00 4.78 C ATOM 81 O HIS A 5 5.175 4.043 8.079 1.00 4.11 O ATOM 82 CB HIS A 5 6.637 2.877 10.799 1.00 5.14 C ATOM 83 CG HIS A 5 7.858 2.284 11.430 1.00 5.76 C ATOM 84 ND1 HIS A 5 7.804 1.350 12.443 1.00 6.25 N ATOM 85 CD2 HIS A 5 9.172 2.502 11.191 1.00 6.22 C ATOM 86 CE1 HIS A 5 9.032 1.021 12.802 1.00 6.80 C ATOM 87 NE2 HIS A 5 9.880 1.705 12.057 1.00 6.78 N ATOM 88 H HIS A 5 7.914 5.007 11.267 1.00 6.75 H ATOM 89 HA HIS A 5 7.521 3.467 8.941 1.00 5.41 H ATOM 90 HB2 HIS A 5 6.051 3.335 11.581 1.00 5.32 H ATOM 91 HB3 HIS A 5 6.069 2.074 10.352 1.00 4.54 H ATOM 92 HD1 HIS A 5 6.986 0.984 12.842 1.00 6.37 H ATOM 93 HD2 HIS A 5 9.587 3.177 10.456 1.00 6.33 H ATOM 94 HE1 HIS A 5 9.296 0.312 13.572 1.00 7.33 H ATOM 95 HE2 HIS A 5 10.853 1.711 12.170 1.00 7.23 H ATOM 96 N LYS A 6 5.098 5.489 9.802 1.00 5.27 N ATOM 97 CA LYS A 6 3.869 6.085 9.319 1.00 5.05 C ATOM 98 C LYS A 6 4.225 7.247 8.406 1.00 5.54 C ATOM 99 O LYS A 6 3.361 7.854 7.753 1.00 5.47 O ATOM 100 CB LYS A 6 3.010 6.571 10.488 1.00 5.70 C ATOM 101 CG LYS A 6 2.621 5.466 11.456 1.00 5.45 C ATOM 102 CD LYS A 6 1.779 6.002 12.603 1.00 6.10 C ATOM 103 CE LYS A 6 1.245 4.876 13.473 1.00 6.27 C ATOM 104 NZ LYS A 6 2.342 4.095 14.107 1.00 6.56 N1+ ATOM 105 H LYS A 6 5.526 5.836 10.613 1.00 5.90 H ATOM 106 HA LYS A 6 3.330 5.338 8.758 1.00 4.30 H ATOM 107 HB2 LYS A 6 3.558 7.323 11.035 1.00 6.47 H ATOM 108 HB3 LYS A 6 2.105 7.010 10.096 1.00 5.79 H ATOM 109 HG2 LYS A 6 2.052 4.718 10.924 1.00 5.36 H ATOM 110 HG3 LYS A 6 3.519 5.021 11.858 1.00 5.20 H ATOM 111 HD2 LYS A 6 2.389 6.654 13.210 1.00 6.33 H ATOM 112 HD3 LYS A 6 0.947 6.558 12.197 1.00 6.56 H ATOM 113 HE2 LYS A 6 0.623 5.300 14.247 1.00 6.50 H ATOM 114 HE3 LYS A 6 0.653 4.215 12.858 1.00 6.27 H ATOM 115 HZ1 LYS A 6 2.890 4.704 14.746 1.00 6.94 H ATOM 116 HZ2 LYS A 6 2.978 3.715 13.377 1.00 6.86 H ATOM 117 HZ3 LYS A 6 1.947 3.303 14.653 1.00 6.38 H ATOM 118 N ALA A 7 5.524 7.515 8.330 1.00 6.18 N ATOM 119 CA ALA A 7 6.035 8.548 7.456 1.00 6.81 C ATOM 120 C ALA A 7 5.857 8.058 6.047 1.00 6.18 C ATOM 121 O ALA A 7 5.393 8.782 5.170 1.00 6.24 O ATOM 122 CB ALA A 7 7.498 8.855 7.744 1.00 7.83 C ATOM 123 H ALA A 7 6.151 7.007 8.879 1.00 6.32 H ATOM 124 HA ALA A 7 5.450 9.445 7.604 1.00 7.13 H ATOM 125 HB1 ALA A 7 8.107 8.010 7.462 1.00 8.25 H ATOM 126 HB2 ALA A 7 7.626 9.055 8.796 1.00 8.09 H ATOM 127 HB3 ALA A 7 7.802 9.721 7.175 1.00 8.08 H ATOM 128 N VAL A 8 6.224 6.795 5.849 1.00 5.69 N ATOM 129 CA VAL A 8 6.069 6.171 4.562 1.00 5.34 C ATOM 130 C VAL A 8 4.596 5.820 4.374 1.00 4.24 C ATOM 131 O VAL A 8 4.133 5.634 3.248 1.00 4.15 O ATOM 132 CB VAL A 8 6.966 4.928 4.395 1.00 5.55 C ATOM 133 CG1 VAL A 8 7.140 4.598 2.919 1.00 5.75 C ATOM 134 CG2 VAL A 8 8.325 5.154 5.051 1.00 6.55 C ATOM 135 H VAL A 8 6.604 6.281 6.592 1.00 5.72 H ATOM 136 HA VAL A 8 6.349 6.896 3.810 1.00 5.91 H ATOM 137 HB VAL A 8 6.487 4.089 4.879 1.00 4.98 H ATOM 138 HG11 VAL A 8 7.710 3.686 2.821 1.00 5.83 H ATOM 139 HG12 VAL A 8 7.664 5.405 2.429 1.00 5.75 H ATOM 140 HG13 VAL A 8 6.170 4.468 2.462 1.00 6.14 H ATOM 141 HG21 VAL A 8 8.970 4.314 4.841 1.00 6.81 H ATOM 142 HG22 VAL A 8 8.198 5.252 6.118 1.00 7.04 H ATOM 143 HG23 VAL A 8 8.769 6.057 4.657 1.00 6.75 H ATOM 144 N CYS A 9 3.852 5.730 5.496 1.00 3.54 N ATOM 145 CA CYS A 9 2.409 5.478 5.422 1.00 2.62 C ATOM 146 C CYS A 9 1.778 6.484 4.467 1.00 2.96 C ATOM 147 O CYS A 9 1.354 6.140 3.365 1.00 2.62 O ATOM 148 CB CYS A 9 1.732 5.640 6.794 1.00 2.45 C ATOM 149 SG CYS A 9 1.271 4.090 7.625 1.00 1.43 S ATOM 150 H CYS A 9 4.279 5.829 6.372 1.00 3.79 H ATOM 151 HA CYS A 9 2.250 4.476 5.051 1.00 2.29 H ATOM 152 HB2 CYS A 9 2.394 6.167 7.446 1.00 3.05 H ATOM 153 HB3 CYS A 9 0.830 6.221 6.671 1.00 2.86 H ATOM 154 N ARG A 10 1.722 7.738 4.918 1.00 3.85 N ATOM 155 CA ARG A 10 1.142 8.827 4.125 1.00 4.48 C ATOM 156 C ARG A 10 2.010 9.208 2.922 1.00 4.75 C ATOM 157 O ARG A 10 1.516 9.778 1.949 1.00 4.85 O ATOM 158 CB ARG A 10 0.910 10.061 4.999 1.00 5.52 C ATOM 159 CG ARG A 10 -0.334 9.972 5.869 1.00 6.10 C ATOM 160 CD ARG A 10 -0.147 8.998 7.019 1.00 6.70 C ATOM 161 NE ARG A 10 0.886 9.444 7.951 1.00 6.91 N ATOM 162 CZ ARG A 10 0.976 9.030 9.213 1.00 7.57 C ATOM 163 NH1 ARG A 10 0.102 8.156 9.697 1.00 8.09 N1+ ATOM 164 NH2 ARG A 10 1.945 9.490 9.993 1.00 7.93 N ATOM 165 H ARG A 10 2.081 7.939 5.808 1.00 4.18 H ATOM 166 HA ARG A 10 0.190 8.483 3.758 1.00 4.18 H ATOM 167 HB2 ARG A 10 1.765 10.196 5.645 1.00 5.89 H ATOM 168 HB3 ARG A 10 0.814 10.927 4.360 1.00 5.79 H ATOM 169 HG2 ARG A 10 -0.550 10.950 6.272 1.00 6.05 H ATOM 170 HG3 ARG A 10 -1.163 9.641 5.260 1.00 6.49 H ATOM 171 HD2 ARG A 10 -1.083 8.906 7.551 1.00 6.93 H ATOM 172 HD3 ARG A 10 0.134 8.037 6.617 1.00 7.05 H ATOM 173 HE ARG A 10 1.546 10.088 7.620 1.00 6.72 H ATOM 174 HH11 ARG A 10 -0.630 7.804 9.115 1.00 8.03 H ATOM 175 HH12 ARG A 10 0.176 7.850 10.646 1.00 8.68 H ATOM 176 HH21 ARG A 10 2.607 10.147 9.633 1.00 7.77 H ATOM 177 HH22 ARG A 10 2.013 9.179 10.941 1.00 8.49 H ATOM 178 N ASP A 11 3.297 8.893 2.993 1.00 5.06 N ATOM 179 CA ASP A 11 4.237 9.238 1.923 1.00 5.61 C ATOM 180 C ASP A 11 4.238 8.222 0.781 1.00 5.08 C ATOM 181 O ASP A 11 5.104 8.274 -0.092 1.00 5.61 O ATOM 182 CB ASP A 11 5.653 9.392 2.478 1.00 6.59 C ATOM 183 CG ASP A 11 5.827 10.673 3.272 1.00 7.41 C ATOM 184 OD1 ASP A 11 6.815 11.395 3.025 1.00 7.77 O ATOM 185 OD2 ASP A 11 4.971 10.958 4.136 1.00 7.89 O1- ATOM 186 H ASP A 11 3.626 8.415 3.781 1.00 5.04 H ATOM 187 HA ASP A 11 3.927 10.191 1.523 1.00 5.91 H ATOM 188 HB2 ASP A 11 5.875 8.557 3.121 1.00 6.40 H ATOM 189 HB3 ASP A 11 6.355 9.402 1.657 1.00 7.04 H ATOM 190 N GLU A 12 3.276 7.304 0.774 1.00 4.19 N ATOM 191 CA GLU A 12 3.210 6.300 -0.273 1.00 3.98 C ATOM 192 C GLU A 12 2.532 6.890 -1.513 1.00 3.29 C ATOM 193 O GLU A 12 2.759 8.054 -1.845 1.00 3.16 O ATOM 194 CB GLU A 12 2.458 5.067 0.242 1.00 3.93 C ATOM 195 CG GLU A 12 0.998 5.332 0.575 1.00 4.52 C ATOM 196 CD GLU A 12 0.328 4.140 1.230 1.00 5.23 C ATOM 197 OE1 GLU A 12 -0.288 3.332 0.504 1.00 5.69 O ATOM 198 OE2 GLU A 12 0.421 4.013 2.469 1.00 5.68 O1- ATOM 199 H GLU A 12 2.595 7.306 1.474 1.00 3.84 H ATOM 200 HA GLU A 12 4.221 6.019 -0.528 1.00 4.68 H ATOM 201 HB2 GLU A 12 2.501 4.293 -0.507 1.00 3.89 H ATOM 202 HB3 GLU A 12 2.948 4.713 1.137 1.00 3.99 H ATOM 203 HG2 GLU A 12 0.941 6.173 1.248 1.00 4.68 H ATOM 204 HG3 GLU A 12 0.469 5.566 -0.336 1.00 4.68 H ATOM 205 N ASP A 13 1.707 6.107 -2.198 1.00 3.08 N ATOM 206 CA ASP A 13 1.036 6.592 -3.399 1.00 2.63 C ATOM 207 C ASP A 13 -0.461 6.731 -3.161 1.00 1.80 C ATOM 208 O ASP A 13 -1.122 5.766 -2.778 1.00 1.58 O ATOM 209 CB ASP A 13 1.291 5.657 -4.596 1.00 2.89 C ATOM 210 CG ASP A 13 0.567 6.113 -5.848 1.00 3.75 C ATOM 211 OD1 ASP A 13 0.569 5.359 -6.840 1.00 4.07 O ATOM 212 OD2 ASP A 13 -0.004 7.223 -5.834 1.00 4.38 O1- ATOM 213 H ASP A 13 1.528 5.202 -1.882 1.00 3.41 H ATOM 214 HA ASP A 13 1.444 7.565 -3.627 1.00 2.97 H ATOM 215 HB2 ASP A 13 2.348 5.632 -4.809 1.00 2.94 H ATOM 216 HB3 ASP A 13 0.958 4.654 -4.358 1.00 2.80 H ATOM 217 N PRO A 14 -1.026 7.934 -3.379 1.00 1.83 N ATOM 218 CA PRO A 14 -2.458 8.158 -3.204 1.00 1.75 C ATOM 219 C PRO A 14 -3.261 7.134 -3.993 1.00 1.81 C ATOM 220 O PRO A 14 -4.412 6.843 -3.674 1.00 2.21 O ATOM 221 CB PRO A 14 -2.689 9.575 -3.753 1.00 2.45 C ATOM 222 CG PRO A 14 -1.430 9.940 -4.470 1.00 2.84 C ATOM 223 CD PRO A 14 -0.332 9.156 -3.811 1.00 2.56 C ATOM 224 HA PRO A 14 -2.743 8.115 -2.162 1.00 1.73 H ATOM 225 HB2 PRO A 14 -3.535 9.568 -4.425 1.00 2.83 H ATOM 226 HB3 PRO A 14 -2.883 10.252 -2.934 1.00 2.54 H ATOM 227 HG2 PRO A 14 -1.510 9.669 -5.512 1.00 3.11 H ATOM 228 HG3 PRO A 14 -1.245 10.999 -4.371 1.00 3.31 H ATOM 229 HD2 PRO A 14 0.450 8.931 -4.521 1.00 2.98 H ATOM 230 HD3 PRO A 14 0.065 9.695 -2.965 1.00 2.73 H ATOM 231 N GLU A 15 -2.631 6.591 -5.032 1.00 1.83 N ATOM 232 CA GLU A 15 -3.259 5.584 -5.868 1.00 2.05 C ATOM 233 C GLU A 15 -3.443 4.277 -5.090 1.00 1.84 C ATOM 234 O GLU A 15 -4.258 3.435 -5.465 1.00 2.30 O ATOM 235 CB GLU A 15 -2.425 5.360 -7.140 1.00 2.31 C ATOM 236 CG GLU A 15 -2.197 6.630 -7.944 1.00 3.05 C ATOM 237 CD GLU A 15 -3.492 7.266 -8.408 1.00 4.04 C ATOM 238 OE1 GLU A 15 -3.960 6.920 -9.513 1.00 4.57 O ATOM 239 OE2 GLU A 15 -4.038 8.110 -7.667 1.00 4.66 O1- ATOM 240 H GLU A 15 -1.722 6.883 -5.246 1.00 1.96 H ATOM 241 HA GLU A 15 -4.234 5.954 -6.149 1.00 2.57 H ATOM 242 HB2 GLU A 15 -1.456 4.951 -6.872 1.00 2.12 H ATOM 243 HB3 GLU A 15 -2.936 4.651 -7.772 1.00 2.45 H ATOM 244 HG2 GLU A 15 -1.666 7.340 -7.328 1.00 2.97 H ATOM 245 HG3 GLU A 15 -1.599 6.389 -8.811 1.00 3.37 H ATOM 246 N LEU A 16 -2.681 4.112 -4.004 1.00 1.54 N ATOM 247 CA LEU A 16 -2.794 2.914 -3.166 1.00 1.99 C ATOM 248 C LEU A 16 -4.015 3.022 -2.264 1.00 2.62 C ATOM 249 O LEU A 16 -4.578 2.014 -1.837 1.00 3.26 O ATOM 250 CB LEU A 16 -1.516 2.697 -2.332 1.00 2.13 C ATOM 251 CG LEU A 16 -0.208 2.737 -3.135 1.00 2.14 C ATOM 252 CD1 LEU A 16 0.785 1.673 -2.682 1.00 2.40 C ATOM 253 CD2 LEU A 16 -0.494 2.548 -4.599 1.00 2.38 C ATOM 254 H LEU A 16 -2.019 4.798 -3.774 1.00 1.32 H ATOM 255 HA LEU A 16 -2.930 2.069 -3.824 1.00 2.16 H ATOM 256 HB2 LEU A 16 -1.473 3.462 -1.571 1.00 2.03 H ATOM 257 HB3 LEU A 16 -1.586 1.734 -1.848 1.00 2.65 H ATOM 258 HG LEU A 16 0.254 3.702 -3.006 1.00 2.42 H ATOM 259 HD11 LEU A 16 0.283 0.722 -2.602 1.00 2.85 H ATOM 260 HD12 LEU A 16 1.200 1.945 -1.725 1.00 2.78 H ATOM 261 HD13 LEU A 16 1.588 1.594 -3.422 1.00 2.46 H ATOM 262 HD21 LEU A 16 -0.859 3.467 -5.027 1.00 2.63 H ATOM 263 HD22 LEU A 16 -1.242 1.780 -4.718 1.00 2.78 H ATOM 264 HD23 LEU A 16 0.412 2.246 -5.092 1.00 2.70 H ATOM 265 N PHE A 17 -4.420 4.256 -1.979 1.00 2.64 N ATOM 266 CA PHE A 17 -5.593 4.503 -1.155 1.00 3.41 C ATOM 267 C PHE A 17 -6.806 4.796 -2.037 1.00 3.84 C ATOM 268 O PHE A 17 -7.936 4.853 -1.552 1.00 4.59 O ATOM 269 CB PHE A 17 -5.346 5.677 -0.206 1.00 3.49 C ATOM 270 CG PHE A 17 -4.261 5.424 0.800 1.00 3.24 C ATOM 271 CD1 PHE A 17 -3.057 6.106 0.726 1.00 3.31 C ATOM 272 CD2 PHE A 17 -4.445 4.506 1.822 1.00 3.50 C ATOM 273 CE1 PHE A 17 -2.057 5.877 1.652 1.00 3.33 C ATOM 274 CE2 PHE A 17 -3.449 4.272 2.750 1.00 3.56 C ATOM 275 CZ PHE A 17 -2.253 4.959 2.665 1.00 3.33 C ATOM 276 H PHE A 17 -3.915 5.018 -2.329 1.00 2.26 H ATOM 277 HA PHE A 17 -5.787 3.613 -0.575 1.00 3.75 H ATOM 278 HB2 PHE A 17 -5.066 6.545 -0.784 1.00 3.25 H ATOM 279 HB3 PHE A 17 -6.258 5.891 0.334 1.00 4.15 H ATOM 280 HD1 PHE A 17 -2.903 6.824 -0.066 1.00 3.72 H ATOM 281 HD2 PHE A 17 -5.380 3.969 1.889 1.00 3.99 H ATOM 282 HE1 PHE A 17 -1.123 6.415 1.583 1.00 3.72 H ATOM 283 HE2 PHE A 17 -3.605 3.554 3.542 1.00 4.12 H ATOM 284 HZ PHE A 17 -1.473 4.779 3.390 1.00 3.55 H ATOM 285 N PHE A 18 -6.565 4.982 -3.337 1.00 3.47 N ATOM 286 CA PHE A 18 -7.640 5.264 -4.280 1.00 3.96 C ATOM 287 C PHE A 18 -7.529 4.362 -5.509 1.00 3.55 C ATOM 288 O PHE A 18 -6.477 4.301 -6.143 1.00 2.91 O ATOM 289 CB PHE A 18 -7.602 6.734 -4.704 1.00 4.23 C ATOM 290 CG PHE A 18 -7.956 7.687 -3.598 1.00 4.89 C ATOM 291 CD1 PHE A 18 -7.118 7.844 -2.505 1.00 5.32 C ATOM 292 CD2 PHE A 18 -9.127 8.426 -3.651 1.00 5.32 C ATOM 293 CE1 PHE A 18 -7.441 8.721 -1.487 1.00 5.95 C ATOM 294 CE2 PHE A 18 -9.455 9.304 -2.636 1.00 5.93 C ATOM 295 CZ PHE A 18 -8.611 9.452 -1.553 1.00 6.17 C ATOM 296 H PHE A 18 -5.640 4.928 -3.670 1.00 2.92 H ATOM 297 HA PHE A 18 -8.575 5.068 -3.780 1.00 4.64 H ATOM 298 HB2 PHE A 18 -6.607 6.977 -5.045 1.00 3.76 H ATOM 299 HB3 PHE A 18 -8.302 6.886 -5.512 1.00 4.61 H ATOM 300 HD1 PHE A 18 -6.203 7.273 -2.453 1.00 5.32 H ATOM 301 HD2 PHE A 18 -9.787 8.311 -4.498 1.00 5.34 H ATOM 302 HE1 PHE A 18 -6.780 8.834 -0.641 1.00 6.42 H ATOM 303 HE2 PHE A 18 -10.371 9.874 -2.690 1.00 6.37 H ATOM 304 HZ PHE A 18 -8.866 10.138 -0.758 1.00 6.68 H ATOM 305 N PRO A 19 -8.614 3.650 -5.866 1.00 4.05 N ATOM 306 CA PRO A 19 -8.615 2.753 -7.027 1.00 3.82 C ATOM 307 C PRO A 19 -8.302 3.490 -8.325 1.00 3.22 C ATOM 308 O PRO A 19 -8.845 4.565 -8.585 1.00 3.47 O ATOM 309 CB PRO A 19 -10.044 2.200 -7.063 1.00 4.70 C ATOM 310 CG PRO A 19 -10.579 2.412 -5.688 1.00 5.41 C ATOM 311 CD PRO A 19 -9.915 3.656 -5.174 1.00 5.00 C ATOM 312 HA PRO A 19 -7.915 1.941 -6.896 1.00 3.73 H ATOM 313 HB2 PRO A 19 -10.622 2.740 -7.798 1.00 4.71 H ATOM 314 HB3 PRO A 19 -10.020 1.151 -7.317 1.00 4.89 H ATOM 315 HG2 PRO A 19 -11.650 2.548 -5.728 1.00 6.02 H ATOM 316 HG3 PRO A 19 -10.330 1.568 -5.063 1.00 5.68 H ATOM 317 HD2 PRO A 19 -10.491 4.530 -5.439 1.00 5.23 H ATOM 318 HD3 PRO A 19 -9.783 3.597 -4.104 1.00 5.28 H ATOM 319 N VAL A 20 -7.425 2.909 -9.140 1.00 2.75 N ATOM 320 CA VAL A 20 -7.048 3.511 -10.410 1.00 2.39 C ATOM 321 C VAL A 20 -8.238 3.592 -11.354 1.00 2.36 C ATOM 322 O VAL A 20 -9.179 2.804 -11.257 1.00 2.67 O ATOM 323 CB VAL A 20 -5.925 2.712 -11.097 1.00 2.54 C ATOM 324 CG1 VAL A 20 -5.553 3.339 -12.433 1.00 2.80 C ATOM 325 CG2 VAL A 20 -4.713 2.616 -10.189 1.00 2.90 C ATOM 326 H VAL A 20 -7.018 2.057 -8.879 1.00 2.94 H ATOM 327 HA VAL A 20 -6.685 4.509 -10.214 1.00 2.59 H ATOM 328 HB VAL A 20 -6.287 1.712 -11.283 1.00 2.73 H ATOM 329 HG11 VAL A 20 -4.719 2.804 -12.863 1.00 3.02 H ATOM 330 HG12 VAL A 20 -5.281 4.373 -12.283 1.00 2.78 H ATOM 331 HG13 VAL A 20 -6.399 3.284 -13.104 1.00 3.39 H ATOM 332 HG21 VAL A 20 -4.353 3.608 -9.962 1.00 3.32 H ATOM 333 HG22 VAL A 20 -3.934 2.056 -10.687 1.00 2.90 H ATOM 334 HG23 VAL A 20 -4.988 2.114 -9.274 1.00 3.26 H ATOM 335 N GLY A 21 -8.187 4.552 -12.267 1.00 2.42 N ATOM 336 CA GLY A 21 -9.258 4.715 -13.225 1.00 2.52 C ATOM 337 C GLY A 21 -8.987 3.968 -14.516 1.00 2.65 C ATOM 338 O GLY A 21 -9.190 2.756 -14.593 1.00 3.01 O ATOM 339 H GLY A 21 -7.415 5.154 -12.291 1.00 2.67 H ATOM 340 HA2 GLY A 21 -10.175 4.343 -12.791 1.00 2.88 H ATOM 341 HA3 GLY A 21 -9.376 5.765 -13.444 1.00 2.48 H ATOM 342 N ASN A 22 -8.527 4.690 -15.531 1.00 2.69 N ATOM 343 CA ASN A 22 -8.235 4.088 -16.826 1.00 3.11 C ATOM 344 C ASN A 22 -6.791 4.342 -17.257 1.00 3.00 C ATOM 345 O ASN A 22 -6.462 4.188 -18.433 1.00 3.47 O ATOM 346 CB ASN A 22 -9.193 4.635 -17.887 1.00 3.74 C ATOM 347 CG ASN A 22 -10.653 4.479 -17.500 1.00 3.98 C ATOM 348 OD1 ASN A 22 -11.483 5.330 -17.821 1.00 4.04 O ATOM 349 ND2 ASN A 22 -10.980 3.387 -16.814 1.00 4.46 N ATOM 350 H ASN A 22 -8.379 5.651 -15.408 1.00 2.65 H ATOM 351 HA ASN A 22 -8.385 3.024 -16.736 1.00 3.29 H ATOM 352 HB2 ASN A 22 -8.992 5.685 -18.036 1.00 3.77 H ATOM 353 HB3 ASN A 22 -9.028 4.107 -18.815 1.00 4.17 H ATOM 354 HD21 ASN A 22 -10.273 2.746 -16.597 1.00 4.76 H ATOM 355 HD22 ASN A 22 -11.917 3.269 -16.554 1.00 4.67 H ATOM 356 N SER A 23 -5.922 4.724 -16.318 1.00 2.51 N ATOM 357 CA SER A 23 -4.537 5.012 -16.665 1.00 2.53 C ATOM 358 C SER A 23 -3.607 3.851 -16.348 1.00 2.10 C ATOM 359 O SER A 23 -3.891 3.017 -15.488 1.00 1.90 O ATOM 360 CB SER A 23 -4.060 6.258 -15.917 1.00 2.85 C ATOM 361 OG SER A 23 -4.134 6.069 -14.515 1.00 2.71 O ATOM 362 H SER A 23 -6.209 4.798 -15.380 1.00 2.28 H ATOM 363 HA SER A 23 -4.497 5.209 -17.725 1.00 2.92 H ATOM 364 HB2 SER A 23 -3.031 6.458 -16.179 1.00 3.04 H ATOM 365 HB3 SER A 23 -4.676 7.102 -16.190 1.00 3.24 H ATOM 366 HG SER A 23 -4.438 6.878 -14.099 1.00 2.79 H ATOM 367 N GLY A 24 -2.488 3.816 -17.063 1.00 2.24 N ATOM 368 CA GLY A 24 -1.486 2.794 -16.845 1.00 1.95 C ATOM 369 C GLY A 24 -0.462 3.240 -15.824 1.00 1.72 C ATOM 370 O GLY A 24 -0.092 2.473 -14.935 1.00 1.47 O ATOM 371 H GLY A 24 -2.352 4.485 -17.764 1.00 2.67 H ATOM 372 HA2 GLY A 24 -1.971 1.903 -16.486 1.00 1.86 H ATOM 373 HA3 GLY A 24 -0.986 2.580 -17.775 1.00 2.12 H ATOM 374 N PRO A 25 0.018 4.492 -15.931 1.00 1.91 N ATOM 375 CA PRO A 25 0.975 5.056 -14.987 1.00 1.84 C ATOM 376 C PRO A 25 0.530 4.851 -13.556 1.00 1.53 C ATOM 377 O PRO A 25 1.350 4.814 -12.647 1.00 1.42 O ATOM 378 CB PRO A 25 1.021 6.539 -15.348 1.00 2.19 C ATOM 379 CG PRO A 25 0.667 6.575 -16.791 1.00 2.48 C ATOM 380 CD PRO A 25 -0.320 5.458 -16.998 1.00 2.31 C ATOM 381 HA PRO A 25 1.949 4.613 -15.109 1.00 1.88 H ATOM 382 HB2 PRO A 25 0.304 7.082 -14.749 1.00 2.17 H ATOM 383 HB3 PRO A 25 2.014 6.926 -15.175 1.00 2.30 H ATOM 384 HG2 PRO A 25 0.216 7.525 -17.036 1.00 2.72 H ATOM 385 HG3 PRO A 25 1.549 6.410 -17.391 1.00 2.63 H ATOM 386 HD2 PRO A 25 -1.328 5.825 -16.879 1.00 2.38 H ATOM 387 HD3 PRO A 25 -0.191 5.015 -17.974 1.00 2.47 H ATOM 388 N ALA A 26 -0.775 4.736 -13.355 1.00 1.49 N ATOM 389 CA ALA A 26 -1.304 4.548 -12.009 1.00 1.32 C ATOM 390 C ALA A 26 -0.753 3.272 -11.404 1.00 1.06 C ATOM 391 O ALA A 26 -0.518 3.189 -10.202 1.00 0.93 O ATOM 392 CB ALA A 26 -2.823 4.491 -12.012 1.00 1.52 C ATOM 393 H ALA A 26 -1.388 4.760 -14.128 1.00 1.64 H ATOM 394 HA ALA A 26 -0.994 5.384 -11.407 1.00 1.37 H ATOM 395 HB1 ALA A 26 -3.199 5.092 -11.199 1.00 2.24 H ATOM 396 HB2 ALA A 26 -3.141 3.462 -11.875 1.00 1.59 H ATOM 397 HB3 ALA A 26 -3.206 4.866 -12.952 1.00 1.74 H ATOM 398 N LEU A 27 -0.555 2.280 -12.248 1.00 1.12 N ATOM 399 CA LEU A 27 -0.016 1.004 -11.809 1.00 1.08 C ATOM 400 C LEU A 27 1.439 1.163 -11.434 1.00 1.01 C ATOM 401 O LEU A 27 1.903 0.606 -10.442 1.00 0.98 O ATOM 402 CB LEU A 27 -0.144 -0.031 -12.918 1.00 1.35 C ATOM 403 CG LEU A 27 -1.575 -0.369 -13.341 1.00 1.62 C ATOM 404 CD1 LEU A 27 -2.517 -0.300 -12.151 1.00 2.10 C ATOM 405 CD2 LEU A 27 -2.037 0.569 -14.442 1.00 2.05 C ATOM 406 H LEU A 27 -0.767 2.414 -13.192 1.00 1.28 H ATOM 407 HA LEU A 27 -0.565 0.679 -10.941 1.00 1.09 H ATOM 408 HB2 LEU A 27 0.387 0.346 -13.781 1.00 1.43 H ATOM 409 HB3 LEU A 27 0.337 -0.937 -12.590 1.00 1.38 H ATOM 410 HG LEU A 27 -1.600 -1.378 -13.728 1.00 2.19 H ATOM 411 HD11 LEU A 27 -2.783 0.730 -11.963 1.00 2.70 H ATOM 412 HD12 LEU A 27 -2.022 -0.705 -11.282 1.00 2.28 H ATOM 413 HD13 LEU A 27 -3.408 -0.872 -12.360 1.00 2.53 H ATOM 414 HD21 LEU A 27 -1.287 0.609 -15.217 1.00 2.37 H ATOM 415 HD22 LEU A 27 -2.188 1.558 -14.035 1.00 2.36 H ATOM 416 HD23 LEU A 27 -2.965 0.206 -14.859 1.00 2.61 H ATOM 417 N ALA A 28 2.160 1.916 -12.246 1.00 1.16 N ATOM 418 CA ALA A 28 3.563 2.163 -11.983 1.00 1.33 C ATOM 419 C ALA A 28 3.699 3.050 -10.762 1.00 1.26 C ATOM 420 O ALA A 28 4.628 2.906 -9.966 1.00 1.31 O ATOM 421 CB ALA A 28 4.234 2.798 -13.192 1.00 1.68 C ATOM 422 H ALA A 28 1.732 2.323 -13.031 1.00 1.26 H ATOM 423 HA ALA A 28 4.037 1.218 -11.782 1.00 1.39 H ATOM 424 HB1 ALA A 28 3.771 3.751 -13.401 1.00 1.80 H ATOM 425 HB2 ALA A 28 4.124 2.149 -14.048 1.00 1.93 H ATOM 426 HB3 ALA A 28 5.284 2.946 -12.984 1.00 2.22 H ATOM 427 N GLN A 29 2.747 3.961 -10.618 1.00 1.24 N ATOM 428 CA GLN A 29 2.743 4.885 -9.491 1.00 1.29 C ATOM 429 C GLN A 29 2.422 4.113 -8.221 1.00 1.03 C ATOM 430 O GLN A 29 3.135 4.187 -7.207 1.00 1.10 O ATOM 431 CB GLN A 29 1.690 5.977 -9.726 1.00 1.50 C ATOM 432 CG GLN A 29 1.846 7.182 -8.813 1.00 1.85 C ATOM 433 CD GLN A 29 3.106 7.974 -9.104 1.00 1.88 C ATOM 434 OE1 GLN A 29 3.580 8.013 -10.240 1.00 2.46 O ATOM 435 NE2 GLN A 29 3.656 8.610 -8.076 1.00 2.13 N ATOM 436 H GLN A 29 2.012 3.984 -11.274 1.00 1.26 H ATOM 437 HA GLN A 29 3.722 5.333 -9.406 1.00 1.49 H ATOM 438 HB2 GLN A 29 1.765 6.316 -10.749 1.00 1.75 H ATOM 439 HB3 GLN A 29 0.701 5.556 -9.572 1.00 1.89 H ATOM 440 HG2 GLN A 29 0.993 7.831 -8.945 1.00 2.39 H ATOM 441 HG3 GLN A 29 1.883 6.841 -7.791 1.00 2.43 H ATOM 442 HE21 GLN A 29 3.223 8.534 -7.200 1.00 2.32 H ATOM 443 HE22 GLN A 29 4.471 9.129 -8.236 1.00 2.57 H ATOM 444 N ILE A 30 1.349 3.341 -8.307 1.00 0.85 N ATOM 445 CA ILE A 30 0.925 2.494 -7.226 1.00 0.87 C ATOM 446 C ILE A 30 1.992 1.470 -6.872 1.00 0.85 C ATOM 447 O ILE A 30 2.252 1.197 -5.700 1.00 1.00 O ATOM 448 CB ILE A 30 -0.371 1.749 -7.604 1.00 1.07 C ATOM 449 CG1 ILE A 30 -1.564 2.694 -7.586 1.00 1.31 C ATOM 450 CG2 ILE A 30 -0.600 0.579 -6.675 1.00 1.39 C ATOM 451 CD1 ILE A 30 -2.867 2.041 -7.977 1.00 1.41 C ATOM 452 H ILE A 30 0.767 3.418 -9.091 1.00 0.88 H ATOM 453 HA ILE A 30 0.736 3.117 -6.380 1.00 1.02 H ATOM 454 HB ILE A 30 -0.250 1.358 -8.604 1.00 1.00 H ATOM 455 HG12 ILE A 30 -1.686 3.089 -6.593 1.00 1.90 H ATOM 456 HG13 ILE A 30 -1.381 3.506 -8.272 1.00 1.88 H ATOM 457 HG21 ILE A 30 0.009 0.709 -5.789 1.00 2.05 H ATOM 458 HG22 ILE A 30 -0.325 -0.334 -7.181 1.00 1.58 H ATOM 459 HG23 ILE A 30 -1.640 0.542 -6.395 1.00 1.68 H ATOM 460 HD11 ILE A 30 -3.084 1.233 -7.295 1.00 1.79 H ATOM 461 HD12 ILE A 30 -2.788 1.655 -8.982 1.00 2.05 H ATOM 462 HD13 ILE A 30 -3.662 2.771 -7.933 1.00 1.76 H ATOM 463 N ALA A 31 2.601 0.914 -7.896 1.00 0.86 N ATOM 464 CA ALA A 31 3.629 -0.095 -7.723 1.00 1.12 C ATOM 465 C ALA A 31 4.802 0.464 -6.939 1.00 1.15 C ATOM 466 O ALA A 31 5.457 -0.251 -6.187 1.00 1.34 O ATOM 467 CB ALA A 31 4.093 -0.616 -9.075 1.00 1.36 C ATOM 468 H ALA A 31 2.355 1.196 -8.800 1.00 0.82 H ATOM 469 HA ALA A 31 3.200 -0.919 -7.172 1.00 1.30 H ATOM 470 HB1 ALA A 31 4.822 -1.399 -8.928 1.00 1.73 H ATOM 471 HB2 ALA A 31 4.539 0.191 -9.637 1.00 1.50 H ATOM 472 HB3 ALA A 31 3.247 -1.009 -9.618 1.00 1.88 H ATOM 473 N ASP A 32 5.045 1.755 -7.097 1.00 1.13 N ATOM 474 CA ASP A 32 6.168 2.390 -6.428 1.00 1.35 C ATOM 475 C ASP A 32 5.883 2.494 -4.956 1.00 1.35 C ATOM 476 O ASP A 32 6.743 2.225 -4.115 1.00 1.51 O ATOM 477 CB ASP A 32 6.456 3.772 -7.019 1.00 1.57 C ATOM 478 CG ASP A 32 6.939 3.702 -8.454 1.00 1.77 C ATOM 479 OD1 ASP A 32 6.410 4.456 -9.297 1.00 1.97 O ATOM 480 OD2 ASP A 32 7.848 2.892 -8.736 1.00 2.21 O1- ATOM 481 H ASP A 32 4.401 2.304 -7.585 1.00 1.07 H ATOM 482 HA ASP A 32 7.025 1.756 -6.559 1.00 1.50 H ATOM 483 HB2 ASP A 32 5.553 4.363 -6.992 1.00 1.45 H ATOM 484 HB3 ASP A 32 7.217 4.258 -6.426 1.00 1.80 H ATOM 485 N ALA A 33 4.662 2.877 -4.648 1.00 1.25 N ATOM 486 CA ALA A 33 4.254 2.987 -3.268 1.00 1.40 C ATOM 487 C ALA A 33 4.196 1.601 -2.648 1.00 1.47 C ATOM 488 O ALA A 33 4.493 1.422 -1.473 1.00 1.68 O ATOM 489 CB ALA A 33 2.923 3.695 -3.166 1.00 1.46 C ATOM 490 H ALA A 33 4.019 3.070 -5.365 1.00 1.14 H ATOM 491 HA ALA A 33 4.995 3.576 -2.746 1.00 1.58 H ATOM 492 HB1 ALA A 33 3.084 4.758 -3.242 1.00 1.96 H ATOM 493 HB2 ALA A 33 2.463 3.467 -2.218 1.00 1.66 H ATOM 494 HB3 ALA A 33 2.281 3.372 -3.970 1.00 1.76 H ATOM 495 N LYS A 34 3.800 0.623 -3.457 1.00 1.40 N ATOM 496 CA LYS A 34 3.699 -0.759 -3.006 1.00 1.66 C ATOM 497 C LYS A 34 5.043 -1.288 -2.502 1.00 1.71 C ATOM 498 O LYS A 34 5.107 -1.920 -1.450 1.00 2.01 O ATOM 499 CB LYS A 34 3.188 -1.649 -4.143 1.00 1.75 C ATOM 500 CG LYS A 34 2.654 -2.996 -3.676 1.00 1.91 C ATOM 501 CD LYS A 34 3.549 -4.148 -4.110 1.00 2.07 C ATOM 502 CE LYS A 34 4.888 -4.126 -3.393 1.00 2.56 C ATOM 503 NZ LYS A 34 5.625 -5.410 -3.556 1.00 2.85 N1+ ATOM 504 H LYS A 34 3.569 0.837 -4.384 1.00 1.25 H ATOM 505 HA LYS A 34 2.989 -0.790 -2.194 1.00 1.87 H ATOM 506 HB2 LYS A 34 2.393 -1.131 -4.659 1.00 2.00 H ATOM 507 HB3 LYS A 34 3.997 -1.826 -4.836 1.00 1.92 H ATOM 508 HG2 LYS A 34 2.591 -2.992 -2.599 1.00 2.40 H ATOM 509 HG3 LYS A 34 1.669 -3.143 -4.095 1.00 2.26 H ATOM 510 HD2 LYS A 34 3.051 -5.079 -3.888 1.00 2.35 H ATOM 511 HD3 LYS A 34 3.720 -4.076 -5.175 1.00 2.50 H ATOM 512 HE2 LYS A 34 5.487 -3.325 -3.800 1.00 2.90 H ATOM 513 HE3 LYS A 34 4.717 -3.949 -2.341 1.00 3.02 H ATOM 514 HZ1 LYS A 34 5.012 -6.209 -3.296 1.00 3.13 H ATOM 515 HZ2 LYS A 34 6.466 -5.420 -2.944 1.00 3.19 H ATOM 516 HZ3 LYS A 34 5.928 -5.525 -4.545 1.00 3.04 H ATOM 517 N LEU A 35 6.121 -1.028 -3.246 1.00 1.51 N ATOM 518 CA LEU A 35 7.443 -1.516 -2.846 1.00 1.62 C ATOM 519 C LEU A 35 7.975 -0.751 -1.647 1.00 1.70 C ATOM 520 O LEU A 35 8.515 -1.335 -0.708 1.00 1.88 O ATOM 521 CB LEU A 35 8.442 -1.401 -4.001 1.00 1.54 C ATOM 522 CG LEU A 35 8.330 -2.487 -5.069 1.00 1.68 C ATOM 523 CD1 LEU A 35 8.365 -3.866 -4.433 1.00 2.31 C ATOM 524 CD2 LEU A 35 7.060 -2.300 -5.875 1.00 1.65 C ATOM 525 H LEU A 35 6.030 -0.491 -4.069 1.00 1.35 H ATOM 526 HA LEU A 35 7.341 -2.555 -2.575 1.00 1.82 H ATOM 527 HB2 LEU A 35 8.299 -0.442 -4.478 1.00 1.40 H ATOM 528 HB3 LEU A 35 9.440 -1.433 -3.590 1.00 1.64 H ATOM 529 HG LEU A 35 9.171 -2.408 -5.743 1.00 2.27 H ATOM 530 HD11 LEU A 35 8.402 -4.619 -5.205 1.00 2.74 H ATOM 531 HD12 LEU A 35 7.478 -4.006 -3.834 1.00 2.59 H ATOM 532 HD13 LEU A 35 9.240 -3.950 -3.805 1.00 2.87 H ATOM 533 HD21 LEU A 35 7.194 -1.483 -6.567 1.00 2.16 H ATOM 534 HD22 LEU A 35 6.244 -2.071 -5.206 1.00 1.95 H ATOM 535 HD23 LEU A 35 6.839 -3.204 -6.421 1.00 1.98 H ATOM 536 N VAL A 36 7.816 0.559 -1.689 1.00 1.67 N ATOM 537 CA VAL A 36 8.292 1.422 -0.610 1.00 1.92 C ATOM 538 C VAL A 36 7.476 1.234 0.673 1.00 2.27 C ATOM 539 O VAL A 36 8.017 1.291 1.778 1.00 2.56 O ATOM 540 CB VAL A 36 8.254 2.905 -1.028 1.00 2.08 C ATOM 541 CG1 VAL A 36 8.804 3.791 0.078 1.00 2.44 C ATOM 542 CG2 VAL A 36 9.030 3.114 -2.319 1.00 1.96 C ATOM 543 H VAL A 36 7.373 0.955 -2.472 1.00 1.55 H ATOM 544 HA VAL A 36 9.320 1.158 -0.407 1.00 1.89 H ATOM 545 HB VAL A 36 7.224 3.183 -1.203 1.00 2.14 H ATOM 546 HG11 VAL A 36 9.858 3.593 0.207 1.00 2.71 H ATOM 547 HG12 VAL A 36 8.284 3.580 0.998 1.00 2.87 H ATOM 548 HG13 VAL A 36 8.662 4.829 -0.187 1.00 2.51 H ATOM 549 HG21 VAL A 36 8.673 2.425 -3.070 1.00 2.06 H ATOM 550 HG22 VAL A 36 10.081 2.939 -2.140 1.00 2.16 H ATOM 551 HG23 VAL A 36 8.888 4.127 -2.665 1.00 2.25 H ATOM 552 N CYS A 37 6.176 1.010 0.516 1.00 2.30 N ATOM 553 CA CYS A 37 5.271 0.824 1.652 1.00 2.78 C ATOM 554 C CYS A 37 5.348 -0.599 2.208 1.00 3.05 C ATOM 555 O CYS A 37 5.113 -0.821 3.395 1.00 3.55 O ATOM 556 CB CYS A 37 3.837 1.152 1.215 1.00 2.92 C ATOM 557 SG CYS A 37 2.526 0.712 2.409 1.00 2.70 S ATOM 558 H CYS A 37 5.810 0.968 -0.392 1.00 2.05 H ATOM 559 HA CYS A 37 5.567 1.516 2.426 1.00 3.01 H ATOM 560 HB2 CYS A 37 3.762 2.212 1.034 1.00 2.99 H ATOM 561 HB3 CYS A 37 3.626 0.624 0.297 1.00 3.42 H ATOM 562 N ASN A 38 5.676 -1.557 1.347 1.00 2.91 N ATOM 563 CA ASN A 38 5.764 -2.956 1.760 1.00 3.45 C ATOM 564 C ASN A 38 7.091 -3.279 2.445 1.00 3.36 C ATOM 565 O ASN A 38 7.148 -4.154 3.309 1.00 3.83 O ATOM 566 CB ASN A 38 5.563 -3.880 0.558 1.00 3.70 C ATOM 567 CG ASN A 38 4.124 -3.904 0.081 1.00 3.92 C ATOM 568 OD1 ASN A 38 3.397 -2.919 0.214 1.00 4.18 O ATOM 569 ND2 ASN A 38 3.704 -5.032 -0.479 1.00 4.10 N ATOM 570 H ASN A 38 5.864 -1.321 0.415 1.00 2.60 H ATOM 571 HA ASN A 38 4.966 -3.135 2.465 1.00 3.88 H ATOM 572 HB2 ASN A 38 6.187 -3.542 -0.256 1.00 3.40 H ATOM 573 HB3 ASN A 38 5.849 -4.885 0.832 1.00 4.15 H ATOM 574 HD21 ASN A 38 4.338 -5.776 -0.552 1.00 4.26 H ATOM 575 HD22 ASN A 38 2.778 -5.075 -0.797 1.00 4.23 H ATOM 576 N ARG A 39 8.158 -2.579 2.068 1.00 2.85 N ATOM 577 CA ARG A 39 9.470 -2.834 2.661 1.00 2.71 C ATOM 578 C ARG A 39 9.678 -2.034 3.948 1.00 2.32 C ATOM 579 O ARG A 39 10.677 -2.217 4.643 1.00 2.32 O ATOM 580 CB ARG A 39 10.575 -2.498 1.659 1.00 2.85 C ATOM 581 CG ARG A 39 10.533 -3.347 0.399 1.00 3.52 C ATOM 582 CD ARG A 39 11.641 -2.964 -0.568 1.00 4.09 C ATOM 583 NE ARG A 39 11.543 -1.567 -0.987 1.00 4.53 N ATOM 584 CZ ARG A 39 12.392 -0.985 -1.831 1.00 5.23 C ATOM 585 NH1 ARG A 39 13.402 -1.674 -2.348 1.00 5.50 N1+ ATOM 586 NH2 ARG A 39 12.230 0.289 -2.160 1.00 5.96 N ATOM 587 H ARG A 39 8.063 -1.884 1.383 1.00 2.67 H ATOM 588 HA ARG A 39 9.524 -3.886 2.897 1.00 3.01 H ATOM 589 HB2 ARG A 39 10.482 -1.461 1.371 1.00 2.80 H ATOM 590 HB3 ARG A 39 11.534 -2.645 2.135 1.00 2.74 H ATOM 591 HG2 ARG A 39 10.651 -4.385 0.672 1.00 3.84 H ATOM 592 HG3 ARG A 39 9.578 -3.207 -0.086 1.00 3.66 H ATOM 593 HD2 ARG A 39 12.594 -3.118 -0.084 1.00 4.72 H ATOM 594 HD3 ARG A 39 11.575 -3.597 -1.441 1.00 4.02 H ATOM 595 HE ARG A 39 10.806 -1.036 -0.621 1.00 4.57 H ATOM 596 HH11 ARG A 39 13.530 -2.635 -2.105 1.00 5.27 H ATOM 597 HH12 ARG A 39 14.036 -1.230 -2.982 1.00 6.12 H ATOM 598 HH21 ARG A 39 11.471 0.813 -1.773 1.00 6.06 H ATOM 599 HH22 ARG A 39 12.868 0.727 -2.793 1.00 6.58 H ATOM 600 N CYS A 40 8.736 -1.151 4.262 1.00 2.21 N ATOM 601 CA CYS A 40 8.818 -0.346 5.476 1.00 2.26 C ATOM 602 C CYS A 40 8.441 -1.182 6.701 1.00 2.61 C ATOM 603 O CYS A 40 7.682 -2.145 6.592 1.00 2.77 O ATOM 604 CB CYS A 40 7.925 0.897 5.344 1.00 2.34 C ATOM 605 SG CYS A 40 6.964 1.336 6.833 1.00 1.86 S ATOM 606 H CYS A 40 7.969 -1.034 3.665 1.00 2.27 H ATOM 607 HA CYS A 40 9.844 -0.026 5.584 1.00 2.31 H ATOM 608 HB2 CYS A 40 8.545 1.746 5.101 1.00 2.97 H ATOM 609 HB3 CYS A 40 7.222 0.736 4.539 1.00 2.44 H ATOM 610 N PRO A 41 8.979 -0.827 7.882 1.00 2.99 N ATOM 611 CA PRO A 41 8.690 -1.540 9.134 1.00 3.58 C ATOM 612 C PRO A 41 7.191 -1.714 9.377 1.00 3.72 C ATOM 613 O PRO A 41 6.375 -1.439 8.497 1.00 4.42 O ATOM 614 CB PRO A 41 9.312 -0.637 10.199 1.00 4.16 C ATOM 615 CG PRO A 41 10.421 0.056 9.488 1.00 3.79 C ATOM 616 CD PRO A 41 9.920 0.290 8.090 1.00 3.10 C ATOM 617 HA PRO A 41 9.169 -2.508 9.155 1.00 3.74 H ATOM 618 HB2 PRO A 41 8.572 0.062 10.560 1.00 4.63 H ATOM 619 HB3 PRO A 41 9.682 -1.238 11.017 1.00 4.52 H ATOM 620 HG2 PRO A 41 10.642 0.995 9.971 1.00 4.16 H ATOM 621 HG3 PRO A 41 11.298 -0.574 9.471 1.00 3.79 H ATOM 622 HD2 PRO A 41 9.413 1.241 8.025 1.00 3.16 H ATOM 623 HD3 PRO A 41 10.735 0.244 7.383 1.00 2.86 H ATOM 624 N VAL A 42 6.831 -2.164 10.577 1.00 3.42 N ATOM 625 CA VAL A 42 5.428 -2.388 10.916 1.00 3.71 C ATOM 626 C VAL A 42 4.950 -1.475 12.046 1.00 3.72 C ATOM 627 O VAL A 42 5.704 -1.149 12.963 1.00 4.29 O ATOM 628 CB VAL A 42 5.183 -3.856 11.320 1.00 4.48 C ATOM 629 CG1 VAL A 42 5.992 -4.214 12.557 1.00 4.82 C ATOM 630 CG2 VAL A 42 3.701 -4.110 11.550 1.00 5.23 C ATOM 631 H VAL A 42 7.521 -2.348 11.247 1.00 3.29 H ATOM 632 HA VAL A 42 4.839 -2.183 10.033 1.00 3.73 H ATOM 633 HB VAL A 42 5.512 -4.489 10.509 1.00 4.71 H ATOM 634 HG11 VAL A 42 5.701 -3.572 13.376 1.00 5.08 H ATOM 635 HG12 VAL A 42 7.044 -4.079 12.352 1.00 5.24 H ATOM 636 HG13 VAL A 42 5.806 -5.244 12.823 1.00 4.81 H ATOM 637 HG21 VAL A 42 3.160 -3.939 10.631 1.00 5.51 H ATOM 638 HG22 VAL A 42 3.335 -3.438 12.313 1.00 5.70 H ATOM 639 HG23 VAL A 42 3.556 -5.131 11.870 1.00 5.37 H ATOM 640 N THR A 43 3.685 -1.070 11.959 1.00 3.43 N ATOM 641 CA THR A 43 3.067 -0.204 12.962 1.00 3.73 C ATOM 642 C THR A 43 1.698 -0.717 13.356 1.00 3.66 C ATOM 643 O THR A 43 1.149 -1.614 12.716 1.00 3.29 O ATOM 644 CB THR A 43 2.869 1.228 12.447 1.00 3.96 C ATOM 645 OG1 THR A 43 2.011 1.222 11.299 1.00 3.69 O ATOM 646 CG2 THR A 43 4.185 1.869 12.091 1.00 4.50 C ATOM 647 H THR A 43 3.149 -1.363 11.196 1.00 3.26 H ATOM 648 HA THR A 43 3.706 -0.174 13.832 1.00 4.30 H ATOM 649 HB THR A 43 2.403 1.811 13.228 1.00 4.38 H ATOM 650 HG1 THR A 43 1.806 2.125 11.048 1.00 3.93 H ATOM 651 HG21 THR A 43 4.780 1.984 12.984 1.00 4.59 H ATOM 652 HG22 THR A 43 3.999 2.836 11.652 1.00 4.65 H ATOM 653 HG23 THR A 43 4.707 1.243 11.386 1.00 5.03 H ATOM 654 N THR A 44 1.140 -0.130 14.407 1.00 4.35 N ATOM 655 CA THR A 44 -0.189 -0.500 14.853 1.00 4.63 C ATOM 656 C THR A 44 -1.176 -0.309 13.707 1.00 3.94 C ATOM 657 O THR A 44 -2.196 -0.993 13.628 1.00 4.00 O ATOM 658 CB THR A 44 -0.639 0.343 16.063 1.00 5.70 C ATOM 659 OG1 THR A 44 0.313 0.221 17.126 1.00 6.41 O ATOM 660 CG2 THR A 44 -2.010 -0.100 16.553 1.00 6.27 C ATOM 661 H THR A 44 1.635 0.565 14.890 1.00 4.85 H ATOM 662 HA THR A 44 -0.173 -1.542 15.141 1.00 4.83 H ATOM 663 HB THR A 44 -0.698 1.378 15.759 1.00 5.79 H ATOM 664 HG1 THR A 44 1.149 0.608 16.854 1.00 6.77 H ATOM 665 HG21 THR A 44 -2.302 0.505 17.399 1.00 6.56 H ATOM 666 HG22 THR A 44 -1.969 -1.137 16.850 1.00 6.28 H ATOM 667 HG23 THR A 44 -2.732 0.019 15.759 1.00 6.71 H ATOM 668 N GLU A 45 -0.858 0.635 12.815 1.00 3.59 N ATOM 669 CA GLU A 45 -1.708 0.909 11.662 1.00 3.30 C ATOM 670 C GLU A 45 -1.672 -0.259 10.689 1.00 2.69 C ATOM 671 O GLU A 45 -2.678 -0.606 10.070 1.00 2.95 O ATOM 672 CB GLU A 45 -1.261 2.188 10.951 1.00 3.58 C ATOM 673 CG GLU A 45 -1.659 3.460 11.681 1.00 3.98 C ATOM 674 CD GLU A 45 -1.328 4.712 10.893 1.00 4.30 C ATOM 675 OE1 GLU A 45 -2.251 5.290 10.282 1.00 4.58 O ATOM 676 OE2 GLU A 45 -0.146 5.114 10.885 1.00 4.71 O1- ATOM 677 H GLU A 45 -0.018 1.145 12.925 1.00 3.80 H ATOM 678 HA GLU A 45 -2.720 1.038 12.017 1.00 3.74 H ATOM 679 HB2 GLU A 45 -0.185 2.176 10.854 1.00 4.03 H ATOM 680 HB3 GLU A 45 -1.702 2.212 9.965 1.00 3.62 H ATOM 681 HG2 GLU A 45 -2.724 3.438 11.861 1.00 4.26 H ATOM 682 HG3 GLU A 45 -1.137 3.497 12.625 1.00 4.34 H ATOM 683 N CYS A 46 -0.496 -0.861 10.565 1.00 2.29 N ATOM 684 CA CYS A 46 -0.297 -1.987 9.667 1.00 2.34 C ATOM 685 C CYS A 46 -1.056 -3.222 10.149 1.00 2.72 C ATOM 686 O CYS A 46 -1.714 -3.901 9.361 1.00 3.24 O ATOM 687 CB CYS A 46 1.197 -2.291 9.558 1.00 2.42 C ATOM 688 SG CYS A 46 1.830 -2.334 7.853 1.00 2.25 S ATOM 689 H CYS A 46 0.261 -0.536 11.095 1.00 2.37 H ATOM 690 HA CYS A 46 -0.669 -1.706 8.693 1.00 2.70 H ATOM 691 HB2 CYS A 46 1.746 -1.530 10.088 1.00 2.68 H ATOM 692 HB3 CYS A 46 1.397 -3.252 10.009 1.00 3.02 H ATOM 693 N LEU A 47 -0.963 -3.509 11.445 1.00 2.97 N ATOM 694 CA LEU A 47 -1.653 -4.662 12.018 1.00 3.78 C ATOM 695 C LEU A 47 -3.161 -4.450 11.998 1.00 4.19 C ATOM 696 O LEU A 47 -3.920 -5.331 11.594 1.00 4.73 O ATOM 697 CB LEU A 47 -1.190 -4.920 13.455 1.00 4.40 C ATOM 698 CG LEU A 47 0.255 -5.400 13.602 1.00 4.55 C ATOM 699 CD1 LEU A 47 0.528 -6.573 12.674 1.00 4.85 C ATOM 700 CD2 LEU A 47 1.222 -4.261 13.330 1.00 5.05 C ATOM 701 H LEU A 47 -0.427 -2.932 12.027 1.00 2.90 H ATOM 702 HA LEU A 47 -1.416 -5.524 11.412 1.00 3.99 H ATOM 703 HB2 LEU A 47 -1.300 -4.002 14.014 1.00 4.40 H ATOM 704 HB3 LEU A 47 -1.839 -5.665 13.890 1.00 5.07 H ATOM 705 HG LEU A 47 0.412 -5.736 14.617 1.00 4.52 H ATOM 706 HD11 LEU A 47 1.538 -6.926 12.828 1.00 5.11 H ATOM 707 HD12 LEU A 47 0.410 -6.256 11.649 1.00 4.92 H ATOM 708 HD13 LEU A 47 -0.168 -7.371 12.887 1.00 5.14 H ATOM 709 HD21 LEU A 47 1.170 -3.987 12.287 1.00 5.32 H ATOM 710 HD22 LEU A 47 2.226 -4.575 13.571 1.00 5.03 H ATOM 711 HD23 LEU A 47 0.953 -3.411 13.939 1.00 5.58 H ATOM 712 N SER A 48 -3.584 -3.272 12.437 1.00 4.20 N ATOM 713 CA SER A 48 -5.001 -2.933 12.479 1.00 4.87 C ATOM 714 C SER A 48 -5.612 -2.962 11.085 1.00 4.81 C ATOM 715 O SER A 48 -6.771 -3.336 10.908 1.00 5.48 O ATOM 716 CB SER A 48 -5.201 -1.553 13.109 1.00 5.23 C ATOM 717 OG SER A 48 -6.575 -1.208 13.157 1.00 5.85 O ATOM 718 H SER A 48 -2.923 -2.613 12.743 1.00 3.94 H ATOM 719 HA SER A 48 -5.496 -3.669 13.084 1.00 5.46 H ATOM 720 HB2 SER A 48 -4.810 -1.559 14.115 1.00 5.43 H ATOM 721 HB3 SER A 48 -4.677 -0.813 12.523 1.00 5.16 H ATOM 722 HG SER A 48 -6.885 -1.254 14.064 1.00 5.84 H ATOM 723 N TRP A 49 -4.820 -2.568 10.101 1.00 4.23 N ATOM 724 CA TRP A 49 -5.274 -2.544 8.715 1.00 4.59 C ATOM 725 C TRP A 49 -5.489 -3.960 8.193 1.00 4.95 C ATOM 726 O TRP A 49 -6.504 -4.254 7.561 1.00 5.71 O ATOM 727 CB TRP A 49 -4.260 -1.811 7.835 1.00 4.34 C ATOM 728 CG TRP A 49 -4.694 -1.688 6.407 1.00 5.19 C ATOM 729 CD1 TRP A 49 -4.368 -2.523 5.377 1.00 5.74 C ATOM 730 CD2 TRP A 49 -5.535 -0.671 5.850 1.00 5.86 C ATOM 731 NE1 TRP A 49 -4.955 -2.087 4.213 1.00 6.60 N ATOM 732 CE2 TRP A 49 -5.676 -0.952 4.478 1.00 6.66 C ATOM 733 CE3 TRP A 49 -6.182 0.449 6.379 1.00 6.10 C ATOM 734 CZ2 TRP A 49 -6.439 -0.153 3.630 1.00 7.52 C ATOM 735 CZ3 TRP A 49 -6.938 1.241 5.536 1.00 7.03 C ATOM 736 CH2 TRP A 49 -7.061 0.937 4.174 1.00 7.67 C ATOM 737 H TRP A 49 -3.906 -2.294 10.312 1.00 3.75 H ATOM 738 HA TRP A 49 -6.215 -2.015 8.684 1.00 5.14 H ATOM 739 HB2 TRP A 49 -4.110 -0.815 8.224 1.00 4.15 H ATOM 740 HB3 TRP A 49 -3.322 -2.346 7.856 1.00 4.01 H ATOM 741 HD1 TRP A 49 -3.739 -3.395 5.476 1.00 5.69 H ATOM 742 HE1 TRP A 49 -4.871 -2.518 3.337 1.00 7.19 H ATOM 743 HE3 TRP A 49 -6.099 0.700 7.426 1.00 5.73 H ATOM 744 HZ2 TRP A 49 -6.544 -0.374 2.578 1.00 8.18 H ATOM 745 HZ3 TRP A 49 -7.445 2.111 5.927 1.00 7.41 H ATOM 746 HH2 TRP A 49 -7.661 1.584 3.553 1.00 8.41 H ATOM 747 N ALA A 50 -4.525 -4.834 8.463 1.00 4.62 N ATOM 748 CA ALA A 50 -4.606 -6.222 8.025 1.00 5.25 C ATOM 749 C ALA A 50 -5.830 -6.910 8.616 1.00 5.86 C ATOM 750 O ALA A 50 -6.484 -7.713 7.951 1.00 6.61 O ATOM 751 CB ALA A 50 -3.338 -6.968 8.414 1.00 5.08 C ATOM 752 H ALA A 50 -3.740 -4.538 8.969 1.00 4.10 H ATOM 753 HA ALA A 50 -4.686 -6.230 6.948 1.00 5.66 H ATOM 754 HB1 ALA A 50 -2.481 -6.467 7.989 1.00 5.07 H ATOM 755 HB2 ALA A 50 -3.387 -7.979 8.039 1.00 5.38 H ATOM 756 HB3 ALA A 50 -3.247 -6.987 9.490 1.00 4.97 H ATOM 757 N LEU A 51 -6.136 -6.589 9.869 1.00 5.70 N ATOM 758 CA LEU A 51 -7.284 -7.178 10.547 1.00 6.44 C ATOM 759 C LEU A 51 -8.588 -6.669 9.949 1.00 6.99 C ATOM 760 O LEU A 51 -9.584 -7.390 9.891 1.00 7.73 O ATOM 761 CB LEU A 51 -7.237 -6.869 12.045 1.00 6.49 C ATOM 762 CG LEU A 51 -6.037 -7.455 12.790 1.00 6.39 C ATOM 763 CD1 LEU A 51 -6.087 -7.079 14.262 1.00 6.17 C ATOM 764 CD2 LEU A 51 -5.996 -8.966 12.625 1.00 6.43 C ATOM 765 H LEU A 51 -5.578 -5.940 10.348 1.00 5.21 H ATOM 766 HA LEU A 51 -7.236 -8.243 10.407 1.00 6.79 H ATOM 767 HB2 LEU A 51 -7.223 -5.795 12.168 1.00 6.16 H ATOM 768 HB3 LEU A 51 -8.138 -7.254 12.499 1.00 7.15 H ATOM 769 HG LEU A 51 -5.128 -7.047 12.372 1.00 6.78 H ATOM 770 HD11 LEU A 51 -6.069 -6.003 14.360 1.00 6.28 H ATOM 771 HD12 LEU A 51 -5.233 -7.501 14.771 1.00 6.13 H ATOM 772 HD13 LEU A 51 -6.995 -7.465 14.702 1.00 6.30 H ATOM 773 HD21 LEU A 51 -5.912 -9.212 11.576 1.00 6.34 H ATOM 774 HD22 LEU A 51 -6.902 -9.397 13.024 1.00 6.36 H ATOM 775 HD23 LEU A 51 -5.143 -9.363 13.156 1.00 6.89 H ATOM 776 N ASN A 52 -8.570 -5.421 9.507 1.00 6.71 N ATOM 777 CA ASN A 52 -9.747 -4.801 8.909 1.00 7.39 C ATOM 778 C ASN A 52 -10.034 -5.391 7.534 1.00 7.94 C ATOM 779 O ASN A 52 -11.186 -5.464 7.105 1.00 8.70 O ATOM 780 CB ASN A 52 -9.556 -3.286 8.798 1.00 7.10 C ATOM 781 CG ASN A 52 -9.296 -2.623 10.140 1.00 7.03 C ATOM 782 OD1 ASN A 52 -8.533 -1.661 10.228 1.00 7.08 O ATOM 783 ND2 ASN A 52 -9.936 -3.125 11.192 1.00 7.21 N ATOM 784 H ASN A 52 -7.742 -4.906 9.581 1.00 6.12 H ATOM 785 HA ASN A 52 -10.586 -5.005 9.549 1.00 7.86 H ATOM 786 HB2 ASN A 52 -8.716 -3.084 8.151 1.00 6.53 H ATOM 787 HB3 ASN A 52 -10.446 -2.850 8.369 1.00 7.65 H ATOM 788 HD21 ASN A 52 -10.535 -3.886 11.053 1.00 7.38 H ATOM 789 HD22 ASN A 52 -9.780 -2.711 12.067 1.00 7.32 H ATOM 790 N THR A 53 -8.979 -5.809 6.851 1.00 7.71 N ATOM 791 CA THR A 53 -9.111 -6.392 5.521 1.00 8.40 C ATOM 792 C THR A 53 -8.946 -7.910 5.556 1.00 8.70 C ATOM 793 O THR A 53 -9.077 -8.581 4.532 1.00 9.31 O ATOM 794 CB THR A 53 -8.071 -5.801 4.554 1.00 8.44 C ATOM 795 OG1 THR A 53 -6.757 -6.240 4.919 1.00 7.93 O ATOM 796 CG2 THR A 53 -8.124 -4.283 4.581 1.00 8.38 C ATOM 797 H THR A 53 -8.091 -5.726 7.253 1.00 7.14 H ATOM 798 HA THR A 53 -10.096 -6.154 5.147 1.00 8.87 H ATOM 799 HB THR A 53 -8.294 -6.138 3.553 1.00 9.09 H ATOM 800 HG1 THR A 53 -6.157 -6.101 4.183 1.00 7.55 H ATOM 801 HG21 THR A 53 -9.091 -3.951 4.236 1.00 8.62 H ATOM 802 HG22 THR A 53 -7.354 -3.884 3.939 1.00 8.11 H ATOM 803 HG23 THR A 53 -7.965 -3.939 5.593 1.00 8.59 H ATOM 804 N GLY A 54 -8.659 -8.445 6.738 1.00 8.39 N ATOM 805 CA GLY A 54 -8.492 -9.880 6.881 1.00 8.75 C ATOM 806 C GLY A 54 -7.314 -10.417 6.090 1.00 8.83 C ATOM 807 O GLY A 54 -7.348 -11.551 5.613 1.00 9.34 O ATOM 808 H GLY A 54 -8.554 -7.862 7.517 1.00 8.00 H ATOM 809 HA2 GLY A 54 -8.344 -10.110 7.926 1.00 8.62 H ATOM 810 HA3 GLY A 54 -9.392 -10.370 6.541 1.00 9.23 H ATOM 811 N GLN A 55 -6.271 -9.605 5.950 1.00 8.43 N ATOM 812 CA GLN A 55 -5.083 -10.017 5.208 1.00 8.55 C ATOM 813 C GLN A 55 -4.014 -10.564 6.148 1.00 7.96 C ATOM 814 O GLN A 55 -3.730 -9.977 7.191 1.00 7.58 O ATOM 815 CB GLN A 55 -4.522 -8.841 4.406 1.00 8.86 C ATOM 816 CG GLN A 55 -5.424 -8.399 3.264 1.00 9.52 C ATOM 817 CD GLN A 55 -5.747 -9.520 2.291 1.00 10.46 C ATOM 818 OE1 GLN A 55 -6.834 -9.557 1.713 1.00 10.94 O ATOM 819 NE2 GLN A 55 -4.805 -10.438 2.094 1.00 10.88 N ATOM 820 H GLN A 55 -6.298 -8.711 6.353 1.00 8.09 H ATOM 821 HA GLN A 55 -5.376 -10.798 4.524 1.00 8.99 H ATOM 822 HB2 GLN A 55 -4.383 -8.001 5.072 1.00 8.52 H ATOM 823 HB3 GLN A 55 -3.565 -9.123 3.994 1.00 9.05 H ATOM 824 HG2 GLN A 55 -6.350 -8.029 3.677 1.00 9.54 H ATOM 825 HG3 GLN A 55 -4.931 -7.604 2.722 1.00 9.47 H ATOM 826 HE21 GLN A 55 -3.959 -10.347 2.578 1.00 10.58 H ATOM 827 HE22 GLN A 55 -4.996 -11.169 1.471 1.00 11.56 H ATOM 828 N ASP A 56 -3.426 -11.696 5.772 1.00 7.99 N ATOM 829 CA ASP A 56 -2.387 -12.322 6.580 1.00 7.51 C ATOM 830 C ASP A 56 -1.050 -11.611 6.391 1.00 7.22 C ATOM 831 O ASP A 56 -0.357 -11.827 5.396 1.00 7.41 O ATOM 832 CB ASP A 56 -2.248 -13.801 6.214 1.00 7.78 C ATOM 833 CG ASP A 56 -3.531 -14.576 6.440 1.00 8.18 C ATOM 834 OD1 ASP A 56 -3.718 -15.102 7.557 1.00 8.69 O ATOM 835 OD2 ASP A 56 -4.350 -14.656 5.500 1.00 8.18 O1- ATOM 836 H ASP A 56 -3.698 -12.119 4.930 1.00 8.41 H ATOM 837 HA ASP A 56 -2.681 -12.243 7.616 1.00 7.30 H ATOM 838 HB2 ASP A 56 -1.979 -13.884 5.172 1.00 8.11 H ATOM 839 HB3 ASP A 56 -1.470 -14.243 6.819 1.00 7.49 H ATOM 840 N SER A 57 -0.694 -10.760 7.348 1.00 6.95 N ATOM 841 CA SER A 57 0.560 -10.020 7.283 1.00 6.82 C ATOM 842 C SER A 57 1.029 -9.617 8.677 1.00 6.34 C ATOM 843 O SER A 57 0.258 -9.652 9.637 1.00 6.22 O ATOM 844 CB SER A 57 0.396 -8.775 6.408 1.00 7.25 C ATOM 845 OG SER A 57 -0.600 -7.913 6.929 1.00 7.82 O ATOM 846 H SER A 57 -1.289 -10.627 8.116 1.00 6.93 H ATOM 847 HA SER A 57 1.303 -10.665 6.839 1.00 6.95 H ATOM 848 HB2 SER A 57 1.333 -8.239 6.369 1.00 7.17 H ATOM 849 HB3 SER A 57 0.111 -9.074 5.410 1.00 7.43 H ATOM 850 HG SER A 57 -1.367 -8.429 7.189 1.00 8.24 H ATOM 851 N GLY A 58 2.297 -9.235 8.781 1.00 6.22 N ATOM 852 CA GLY A 58 2.848 -8.830 10.061 1.00 5.88 C ATOM 853 C GLY A 58 4.188 -8.134 9.921 1.00 5.94 C ATOM 854 O GLY A 58 4.424 -7.097 10.540 1.00 5.81 O ATOM 855 H GLY A 58 2.864 -9.228 7.982 1.00 6.47 H ATOM 856 HA2 GLY A 58 2.154 -8.157 10.543 1.00 5.93 H ATOM 857 HA3 GLY A 58 2.973 -9.706 10.680 1.00 5.71 H ATOM 858 N VAL A 59 5.066 -8.707 9.105 1.00 6.39 N ATOM 859 CA VAL A 59 6.389 -8.136 8.884 1.00 6.72 C ATOM 860 C VAL A 59 6.383 -7.177 7.697 1.00 5.91 C ATOM 861 O VAL A 59 7.182 -6.242 7.639 1.00 6.11 O ATOM 862 CB VAL A 59 7.441 -9.236 8.638 1.00 7.80 C ATOM 863 CG1 VAL A 59 8.833 -8.633 8.522 1.00 8.32 C ATOM 864 CG2 VAL A 59 7.393 -10.277 9.746 1.00 8.69 C ATOM 865 H VAL A 59 4.819 -9.533 8.639 1.00 6.65 H ATOM 866 HA VAL A 59 6.670 -7.591 9.774 1.00 6.97 H ATOM 867 HB VAL A 59 7.207 -9.725 7.704 1.00 7.73 H ATOM 868 HG11 VAL A 59 9.553 -9.420 8.350 1.00 8.03 H ATOM 869 HG12 VAL A 59 9.078 -8.115 9.438 1.00 8.77 H ATOM 870 HG13 VAL A 59 8.857 -7.937 7.697 1.00 8.71 H ATOM 871 HG21 VAL A 59 8.135 -11.038 9.557 1.00 9.13 H ATOM 872 HG22 VAL A 59 6.412 -10.729 9.773 1.00 8.96 H ATOM 873 HG23 VAL A 59 7.597 -9.802 10.694 1.00 8.78 H ATOM 874 N TRP A 60 5.478 -7.413 6.753 1.00 5.23 N ATOM 875 CA TRP A 60 5.370 -6.570 5.569 1.00 4.68 C ATOM 876 C TRP A 60 4.537 -5.325 5.861 1.00 3.77 C ATOM 877 O TRP A 60 4.090 -5.116 6.988 1.00 3.70 O ATOM 878 CB TRP A 60 4.748 -7.355 4.413 1.00 5.13 C ATOM 879 CG TRP A 60 5.541 -8.563 4.021 1.00 6.01 C ATOM 880 CD1 TRP A 60 5.408 -9.828 4.518 1.00 6.56 C ATOM 881 CD2 TRP A 60 6.593 -8.621 3.050 1.00 6.74 C ATOM 882 NE1 TRP A 60 6.312 -10.669 3.915 1.00 7.52 N ATOM 883 CE2 TRP A 60 7.051 -9.952 3.010 1.00 7.62 C ATOM 884 CE3 TRP A 60 7.191 -7.678 2.210 1.00 6.96 C ATOM 885 CZ2 TRP A 60 8.078 -10.361 2.164 1.00 8.57 C ATOM 886 CZ3 TRP A 60 8.210 -8.085 1.370 1.00 7.95 C ATOM 887 CH2 TRP A 60 8.645 -9.417 1.352 1.00 8.69 C ATOM 888 H TRP A 60 4.868 -8.174 6.855 1.00 5.30 H ATOM 889 HA TRP A 60 6.367 -6.263 5.289 1.00 4.97 H ATOM 890 HB2 TRP A 60 3.760 -7.683 4.700 1.00 5.28 H ATOM 891 HB3 TRP A 60 4.671 -6.710 3.549 1.00 5.04 H ATOM 892 HD1 TRP A 60 4.692 -10.112 5.275 1.00 6.44 H ATOM 893 HE1 TRP A 60 6.412 -11.626 4.102 1.00 8.16 H ATOM 894 HE3 TRP A 60 6.869 -6.647 2.209 1.00 6.54 H ATOM 895 HZ2 TRP A 60 8.424 -11.384 2.138 1.00 9.31 H ATOM 896 HZ3 TRP A 60 8.684 -7.370 0.714 1.00 8.30 H ATOM 897 HH2 TRP A 60 9.445 -9.690 0.681 1.00 9.49 H ATOM 898 N GLY A 61 4.334 -4.503 4.837 1.00 3.53 N ATOM 899 CA GLY A 61 3.556 -3.289 5.004 1.00 3.00 C ATOM 900 C GLY A 61 2.078 -3.504 4.742 1.00 2.29 C ATOM 901 O GLY A 61 1.657 -4.605 4.388 1.00 2.56 O ATOM 902 H GLY A 61 4.714 -4.721 3.961 1.00 4.04 H ATOM 903 HA2 GLY A 61 3.683 -2.931 6.015 1.00 3.57 H ATOM 904 HA3 GLY A 61 3.927 -2.540 4.320 1.00 3.02 H ATOM 905 N GLY A 62 1.290 -2.448 4.915 1.00 2.03 N ATOM 906 CA GLY A 62 -0.140 -2.545 4.691 1.00 1.67 C ATOM 907 C GLY A 62 -0.521 -2.215 3.263 1.00 1.78 C ATOM 908 O GLY A 62 -0.014 -1.252 2.686 1.00 2.57 O ATOM 909 H GLY A 62 1.683 -1.596 5.198 1.00 2.54 H ATOM 910 HA2 GLY A 62 -0.462 -3.551 4.915 1.00 2.07 H ATOM 911 HA3 GLY A 62 -0.645 -1.859 5.355 1.00 1.72 H ATOM 912 N MET A 63 -1.414 -3.013 2.689 1.00 1.47 N ATOM 913 CA MET A 63 -1.854 -2.797 1.316 1.00 1.74 C ATOM 914 C MET A 63 -3.347 -3.080 1.160 1.00 1.64 C ATOM 915 O MET A 63 -3.864 -4.060 1.697 1.00 1.80 O ATOM 916 CB MET A 63 -1.052 -3.694 0.370 1.00 2.36 C ATOM 917 CG MET A 63 -1.472 -3.582 -1.085 1.00 3.35 C ATOM 918 SD MET A 63 -0.568 -4.715 -2.158 1.00 4.59 S ATOM 919 CE MET A 63 -1.017 -6.293 -1.439 1.00 5.21 C ATOM 920 H MET A 63 -1.786 -3.762 3.199 1.00 1.51 H ATOM 921 HA MET A 63 -1.665 -1.764 1.064 1.00 2.32 H ATOM 922 HB2 MET A 63 -0.007 -3.428 0.441 1.00 2.61 H ATOM 923 HB3 MET A 63 -1.174 -4.721 0.679 1.00 2.66 H ATOM 924 HG2 MET A 63 -2.526 -3.803 -1.159 1.00 3.45 H ATOM 925 HG3 MET A 63 -1.294 -2.571 -1.420 1.00 3.72 H ATOM 926 HE1 MET A 63 -2.089 -6.415 -1.479 1.00 5.52 H ATOM 927 HE2 MET A 63 -0.689 -6.326 -0.410 1.00 5.43 H ATOM 928 HE3 MET A 63 -0.543 -7.089 -1.994 1.00 5.49 H ATOM 929 N SER A 64 -4.034 -2.212 0.420 1.00 2.06 N ATOM 930 CA SER A 64 -5.456 -2.362 0.178 1.00 2.41 C ATOM 931 C SER A 64 -5.702 -3.321 -0.977 1.00 2.12 C ATOM 932 O SER A 64 -4.793 -3.641 -1.744 1.00 1.74 O ATOM 933 CB SER A 64 -6.094 -1.004 -0.122 1.00 3.08 C ATOM 934 OG SER A 64 -5.565 -0.442 -1.310 1.00 3.03 O ATOM 935 H SER A 64 -3.571 -1.456 0.020 1.00 2.41 H ATOM 936 HA SER A 64 -5.903 -2.771 1.071 1.00 2.70 H ATOM 937 HB2 SER A 64 -7.160 -1.129 -0.242 1.00 3.42 H ATOM 938 HB3 SER A 64 -5.900 -0.329 0.698 1.00 3.48 H ATOM 939 HG SER A 64 -6.134 0.272 -1.608 1.00 3.24 H ATOM 940 N GLU A 65 -6.938 -3.770 -1.094 1.00 2.58 N ATOM 941 CA GLU A 65 -7.320 -4.691 -2.158 1.00 2.63 C ATOM 942 C GLU A 65 -7.166 -4.023 -3.521 1.00 2.32 C ATOM 943 O GLU A 65 -6.665 -4.627 -4.470 1.00 2.22 O ATOM 944 CB GLU A 65 -8.763 -5.161 -1.964 1.00 3.25 C ATOM 945 CG GLU A 65 -9.234 -6.136 -3.031 1.00 3.84 C ATOM 946 CD GLU A 65 -10.666 -6.587 -2.817 1.00 4.32 C ATOM 947 OE1 GLU A 65 -10.870 -7.605 -2.123 1.00 4.57 O ATOM 948 OE2 GLU A 65 -11.583 -5.921 -3.342 1.00 4.81 O1- ATOM 949 H GLU A 65 -7.608 -3.470 -0.451 1.00 3.00 H ATOM 950 HA GLU A 65 -6.661 -5.545 -2.112 1.00 2.59 H ATOM 951 HB2 GLU A 65 -8.845 -5.646 -1.003 1.00 3.48 H ATOM 952 HB3 GLU A 65 -9.415 -4.300 -1.980 1.00 3.51 H ATOM 953 HG2 GLU A 65 -9.165 -5.655 -3.996 1.00 4.01 H ATOM 954 HG3 GLU A 65 -8.592 -7.004 -3.016 1.00 4.30 H ATOM 955 N ASP A 66 -7.588 -2.766 -3.609 1.00 2.33 N ATOM 956 CA ASP A 66 -7.480 -2.018 -4.855 1.00 2.18 C ATOM 957 C ASP A 66 -6.018 -1.867 -5.242 1.00 1.80 C ATOM 958 O ASP A 66 -5.664 -1.864 -6.422 1.00 1.73 O ATOM 959 CB ASP A 66 -8.135 -0.643 -4.714 1.00 2.47 C ATOM 960 CG ASP A 66 -9.624 -0.738 -4.443 1.00 2.95 C ATOM 961 OD1 ASP A 66 -10.009 -0.792 -3.256 1.00 3.41 O ATOM 962 OD2 ASP A 66 -10.405 -0.759 -5.417 1.00 3.23 O1- ATOM 963 H ASP A 66 -7.978 -2.334 -2.822 1.00 2.53 H ATOM 964 HA ASP A 66 -7.986 -2.577 -5.622 1.00 2.29 H ATOM 965 HB2 ASP A 66 -7.673 -0.113 -3.895 1.00 2.45 H ATOM 966 HB3 ASP A 66 -7.989 -0.086 -5.627 1.00 2.45 H ATOM 967 N GLU A 67 -5.175 -1.748 -4.227 1.00 1.65 N ATOM 968 CA GLU A 67 -3.743 -1.606 -4.429 1.00 1.46 C ATOM 969 C GLU A 67 -3.179 -2.860 -5.086 1.00 1.50 C ATOM 970 O GLU A 67 -2.379 -2.779 -6.017 1.00 1.58 O ATOM 971 CB GLU A 67 -3.048 -1.349 -3.090 1.00 1.46 C ATOM 972 CG GLU A 67 -1.728 -0.606 -3.214 1.00 1.92 C ATOM 973 CD GLU A 67 -0.613 -1.467 -3.772 1.00 2.66 C ATOM 974 OE1 GLU A 67 0.167 -2.019 -2.969 1.00 3.17 O ATOM 975 OE2 GLU A 67 -0.515 -1.584 -5.011 1.00 3.32 O1- ATOM 976 H GLU A 67 -5.531 -1.759 -3.316 1.00 1.78 H ATOM 977 HA GLU A 67 -3.579 -0.762 -5.082 1.00 1.52 H ATOM 978 HB2 GLU A 67 -3.706 -0.765 -2.464 1.00 1.75 H ATOM 979 HB3 GLU A 67 -2.860 -2.297 -2.611 1.00 1.55 H ATOM 980 HG2 GLU A 67 -1.869 0.239 -3.869 1.00 2.31 H ATOM 981 HG3 GLU A 67 -1.436 -0.255 -2.235 1.00 2.22 H ATOM 982 N ARG A 68 -3.609 -4.024 -4.601 1.00 1.69 N ATOM 983 CA ARG A 68 -3.148 -5.290 -5.158 1.00 1.98 C ATOM 984 C ARG A 68 -3.547 -5.387 -6.627 1.00 2.02 C ATOM 985 O ARG A 68 -2.810 -5.932 -7.448 1.00 2.19 O ATOM 986 CB ARG A 68 -3.710 -6.475 -4.356 1.00 2.33 C ATOM 987 CG ARG A 68 -4.946 -7.124 -4.966 1.00 2.67 C ATOM 988 CD ARG A 68 -5.529 -8.185 -4.047 1.00 3.03 C ATOM 989 NE ARG A 68 -4.574 -9.255 -3.771 1.00 3.92 N ATOM 990 CZ ARG A 68 -4.838 -10.303 -2.994 1.00 4.62 C ATOM 991 NH1 ARG A 68 -6.027 -10.426 -2.416 1.00 4.63 N1+ ATOM 992 NH2 ARG A 68 -3.913 -11.232 -2.796 1.00 5.64 N ATOM 993 H ARG A 68 -4.248 -4.030 -3.858 1.00 1.75 H ATOM 994 HA ARG A 68 -2.069 -5.302 -5.093 1.00 2.04 H ATOM 995 HB2 ARG A 68 -2.943 -7.231 -4.273 1.00 2.68 H ATOM 996 HB3 ARG A 68 -3.966 -6.130 -3.365 1.00 2.54 H ATOM 997 HG2 ARG A 68 -5.691 -6.366 -5.142 1.00 2.97 H ATOM 998 HG3 ARG A 68 -4.672 -7.585 -5.904 1.00 3.03 H ATOM 999 HD2 ARG A 68 -5.813 -7.720 -3.115 1.00 3.05 H ATOM 1000 HD3 ARG A 68 -6.404 -8.609 -4.518 1.00 3.20 H ATOM 1001 HE ARG A 68 -3.688 -9.189 -4.185 1.00 4.30 H ATOM 1002 HH11 ARG A 68 -6.730 -9.730 -2.562 1.00 4.12 H ATOM 1003 HH12 ARG A 68 -6.220 -11.216 -1.834 1.00 5.37 H ATOM 1004 HH21 ARG A 68 -3.016 -11.144 -3.229 1.00 5.92 H ATOM 1005 HH22 ARG A 68 -4.111 -12.019 -2.212 1.00 6.27 H ATOM 1006 N ARG A 69 -4.723 -4.851 -6.949 1.00 1.95 N ATOM 1007 CA ARG A 69 -5.211 -4.857 -8.324 1.00 2.02 C ATOM 1008 C ARG A 69 -4.258 -4.069 -9.217 1.00 1.88 C ATOM 1009 O ARG A 69 -3.923 -4.493 -10.324 1.00 2.03 O ATOM 1010 CB ARG A 69 -6.615 -4.251 -8.394 1.00 2.06 C ATOM 1011 CG ARG A 69 -7.633 -4.967 -7.523 1.00 2.39 C ATOM 1012 CD ARG A 69 -8.009 -6.323 -8.098 1.00 2.79 C ATOM 1013 NE ARG A 69 -8.732 -6.199 -9.361 1.00 3.21 N ATOM 1014 CZ ARG A 69 -9.520 -7.148 -9.862 1.00 3.74 C ATOM 1015 NH1 ARG A 69 -9.684 -8.295 -9.214 1.00 3.98 N1+ ATOM 1016 NH2 ARG A 69 -10.144 -6.950 -11.015 1.00 4.43 N ATOM 1017 H ARG A 69 -5.273 -4.443 -6.248 1.00 1.91 H ATOM 1018 HA ARG A 69 -5.247 -5.882 -8.663 1.00 2.22 H ATOM 1019 HB2 ARG A 69 -6.565 -3.220 -8.078 1.00 2.55 H ATOM 1020 HB3 ARG A 69 -6.959 -4.288 -9.417 1.00 1.98 H ATOM 1021 HG2 ARG A 69 -7.213 -5.110 -6.540 1.00 2.61 H ATOM 1022 HG3 ARG A 69 -8.522 -4.358 -7.451 1.00 2.95 H ATOM 1023 HD2 ARG A 69 -7.106 -6.892 -8.264 1.00 3.26 H ATOM 1024 HD3 ARG A 69 -8.634 -6.840 -7.385 1.00 2.99 H ATOM 1025 HE ARG A 69 -8.626 -5.364 -9.863 1.00 3.45 H ATOM 1026 HH11 ARG A 69 -9.215 -8.453 -8.346 1.00 3.83 H ATOM 1027 HH12 ARG A 69 -10.278 -9.003 -9.596 1.00 4.57 H ATOM 1028 HH21 ARG A 69 -10.023 -6.088 -11.507 1.00 4.65 H ATOM 1029 HH22 ARG A 69 -10.737 -7.663 -11.391 1.00 4.93 H ATOM 1030 N ALA A 70 -3.825 -2.916 -8.719 1.00 1.68 N ATOM 1031 CA ALA A 70 -2.898 -2.059 -9.447 1.00 1.64 C ATOM 1032 C ALA A 70 -1.577 -2.776 -9.697 1.00 1.79 C ATOM 1033 O ALA A 70 -0.920 -2.567 -10.718 1.00 1.95 O ATOM 1034 CB ALA A 70 -2.653 -0.782 -8.666 1.00 1.49 C ATOM 1035 H ALA A 70 -4.139 -2.632 -7.834 1.00 1.60 H ATOM 1036 HA ALA A 70 -3.345 -1.793 -10.391 1.00 1.71 H ATOM 1037 HB1 ALA A 70 -2.209 -1.024 -7.711 1.00 1.59 H ATOM 1038 HB2 ALA A 70 -3.592 -0.272 -8.507 1.00 1.97 H ATOM 1039 HB3 ALA A 70 -1.985 -0.142 -9.222 1.00 1.73 H ATOM 1040 N LEU A 71 -1.201 -3.623 -8.749 1.00 1.82 N ATOM 1041 CA LEU A 71 0.048 -4.377 -8.827 1.00 2.05 C ATOM 1042 C LEU A 71 -0.026 -5.494 -9.865 1.00 2.34 C ATOM 1043 O LEU A 71 0.890 -5.661 -10.672 1.00 2.55 O ATOM 1044 CB LEU A 71 0.388 -4.969 -7.459 1.00 2.08 C ATOM 1045 CG LEU A 71 1.669 -5.803 -7.414 1.00 2.34 C ATOM 1046 CD1 LEU A 71 2.879 -4.940 -7.736 1.00 3.12 C ATOM 1047 CD2 LEU A 71 1.827 -6.462 -6.053 1.00 2.12 C ATOM 1048 H LEU A 71 -1.784 -3.746 -7.974 1.00 1.73 H ATOM 1049 HA LEU A 71 0.831 -3.690 -9.111 1.00 2.07 H ATOM 1050 HB2 LEU A 71 0.486 -4.157 -6.753 1.00 2.01 H ATOM 1051 HB3 LEU A 71 -0.434 -5.597 -7.147 1.00 2.21 H ATOM 1052 HG LEU A 71 1.609 -6.583 -8.160 1.00 2.70 H ATOM 1053 HD11 LEU A 71 3.774 -5.544 -7.692 1.00 3.26 H ATOM 1054 HD12 LEU A 71 2.950 -4.138 -7.017 1.00 3.61 H ATOM 1055 HD13 LEU A 71 2.773 -4.526 -8.728 1.00 3.60 H ATOM 1056 HD21 LEU A 71 1.014 -7.156 -5.892 1.00 2.52 H ATOM 1057 HD22 LEU A 71 1.811 -5.706 -5.283 1.00 2.42 H ATOM 1058 HD23 LEU A 71 2.766 -6.994 -6.017 1.00 2.10 H ATOM 1059 N LYS A 72 -1.116 -6.258 -9.847 1.00 2.40 N ATOM 1060 CA LYS A 72 -1.278 -7.363 -10.786 1.00 2.71 C ATOM 1061 C LYS A 72 -1.324 -6.856 -12.219 1.00 2.70 C ATOM 1062 O LYS A 72 -0.804 -7.495 -13.134 1.00 2.97 O ATOM 1063 CB LYS A 72 -2.541 -8.169 -10.469 1.00 2.82 C ATOM 1064 CG LYS A 72 -3.835 -7.418 -10.735 1.00 2.97 C ATOM 1065 CD LYS A 72 -5.034 -8.352 -10.704 1.00 3.44 C ATOM 1066 CE LYS A 72 -6.294 -7.659 -11.196 1.00 4.03 C ATOM 1067 NZ LYS A 72 -7.443 -8.601 -11.296 1.00 5.17 N1+ ATOM 1068 H LYS A 72 -1.822 -6.075 -9.192 1.00 2.26 H ATOM 1069 HA LYS A 72 -0.422 -8.002 -10.682 1.00 2.93 H ATOM 1070 HB2 LYS A 72 -2.542 -9.065 -11.073 1.00 3.01 H ATOM 1071 HB3 LYS A 72 -2.521 -8.450 -9.427 1.00 3.18 H ATOM 1072 HG2 LYS A 72 -3.963 -6.662 -9.975 1.00 3.19 H ATOM 1073 HG3 LYS A 72 -3.778 -6.951 -11.707 1.00 3.23 H ATOM 1074 HD2 LYS A 72 -4.832 -9.202 -11.339 1.00 3.70 H ATOM 1075 HD3 LYS A 72 -5.191 -8.688 -9.690 1.00 3.72 H ATOM 1076 HE2 LYS A 72 -6.547 -6.868 -10.506 1.00 4.09 H ATOM 1077 HE3 LYS A 72 -6.100 -7.236 -12.171 1.00 4.06 H ATOM 1078 HZ1 LYS A 72 -7.176 -9.429 -11.865 1.00 5.39 H ATOM 1079 HZ2 LYS A 72 -8.252 -8.131 -11.747 1.00 5.59 H ATOM 1080 HZ3 LYS A 72 -7.726 -8.921 -10.348 1.00 5.68 H ATOM 1081 N ARG A 73 -1.948 -5.705 -12.405 1.00 2.43 N ATOM 1082 CA ARG A 73 -2.056 -5.103 -13.727 1.00 2.46 C ATOM 1083 C ARG A 73 -0.703 -4.567 -14.181 1.00 2.55 C ATOM 1084 O ARG A 73 -0.378 -4.593 -15.368 1.00 2.75 O ATOM 1085 CB ARG A 73 -3.098 -3.983 -13.729 1.00 2.26 C ATOM 1086 CG ARG A 73 -4.515 -4.474 -13.480 1.00 2.46 C ATOM 1087 CD ARG A 73 -5.546 -3.429 -13.873 1.00 2.75 C ATOM 1088 NE ARG A 73 -5.371 -2.180 -13.136 1.00 2.78 N ATOM 1089 CZ ARG A 73 -5.862 -1.009 -13.536 1.00 3.40 C ATOM 1090 NH1 ARG A 73 -6.559 -0.922 -14.662 1.00 3.94 N1+ ATOM 1091 NH2 ARG A 73 -5.656 0.079 -12.807 1.00 3.93 N ATOM 1092 H ARG A 73 -2.341 -5.251 -11.634 1.00 2.25 H ATOM 1093 HA ARG A 73 -2.370 -5.874 -14.415 1.00 2.64 H ATOM 1094 HB2 ARG A 73 -2.846 -3.270 -12.957 1.00 2.28 H ATOM 1095 HB3 ARG A 73 -3.075 -3.486 -14.687 1.00 2.37 H ATOM 1096 HG2 ARG A 73 -4.683 -5.367 -14.063 1.00 2.77 H ATOM 1097 HG3 ARG A 73 -4.627 -4.701 -12.430 1.00 2.86 H ATOM 1098 HD2 ARG A 73 -5.450 -3.227 -14.929 1.00 3.46 H ATOM 1099 HD3 ARG A 73 -6.532 -3.820 -13.671 1.00 2.95 H ATOM 1100 HE ARG A 73 -4.861 -2.216 -12.300 1.00 2.78 H ATOM 1101 HH11 ARG A 73 -6.720 -1.739 -15.216 1.00 3.97 H ATOM 1102 HH12 ARG A 73 -6.925 -0.039 -14.956 1.00 4.57 H ATOM 1103 HH21 ARG A 73 -5.133 0.020 -11.957 1.00 3.97 H ATOM 1104 HH22 ARG A 73 -6.024 0.959 -13.108 1.00 4.53 H ATOM 1105 N ARG A 74 0.083 -4.082 -13.224 1.00 2.47 N ATOM 1106 CA ARG A 74 1.405 -3.542 -13.520 1.00 2.62 C ATOM 1107 C ARG A 74 2.315 -4.633 -14.075 1.00 2.91 C ATOM 1108 O ARG A 74 3.040 -4.418 -15.046 1.00 3.11 O ATOM 1109 CB ARG A 74 2.021 -2.940 -12.252 1.00 2.56 C ATOM 1110 CG ARG A 74 3.185 -1.996 -12.516 1.00 2.63 C ATOM 1111 CD ARG A 74 4.466 -2.753 -12.829 1.00 3.24 C ATOM 1112 NE ARG A 74 5.621 -1.861 -12.916 1.00 3.74 N ATOM 1113 CZ ARG A 74 6.010 -1.254 -14.036 1.00 4.48 C ATOM 1114 NH1 ARG A 74 5.330 -1.422 -15.164 1.00 4.89 N1+ ATOM 1115 NH2 ARG A 74 7.080 -0.471 -14.026 1.00 5.14 N ATOM 1116 H ARG A 74 -0.234 -4.088 -12.297 1.00 2.33 H ATOM 1117 HA ARG A 74 1.292 -2.767 -14.262 1.00 2.66 H ATOM 1118 HB2 ARG A 74 1.257 -2.394 -11.721 1.00 2.63 H ATOM 1119 HB3 ARG A 74 2.375 -3.744 -11.624 1.00 2.72 H ATOM 1120 HG2 ARG A 74 2.939 -1.365 -13.357 1.00 2.79 H ATOM 1121 HG3 ARG A 74 3.343 -1.384 -11.640 1.00 2.69 H ATOM 1122 HD2 ARG A 74 4.642 -3.476 -12.046 1.00 3.75 H ATOM 1123 HD3 ARG A 74 4.348 -3.267 -13.769 1.00 3.39 H ATOM 1124 HE ARG A 74 6.137 -1.710 -12.097 1.00 3.82 H ATOM 1125 HH11 ARG A 74 4.519 -2.006 -15.180 1.00 4.72 H ATOM 1126 HH12 ARG A 74 5.630 -0.962 -16.000 1.00 5.59 H ATOM 1127 HH21 ARG A 74 7.593 -0.337 -13.179 1.00 5.21 H ATOM 1128 HH22 ARG A 74 7.373 -0.015 -14.866 1.00 5.75 H ATOM 1129 N ASN A 75 2.260 -5.810 -13.459 1.00 2.97 N ATOM 1130 CA ASN A 75 3.079 -6.937 -13.890 1.00 3.31 C ATOM 1131 C ASN A 75 2.569 -7.506 -15.211 1.00 3.49 C ATOM 1132 O ASN A 75 3.350 -7.978 -16.037 1.00 3.76 O ATOM 1133 CB ASN A 75 3.085 -8.030 -12.820 1.00 3.37 C ATOM 1134 CG ASN A 75 3.744 -7.574 -11.532 1.00 3.32 C ATOM 1135 OD1 ASN A 75 3.712 -6.392 -11.189 1.00 3.40 O ATOM 1136 ND2 ASN A 75 4.347 -8.513 -10.812 1.00 3.55 N ATOM 1137 H ASN A 75 1.656 -5.923 -12.696 1.00 2.83 H ATOM 1138 HA ASN A 75 4.088 -6.579 -14.032 1.00 3.43 H ATOM 1139 HB2 ASN A 75 2.067 -8.315 -12.599 1.00 3.25 H ATOM 1140 HB3 ASN A 75 3.622 -8.889 -13.194 1.00 3.63 H ATOM 1141 HD21 ASN A 75 4.333 -9.434 -11.147 1.00 3.91 H ATOM 1142 HD22 ASN A 75 4.781 -8.246 -9.975 1.00 3.55 H ATOM 1143 N ALA A 76 1.255 -7.456 -15.402 1.00 3.38 N ATOM 1144 CA ALA A 76 0.641 -7.966 -16.622 1.00 3.59 C ATOM 1145 C ALA A 76 0.921 -9.454 -16.797 1.00 4.38 C ATOM 1146 O ALA A 76 1.102 -10.181 -15.821 1.00 4.92 O ATOM 1147 CB ALA A 76 1.141 -7.187 -17.830 1.00 3.28 C ATOM 1148 H ALA A 76 0.685 -7.067 -14.707 1.00 3.18 H ATOM 1149 HA ALA A 76 -0.426 -7.817 -16.545 1.00 3.75 H ATOM 1150 HB1 ALA A 76 2.206 -7.333 -17.937 1.00 3.40 H ATOM 1151 HB2 ALA A 76 0.935 -6.136 -17.691 1.00 3.34 H ATOM 1152 HB3 ALA A 76 0.638 -7.538 -18.718 1.00 3.51 H TER 1153 ALA A 76 HETATM 1154 FE1 SF4 A 101 4.730 1.159 6.519 1.00 10.77 FE HETATM 1155 FE2 SF4 A 101 2.525 -0.327 7.061 1.00 10.52 FE HETATM 1156 FE3 SF4 A 101 2.339 2.380 7.061 1.00 10.25 FE HETATM 1157 FE4 SF4 A 101 2.770 1.017 4.633 1.00 11.02 FE HETATM 1158 S1 SF4 A 101 0.960 0.942 5.952 1.00 10.48 S HETATM 1159 S2 SF4 A 101 3.724 2.916 5.389 1.00 10.90 S HETATM 1160 S3 SF4 A 101 4.004 -0.678 5.392 1.00 9.67 S HETATM 1161 S4 SF4 A 101 3.586 1.129 8.465 1.00 9.54 S