ATOM 1 N MET A 1 8.968 7.450 16.592 1.00 10.15 N ATOM 2 CA MET A 1 9.080 6.384 15.563 1.00 9.29 C ATOM 3 C MET A 1 7.733 6.117 14.895 1.00 8.34 C ATOM 4 O MET A 1 7.677 5.667 13.751 1.00 7.76 O ATOM 5 CB MET A 1 9.607 5.095 16.196 1.00 9.20 C ATOM 6 CG MET A 1 10.980 5.246 16.830 1.00 10.16 C ATOM 7 SD MET A 1 11.577 3.714 17.569 1.00 10.60 S ATOM 8 CE MET A 1 11.601 2.635 16.140 1.00 10.46 C ATOM 9 H1 MET A 1 8.508 8.290 16.187 1.00 10.56 H ATOM 10 HA MET A 1 9.779 6.716 14.808 1.00 9.52 H ATOM 11 HB2 MET A 1 8.915 4.773 16.960 1.00 9.03 H ATOM 12 HB3 MET A 1 9.668 4.332 15.434 1.00 8.69 H ATOM 13 HG2 MET A 1 11.681 5.558 16.070 1.00 10.55 H ATOM 14 HG3 MET A 1 10.926 6.003 17.598 1.00 10.39 H ATOM 15 HE1 MET A 1 11.946 1.654 16.435 1.00 10.46 H ATOM 16 HE2 MET A 1 12.266 3.042 15.393 1.00 10.67 H ATOM 17 HE3 MET A 1 10.604 2.557 15.731 1.00 10.40 H ATOM 18 N ASP A 2 6.649 6.394 15.615 1.00 8.30 N ATOM 19 CA ASP A 2 5.308 6.180 15.085 1.00 7.59 C ATOM 20 C ASP A 2 5.038 7.096 13.895 1.00 7.57 C ATOM 21 O ASP A 2 4.570 6.647 12.847 1.00 6.80 O ATOM 22 CB ASP A 2 4.262 6.421 16.177 1.00 7.98 C ATOM 23 CG ASP A 2 2.848 6.160 15.695 1.00 8.24 C ATOM 24 OD1 ASP A 2 2.381 5.010 15.820 1.00 8.51 O ATOM 25 OD2 ASP A 2 2.209 7.108 15.191 1.00 8.43 O1- ATOM 26 H ASP A 2 6.753 6.751 16.521 1.00 8.83 H ATOM 27 HA ASP A 2 5.241 5.154 14.757 1.00 6.93 H ATOM 28 HB2 ASP A 2 4.464 5.765 17.010 1.00 8.18 H ATOM 29 HB3 ASP A 2 4.327 7.447 16.508 1.00 8.15 H ATOM 30 N TRP A 3 5.343 8.380 14.058 1.00 8.50 N ATOM 31 CA TRP A 3 5.126 9.351 12.988 1.00 8.71 C ATOM 32 C TRP A 3 5.951 8.991 11.759 1.00 8.22 C ATOM 33 O TRP A 3 5.549 9.270 10.630 1.00 7.87 O ATOM 34 CB TRP A 3 5.453 10.778 13.452 1.00 9.94 C ATOM 35 CG TRP A 3 6.470 10.849 14.549 1.00 10.24 C ATOM 36 CD1 TRP A 3 7.724 10.314 14.538 1.00 10.46 C ATOM 37 CD2 TRP A 3 6.317 11.488 15.821 1.00 10.62 C ATOM 38 NE1 TRP A 3 8.359 10.576 15.727 1.00 10.93 N ATOM 39 CE2 TRP A 3 7.518 11.299 16.530 1.00 11.03 C ATOM 40 CE3 TRP A 3 5.282 12.204 16.429 1.00 10.86 C ATOM 41 CZ2 TRP A 3 7.711 11.797 17.817 1.00 11.64 C ATOM 42 CZ3 TRP A 3 5.474 12.698 17.706 1.00 11.49 C ATOM 43 CH2 TRP A 3 6.680 12.494 18.386 1.00 11.85 C ATOM 44 H TRP A 3 5.725 8.677 14.911 1.00 9.10 H ATOM 45 HA TRP A 3 4.081 9.305 12.720 1.00 8.45 H ATOM 46 HB2 TRP A 3 5.833 11.342 12.613 1.00 10.31 H ATOM 47 HB3 TRP A 3 4.546 11.247 13.809 1.00 10.46 H ATOM 48 HD1 TRP A 3 8.141 9.762 13.711 1.00 10.44 H ATOM 49 HE1 TRP A 3 9.267 10.294 15.959 1.00 11.27 H ATOM 50 HE3 TRP A 3 4.344 12.372 15.919 1.00 10.72 H ATOM 51 HZ2 TRP A 3 8.635 11.649 18.354 1.00 12.08 H ATOM 52 HZ3 TRP A 3 4.685 13.254 18.191 1.00 11.84 H ATOM 53 HH2 TRP A 3 6.787 12.898 19.382 1.00 12.45 H ATOM 54 N ARG A 4 7.105 8.367 11.981 1.00 8.33 N ATOM 55 CA ARG A 4 7.973 7.958 10.881 1.00 8.12 C ATOM 56 C ARG A 4 7.343 6.801 10.115 1.00 6.96 C ATOM 57 O ARG A 4 7.410 6.738 8.884 1.00 6.66 O ATOM 58 CB ARG A 4 9.352 7.547 11.404 1.00 8.77 C ATOM 59 CG ARG A 4 10.185 8.708 11.923 1.00 9.20 C ATOM 60 CD ARG A 4 10.431 9.747 10.839 1.00 9.68 C ATOM 61 NE ARG A 4 11.275 10.841 11.312 1.00 10.56 N ATOM 62 CZ ARG A 4 10.809 11.939 11.906 1.00 11.36 C ATOM 63 NH1 ARG A 4 9.508 12.087 12.120 1.00 11.43 N1+ ATOM 64 NH2 ARG A 4 11.649 12.890 12.290 1.00 12.22 N ATOM 65 H ARG A 4 7.377 8.173 12.902 1.00 8.65 H ATOM 66 HA ARG A 4 8.084 8.799 10.214 1.00 8.48 H ATOM 67 HB2 ARG A 4 9.221 6.840 12.210 1.00 9.38 H ATOM 68 HB3 ARG A 4 9.899 7.068 10.604 1.00 8.49 H ATOM 69 HG2 ARG A 4 9.664 9.175 12.743 1.00 9.47 H ATOM 70 HG3 ARG A 4 11.136 8.330 12.267 1.00 9.13 H ATOM 71 HD2 ARG A 4 10.917 9.266 10.003 1.00 9.61 H ATOM 72 HD3 ARG A 4 9.482 10.147 10.519 1.00 9.64 H ATOM 73 HE ARG A 4 12.243 10.757 11.176 1.00 10.66 H ATOM 74 HH11 ARG A 4 8.868 11.374 11.838 1.00 10.90 H ATOM 75 HH12 ARG A 4 9.168 12.916 12.566 1.00 12.11 H ATOM 76 HH21 ARG A 4 12.631 12.783 12.136 1.00 12.30 H ATOM 77 HH22 ARG A 4 11.301 13.715 12.735 1.00 12.86 H ATOM 78 N HIS A 5 6.713 5.893 10.854 1.00 6.40 N ATOM 79 CA HIS A 5 6.069 4.738 10.249 1.00 5.38 C ATOM 80 C HIS A 5 4.925 5.193 9.340 1.00 4.78 C ATOM 81 O HIS A 5 4.711 4.658 8.236 1.00 4.11 O ATOM 82 CB HIS A 5 5.536 3.813 11.343 1.00 5.14 C ATOM 83 CG HIS A 5 6.597 3.340 12.290 1.00 5.76 C ATOM 84 ND1 HIS A 5 6.324 2.895 13.566 1.00 6.25 N ATOM 85 CD2 HIS A 5 7.942 3.253 12.143 1.00 6.22 C ATOM 86 CE1 HIS A 5 7.453 2.554 14.163 1.00 6.80 C ATOM 87 NE2 HIS A 5 8.448 2.760 13.321 1.00 6.78 N ATOM 88 H HIS A 5 6.682 6.005 11.827 1.00 6.75 H ATOM 89 HA HIS A 5 6.804 4.211 9.659 1.00 5.41 H ATOM 90 HB2 HIS A 5 4.788 4.339 11.918 1.00 5.32 H ATOM 91 HB3 HIS A 5 5.088 2.944 10.884 1.00 4.54 H ATOM 92 HD1 HIS A 5 5.436 2.838 13.974 1.00 6.37 H ATOM 93 HD2 HIS A 5 8.509 3.523 11.265 1.00 6.33 H ATOM 94 HE1 HIS A 5 7.545 2.170 15.168 1.00 7.33 H ATOM 95 HE2 HIS A 5 9.382 2.509 13.477 1.00 7.23 H ATOM 96 N LYS A 6 4.247 6.250 9.759 1.00 5.27 N ATOM 97 CA LYS A 6 3.153 6.771 8.968 1.00 5.05 C ATOM 98 C LYS A 6 3.696 7.858 8.056 1.00 5.54 C ATOM 99 O LYS A 6 2.986 8.398 7.197 1.00 5.47 O ATOM 100 CB LYS A 6 2.045 7.333 9.864 1.00 5.70 C ATOM 101 CG LYS A 6 1.317 6.275 10.680 1.00 5.45 C ATOM 102 CD LYS A 6 2.152 5.801 11.859 1.00 6.10 C ATOM 103 CE LYS A 6 1.410 4.763 12.685 1.00 6.27 C ATOM 104 NZ LYS A 6 0.125 5.292 13.220 1.00 6.56 N1+ ATOM 105 H LYS A 6 4.486 6.681 10.606 1.00 5.90 H ATOM 106 HA LYS A 6 2.759 5.964 8.370 1.00 4.30 H ATOM 107 HB2 LYS A 6 2.480 8.046 10.548 1.00 6.47 H ATOM 108 HB3 LYS A 6 1.320 7.839 9.244 1.00 5.79 H ATOM 109 HG2 LYS A 6 0.395 6.694 11.052 1.00 5.36 H ATOM 110 HG3 LYS A 6 1.100 5.431 10.042 1.00 5.20 H ATOM 111 HD2 LYS A 6 3.066 5.364 11.490 1.00 6.33 H ATOM 112 HD3 LYS A 6 2.382 6.649 12.487 1.00 6.56 H ATOM 113 HE2 LYS A 6 1.204 3.906 12.061 1.00 6.50 H ATOM 114 HE3 LYS A 6 2.038 4.462 13.510 1.00 6.27 H ATOM 115 HZ1 LYS A 6 -0.500 5.572 12.438 1.00 6.94 H ATOM 116 HZ2 LYS A 6 0.303 6.123 13.820 1.00 6.86 H ATOM 117 HZ3 LYS A 6 -0.352 4.564 13.788 1.00 6.38 H ATOM 118 N ALA A 7 4.981 8.144 8.235 1.00 6.18 N ATOM 119 CA ALA A 7 5.662 9.119 7.411 1.00 6.81 C ATOM 120 C ALA A 7 5.795 8.537 6.033 1.00 6.18 C ATOM 121 O ALA A 7 5.530 9.198 5.031 1.00 6.24 O ATOM 122 CB ALA A 7 7.026 9.481 7.984 1.00 7.83 C ATOM 123 H ALA A 7 5.479 7.691 8.941 1.00 6.32 H ATOM 124 HA ALA A 7 5.055 10.012 7.367 1.00 7.13 H ATOM 125 HB1 ALA A 7 6.915 9.790 9.012 1.00 8.25 H ATOM 126 HB2 ALA A 7 7.453 10.289 7.410 1.00 8.09 H ATOM 127 HB3 ALA A 7 7.678 8.623 7.933 1.00 8.08 H ATOM 128 N VAL A 8 6.203 7.271 5.992 1.00 5.69 N ATOM 129 CA VAL A 8 6.326 6.580 4.733 1.00 5.34 C ATOM 130 C VAL A 8 4.932 6.157 4.279 1.00 4.24 C ATOM 131 O VAL A 8 4.704 5.910 3.094 1.00 4.15 O ATOM 132 CB VAL A 8 7.281 5.370 4.805 1.00 5.55 C ATOM 133 CG1 VAL A 8 7.754 4.989 3.408 1.00 5.75 C ATOM 134 CG2 VAL A 8 8.475 5.682 5.702 1.00 6.55 C ATOM 135 H VAL A 8 6.422 6.805 6.827 1.00 5.72 H ATOM 136 HA VAL A 8 6.722 7.281 4.014 1.00 5.91 H ATOM 137 HB VAL A 8 6.745 4.533 5.225 1.00 4.98 H ATOM 138 HG11 VAL A 8 8.421 4.142 3.471 1.00 5.83 H ATOM 139 HG12 VAL A 8 8.274 5.825 2.963 1.00 5.75 H ATOM 140 HG13 VAL A 8 6.901 4.731 2.797 1.00 6.14 H ATOM 141 HG21 VAL A 8 8.133 5.845 6.713 1.00 6.81 H ATOM 142 HG22 VAL A 8 8.973 6.570 5.343 1.00 7.04 H ATOM 143 HG23 VAL A 8 9.164 4.851 5.685 1.00 6.75 H ATOM 144 N CYS A 9 3.987 6.077 5.240 1.00 3.54 N ATOM 145 CA CYS A 9 2.595 5.756 4.902 1.00 2.62 C ATOM 146 C CYS A 9 2.111 6.691 3.799 1.00 2.96 C ATOM 147 O CYS A 9 1.901 6.285 2.656 1.00 2.62 O ATOM 148 CB CYS A 9 1.668 5.955 6.110 1.00 2.45 C ATOM 149 SG CYS A 9 1.125 4.433 6.935 1.00 1.43 S ATOM 150 H CYS A 9 4.231 6.232 6.176 1.00 3.79 H ATOM 151 HA CYS A 9 2.543 4.733 4.564 1.00 2.29 H ATOM 152 HB2 CYS A 9 2.173 6.552 6.837 1.00 3.05 H ATOM 153 HB3 CYS A 9 0.780 6.481 5.786 1.00 2.86 H ATOM 154 N ARG A 10 1.942 7.958 4.177 1.00 3.85 N ATOM 155 CA ARG A 10 1.466 8.998 3.261 1.00 4.48 C ATOM 156 C ARG A 10 2.503 9.355 2.196 1.00 4.75 C ATOM 157 O ARG A 10 2.159 9.875 1.135 1.00 4.85 O ATOM 158 CB ARG A 10 1.080 10.252 4.047 1.00 5.52 C ATOM 159 CG ARG A 10 -0.025 10.016 5.063 1.00 6.10 C ATOM 160 CD ARG A 10 -0.371 11.292 5.815 1.00 6.70 C ATOM 161 NE ARG A 10 -0.832 12.348 4.917 1.00 6.91 N ATOM 162 CZ ARG A 10 -1.197 13.562 5.326 1.00 7.57 C ATOM 163 NH1 ARG A 10 -1.156 13.875 6.614 1.00 8.09 N1+ ATOM 164 NH2 ARG A 10 -1.604 14.463 4.444 1.00 7.93 N ATOM 165 H ARG A 10 2.143 8.203 5.105 1.00 4.18 H ATOM 166 HA ARG A 10 0.589 8.617 2.766 1.00 4.18 H ATOM 167 HB2 ARG A 10 1.951 10.617 4.570 1.00 5.89 H ATOM 168 HB3 ARG A 10 0.745 11.008 3.352 1.00 5.79 H ATOM 169 HG2 ARG A 10 -0.906 9.664 4.550 1.00 6.05 H ATOM 170 HG3 ARG A 10 0.305 9.270 5.772 1.00 6.49 H ATOM 171 HD2 ARG A 10 -1.151 11.073 6.529 1.00 6.93 H ATOM 172 HD3 ARG A 10 0.509 11.636 6.338 1.00 7.05 H ATOM 173 HE ARG A 10 -0.872 12.142 3.959 1.00 6.72 H ATOM 174 HH11 ARG A 10 -0.850 13.200 7.286 1.00 8.03 H ATOM 175 HH12 ARG A 10 -1.431 14.789 6.915 1.00 8.68 H ATOM 176 HH21 ARG A 10 -1.637 14.232 3.471 1.00 7.77 H ATOM 177 HH22 ARG A 10 -1.879 15.374 4.750 1.00 8.49 H ATOM 178 N ASP A 11 3.766 9.076 2.484 1.00 5.06 N ATOM 179 CA ASP A 11 4.855 9.384 1.557 1.00 5.61 C ATOM 180 C ASP A 11 5.026 8.297 0.498 1.00 5.08 C ATOM 181 O ASP A 11 6.010 8.296 -0.243 1.00 5.61 O ATOM 182 CB ASP A 11 6.167 9.591 2.313 1.00 6.59 C ATOM 183 CG ASP A 11 6.209 10.919 3.045 1.00 7.41 C ATOM 184 OD1 ASP A 11 5.219 11.250 3.732 1.00 7.77 O ATOM 185 OD2 ASP A 11 7.230 11.627 2.932 1.00 7.89 O1- ATOM 186 H ASP A 11 3.975 8.651 3.340 1.00 5.04 H ATOM 187 HA ASP A 11 4.599 10.306 1.057 1.00 5.91 H ATOM 188 HB2 ASP A 11 6.290 8.799 3.033 1.00 6.40 H ATOM 189 HB3 ASP A 11 6.987 9.563 1.611 1.00 7.04 H ATOM 190 N GLU A 12 4.071 7.375 0.422 1.00 4.19 N ATOM 191 CA GLU A 12 4.136 6.292 -0.543 1.00 3.98 C ATOM 192 C GLU A 12 3.639 6.790 -1.912 1.00 3.29 C ATOM 193 O GLU A 12 4.014 7.888 -2.328 1.00 3.16 O ATOM 194 CB GLU A 12 3.314 5.108 -0.019 1.00 3.93 C ATOM 195 CG GLU A 12 4.005 3.765 -0.192 1.00 4.52 C ATOM 196 CD GLU A 12 5.089 3.534 0.842 1.00 5.23 C ATOM 197 OE1 GLU A 12 6.270 3.807 0.536 1.00 5.69 O ATOM 198 OE2 GLU A 12 4.760 3.080 1.958 1.00 5.68 O1- ATOM 199 H GLU A 12 3.302 7.423 1.022 1.00 3.84 H ATOM 200 HA GLU A 12 5.170 5.993 -0.636 1.00 4.68 H ATOM 201 HB2 GLU A 12 3.138 5.256 1.037 1.00 3.89 H ATOM 202 HB3 GLU A 12 2.366 5.075 -0.525 1.00 3.99 H ATOM 203 HG2 GLU A 12 3.270 2.980 -0.103 1.00 4.68 H ATOM 204 HG3 GLU A 12 4.453 3.732 -1.172 1.00 4.68 H ATOM 205 N ASP A 13 2.810 6.020 -2.621 1.00 3.08 N ATOM 206 CA ASP A 13 2.330 6.456 -3.928 1.00 2.63 C ATOM 207 C ASP A 13 0.906 6.987 -3.820 1.00 1.80 C ATOM 208 O ASP A 13 0.014 6.289 -3.339 1.00 1.58 O ATOM 209 CB ASP A 13 2.399 5.317 -4.965 1.00 2.89 C ATOM 210 CG ASP A 13 2.139 5.815 -6.371 1.00 3.75 C ATOM 211 OD1 ASP A 13 3.071 5.751 -7.200 1.00 4.07 O ATOM 212 OD2 ASP A 13 1.013 6.274 -6.640 1.00 4.38 O1- ATOM 213 H ASP A 13 2.498 5.173 -2.259 1.00 3.41 H ATOM 214 HA ASP A 13 2.974 7.258 -4.255 1.00 2.97 H ATOM 215 HB2 ASP A 13 3.383 4.880 -4.946 1.00 2.94 H ATOM 216 HB3 ASP A 13 1.667 4.552 -4.730 1.00 2.80 H ATOM 217 N PRO A 14 0.668 8.238 -4.263 1.00 1.83 N ATOM 218 CA PRO A 14 -0.662 8.843 -4.204 1.00 1.75 C ATOM 219 C PRO A 14 -1.706 7.942 -4.845 1.00 1.81 C ATOM 220 O PRO A 14 -2.894 8.027 -4.533 1.00 2.21 O ATOM 221 CB PRO A 14 -0.514 10.153 -4.996 1.00 2.45 C ATOM 222 CG PRO A 14 0.798 10.052 -5.701 1.00 2.84 C ATOM 223 CD PRO A 14 1.654 9.146 -4.863 1.00 2.56 C ATOM 224 HA PRO A 14 -0.951 9.061 -3.187 1.00 1.73 H ATOM 225 HB2 PRO A 14 -1.330 10.244 -5.696 1.00 2.83 H ATOM 226 HB3 PRO A 14 -0.528 10.989 -4.312 1.00 2.54 H ATOM 227 HG2 PRO A 14 0.655 9.628 -6.684 1.00 3.11 H ATOM 228 HG3 PRO A 14 1.251 11.030 -5.776 1.00 3.31 H ATOM 229 HD2 PRO A 14 2.353 8.606 -5.485 1.00 2.98 H ATOM 230 HD3 PRO A 14 2.174 9.710 -4.104 1.00 2.73 H ATOM 231 N GLU A 15 -1.250 7.076 -5.743 1.00 1.83 N ATOM 232 CA GLU A 15 -2.133 6.145 -6.419 1.00 2.05 C ATOM 233 C GLU A 15 -2.625 5.064 -5.453 1.00 1.84 C ATOM 234 O GLU A 15 -3.632 4.408 -5.711 1.00 2.30 O ATOM 235 CB GLU A 15 -1.420 5.520 -7.627 1.00 2.31 C ATOM 236 CG GLU A 15 -0.931 6.546 -8.638 1.00 3.05 C ATOM 237 CD GLU A 15 -2.066 7.325 -9.272 1.00 4.04 C ATOM 238 OE1 GLU A 15 -2.578 6.880 -10.320 1.00 4.57 O ATOM 239 OE2 GLU A 15 -2.443 8.380 -8.721 1.00 4.66 O1- ATOM 240 H GLU A 15 -0.295 7.069 -5.959 1.00 1.96 H ATOM 241 HA GLU A 15 -2.989 6.703 -6.770 1.00 2.57 H ATOM 242 HB2 GLU A 15 -0.566 4.945 -7.285 1.00 2.12 H ATOM 243 HB3 GLU A 15 -2.107 4.857 -8.130 1.00 2.45 H ATOM 244 HG2 GLU A 15 -0.275 7.242 -8.138 1.00 2.97 H ATOM 245 HG3 GLU A 15 -0.385 6.033 -9.417 1.00 3.37 H ATOM 246 N LEU A 16 -1.910 4.875 -4.340 1.00 1.54 N ATOM 247 CA LEU A 16 -2.314 3.885 -3.339 1.00 1.99 C ATOM 248 C LEU A 16 -3.500 4.396 -2.530 1.00 2.62 C ATOM 249 O LEU A 16 -4.130 3.644 -1.787 1.00 3.26 O ATOM 250 CB LEU A 16 -1.131 3.513 -2.424 1.00 2.13 C ATOM 251 CG LEU A 16 0.135 3.081 -3.176 1.00 2.14 C ATOM 252 CD1 LEU A 16 0.827 1.886 -2.533 1.00 2.40 C ATOM 253 CD2 LEU A 16 -0.209 2.727 -4.592 1.00 2.38 C ATOM 254 H LEU A 16 -1.086 5.394 -4.200 1.00 1.32 H ATOM 255 HA LEU A 16 -2.630 3.000 -3.873 1.00 2.16 H ATOM 256 HB2 LEU A 16 -0.892 4.368 -1.810 1.00 2.03 H ATOM 257 HB3 LEU A 16 -1.438 2.701 -1.782 1.00 2.65 H ATOM 258 HG LEU A 16 0.834 3.902 -3.197 1.00 2.42 H ATOM 259 HD11 LEU A 16 0.104 1.107 -2.353 1.00 2.85 H ATOM 260 HD12 LEU A 16 1.279 2.184 -1.601 1.00 2.78 H ATOM 261 HD13 LEU A 16 1.597 1.510 -3.215 1.00 2.46 H ATOM 262 HD21 LEU A 16 0.602 2.162 -5.013 1.00 2.63 H ATOM 263 HD22 LEU A 16 -0.371 3.624 -5.169 1.00 2.78 H ATOM 264 HD23 LEU A 16 -1.106 2.128 -4.602 1.00 2.70 H ATOM 265 N PHE A 17 -3.798 5.684 -2.681 1.00 2.64 N ATOM 266 CA PHE A 17 -4.924 6.299 -1.996 1.00 3.41 C ATOM 267 C PHE A 17 -6.086 6.513 -2.967 1.00 3.84 C ATOM 268 O PHE A 17 -7.195 6.855 -2.555 1.00 4.59 O ATOM 269 CB PHE A 17 -4.506 7.632 -1.373 1.00 3.49 C ATOM 270 CG PHE A 17 -3.434 7.496 -0.330 1.00 3.24 C ATOM 271 CD1 PHE A 17 -3.765 7.300 1.001 1.00 3.31 C ATOM 272 CD2 PHE A 17 -2.095 7.563 -0.681 1.00 3.50 C ATOM 273 CE1 PHE A 17 -2.781 7.173 1.963 1.00 3.33 C ATOM 274 CE2 PHE A 17 -1.106 7.436 0.277 1.00 3.56 C ATOM 275 CZ PHE A 17 -1.450 7.242 1.600 1.00 3.33 C ATOM 276 H PHE A 17 -3.243 6.237 -3.269 1.00 2.26 H ATOM 277 HA PHE A 17 -5.242 5.627 -1.211 1.00 3.75 H ATOM 278 HB2 PHE A 17 -4.133 8.283 -2.150 1.00 3.25 H ATOM 279 HB3 PHE A 17 -5.367 8.090 -0.909 1.00 4.15 H ATOM 280 HD1 PHE A 17 -4.805 7.247 1.286 1.00 3.72 H ATOM 281 HD2 PHE A 17 -1.825 7.715 -1.716 1.00 3.99 H ATOM 282 HE1 PHE A 17 -3.052 7.023 2.997 1.00 3.72 H ATOM 283 HE2 PHE A 17 -0.066 7.490 -0.010 1.00 4.12 H ATOM 284 HZ PHE A 17 -0.679 7.143 2.350 1.00 3.55 H ATOM 285 N PHE A 18 -5.824 6.310 -4.261 1.00 3.47 N ATOM 286 CA PHE A 18 -6.849 6.475 -5.287 1.00 3.96 C ATOM 287 C PHE A 18 -6.920 5.237 -6.182 1.00 3.55 C ATOM 288 O PHE A 18 -5.890 4.674 -6.549 1.00 2.91 O ATOM 289 CB PHE A 18 -6.561 7.717 -6.132 1.00 4.23 C ATOM 290 CG PHE A 18 -6.659 9.003 -5.361 1.00 4.89 C ATOM 291 CD1 PHE A 18 -5.764 9.284 -4.341 1.00 5.32 C ATOM 292 CD2 PHE A 18 -7.646 9.929 -5.658 1.00 5.32 C ATOM 293 CE1 PHE A 18 -5.852 10.467 -3.632 1.00 5.95 C ATOM 294 CE2 PHE A 18 -7.737 11.113 -4.951 1.00 5.93 C ATOM 295 CZ PHE A 18 -6.840 11.383 -3.936 1.00 6.17 C ATOM 296 H PHE A 18 -4.917 6.043 -4.533 1.00 2.92 H ATOM 297 HA PHE A 18 -7.796 6.603 -4.786 1.00 4.64 H ATOM 298 HB2 PHE A 18 -5.560 7.647 -6.533 1.00 3.76 H ATOM 299 HB3 PHE A 18 -7.268 7.761 -6.947 1.00 4.61 H ATOM 300 HD1 PHE A 18 -4.991 8.569 -4.102 1.00 5.32 H ATOM 301 HD2 PHE A 18 -8.347 9.720 -6.451 1.00 5.34 H ATOM 302 HE1 PHE A 18 -5.148 10.674 -2.838 1.00 6.42 H ATOM 303 HE2 PHE A 18 -8.511 11.828 -5.191 1.00 6.37 H ATOM 304 HZ PHE A 18 -6.910 12.307 -3.383 1.00 6.68 H ATOM 305 N PRO A 19 -8.137 4.795 -6.553 1.00 4.05 N ATOM 306 CA PRO A 19 -8.320 3.613 -7.399 1.00 3.82 C ATOM 307 C PRO A 19 -7.953 3.870 -8.861 1.00 3.22 C ATOM 308 O PRO A 19 -8.337 4.888 -9.438 1.00 3.47 O ATOM 309 CB PRO A 19 -9.823 3.301 -7.281 1.00 4.70 C ATOM 310 CG PRO A 19 -10.360 4.229 -6.238 1.00 5.41 C ATOM 311 CD PRO A 19 -9.422 5.399 -6.184 1.00 5.00 C ATOM 312 HA PRO A 19 -7.749 2.775 -7.029 1.00 3.73 H ATOM 313 HB2 PRO A 19 -10.302 3.468 -8.234 1.00 4.71 H ATOM 314 HB3 PRO A 19 -9.952 2.269 -6.989 1.00 4.89 H ATOM 315 HG2 PRO A 19 -11.350 4.557 -6.516 1.00 6.02 H ATOM 316 HG3 PRO A 19 -10.388 3.728 -5.281 1.00 5.68 H ATOM 317 HD2 PRO A 19 -9.717 6.155 -6.898 1.00 5.23 H ATOM 318 HD3 PRO A 19 -9.387 5.808 -5.187 1.00 5.28 H ATOM 319 N VAL A 20 -7.207 2.939 -9.455 1.00 2.75 N ATOM 320 CA VAL A 20 -6.802 3.050 -10.849 1.00 2.39 C ATOM 321 C VAL A 20 -7.914 2.588 -11.780 1.00 2.36 C ATOM 322 O VAL A 20 -8.762 1.780 -11.402 1.00 2.67 O ATOM 323 CB VAL A 20 -5.540 2.220 -11.132 1.00 2.54 C ATOM 324 CG1 VAL A 20 -5.069 2.424 -12.564 1.00 2.80 C ATOM 325 CG2 VAL A 20 -4.445 2.577 -10.145 1.00 2.90 C ATOM 326 H VAL A 20 -6.904 2.165 -8.938 1.00 2.94 H ATOM 327 HA VAL A 20 -6.581 4.088 -11.052 1.00 2.59 H ATOM 328 HB VAL A 20 -5.784 1.176 -11.003 1.00 2.73 H ATOM 329 HG11 VAL A 20 -4.152 1.877 -12.724 1.00 3.02 H ATOM 330 HG12 VAL A 20 -4.895 3.476 -12.741 1.00 2.78 H ATOM 331 HG13 VAL A 20 -5.825 2.065 -13.247 1.00 3.39 H ATOM 332 HG21 VAL A 20 -3.554 2.013 -10.376 1.00 3.32 H ATOM 333 HG22 VAL A 20 -4.773 2.340 -9.144 1.00 2.90 H ATOM 334 HG23 VAL A 20 -4.230 3.633 -10.212 1.00 3.26 H ATOM 335 N GLY A 21 -7.902 3.107 -12.999 1.00 2.42 N ATOM 336 CA GLY A 21 -8.912 2.739 -13.971 1.00 2.52 C ATOM 337 C GLY A 21 -8.760 3.482 -15.284 1.00 2.65 C ATOM 338 O GLY A 21 -9.259 3.033 -16.317 1.00 3.01 O ATOM 339 H GLY A 21 -7.194 3.739 -13.243 1.00 2.67 H ATOM 340 HA2 GLY A 21 -8.843 1.679 -14.161 1.00 2.88 H ATOM 341 HA3 GLY A 21 -9.886 2.958 -13.559 1.00 2.48 H ATOM 342 N ASN A 22 -8.070 4.620 -15.251 1.00 2.69 N ATOM 343 CA ASN A 22 -7.869 5.417 -16.452 1.00 3.11 C ATOM 344 C ASN A 22 -6.441 5.301 -16.987 1.00 3.00 C ATOM 345 O ASN A 22 -6.173 5.695 -18.121 1.00 3.47 O ATOM 346 CB ASN A 22 -8.196 6.884 -16.170 1.00 3.74 C ATOM 347 CG ASN A 22 -9.631 7.081 -15.722 1.00 3.98 C ATOM 348 OD1 ASN A 22 -10.525 7.291 -16.541 1.00 4.04 O ATOM 349 ND2 ASN A 22 -9.858 7.013 -14.416 1.00 4.46 N ATOM 350 H ASN A 22 -7.697 4.934 -14.403 1.00 2.65 H ATOM 351 HA ASN A 22 -8.549 5.051 -17.206 1.00 3.29 H ATOM 352 HB2 ASN A 22 -7.543 7.248 -15.391 1.00 3.77 H ATOM 353 HB3 ASN A 22 -8.035 7.462 -17.068 1.00 4.17 H ATOM 354 HD21 ASN A 22 -9.097 6.844 -13.822 1.00 4.76 H ATOM 355 HD22 ASN A 22 -10.777 7.137 -14.099 1.00 4.67 H ATOM 356 N SER A 23 -5.520 4.763 -16.183 1.00 2.51 N ATOM 357 CA SER A 23 -4.139 4.628 -16.630 1.00 2.53 C ATOM 358 C SER A 23 -3.508 3.310 -16.201 1.00 2.10 C ATOM 359 O SER A 23 -3.922 2.688 -15.223 1.00 1.90 O ATOM 360 CB SER A 23 -3.302 5.786 -16.083 1.00 2.85 C ATOM 361 OG SER A 23 -3.309 5.793 -14.667 1.00 2.71 O ATOM 362 H SER A 23 -5.766 4.469 -15.278 1.00 2.28 H ATOM 363 HA SER A 23 -4.135 4.680 -17.707 1.00 2.92 H ATOM 364 HB2 SER A 23 -2.281 5.676 -16.416 1.00 3.04 H ATOM 365 HB3 SER A 23 -3.702 6.723 -16.441 1.00 3.24 H ATOM 366 HG SER A 23 -3.860 6.516 -14.353 1.00 2.79 H ATOM 367 N GLY A 24 -2.495 2.900 -16.958 1.00 2.24 N ATOM 368 CA GLY A 24 -1.757 1.690 -16.651 1.00 1.95 C ATOM 369 C GLY A 24 -0.588 1.984 -15.734 1.00 1.72 C ATOM 370 O GLY A 24 -0.348 1.256 -14.772 1.00 1.47 O ATOM 371 H GLY A 24 -2.256 3.422 -17.751 1.00 2.67 H ATOM 372 HA2 GLY A 24 -2.417 0.992 -16.161 1.00 1.86 H ATOM 373 HA3 GLY A 24 -1.388 1.254 -17.564 1.00 2.12 H ATOM 374 N PRO A 25 0.167 3.061 -16.016 1.00 1.91 N ATOM 375 CA PRO A 25 1.291 3.482 -15.187 1.00 1.84 C ATOM 376 C PRO A 25 0.904 3.549 -13.726 1.00 1.53 C ATOM 377 O PRO A 25 1.749 3.418 -12.849 1.00 1.42 O ATOM 378 CB PRO A 25 1.656 4.861 -15.731 1.00 2.19 C ATOM 379 CG PRO A 25 1.233 4.815 -17.155 1.00 2.48 C ATOM 380 CD PRO A 25 0.002 3.949 -17.189 1.00 2.31 C ATOM 381 HA PRO A 25 2.124 2.808 -15.291 1.00 1.88 H ATOM 382 HB2 PRO A 25 1.122 5.622 -15.181 1.00 2.17 H ATOM 383 HB3 PRO A 25 2.720 5.020 -15.640 1.00 2.30 H ATOM 384 HG2 PRO A 25 1.001 5.811 -17.503 1.00 2.72 H ATOM 385 HG3 PRO A 25 2.015 4.377 -17.758 1.00 2.63 H ATOM 386 HD2 PRO A 25 -0.884 4.557 -17.089 1.00 2.38 H ATOM 387 HD3 PRO A 25 -0.032 3.377 -18.104 1.00 2.47 H ATOM 388 N ALA A 26 -0.379 3.763 -13.466 1.00 1.49 N ATOM 389 CA ALA A 26 -0.852 3.859 -12.089 1.00 1.32 C ATOM 390 C ALA A 26 -0.546 2.576 -11.343 1.00 1.06 C ATOM 391 O ALA A 26 -0.267 2.590 -10.152 1.00 0.93 O ATOM 392 CB ALA A 26 -2.348 4.125 -12.036 1.00 1.52 C ATOM 393 H ALA A 26 -1.017 3.847 -14.213 1.00 1.64 H ATOM 394 HA ALA A 26 -0.339 4.676 -11.613 1.00 1.37 H ATOM 395 HB1 ALA A 26 -2.686 4.525 -12.981 1.00 2.24 H ATOM 396 HB2 ALA A 26 -2.552 4.834 -11.248 1.00 1.59 H ATOM 397 HB3 ALA A 26 -2.869 3.198 -11.826 1.00 1.74 H ATOM 398 N LEU A 27 -0.606 1.470 -12.053 1.00 1.12 N ATOM 399 CA LEU A 27 -0.318 0.175 -11.461 1.00 1.08 C ATOM 400 C LEU A 27 1.155 0.072 -11.133 1.00 1.01 C ATOM 401 O LEU A 27 1.537 -0.433 -10.079 1.00 0.98 O ATOM 402 CB LEU A 27 -0.704 -0.941 -12.423 1.00 1.35 C ATOM 403 CG LEU A 27 -2.195 -1.024 -12.768 1.00 1.62 C ATOM 404 CD1 LEU A 27 -3.043 -0.602 -11.581 1.00 2.10 C ATOM 405 CD2 LEU A 27 -2.510 -0.165 -13.981 1.00 2.05 C ATOM 406 H LEU A 27 -0.838 1.527 -13.000 1.00 1.28 H ATOM 407 HA LEU A 27 -0.883 0.082 -10.549 1.00 1.09 H ATOM 408 HB2 LEU A 27 -0.149 -0.791 -13.338 1.00 1.43 H ATOM 409 HB3 LEU A 27 -0.403 -1.880 -11.989 1.00 1.38 H ATOM 410 HG LEU A 27 -2.444 -2.048 -13.008 1.00 2.19 H ATOM 411 HD11 LEU A 27 -4.030 -1.030 -11.670 1.00 2.70 H ATOM 412 HD12 LEU A 27 -3.118 0.476 -11.560 1.00 2.28 H ATOM 413 HD13 LEU A 27 -2.579 -0.947 -10.670 1.00 2.53 H ATOM 414 HD21 LEU A 27 -3.523 -0.355 -14.305 1.00 2.37 H ATOM 415 HD22 LEU A 27 -1.826 -0.406 -14.781 1.00 2.36 H ATOM 416 HD23 LEU A 27 -2.407 0.877 -13.721 1.00 2.61 H ATOM 417 N ALA A 28 1.981 0.548 -12.048 1.00 1.16 N ATOM 418 CA ALA A 28 3.417 0.526 -11.842 1.00 1.33 C ATOM 419 C ALA A 28 3.788 1.514 -10.754 1.00 1.26 C ATOM 420 O ALA A 28 4.697 1.280 -9.958 1.00 1.31 O ATOM 421 CB ALA A 28 4.154 0.842 -13.136 1.00 1.68 C ATOM 422 H ALA A 28 1.614 0.932 -12.875 1.00 1.26 H ATOM 423 HA ALA A 28 3.692 -0.464 -11.521 1.00 1.39 H ATOM 424 HB1 ALA A 28 3.891 1.836 -13.465 1.00 1.80 H ATOM 425 HB2 ALA A 28 3.874 0.126 -13.893 1.00 1.93 H ATOM 426 HB3 ALA A 28 5.219 0.789 -12.966 1.00 2.22 H ATOM 427 N GLN A 29 3.055 2.617 -10.724 1.00 1.24 N ATOM 428 CA GLN A 29 3.285 3.660 -9.731 1.00 1.29 C ATOM 429 C GLN A 29 2.861 3.146 -8.366 1.00 1.03 C ATOM 430 O GLN A 29 3.606 3.210 -7.373 1.00 1.10 O ATOM 431 CB GLN A 29 2.478 4.912 -10.100 1.00 1.50 C ATOM 432 CG GLN A 29 3.058 5.683 -11.274 1.00 1.85 C ATOM 433 CD GLN A 29 4.456 6.201 -10.999 1.00 1.88 C ATOM 434 OE1 GLN A 29 4.808 6.490 -9.855 1.00 2.46 O ATOM 435 NE2 GLN A 29 5.260 6.319 -12.048 1.00 2.13 N ATOM 436 H GLN A 29 2.315 2.710 -11.369 1.00 1.26 H ATOM 437 HA GLN A 29 4.338 3.897 -9.717 1.00 1.49 H ATOM 438 HB2 GLN A 29 1.465 4.615 -10.358 1.00 1.75 H ATOM 439 HB3 GLN A 29 2.442 5.571 -9.247 1.00 1.89 H ATOM 440 HG2 GLN A 29 3.096 5.031 -12.134 1.00 2.39 H ATOM 441 HG3 GLN A 29 2.414 6.524 -11.489 1.00 2.43 H ATOM 442 HE21 GLN A 29 4.912 6.069 -12.930 1.00 2.32 H ATOM 443 HE22 GLN A 29 6.170 6.651 -11.899 1.00 2.57 H ATOM 444 N ILE A 30 1.658 2.598 -8.345 1.00 0.85 N ATOM 445 CA ILE A 30 1.101 2.016 -7.155 1.00 0.87 C ATOM 446 C ILE A 30 1.953 0.859 -6.656 1.00 0.85 C ATOM 447 O ILE A 30 2.205 0.719 -5.459 1.00 1.00 O ATOM 448 CB ILE A 30 -0.326 1.500 -7.417 1.00 1.07 C ATOM 449 CG1 ILE A 30 -1.308 2.660 -7.542 1.00 1.31 C ATOM 450 CG2 ILE A 30 -0.750 0.548 -6.320 1.00 1.39 C ATOM 451 CD1 ILE A 30 -2.737 2.227 -7.763 1.00 1.41 C ATOM 452 H ILE A 30 1.096 2.650 -9.145 1.00 0.88 H ATOM 453 HA ILE A 30 1.067 2.777 -6.408 1.00 1.02 H ATOM 454 HB ILE A 30 -0.315 0.948 -8.345 1.00 1.00 H ATOM 455 HG12 ILE A 30 -1.282 3.248 -6.643 1.00 1.90 H ATOM 456 HG13 ILE A 30 -1.017 3.276 -8.376 1.00 1.88 H ATOM 457 HG21 ILE A 30 -0.088 0.671 -5.471 1.00 2.05 H ATOM 458 HG22 ILE A 30 -0.692 -0.465 -6.688 1.00 1.58 H ATOM 459 HG23 ILE A 30 -1.762 0.770 -6.022 1.00 1.68 H ATOM 460 HD11 ILE A 30 -2.790 1.599 -8.638 1.00 1.79 H ATOM 461 HD12 ILE A 30 -3.359 3.099 -7.907 1.00 2.05 H ATOM 462 HD13 ILE A 30 -3.084 1.675 -6.902 1.00 1.76 H ATOM 463 N ALA A 31 2.391 0.043 -7.588 1.00 0.86 N ATOM 464 CA ALA A 31 3.203 -1.116 -7.274 1.00 1.12 C ATOM 465 C ALA A 31 4.494 -0.691 -6.600 1.00 1.15 C ATOM 466 O ALA A 31 5.027 -1.399 -5.752 1.00 1.34 O ATOM 467 CB ALA A 31 3.498 -1.916 -8.535 1.00 1.36 C ATOM 468 H ALA A 31 2.166 0.230 -8.523 1.00 0.82 H ATOM 469 HA ALA A 31 2.642 -1.745 -6.597 1.00 1.30 H ATOM 470 HB1 ALA A 31 4.065 -1.307 -9.222 1.00 1.73 H ATOM 471 HB2 ALA A 31 2.568 -2.211 -8.997 1.00 1.50 H ATOM 472 HB3 ALA A 31 4.068 -2.796 -8.277 1.00 1.88 H ATOM 473 N ASP A 32 4.967 0.494 -6.952 1.00 1.13 N ATOM 474 CA ASP A 32 6.226 0.985 -6.419 1.00 1.35 C ATOM 475 C ASP A 32 6.052 1.331 -4.967 1.00 1.35 C ATOM 476 O ASP A 32 6.919 1.058 -4.136 1.00 1.51 O ATOM 477 CB ASP A 32 6.722 2.202 -7.203 1.00 1.57 C ATOM 478 CG ASP A 32 7.094 1.861 -8.633 1.00 1.77 C ATOM 479 OD1 ASP A 32 7.773 0.833 -8.841 1.00 1.97 O ATOM 480 OD2 ASP A 32 6.711 2.623 -9.544 1.00 2.21 O1- ATOM 481 H ASP A 32 4.404 1.089 -7.483 1.00 1.07 H ATOM 482 HA ASP A 32 6.946 0.191 -6.493 1.00 1.50 H ATOM 483 HB2 ASP A 32 5.945 2.951 -7.223 1.00 1.45 H ATOM 484 HB3 ASP A 32 7.594 2.607 -6.711 1.00 1.80 H ATOM 485 N ALA A 33 4.920 1.926 -4.665 1.00 1.25 N ATOM 486 CA ALA A 33 4.618 2.278 -3.297 1.00 1.40 C ATOM 487 C ALA A 33 4.395 1.015 -2.483 1.00 1.47 C ATOM 488 O ALA A 33 4.723 0.960 -1.304 1.00 1.68 O ATOM 489 CB ALA A 33 3.422 3.195 -3.231 1.00 1.46 C ATOM 490 H ALA A 33 4.270 2.120 -5.374 1.00 1.14 H ATOM 491 HA ALA A 33 5.473 2.805 -2.895 1.00 1.58 H ATOM 492 HB1 ALA A 33 2.737 2.958 -4.031 1.00 1.96 H ATOM 493 HB2 ALA A 33 3.759 4.212 -3.331 1.00 1.66 H ATOM 494 HB3 ALA A 33 2.928 3.074 -2.281 1.00 1.76 H ATOM 495 N LYS A 34 3.812 0.005 -3.124 1.00 1.40 N ATOM 496 CA LYS A 34 3.551 -1.268 -2.464 1.00 1.66 C ATOM 497 C LYS A 34 4.845 -1.902 -1.953 1.00 1.71 C ATOM 498 O LYS A 34 4.898 -2.377 -0.820 1.00 2.01 O ATOM 499 CB LYS A 34 2.852 -2.234 -3.421 1.00 1.75 C ATOM 500 CG LYS A 34 2.598 -3.608 -2.818 1.00 1.91 C ATOM 501 CD LYS A 34 2.481 -4.677 -3.890 1.00 2.07 C ATOM 502 CE LYS A 34 2.567 -6.075 -3.297 1.00 2.56 C ATOM 503 NZ LYS A 34 3.858 -6.299 -2.585 1.00 2.85 N1+ ATOM 504 H LYS A 34 3.553 0.120 -4.061 1.00 1.25 H ATOM 505 HA LYS A 34 2.902 -1.077 -1.623 1.00 1.87 H ATOM 506 HB2 LYS A 34 1.901 -1.811 -3.713 1.00 2.00 H ATOM 507 HB3 LYS A 34 3.465 -2.359 -4.302 1.00 1.92 H ATOM 508 HG2 LYS A 34 3.417 -3.861 -2.162 1.00 2.40 H ATOM 509 HG3 LYS A 34 1.679 -3.576 -2.251 1.00 2.26 H ATOM 510 HD2 LYS A 34 1.529 -4.569 -4.390 1.00 2.35 H ATOM 511 HD3 LYS A 34 3.281 -4.547 -4.603 1.00 2.50 H ATOM 512 HE2 LYS A 34 1.755 -6.207 -2.598 1.00 2.90 H ATOM 513 HE3 LYS A 34 2.478 -6.797 -4.095 1.00 3.02 H ATOM 514 HZ1 LYS A 34 3.906 -5.702 -1.735 1.00 3.13 H ATOM 515 HZ2 LYS A 34 4.655 -6.061 -3.209 1.00 3.19 H ATOM 516 HZ3 LYS A 34 3.940 -7.296 -2.302 1.00 3.04 H ATOM 517 N LEU A 35 5.889 -1.909 -2.783 1.00 1.51 N ATOM 518 CA LEU A 35 7.161 -2.506 -2.376 1.00 1.62 C ATOM 519 C LEU A 35 7.822 -1.664 -1.296 1.00 1.70 C ATOM 520 O LEU A 35 8.334 -2.188 -0.307 1.00 1.88 O ATOM 521 CB LEU A 35 8.107 -2.660 -3.569 1.00 1.54 C ATOM 522 CG LEU A 35 7.766 -3.805 -4.524 1.00 1.68 C ATOM 523 CD1 LEU A 35 7.566 -5.100 -3.756 1.00 2.31 C ATOM 524 CD2 LEU A 35 6.529 -3.464 -5.332 1.00 1.65 C ATOM 525 H LEU A 35 5.808 -1.500 -3.677 1.00 1.35 H ATOM 526 HA LEU A 35 6.949 -3.483 -1.968 1.00 1.82 H ATOM 527 HB2 LEU A 35 8.099 -1.736 -4.130 1.00 1.40 H ATOM 528 HB3 LEU A 35 9.106 -2.822 -3.191 1.00 1.64 H ATOM 529 HG LEU A 35 8.587 -3.947 -5.212 1.00 2.27 H ATOM 530 HD11 LEU A 35 6.685 -5.018 -3.137 1.00 2.74 H ATOM 531 HD12 LEU A 35 8.428 -5.287 -3.134 1.00 2.59 H ATOM 532 HD13 LEU A 35 7.441 -5.916 -4.453 1.00 2.87 H ATOM 533 HD21 LEU A 35 5.728 -3.186 -4.662 1.00 2.16 H ATOM 534 HD22 LEU A 35 6.228 -4.322 -5.915 1.00 1.95 H ATOM 535 HD23 LEU A 35 6.749 -2.638 -5.990 1.00 1.98 H ATOM 536 N VAL A 36 7.805 -0.357 -1.498 1.00 1.67 N ATOM 537 CA VAL A 36 8.392 0.569 -0.534 1.00 1.92 C ATOM 538 C VAL A 36 7.618 0.537 0.783 1.00 2.27 C ATOM 539 O VAL A 36 8.188 0.715 1.860 1.00 2.56 O ATOM 540 CB VAL A 36 8.414 2.012 -1.080 1.00 2.08 C ATOM 541 CG1 VAL A 36 9.002 2.970 -0.052 1.00 2.44 C ATOM 542 CG2 VAL A 36 9.200 2.076 -2.381 1.00 1.96 C ATOM 543 H VAL A 36 7.392 -0.010 -2.319 1.00 1.55 H ATOM 544 HA VAL A 36 9.410 0.259 -0.349 1.00 1.89 H ATOM 545 HB VAL A 36 7.398 2.316 -1.282 1.00 2.14 H ATOM 546 HG11 VAL A 36 10.012 2.671 0.183 1.00 2.71 H ATOM 547 HG12 VAL A 36 8.401 2.947 0.845 1.00 2.87 H ATOM 548 HG13 VAL A 36 9.007 3.972 -0.455 1.00 2.51 H ATOM 549 HG21 VAL A 36 9.094 3.058 -2.817 1.00 2.06 H ATOM 550 HG22 VAL A 36 8.823 1.333 -3.067 1.00 2.16 H ATOM 551 HG23 VAL A 36 10.244 1.883 -2.180 1.00 2.25 H ATOM 552 N CYS A 37 6.315 0.306 0.680 1.00 2.30 N ATOM 553 CA CYS A 37 5.435 0.241 1.842 1.00 2.78 C ATOM 554 C CYS A 37 5.682 -1.039 2.637 1.00 3.05 C ATOM 555 O CYS A 37 5.479 -1.076 3.851 1.00 3.55 O ATOM 556 CB CYS A 37 3.972 0.314 1.380 1.00 2.92 C ATOM 557 SG CYS A 37 2.725 -0.035 2.669 1.00 2.70 S ATOM 558 H CYS A 37 5.928 0.175 -0.211 1.00 2.05 H ATOM 559 HA CYS A 37 5.649 1.091 2.472 1.00 3.01 H ATOM 560 HB2 CYS A 37 3.775 1.306 1.003 1.00 2.99 H ATOM 561 HB3 CYS A 37 3.824 -0.399 0.581 1.00 3.42 H ATOM 562 N ASN A 38 6.127 -2.084 1.945 1.00 2.91 N ATOM 563 CA ASN A 38 6.397 -3.366 2.584 1.00 3.45 C ATOM 564 C ASN A 38 7.760 -3.379 3.272 1.00 3.36 C ATOM 565 O ASN A 38 7.947 -4.072 4.272 1.00 3.83 O ATOM 566 CB ASN A 38 6.324 -4.495 1.554 1.00 3.70 C ATOM 567 CG ASN A 38 4.913 -4.728 1.050 1.00 3.92 C ATOM 568 OD1 ASN A 38 4.093 -3.811 1.022 1.00 4.18 O ATOM 569 ND2 ASN A 38 4.624 -5.960 0.648 1.00 4.10 N ATOM 570 H ASN A 38 6.276 -1.990 0.981 1.00 2.60 H ATOM 571 HA ASN A 38 5.633 -3.528 3.329 1.00 3.88 H ATOM 572 HB2 ASN A 38 6.950 -4.247 0.711 1.00 3.40 H ATOM 573 HB3 ASN A 38 6.681 -5.409 2.006 1.00 4.15 H ATOM 574 HD21 ASN A 38 5.327 -6.641 0.698 1.00 4.26 H ATOM 575 HD22 ASN A 38 3.719 -6.139 0.317 1.00 4.23 H ATOM 576 N ARG A 39 8.711 -2.615 2.739 1.00 2.85 N ATOM 577 CA ARG A 39 10.050 -2.567 3.322 1.00 2.71 C ATOM 578 C ARG A 39 10.171 -1.460 4.370 1.00 2.32 C ATOM 579 O ARG A 39 11.192 -1.350 5.051 1.00 2.32 O ATOM 580 CB ARG A 39 11.095 -2.357 2.225 1.00 2.85 C ATOM 581 CG ARG A 39 11.106 -3.458 1.177 1.00 3.52 C ATOM 582 CD ARG A 39 12.158 -3.202 0.110 1.00 4.09 C ATOM 583 NE ARG A 39 12.178 -4.254 -0.904 1.00 4.53 N ATOM 584 CZ ARG A 39 13.007 -4.264 -1.945 1.00 5.23 C ATOM 585 NH1 ARG A 39 13.885 -3.283 -2.114 1.00 5.50 N1+ ATOM 586 NH2 ARG A 39 12.958 -5.259 -2.820 1.00 5.96 N ATOM 587 H ARG A 39 8.511 -2.076 1.945 1.00 2.67 H ATOM 588 HA ARG A 39 10.235 -3.516 3.801 1.00 3.01 H ATOM 589 HB2 ARG A 39 10.896 -1.419 1.729 1.00 2.80 H ATOM 590 HB3 ARG A 39 12.074 -2.314 2.679 1.00 2.74 H ATOM 591 HG2 ARG A 39 11.319 -4.400 1.659 1.00 3.84 H ATOM 592 HG3 ARG A 39 10.134 -3.504 0.707 1.00 3.66 H ATOM 593 HD2 ARG A 39 11.945 -2.258 -0.368 1.00 4.72 H ATOM 594 HD3 ARG A 39 13.128 -3.153 0.584 1.00 4.02 H ATOM 595 HE ARG A 39 11.540 -4.991 -0.803 1.00 4.57 H ATOM 596 HH11 ARG A 39 13.926 -2.530 -1.457 1.00 5.27 H ATOM 597 HH12 ARG A 39 14.505 -3.297 -2.897 1.00 6.12 H ATOM 598 HH21 ARG A 39 12.299 -6.001 -2.698 1.00 6.06 H ATOM 599 HH22 ARG A 39 13.581 -5.267 -3.603 1.00 6.58 H ATOM 600 N CYS A 40 9.132 -0.641 4.497 1.00 2.21 N ATOM 601 CA CYS A 40 9.124 0.436 5.479 1.00 2.26 C ATOM 602 C CYS A 40 8.861 -0.129 6.876 1.00 2.61 C ATOM 603 O CYS A 40 8.219 -1.168 7.016 1.00 2.77 O ATOM 604 CB CYS A 40 8.081 1.497 5.091 1.00 2.34 C ATOM 605 SG CYS A 40 7.138 2.226 6.475 1.00 1.86 S ATOM 606 H CYS A 40 8.352 -0.761 3.917 1.00 2.27 H ATOM 607 HA CYS A 40 10.104 0.891 5.473 1.00 2.31 H ATOM 608 HB2 CYS A 40 8.583 2.307 4.585 1.00 2.97 H ATOM 609 HB3 CYS A 40 7.370 1.050 4.412 1.00 2.44 H ATOM 610 N PRO A 41 9.361 0.549 7.926 1.00 2.99 N ATOM 611 CA PRO A 41 9.178 0.116 9.313 1.00 3.58 C ATOM 612 C PRO A 41 7.805 -0.502 9.571 1.00 3.72 C ATOM 613 O PRO A 41 6.778 0.169 9.469 1.00 4.42 O ATOM 614 CB PRO A 41 9.332 1.423 10.081 1.00 4.16 C ATOM 615 CG PRO A 41 10.330 2.203 9.291 1.00 3.79 C ATOM 616 CD PRO A 41 10.151 1.794 7.847 1.00 3.10 C ATOM 617 HA PRO A 41 9.948 -0.576 9.618 1.00 3.74 H ATOM 618 HB2 PRO A 41 8.380 1.928 10.128 1.00 4.63 H ATOM 619 HB3 PRO A 41 9.691 1.220 11.080 1.00 4.52 H ATOM 620 HG2 PRO A 41 10.140 3.260 9.406 1.00 4.16 H ATOM 621 HG3 PRO A 41 11.328 1.964 9.625 1.00 3.79 H ATOM 622 HD2 PRO A 41 9.614 2.557 7.305 1.00 3.16 H ATOM 623 HD3 PRO A 41 11.112 1.611 7.388 1.00 2.86 H ATOM 624 N VAL A 42 7.800 -1.789 9.905 1.00 3.42 N ATOM 625 CA VAL A 42 6.564 -2.513 10.178 1.00 3.71 C ATOM 626 C VAL A 42 5.929 -2.059 11.489 1.00 3.72 C ATOM 627 O VAL A 42 6.611 -1.891 12.500 1.00 4.29 O ATOM 628 CB VAL A 42 6.809 -4.034 10.233 1.00 4.48 C ATOM 629 CG1 VAL A 42 7.783 -4.382 11.348 1.00 4.82 C ATOM 630 CG2 VAL A 42 5.495 -4.782 10.408 1.00 5.23 C ATOM 631 H VAL A 42 8.654 -2.266 9.971 1.00 3.29 H ATOM 632 HA VAL A 42 5.877 -2.311 9.369 1.00 3.73 H ATOM 633 HB VAL A 42 7.249 -4.340 9.295 1.00 4.71 H ATOM 634 HG11 VAL A 42 7.376 -4.059 12.295 1.00 5.08 H ATOM 635 HG12 VAL A 42 8.725 -3.883 11.173 1.00 5.24 H ATOM 636 HG13 VAL A 42 7.939 -5.450 11.369 1.00 4.81 H ATOM 637 HG21 VAL A 42 5.692 -5.841 10.481 1.00 5.51 H ATOM 638 HG22 VAL A 42 4.857 -4.592 9.557 1.00 5.70 H ATOM 639 HG23 VAL A 42 5.006 -4.442 11.308 1.00 5.37 H ATOM 640 N THR A 43 4.616 -1.864 11.458 1.00 3.43 N ATOM 641 CA THR A 43 3.870 -1.427 12.632 1.00 3.73 C ATOM 642 C THR A 43 2.598 -2.232 12.830 1.00 3.66 C ATOM 643 O THR A 43 2.124 -2.919 11.920 1.00 3.29 O ATOM 644 CB THR A 43 3.455 0.049 12.531 1.00 3.96 C ATOM 645 OG1 THR A 43 2.617 0.246 11.387 1.00 3.69 O ATOM 646 CG2 THR A 43 4.660 0.954 12.439 1.00 4.50 C ATOM 647 H THR A 43 4.135 -2.028 10.627 1.00 3.26 H ATOM 648 HA THR A 43 4.503 -1.544 13.500 1.00 4.30 H ATOM 649 HB THR A 43 2.899 0.310 13.420 1.00 4.38 H ATOM 650 HG1 THR A 43 1.834 -0.301 11.466 1.00 3.93 H ATOM 651 HG21 THR A 43 5.181 0.763 11.514 1.00 4.59 H ATOM 652 HG22 THR A 43 5.315 0.762 13.273 1.00 4.65 H ATOM 653 HG23 THR A 43 4.330 1.980 12.464 1.00 5.03 H ATOM 654 N THR A 44 2.037 -2.115 14.026 1.00 4.35 N ATOM 655 CA THR A 44 0.794 -2.786 14.349 1.00 4.63 C ATOM 656 C THR A 44 -0.281 -2.378 13.349 1.00 3.94 C ATOM 657 O THR A 44 -1.222 -3.125 13.093 1.00 4.00 O ATOM 658 CB THR A 44 0.319 -2.448 15.776 1.00 5.70 C ATOM 659 OG1 THR A 44 1.345 -2.771 16.723 1.00 6.41 O ATOM 660 CG2 THR A 44 -0.952 -3.210 16.121 1.00 6.27 C ATOM 661 H THR A 44 2.472 -1.561 14.706 1.00 4.85 H ATOM 662 HA THR A 44 0.956 -3.853 14.282 1.00 4.83 H ATOM 663 HB THR A 44 0.111 -1.388 15.828 1.00 5.79 H ATOM 664 HG1 THR A 44 1.380 -2.091 17.400 1.00 6.77 H ATOM 665 HG21 THR A 44 -1.264 -2.955 17.124 1.00 6.56 H ATOM 666 HG22 THR A 44 -0.762 -4.272 16.062 1.00 6.28 H ATOM 667 HG23 THR A 44 -1.733 -2.944 15.424 1.00 6.71 H ATOM 668 N GLU A 45 -0.132 -1.174 12.791 1.00 3.59 N ATOM 669 CA GLU A 45 -1.090 -0.666 11.815 1.00 3.30 C ATOM 670 C GLU A 45 -1.158 -1.584 10.600 1.00 2.69 C ATOM 671 O GLU A 45 -2.240 -1.918 10.117 1.00 2.95 O ATOM 672 CB GLU A 45 -0.701 0.748 11.371 1.00 3.58 C ATOM 673 CG GLU A 45 -0.638 1.747 12.513 1.00 3.98 C ATOM 674 CD GLU A 45 -1.955 1.870 13.254 1.00 4.30 C ATOM 675 OE1 GLU A 45 -2.782 2.720 12.860 1.00 4.58 O ATOM 676 OE2 GLU A 45 -2.159 1.117 14.229 1.00 4.71 O1- ATOM 677 H GLU A 45 0.653 -0.621 13.028 1.00 3.80 H ATOM 678 HA GLU A 45 -2.061 -0.634 12.286 1.00 3.74 H ATOM 679 HB2 GLU A 45 0.268 0.711 10.897 1.00 4.03 H ATOM 680 HB3 GLU A 45 -1.429 1.098 10.653 1.00 3.62 H ATOM 681 HG2 GLU A 45 0.123 1.430 13.210 1.00 4.26 H ATOM 682 HG3 GLU A 45 -0.376 2.716 12.112 1.00 4.34 H ATOM 683 N CYS A 46 0.009 -1.985 10.116 1.00 2.29 N ATOM 684 CA CYS A 46 0.100 -2.857 8.948 1.00 2.34 C ATOM 685 C CYS A 46 -0.392 -4.264 9.283 1.00 2.72 C ATOM 686 O CYS A 46 -1.160 -4.861 8.524 1.00 3.24 O ATOM 687 CB CYS A 46 1.540 -2.914 8.416 1.00 2.42 C ATOM 688 SG CYS A 46 2.568 -1.467 8.847 1.00 2.25 S ATOM 689 H CYS A 46 0.830 -1.701 10.565 1.00 2.37 H ATOM 690 HA CYS A 46 -0.538 -2.444 8.181 1.00 2.70 H ATOM 691 HB2 CYS A 46 2.028 -3.790 8.817 1.00 2.68 H ATOM 692 HB3 CYS A 46 1.513 -2.989 7.338 1.00 3.02 H ATOM 693 N LEU A 47 0.044 -4.790 10.428 1.00 2.97 N ATOM 694 CA LEU A 47 -0.371 -6.128 10.848 1.00 3.78 C ATOM 695 C LEU A 47 -1.873 -6.160 11.074 1.00 4.19 C ATOM 696 O LEU A 47 -2.564 -7.083 10.641 1.00 4.73 O ATOM 697 CB LEU A 47 0.344 -6.555 12.132 1.00 4.40 C ATOM 698 CG LEU A 47 1.831 -6.867 11.979 1.00 4.55 C ATOM 699 CD1 LEU A 47 2.618 -5.587 11.777 1.00 4.85 C ATOM 700 CD2 LEU A 47 2.340 -7.622 13.196 1.00 5.05 C ATOM 701 H LEU A 47 0.645 -4.270 11.001 1.00 2.90 H ATOM 702 HA LEU A 47 -0.121 -6.819 10.056 1.00 3.99 H ATOM 703 HB2 LEU A 47 0.237 -5.761 12.857 1.00 4.40 H ATOM 704 HB3 LEU A 47 -0.147 -7.437 12.515 1.00 5.07 H ATOM 705 HG LEU A 47 1.976 -7.491 11.110 1.00 4.52 H ATOM 706 HD11 LEU A 47 2.411 -4.909 12.592 1.00 5.11 H ATOM 707 HD12 LEU A 47 2.328 -5.129 10.843 1.00 4.92 H ATOM 708 HD13 LEU A 47 3.674 -5.813 11.755 1.00 5.14 H ATOM 709 HD21 LEU A 47 2.179 -7.027 14.082 1.00 5.32 H ATOM 710 HD22 LEU A 47 3.396 -7.820 13.082 1.00 5.03 H ATOM 711 HD23 LEU A 47 1.807 -8.557 13.288 1.00 5.58 H ATOM 712 N SER A 48 -2.370 -5.126 11.737 1.00 4.20 N ATOM 713 CA SER A 48 -3.793 -5.017 12.028 1.00 4.87 C ATOM 714 C SER A 48 -4.587 -4.991 10.734 1.00 4.81 C ATOM 715 O SER A 48 -5.701 -5.509 10.659 1.00 5.48 O ATOM 716 CB SER A 48 -4.079 -3.758 12.848 1.00 5.23 C ATOM 717 OG SER A 48 -5.461 -3.640 13.138 1.00 5.85 O ATOM 718 H SER A 48 -1.758 -4.421 12.046 1.00 3.94 H ATOM 719 HA SER A 48 -4.082 -5.883 12.594 1.00 5.46 H ATOM 720 HB2 SER A 48 -3.532 -3.805 13.779 1.00 5.43 H ATOM 721 HB3 SER A 48 -3.764 -2.888 12.291 1.00 5.16 H ATOM 722 HG SER A 48 -5.960 -3.628 12.318 1.00 5.84 H ATOM 723 N TRP A 49 -4.000 -4.382 9.716 1.00 4.23 N ATOM 724 CA TRP A 49 -4.633 -4.298 8.410 1.00 4.59 C ATOM 725 C TRP A 49 -4.807 -5.698 7.841 1.00 4.95 C ATOM 726 O TRP A 49 -5.840 -6.022 7.258 1.00 5.71 O ATOM 727 CB TRP A 49 -3.798 -3.438 7.458 1.00 4.34 C ATOM 728 CG TRP A 49 -4.379 -3.347 6.080 1.00 5.19 C ATOM 729 CD1 TRP A 49 -3.936 -3.992 4.960 1.00 5.74 C ATOM 730 CD2 TRP A 49 -5.511 -2.571 5.676 1.00 5.86 C ATOM 731 NE1 TRP A 49 -4.725 -3.663 3.885 1.00 6.60 N ATOM 732 CE2 TRP A 49 -5.699 -2.791 4.298 1.00 6.66 C ATOM 733 CE3 TRP A 49 -6.387 -1.710 6.345 1.00 6.10 C ATOM 734 CZ2 TRP A 49 -6.724 -2.183 3.580 1.00 7.52 C ATOM 735 CZ3 TRP A 49 -7.404 -1.106 5.630 1.00 7.03 C ATOM 736 CH2 TRP A 49 -7.566 -1.346 4.260 1.00 7.67 C ATOM 737 H TRP A 49 -3.113 -3.998 9.845 1.00 3.75 H ATOM 738 HA TRP A 49 -5.606 -3.847 8.538 1.00 5.14 H ATOM 739 HB2 TRP A 49 -3.726 -2.437 7.857 1.00 4.15 H ATOM 740 HB3 TRP A 49 -2.808 -3.861 7.378 1.00 4.01 H ATOM 741 HD1 TRP A 49 -3.089 -4.660 4.938 1.00 5.69 H ATOM 742 HE1 TRP A 49 -4.609 -3.996 2.971 1.00 7.19 H ATOM 743 HE3 TRP A 49 -6.277 -1.513 7.402 1.00 5.73 H ATOM 744 HZ2 TRP A 49 -6.862 -2.358 2.523 1.00 8.18 H ATOM 745 HZ3 TRP A 49 -8.089 -0.439 6.131 1.00 7.41 H ATOM 746 HH2 TRP A 49 -8.374 -0.852 3.742 1.00 8.41 H ATOM 747 N ALA A 50 -3.780 -6.525 8.019 1.00 4.62 N ATOM 748 CA ALA A 50 -3.821 -7.901 7.545 1.00 5.25 C ATOM 749 C ALA A 50 -4.968 -8.651 8.208 1.00 5.86 C ATOM 750 O ALA A 50 -5.669 -9.430 7.562 1.00 6.61 O ATOM 751 CB ALA A 50 -2.497 -8.597 7.820 1.00 5.08 C ATOM 752 H ALA A 50 -2.978 -6.201 8.479 1.00 4.10 H ATOM 753 HA ALA A 50 -3.983 -7.885 6.476 1.00 5.66 H ATOM 754 HB1 ALA A 50 -2.323 -8.633 8.885 1.00 5.07 H ATOM 755 HB2 ALA A 50 -1.697 -8.051 7.342 1.00 5.38 H ATOM 756 HB3 ALA A 50 -2.531 -9.603 7.427 1.00 4.97 H ATOM 757 N LEU A 51 -5.155 -8.413 9.504 1.00 5.70 N ATOM 758 CA LEU A 51 -6.232 -9.063 10.244 1.00 6.44 C ATOM 759 C LEU A 51 -7.586 -8.527 9.803 1.00 6.99 C ATOM 760 O LEU A 51 -8.577 -9.255 9.764 1.00 7.73 O ATOM 761 CB LEU A 51 -6.059 -8.878 11.754 1.00 6.49 C ATOM 762 CG LEU A 51 -4.940 -9.703 12.396 1.00 6.39 C ATOM 763 CD1 LEU A 51 -5.077 -11.172 12.026 1.00 6.17 C ATOM 764 CD2 LEU A 51 -3.576 -9.173 11.985 1.00 6.43 C ATOM 765 H LEU A 51 -4.564 -7.779 9.968 1.00 5.21 H ATOM 766 HA LEU A 51 -6.194 -10.113 10.014 1.00 6.79 H ATOM 767 HB2 LEU A 51 -5.862 -7.833 11.945 1.00 6.16 H ATOM 768 HB3 LEU A 51 -6.990 -9.142 12.236 1.00 7.15 H ATOM 769 HG LEU A 51 -5.019 -9.625 13.471 1.00 6.78 H ATOM 770 HD11 LEU A 51 -4.933 -11.290 10.963 1.00 6.28 H ATOM 771 HD12 LEU A 51 -6.063 -11.521 12.298 1.00 6.13 H ATOM 772 HD13 LEU A 51 -4.333 -11.747 12.557 1.00 6.30 H ATOM 773 HD21 LEU A 51 -2.804 -9.790 12.421 1.00 6.34 H ATOM 774 HD22 LEU A 51 -3.465 -8.157 12.336 1.00 6.36 H ATOM 775 HD23 LEU A 51 -3.489 -9.195 10.910 1.00 6.89 H ATOM 776 N ASN A 52 -7.616 -7.244 9.471 1.00 6.71 N ATOM 777 CA ASN A 52 -8.843 -6.594 9.026 1.00 7.39 C ATOM 778 C ASN A 52 -9.234 -7.068 7.632 1.00 7.94 C ATOM 779 O ASN A 52 -10.413 -7.102 7.282 1.00 8.70 O ATOM 780 CB ASN A 52 -8.677 -5.074 9.036 1.00 7.10 C ATOM 781 CG ASN A 52 -8.539 -4.516 10.439 1.00 7.03 C ATOM 782 OD1 ASN A 52 -8.056 -5.194 11.344 1.00 7.08 O ATOM 783 ND2 ASN A 52 -8.966 -3.272 10.625 1.00 7.21 N ATOM 784 H ASN A 52 -6.789 -6.725 9.525 1.00 6.12 H ATOM 785 HA ASN A 52 -9.625 -6.866 9.712 1.00 7.86 H ATOM 786 HB2 ASN A 52 -7.792 -4.810 8.475 1.00 6.53 H ATOM 787 HB3 ASN A 52 -9.540 -4.621 8.570 1.00 7.65 H ATOM 788 HD21 ASN A 52 -9.340 -2.791 9.858 1.00 7.38 H ATOM 789 HD22 ASN A 52 -8.888 -2.886 11.523 1.00 7.32 H ATOM 790 N THR A 53 -8.233 -7.434 6.844 1.00 7.71 N ATOM 791 CA THR A 53 -8.462 -7.914 5.486 1.00 8.40 C ATOM 792 C THR A 53 -8.334 -9.433 5.408 1.00 8.70 C ATOM 793 O THR A 53 -8.542 -10.030 4.352 1.00 9.31 O ATOM 794 CB THR A 53 -7.470 -7.276 4.498 1.00 8.44 C ATOM 795 OG1 THR A 53 -6.146 -7.758 4.755 1.00 7.93 O ATOM 796 CG2 THR A 53 -7.494 -5.763 4.624 1.00 8.38 C ATOM 797 H THR A 53 -7.318 -7.382 7.185 1.00 7.14 H ATOM 798 HA THR A 53 -9.463 -7.629 5.194 1.00 8.87 H ATOM 799 HB THR A 53 -7.758 -7.545 3.493 1.00 9.09 H ATOM 800 HG1 THR A 53 -5.977 -7.746 5.700 1.00 7.55 H ATOM 801 HG21 THR A 53 -7.293 -5.487 5.649 1.00 8.62 H ATOM 802 HG22 THR A 53 -8.466 -5.393 4.335 1.00 8.11 H ATOM 803 HG23 THR A 53 -6.739 -5.336 3.982 1.00 8.59 H ATOM 804 N GLY A 54 -7.990 -10.052 6.533 1.00 8.39 N ATOM 805 CA GLY A 54 -7.853 -11.495 6.576 1.00 8.75 C ATOM 806 C GLY A 54 -6.739 -12.013 5.686 1.00 8.83 C ATOM 807 O GLY A 54 -6.868 -13.081 5.087 1.00 9.34 O ATOM 808 H GLY A 54 -7.823 -9.523 7.339 1.00 8.00 H ATOM 809 HA2 GLY A 54 -7.650 -11.793 7.594 1.00 8.62 H ATOM 810 HA3 GLY A 54 -8.785 -11.942 6.263 1.00 9.23 H ATOM 811 N GLN A 55 -5.643 -11.265 5.596 1.00 8.43 N ATOM 812 CA GLN A 55 -4.514 -11.679 4.770 1.00 8.55 C ATOM 813 C GLN A 55 -3.465 -12.405 5.607 1.00 7.96 C ATOM 814 O GLN A 55 -3.048 -11.918 6.658 1.00 7.58 O ATOM 815 CB GLN A 55 -3.887 -10.466 4.081 1.00 8.86 C ATOM 816 CG GLN A 55 -4.791 -9.821 3.043 1.00 9.52 C ATOM 817 CD GLN A 55 -4.178 -8.580 2.425 1.00 10.46 C ATOM 818 OE1 GLN A 55 -2.957 -8.469 2.311 1.00 10.94 O ATOM 819 NE2 GLN A 55 -5.024 -7.640 2.022 1.00 10.88 N ATOM 820 H GLN A 55 -5.593 -10.420 6.093 1.00 8.09 H ATOM 821 HA GLN A 55 -4.887 -12.356 4.017 1.00 8.99 H ATOM 822 HB2 GLN A 55 -3.647 -9.725 4.829 1.00 8.52 H ATOM 823 HB3 GLN A 55 -2.976 -10.777 3.589 1.00 9.05 H ATOM 824 HG2 GLN A 55 -4.984 -10.537 2.259 1.00 9.54 H ATOM 825 HG3 GLN A 55 -5.722 -9.548 3.517 1.00 9.47 H ATOM 826 HE21 GLN A 55 -5.983 -7.797 2.145 1.00 10.58 H ATOM 827 HE22 GLN A 55 -4.654 -6.827 1.618 1.00 11.56 H ATOM 828 N ASP A 56 -3.043 -13.573 5.131 1.00 7.99 N ATOM 829 CA ASP A 56 -2.041 -14.367 5.833 1.00 7.51 C ATOM 830 C ASP A 56 -0.639 -13.819 5.587 1.00 7.22 C ATOM 831 O ASP A 56 0.071 -14.283 4.695 1.00 7.41 O ATOM 832 CB ASP A 56 -2.114 -15.829 5.388 1.00 7.78 C ATOM 833 CG ASP A 56 -3.468 -16.453 5.669 1.00 8.18 C ATOM 834 OD1 ASP A 56 -3.646 -17.014 6.770 1.00 8.69 O ATOM 835 OD2 ASP A 56 -4.351 -16.378 4.788 1.00 8.18 O1- ATOM 836 H ASP A 56 -3.415 -13.908 4.289 1.00 8.41 H ATOM 837 HA ASP A 56 -2.256 -14.312 6.889 1.00 7.30 H ATOM 838 HB2 ASP A 56 -1.927 -15.887 4.326 1.00 8.11 H ATOM 839 HB3 ASP A 56 -1.361 -16.397 5.914 1.00 7.49 H ATOM 840 N SER A 57 -0.250 -12.824 6.376 1.00 6.95 N ATOM 841 CA SER A 57 1.069 -12.217 6.239 1.00 6.82 C ATOM 842 C SER A 57 1.516 -11.574 7.547 1.00 6.34 C ATOM 843 O SER A 57 0.694 -11.089 8.326 1.00 6.22 O ATOM 844 CB SER A 57 1.057 -11.172 5.122 1.00 7.25 C ATOM 845 OG SER A 57 0.122 -10.143 5.395 1.00 7.82 O ATOM 846 H SER A 57 -0.861 -12.490 7.066 1.00 6.93 H ATOM 847 HA SER A 57 1.766 -12.998 5.979 1.00 6.95 H ATOM 848 HB2 SER A 57 2.040 -10.733 5.032 1.00 7.17 H ATOM 849 HB3 SER A 57 0.789 -11.647 4.190 1.00 7.43 H ATOM 850 HG SER A 57 0.430 -9.619 6.139 1.00 8.24 H ATOM 851 N GLY A 58 2.824 -11.573 7.782 1.00 6.22 N ATOM 852 CA GLY A 58 3.361 -10.981 8.992 1.00 5.88 C ATOM 853 C GLY A 58 3.860 -9.569 8.760 1.00 5.94 C ATOM 854 O GLY A 58 3.206 -8.600 9.146 1.00 5.81 O ATOM 855 H GLY A 58 3.429 -11.979 7.127 1.00 6.47 H ATOM 856 HA2 GLY A 58 2.586 -10.960 9.745 1.00 5.93 H ATOM 857 HA3 GLY A 58 4.180 -11.588 9.346 1.00 5.71 H ATOM 858 N VAL A 59 5.023 -9.453 8.127 1.00 6.39 N ATOM 859 CA VAL A 59 5.605 -8.149 7.835 1.00 6.72 C ATOM 860 C VAL A 59 5.159 -7.657 6.463 1.00 5.91 C ATOM 861 O VAL A 59 5.879 -7.805 5.475 1.00 6.11 O ATOM 862 CB VAL A 59 7.145 -8.194 7.883 1.00 7.80 C ATOM 863 CG1 VAL A 59 7.729 -6.804 7.677 1.00 8.32 C ATOM 864 CG2 VAL A 59 7.621 -8.791 9.197 1.00 8.69 C ATOM 865 H VAL A 59 5.501 -10.262 7.851 1.00 6.65 H ATOM 866 HA VAL A 59 5.260 -7.453 8.588 1.00 6.97 H ATOM 867 HB VAL A 59 7.490 -8.827 7.078 1.00 7.73 H ATOM 868 HG11 VAL A 59 7.420 -6.422 6.715 1.00 8.03 H ATOM 869 HG12 VAL A 59 8.807 -6.859 7.713 1.00 8.77 H ATOM 870 HG13 VAL A 59 7.377 -6.146 8.457 1.00 8.71 H ATOM 871 HG21 VAL A 59 7.263 -8.187 10.018 1.00 9.13 H ATOM 872 HG22 VAL A 59 8.700 -8.814 9.212 1.00 8.96 H ATOM 873 HG23 VAL A 59 7.238 -9.796 9.296 1.00 8.78 H ATOM 874 N TRP A 60 3.963 -7.080 6.407 1.00 5.23 N ATOM 875 CA TRP A 60 3.415 -6.573 5.154 1.00 4.68 C ATOM 876 C TRP A 60 3.243 -5.058 5.210 1.00 3.77 C ATOM 877 O TRP A 60 3.088 -4.481 6.286 1.00 3.70 O ATOM 878 CB TRP A 60 2.073 -7.245 4.858 1.00 5.13 C ATOM 879 CG TRP A 60 1.514 -6.897 3.512 1.00 6.01 C ATOM 880 CD1 TRP A 60 0.501 -6.022 3.247 1.00 6.56 C ATOM 881 CD2 TRP A 60 1.935 -7.420 2.247 1.00 6.74 C ATOM 882 NE1 TRP A 60 0.267 -5.967 1.893 1.00 7.52 N ATOM 883 CE2 TRP A 60 1.135 -6.816 1.259 1.00 7.62 C ATOM 884 CE3 TRP A 60 2.913 -8.338 1.853 1.00 6.96 C ATOM 885 CZ2 TRP A 60 1.282 -7.102 -0.096 1.00 8.57 C ATOM 886 CZ3 TRP A 60 3.057 -8.622 0.508 1.00 7.95 C ATOM 887 CH2 TRP A 60 2.245 -8.005 -0.452 1.00 8.69 C ATOM 888 H TRP A 60 3.436 -6.994 7.228 1.00 5.30 H ATOM 889 HA TRP A 60 4.112 -6.816 4.365 1.00 4.97 H ATOM 890 HB2 TRP A 60 2.198 -8.316 4.898 1.00 5.28 H ATOM 891 HB3 TRP A 60 1.355 -6.943 5.606 1.00 5.04 H ATOM 892 HD1 TRP A 60 -0.031 -5.461 4.001 1.00 6.44 H ATOM 893 HE1 TRP A 60 -0.410 -5.411 1.456 1.00 8.16 H ATOM 894 HE3 TRP A 60 3.548 -8.823 2.580 1.00 6.54 H ATOM 895 HZ2 TRP A 60 0.664 -6.635 -0.849 1.00 9.31 H ATOM 896 HZ3 TRP A 60 3.806 -9.330 0.186 1.00 8.30 H ATOM 897 HH2 TRP A 60 2.393 -8.257 -1.492 1.00 9.49 H ATOM 898 N GLY A 61 3.271 -4.420 4.043 1.00 3.53 N ATOM 899 CA GLY A 61 3.120 -2.978 3.983 1.00 3.00 C ATOM 900 C GLY A 61 1.820 -2.501 4.598 1.00 2.29 C ATOM 901 O GLY A 61 1.826 -1.724 5.551 1.00 2.56 O ATOM 902 H GLY A 61 3.396 -4.933 3.218 1.00 4.04 H ATOM 903 HA2 GLY A 61 3.943 -2.519 4.509 1.00 3.57 H ATOM 904 HA3 GLY A 61 3.152 -2.668 2.948 1.00 3.02 H ATOM 905 N GLY A 62 0.702 -2.964 4.048 1.00 2.03 N ATOM 906 CA GLY A 62 -0.596 -2.572 4.565 1.00 1.67 C ATOM 907 C GLY A 62 -1.191 -1.403 3.807 1.00 1.78 C ATOM 908 O GLY A 62 -1.021 -0.248 4.199 1.00 2.57 O ATOM 909 H GLY A 62 0.759 -3.573 3.284 1.00 2.54 H ATOM 910 HA2 GLY A 62 -1.268 -3.413 4.493 1.00 2.07 H ATOM 911 HA3 GLY A 62 -0.488 -2.297 5.604 1.00 1.72 H ATOM 912 N MET A 63 -1.892 -1.702 2.718 1.00 1.47 N ATOM 913 CA MET A 63 -2.514 -0.666 1.903 1.00 1.74 C ATOM 914 C MET A 63 -3.973 -1.009 1.603 1.00 1.64 C ATOM 915 O MET A 63 -4.410 -2.141 1.813 1.00 1.80 O ATOM 916 CB MET A 63 -1.734 -0.464 0.604 1.00 2.36 C ATOM 917 CG MET A 63 -1.619 0.995 0.187 1.00 3.35 C ATOM 918 SD MET A 63 -0.806 2.009 1.439 1.00 4.59 S ATOM 919 CE MET A 63 -0.738 3.592 0.605 1.00 5.21 C ATOM 920 H MET A 63 -1.992 -2.640 2.456 1.00 1.51 H ATOM 921 HA MET A 63 -2.490 0.252 2.470 1.00 2.32 H ATOM 922 HB2 MET A 63 -0.736 -0.859 0.732 1.00 2.61 H ATOM 923 HB3 MET A 63 -2.227 -1.005 -0.188 1.00 2.66 H ATOM 924 HG2 MET A 63 -1.048 1.053 -0.727 1.00 3.45 H ATOM 925 HG3 MET A 63 -2.611 1.385 0.016 1.00 3.72 H ATOM 926 HE1 MET A 63 -1.717 3.842 0.224 1.00 5.52 H ATOM 927 HE2 MET A 63 -0.034 3.539 -0.211 1.00 5.43 H ATOM 928 HE3 MET A 63 -0.420 4.353 1.304 1.00 5.49 H ATOM 929 N SER A 64 -4.717 -0.024 1.111 1.00 2.06 N ATOM 930 CA SER A 64 -6.126 -0.195 0.805 1.00 2.41 C ATOM 931 C SER A 64 -6.358 -1.189 -0.326 1.00 2.12 C ATOM 932 O SER A 64 -5.444 -1.555 -1.074 1.00 1.74 O ATOM 933 CB SER A 64 -6.749 1.153 0.442 1.00 3.08 C ATOM 934 OG SER A 64 -6.164 1.688 -0.731 1.00 3.03 O ATOM 935 H SER A 64 -4.308 0.840 0.939 1.00 2.41 H ATOM 936 HA SER A 64 -6.609 -0.569 1.694 1.00 2.70 H ATOM 937 HB2 SER A 64 -7.809 1.023 0.274 1.00 3.42 H ATOM 938 HB3 SER A 64 -6.598 1.848 1.256 1.00 3.48 H ATOM 939 HG SER A 64 -6.676 2.444 -1.029 1.00 3.24 H ATOM 940 N GLU A 65 -7.607 -1.610 -0.432 1.00 2.58 N ATOM 941 CA GLU A 65 -8.028 -2.556 -1.458 1.00 2.63 C ATOM 942 C GLU A 65 -7.681 -2.030 -2.844 1.00 2.32 C ATOM 943 O GLU A 65 -7.395 -2.804 -3.758 1.00 2.22 O ATOM 944 CB GLU A 65 -9.533 -2.815 -1.357 1.00 3.25 C ATOM 945 CG GLU A 65 -9.963 -3.393 -0.020 1.00 3.84 C ATOM 946 CD GLU A 65 -11.457 -3.641 0.055 1.00 4.32 C ATOM 947 OE1 GLU A 65 -11.893 -4.754 -0.307 1.00 4.57 O ATOM 948 OE2 GLU A 65 -12.191 -2.722 0.477 1.00 4.81 O1- ATOM 949 H GLU A 65 -8.266 -1.268 0.201 1.00 3.00 H ATOM 950 HA GLU A 65 -7.499 -3.483 -1.293 1.00 2.59 H ATOM 951 HB2 GLU A 65 -10.057 -1.883 -1.508 1.00 3.48 H ATOM 952 HB3 GLU A 65 -9.820 -3.508 -2.134 1.00 3.51 H ATOM 953 HG2 GLU A 65 -9.450 -4.331 0.135 1.00 4.01 H ATOM 954 HG3 GLU A 65 -9.688 -2.702 0.762 1.00 4.30 H ATOM 955 N ASP A 66 -7.709 -0.709 -2.993 1.00 2.33 N ATOM 956 CA ASP A 66 -7.385 -0.086 -4.268 1.00 2.18 C ATOM 957 C ASP A 66 -5.950 -0.408 -4.644 1.00 1.80 C ATOM 958 O ASP A 66 -5.616 -0.560 -5.819 1.00 1.73 O ATOM 959 CB ASP A 66 -7.588 1.428 -4.193 1.00 2.47 C ATOM 960 CG ASP A 66 -9.034 1.802 -3.931 1.00 2.95 C ATOM 961 OD1 ASP A 66 -9.869 1.620 -4.842 1.00 3.41 O ATOM 962 OD2 ASP A 66 -9.331 2.277 -2.814 1.00 3.23 O1- ATOM 963 H ASP A 66 -7.954 -0.145 -2.230 1.00 2.53 H ATOM 964 HA ASP A 66 -8.040 -0.497 -5.014 1.00 2.29 H ATOM 965 HB2 ASP A 66 -6.982 1.829 -3.395 1.00 2.45 H ATOM 966 HB3 ASP A 66 -7.284 1.873 -5.129 1.00 2.45 H ATOM 967 N GLU A 67 -5.105 -0.510 -3.628 1.00 1.65 N ATOM 968 CA GLU A 67 -3.705 -0.843 -3.829 1.00 1.46 C ATOM 969 C GLU A 67 -3.584 -2.302 -4.245 1.00 1.50 C ATOM 970 O GLU A 67 -2.768 -2.653 -5.097 1.00 1.58 O ATOM 971 CB GLU A 67 -2.907 -0.591 -2.547 1.00 1.46 C ATOM 972 CG GLU A 67 -1.435 -0.969 -2.648 1.00 1.92 C ATOM 973 CD GLU A 67 -1.203 -2.467 -2.566 1.00 2.66 C ATOM 974 OE1 GLU A 67 -1.367 -3.033 -1.465 1.00 3.17 O ATOM 975 OE2 GLU A 67 -0.852 -3.071 -3.601 1.00 3.32 O1- ATOM 976 H GLU A 67 -5.437 -0.357 -2.720 1.00 1.78 H ATOM 977 HA GLU A 67 -3.320 -0.217 -4.620 1.00 1.52 H ATOM 978 HB2 GLU A 67 -2.968 0.458 -2.301 1.00 1.75 H ATOM 979 HB3 GLU A 67 -3.348 -1.165 -1.746 1.00 1.55 H ATOM 980 HG2 GLU A 67 -1.049 -0.615 -3.592 1.00 2.31 H ATOM 981 HG3 GLU A 67 -0.899 -0.494 -1.842 1.00 2.22 H ATOM 982 N ARG A 68 -4.412 -3.149 -3.638 1.00 1.69 N ATOM 983 CA ARG A 68 -4.402 -4.575 -3.949 1.00 1.98 C ATOM 984 C ARG A 68 -4.750 -4.806 -5.418 1.00 2.02 C ATOM 985 O ARG A 68 -4.105 -5.604 -6.102 1.00 2.19 O ATOM 986 CB ARG A 68 -5.393 -5.321 -3.053 1.00 2.33 C ATOM 987 CG ARG A 68 -5.434 -6.819 -3.307 1.00 2.67 C ATOM 988 CD ARG A 68 -4.078 -7.461 -3.067 1.00 3.03 C ATOM 989 NE ARG A 68 -3.616 -7.271 -1.694 1.00 3.92 N ATOM 990 CZ ARG A 68 -2.459 -7.737 -1.230 1.00 4.62 C ATOM 991 NH1 ARG A 68 -1.644 -8.422 -2.023 1.00 4.63 N1+ ATOM 992 NH2 ARG A 68 -2.116 -7.519 0.033 1.00 5.64 N ATOM 993 H ARG A 68 -5.041 -2.809 -2.966 1.00 1.75 H ATOM 994 HA ARG A 68 -3.407 -4.949 -3.763 1.00 2.04 H ATOM 995 HB2 ARG A 68 -5.119 -5.160 -2.021 1.00 2.68 H ATOM 996 HB3 ARG A 68 -6.383 -4.922 -3.220 1.00 2.54 H ATOM 997 HG2 ARG A 68 -6.156 -7.268 -2.641 1.00 2.97 H ATOM 998 HG3 ARG A 68 -5.729 -6.993 -4.331 1.00 3.03 H ATOM 999 HD2 ARG A 68 -4.155 -8.520 -3.267 1.00 3.05 H ATOM 1000 HD3 ARG A 68 -3.359 -7.020 -3.744 1.00 3.20 H ATOM 1001 HE ARG A 68 -4.199 -6.770 -1.087 1.00 4.30 H ATOM 1002 HH11 ARG A 68 -1.896 -8.590 -2.975 1.00 4.12 H ATOM 1003 HH12 ARG A 68 -0.776 -8.769 -1.668 1.00 5.37 H ATOM 1004 HH21 ARG A 68 -2.725 -7.004 0.635 1.00 5.92 H ATOM 1005 HH22 ARG A 68 -1.246 -7.870 0.382 1.00 6.27 H ATOM 1006 N ARG A 69 -5.770 -4.101 -5.899 1.00 1.95 N ATOM 1007 CA ARG A 69 -6.194 -4.224 -7.289 1.00 2.02 C ATOM 1008 C ARG A 69 -5.119 -3.675 -8.218 1.00 1.88 C ATOM 1009 O ARG A 69 -4.866 -4.224 -9.290 1.00 2.03 O ATOM 1010 CB ARG A 69 -7.512 -3.481 -7.515 1.00 2.06 C ATOM 1011 CG ARG A 69 -8.042 -3.601 -8.934 1.00 2.39 C ATOM 1012 CD ARG A 69 -9.348 -2.844 -9.108 1.00 2.79 C ATOM 1013 NE ARG A 69 -9.189 -1.413 -8.861 1.00 3.21 N ATOM 1014 CZ ARG A 69 -10.159 -0.518 -9.033 1.00 3.74 C ATOM 1015 NH1 ARG A 69 -11.359 -0.902 -9.453 1.00 3.98 N1+ ATOM 1016 NH2 ARG A 69 -9.930 0.764 -8.786 1.00 4.43 N ATOM 1017 H ARG A 69 -6.247 -3.484 -5.306 1.00 1.91 H ATOM 1018 HA ARG A 69 -6.338 -5.273 -7.502 1.00 2.22 H ATOM 1019 HB2 ARG A 69 -8.256 -3.879 -6.841 1.00 2.55 H ATOM 1020 HB3 ARG A 69 -7.364 -2.434 -7.297 1.00 1.98 H ATOM 1021 HG2 ARG A 69 -7.309 -3.197 -9.617 1.00 2.61 H ATOM 1022 HG3 ARG A 69 -8.208 -4.645 -9.159 1.00 2.95 H ATOM 1023 HD2 ARG A 69 -9.700 -2.987 -10.120 1.00 3.26 H ATOM 1024 HD3 ARG A 69 -10.075 -3.241 -8.415 1.00 2.99 H ATOM 1025 HE ARG A 69 -8.312 -1.103 -8.550 1.00 3.45 H ATOM 1026 HH11 ARG A 69 -11.538 -1.868 -9.641 1.00 3.83 H ATOM 1027 HH12 ARG A 69 -12.083 -0.226 -9.581 1.00 4.57 H ATOM 1028 HH21 ARG A 69 -9.028 1.058 -8.471 1.00 4.65 H ATOM 1029 HH22 ARG A 69 -10.658 1.436 -8.916 1.00 4.93 H ATOM 1030 N ALA A 70 -4.491 -2.585 -7.792 1.00 1.68 N ATOM 1031 CA ALA A 70 -3.431 -1.954 -8.566 1.00 1.64 C ATOM 1032 C ALA A 70 -2.273 -2.922 -8.777 1.00 1.79 C ATOM 1033 O ALA A 70 -1.602 -2.900 -9.808 1.00 1.95 O ATOM 1034 CB ALA A 70 -2.948 -0.708 -7.851 1.00 1.49 C ATOM 1035 H ALA A 70 -4.749 -2.194 -6.932 1.00 1.60 H ATOM 1036 HA ALA A 70 -3.833 -1.660 -9.522 1.00 1.71 H ATOM 1037 HB1 ALA A 70 -2.137 -0.263 -8.408 1.00 1.59 H ATOM 1038 HB2 ALA A 70 -2.605 -0.973 -6.861 1.00 1.97 H ATOM 1039 HB3 ALA A 70 -3.761 -0.003 -7.772 1.00 1.73 H ATOM 1040 N LEU A 71 -2.056 -3.770 -7.782 1.00 1.82 N ATOM 1041 CA LEU A 71 -0.991 -4.766 -7.822 1.00 2.05 C ATOM 1042 C LEU A 71 -1.335 -5.892 -8.794 1.00 2.34 C ATOM 1043 O LEU A 71 -0.505 -6.301 -9.607 1.00 2.55 O ATOM 1044 CB LEU A 71 -0.763 -5.345 -6.424 1.00 2.08 C ATOM 1045 CG LEU A 71 0.176 -6.551 -6.362 1.00 2.34 C ATOM 1046 CD1 LEU A 71 1.582 -6.158 -6.786 1.00 3.12 C ATOM 1047 CD2 LEU A 71 0.180 -7.148 -4.962 1.00 2.12 C ATOM 1048 H LEU A 71 -2.636 -3.726 -6.996 1.00 1.73 H ATOM 1049 HA LEU A 71 -0.083 -4.278 -8.152 1.00 2.07 H ATOM 1050 HB2 LEU A 71 -0.355 -4.564 -5.798 1.00 2.01 H ATOM 1051 HB3 LEU A 71 -1.720 -5.641 -6.022 1.00 2.21 H ATOM 1052 HG LEU A 71 -0.178 -7.308 -7.046 1.00 2.70 H ATOM 1053 HD11 LEU A 71 1.911 -5.311 -6.204 1.00 3.26 H ATOM 1054 HD12 LEU A 71 1.581 -5.895 -7.834 1.00 3.61 H ATOM 1055 HD13 LEU A 71 2.252 -6.989 -6.625 1.00 3.60 H ATOM 1056 HD21 LEU A 71 0.986 -7.861 -4.878 1.00 2.52 H ATOM 1057 HD22 LEU A 71 -0.762 -7.645 -4.782 1.00 2.42 H ATOM 1058 HD23 LEU A 71 0.317 -6.361 -4.236 1.00 2.10 H ATOM 1059 N LYS A 72 -2.566 -6.386 -8.703 1.00 2.40 N ATOM 1060 CA LYS A 72 -3.018 -7.472 -9.565 1.00 2.71 C ATOM 1061 C LYS A 72 -3.013 -7.049 -11.026 1.00 2.70 C ATOM 1062 O LYS A 72 -2.664 -7.830 -11.911 1.00 2.97 O ATOM 1063 CB LYS A 72 -4.422 -7.927 -9.157 1.00 2.82 C ATOM 1064 CG LYS A 72 -4.961 -9.080 -9.990 1.00 2.97 C ATOM 1065 CD LYS A 72 -4.623 -10.429 -9.372 1.00 3.44 C ATOM 1066 CE LYS A 72 -3.124 -10.621 -9.219 1.00 4.03 C ATOM 1067 NZ LYS A 72 -2.784 -11.999 -8.767 1.00 5.17 N1+ ATOM 1068 H LYS A 72 -3.184 -6.013 -8.040 1.00 2.26 H ATOM 1069 HA LYS A 72 -2.336 -8.290 -9.445 1.00 2.93 H ATOM 1070 HB2 LYS A 72 -4.400 -8.238 -8.124 1.00 3.01 H ATOM 1071 HB3 LYS A 72 -5.100 -7.092 -9.257 1.00 3.18 H ATOM 1072 HG2 LYS A 72 -6.034 -8.988 -10.062 1.00 3.19 H ATOM 1073 HG3 LYS A 72 -4.528 -9.029 -10.979 1.00 3.23 H ATOM 1074 HD2 LYS A 72 -5.085 -10.492 -8.399 1.00 3.70 H ATOM 1075 HD3 LYS A 72 -5.014 -11.211 -10.007 1.00 3.72 H ATOM 1076 HE2 LYS A 72 -2.650 -10.436 -10.171 1.00 4.09 H ATOM 1077 HE3 LYS A 72 -2.756 -9.913 -8.490 1.00 4.06 H ATOM 1078 HZ1 LYS A 72 -3.228 -12.193 -7.847 1.00 5.39 H ATOM 1079 HZ2 LYS A 72 -1.753 -12.099 -8.670 1.00 5.59 H ATOM 1080 HZ3 LYS A 72 -3.125 -12.696 -9.459 1.00 5.68 H ATOM 1081 N ARG A 73 -3.401 -5.809 -11.269 1.00 2.43 N ATOM 1082 CA ARG A 73 -3.442 -5.272 -12.623 1.00 2.46 C ATOM 1083 C ARG A 73 -2.030 -5.047 -13.155 1.00 2.55 C ATOM 1084 O ARG A 73 -1.773 -5.209 -14.347 1.00 2.75 O ATOM 1085 CB ARG A 73 -4.233 -3.964 -12.657 1.00 2.26 C ATOM 1086 CG ARG A 73 -4.383 -3.384 -14.054 1.00 2.46 C ATOM 1087 CD ARG A 73 -5.314 -2.183 -14.065 1.00 2.75 C ATOM 1088 NE ARG A 73 -5.445 -1.604 -15.400 1.00 2.78 N ATOM 1089 CZ ARG A 73 -6.439 -0.800 -15.765 1.00 3.40 C ATOM 1090 NH1 ARG A 73 -7.393 -0.477 -14.901 1.00 3.94 N1+ ATOM 1091 NH2 ARG A 73 -6.482 -0.316 -17.000 1.00 3.93 N ATOM 1092 H ARG A 73 -3.663 -5.242 -10.516 1.00 2.25 H ATOM 1093 HA ARG A 73 -3.936 -5.998 -13.250 1.00 2.64 H ATOM 1094 HB2 ARG A 73 -5.220 -4.141 -12.256 1.00 2.28 H ATOM 1095 HB3 ARG A 73 -3.729 -3.234 -12.041 1.00 2.37 H ATOM 1096 HG2 ARG A 73 -3.411 -3.077 -14.412 1.00 2.77 H ATOM 1097 HG3 ARG A 73 -4.784 -4.145 -14.708 1.00 2.86 H ATOM 1098 HD2 ARG A 73 -6.288 -2.496 -13.722 1.00 3.46 H ATOM 1099 HD3 ARG A 73 -4.920 -1.433 -13.395 1.00 2.95 H ATOM 1100 HE ARG A 73 -4.755 -1.827 -16.059 1.00 2.78 H ATOM 1101 HH11 ARG A 73 -7.367 -0.838 -13.968 1.00 3.97 H ATOM 1102 HH12 ARG A 73 -8.139 0.128 -15.182 1.00 4.57 H ATOM 1103 HH21 ARG A 73 -5.766 -0.556 -17.656 1.00 3.97 H ATOM 1104 HH22 ARG A 73 -7.229 0.288 -17.275 1.00 4.53 H ATOM 1105 N ARG A 74 -1.121 -4.672 -12.261 1.00 2.47 N ATOM 1106 CA ARG A 74 0.266 -4.426 -12.639 1.00 2.62 C ATOM 1107 C ARG A 74 0.919 -5.710 -13.141 1.00 2.91 C ATOM 1108 O ARG A 74 1.629 -5.708 -14.146 1.00 3.11 O ATOM 1109 CB ARG A 74 1.048 -3.877 -11.442 1.00 2.56 C ATOM 1110 CG ARG A 74 2.246 -3.022 -11.826 1.00 2.63 C ATOM 1111 CD ARG A 74 3.230 -3.790 -12.694 1.00 3.24 C ATOM 1112 NE ARG A 74 4.484 -3.061 -12.873 1.00 3.74 N ATOM 1113 CZ ARG A 74 5.509 -3.515 -13.590 1.00 4.48 C ATOM 1114 NH1 ARG A 74 5.433 -4.693 -14.197 1.00 4.89 N1+ ATOM 1115 NH2 ARG A 74 6.613 -2.790 -13.701 1.00 5.14 N ATOM 1116 H ARG A 74 -1.388 -4.558 -11.325 1.00 2.33 H ATOM 1117 HA ARG A 74 0.273 -3.694 -13.432 1.00 2.66 H ATOM 1118 HB2 ARG A 74 0.383 -3.274 -10.839 1.00 2.63 H ATOM 1119 HB3 ARG A 74 1.401 -4.707 -10.848 1.00 2.72 H ATOM 1120 HG2 ARG A 74 1.898 -2.159 -12.373 1.00 2.79 H ATOM 1121 HG3 ARG A 74 2.749 -2.700 -10.926 1.00 2.69 H ATOM 1122 HD2 ARG A 74 3.439 -4.740 -12.228 1.00 3.75 H ATOM 1123 HD3 ARG A 74 2.782 -3.954 -13.662 1.00 3.39 H ATOM 1124 HE ARG A 74 4.567 -2.188 -12.435 1.00 3.82 H ATOM 1125 HH11 ARG A 74 4.604 -5.245 -14.118 1.00 4.72 H ATOM 1126 HH12 ARG A 74 6.207 -5.028 -14.736 1.00 5.59 H ATOM 1127 HH21 ARG A 74 6.676 -1.902 -13.246 1.00 5.21 H ATOM 1128 HH22 ARG A 74 7.384 -3.131 -14.241 1.00 5.75 H ATOM 1129 N ASN A 75 0.663 -6.810 -12.440 1.00 2.97 N ATOM 1130 CA ASN A 75 1.225 -8.103 -12.814 1.00 3.31 C ATOM 1131 C ASN A 75 0.554 -8.643 -14.072 1.00 3.49 C ATOM 1132 O ASN A 75 1.179 -9.344 -14.868 1.00 3.76 O ATOM 1133 CB ASN A 75 1.068 -9.107 -11.667 1.00 3.37 C ATOM 1134 CG ASN A 75 2.124 -8.946 -10.585 1.00 3.32 C ATOM 1135 OD1 ASN A 75 2.535 -9.925 -9.961 1.00 3.40 O ATOM 1136 ND2 ASN A 75 2.569 -7.716 -10.348 1.00 3.55 N ATOM 1137 H ASN A 75 0.083 -6.750 -11.652 1.00 2.83 H ATOM 1138 HA ASN A 75 2.276 -7.961 -13.015 1.00 3.43 H ATOM 1139 HB2 ASN A 75 0.098 -8.975 -11.214 1.00 3.25 H ATOM 1140 HB3 ASN A 75 1.140 -10.108 -12.066 1.00 3.63 H ATOM 1141 HD21 ASN A 75 2.200 -6.978 -10.873 1.00 3.91 H ATOM 1142 HD22 ASN A 75 3.250 -7.597 -9.652 1.00 3.55 H ATOM 1143 N ALA A 76 -0.722 -8.313 -14.245 1.00 3.38 N ATOM 1144 CA ALA A 76 -1.478 -8.765 -15.406 1.00 3.59 C ATOM 1145 C ALA A 76 -1.546 -10.287 -15.458 1.00 4.38 C ATOM 1146 O ALA A 76 -1.495 -10.957 -14.426 1.00 4.92 O ATOM 1147 CB ALA A 76 -0.857 -8.219 -16.684 1.00 3.28 C ATOM 1148 H ALA A 76 -1.165 -7.751 -13.575 1.00 3.18 H ATOM 1149 HA ALA A 76 -2.481 -8.372 -15.325 1.00 3.75 H ATOM 1150 HB1 ALA A 76 -0.816 -7.141 -16.632 1.00 3.40 H ATOM 1151 HB2 ALA A 76 -1.458 -8.516 -17.531 1.00 3.34 H ATOM 1152 HB3 ALA A 76 0.142 -8.614 -16.796 1.00 3.51 H TER 1153 ALA A 76 HETATM 1154 FE1 SF4 A 101 4.941 1.766 6.395 1.00 10.77 FE HETATM 1155 FE2 SF4 A 101 2.968 0.241 7.464 1.00 10.52 FE HETATM 1156 FE3 SF4 A 101 2.430 2.802 6.746 1.00 10.25 FE HETATM 1157 FE4 SF4 A 101 2.956 0.881 4.753 1.00 11.02 FE HETATM 1158 S1 SF4 A 101 1.215 0.963 6.162 1.00 10.48 S HETATM 1159 S2 SF4 A 101 3.678 3.012 4.902 1.00 10.90 S HETATM 1160 S3 SF4 A 101 4.424 -0.382 5.857 1.00 9.67 S HETATM 1161 S4 SF4 A 101 3.875 2.142 8.349 1.00 9.54 S