ATOM 1 N MET A 1 10.267 6.157 15.413 1.00 10.15 N ATOM 2 CA MET A 1 10.156 5.035 14.444 1.00 9.29 C ATOM 3 C MET A 1 8.708 4.827 14.010 1.00 8.34 C ATOM 4 O MET A 1 8.428 4.625 12.829 1.00 7.76 O ATOM 5 CB MET A 1 10.700 3.748 15.067 1.00 9.20 C ATOM 6 CG MET A 1 12.154 3.847 15.499 1.00 10.16 C ATOM 7 SD MET A 1 12.770 2.316 16.225 1.00 10.60 S ATOM 8 CE MET A 1 11.657 2.131 17.617 1.00 10.46 C ATOM 9 H1 MET A 1 11.266 6.325 15.652 1.00 10.56 H ATOM 10 HA MET A 1 10.747 5.281 13.574 1.00 9.52 H ATOM 11 HB2 MET A 1 10.106 3.500 15.934 1.00 9.03 H ATOM 12 HB3 MET A 1 10.616 2.949 14.344 1.00 8.69 H ATOM 13 HG2 MET A 1 12.757 4.086 14.635 1.00 10.55 H ATOM 14 HG3 MET A 1 12.245 4.638 16.229 1.00 10.39 H ATOM 15 HE1 MET A 1 11.910 1.234 18.162 1.00 10.46 H ATOM 16 HE2 MET A 1 10.641 2.060 17.258 1.00 10.67 H ATOM 17 HE3 MET A 1 11.751 2.987 18.269 1.00 10.40 H ATOM 18 N ASP A 2 7.791 4.878 14.972 1.00 8.30 N ATOM 19 CA ASP A 2 6.372 4.695 14.685 1.00 7.59 C ATOM 20 C ASP A 2 5.876 5.748 13.700 1.00 7.57 C ATOM 21 O ASP A 2 5.188 5.429 12.728 1.00 6.80 O ATOM 22 CB ASP A 2 5.556 4.762 15.977 1.00 7.98 C ATOM 23 CG ASP A 2 5.714 6.089 16.694 1.00 8.24 C ATOM 24 OD1 ASP A 2 4.924 7.013 16.411 1.00 8.51 O ATOM 25 OD2 ASP A 2 6.628 6.203 17.537 1.00 8.43 O1- ATOM 26 H ASP A 2 8.074 5.040 15.895 1.00 8.83 H ATOM 27 HA ASP A 2 6.248 3.719 14.242 1.00 6.93 H ATOM 28 HB2 ASP A 2 4.512 4.623 15.743 1.00 8.18 H ATOM 29 HB3 ASP A 2 5.880 3.974 16.642 1.00 8.15 H ATOM 30 N TRP A 3 6.231 7.003 13.954 1.00 8.50 N ATOM 31 CA TRP A 3 5.817 8.102 13.090 1.00 8.71 C ATOM 32 C TRP A 3 6.420 7.955 11.696 1.00 8.22 C ATOM 33 O TRP A 3 5.786 8.296 10.700 1.00 7.87 O ATOM 34 CB TRP A 3 6.226 9.444 13.700 1.00 9.94 C ATOM 35 CG TRP A 3 7.645 9.471 14.170 1.00 10.24 C ATOM 36 CD1 TRP A 3 8.102 9.123 15.408 1.00 10.46 C ATOM 37 CD2 TRP A 3 8.795 9.867 13.414 1.00 10.62 C ATOM 38 NE1 TRP A 3 9.465 9.273 15.467 1.00 10.93 N ATOM 39 CE2 TRP A 3 9.914 9.730 14.256 1.00 11.03 C ATOM 40 CE3 TRP A 3 8.987 10.323 12.106 1.00 10.86 C ATOM 41 CZ2 TRP A 3 11.206 10.032 13.832 1.00 11.64 C ATOM 42 CZ3 TRP A 3 10.270 10.622 11.687 1.00 11.49 C ATOM 43 CH2 TRP A 3 11.365 10.476 12.548 1.00 11.85 C ATOM 44 H TRP A 3 6.788 7.195 14.738 1.00 9.10 H ATOM 45 HA TRP A 3 4.741 8.068 13.006 1.00 8.45 H ATOM 46 HB2 TRP A 3 6.104 10.221 12.959 1.00 10.31 H ATOM 47 HB3 TRP A 3 5.587 9.656 14.545 1.00 10.46 H ATOM 48 HD1 TRP A 3 7.472 8.778 16.213 1.00 10.44 H ATOM 49 HE1 TRP A 3 10.022 9.082 16.248 1.00 11.27 H ATOM 50 HE3 TRP A 3 8.155 10.442 11.427 1.00 10.72 H ATOM 51 HZ2 TRP A 3 12.061 9.924 14.483 1.00 12.08 H ATOM 52 HZ3 TRP A 3 10.437 10.977 10.681 1.00 11.84 H ATOM 53 HH2 TRP A 3 12.350 10.723 12.178 1.00 12.45 H ATOM 54 N ARG A 4 7.646 7.443 11.636 1.00 8.33 N ATOM 55 CA ARG A 4 8.332 7.249 10.363 1.00 8.12 C ATOM 56 C ARG A 4 7.670 6.139 9.551 1.00 6.96 C ATOM 57 O ARG A 4 7.551 6.233 8.327 1.00 6.66 O ATOM 58 CB ARG A 4 9.806 6.914 10.599 1.00 8.77 C ATOM 59 CG ARG A 4 10.600 6.721 9.317 1.00 9.20 C ATOM 60 CD ARG A 4 10.600 7.982 8.468 1.00 9.68 C ATOM 61 NE ARG A 4 11.351 7.806 7.227 1.00 10.56 N ATOM 62 CZ ARG A 4 11.478 8.750 6.297 1.00 11.36 C ATOM 63 NH1 ARG A 4 10.905 9.936 6.463 1.00 11.43 N1+ ATOM 64 NH2 ARG A 4 12.180 8.508 5.198 1.00 12.22 N ATOM 65 H ARG A 4 8.099 7.188 12.467 1.00 8.65 H ATOM 66 HA ARG A 4 8.267 8.173 9.807 1.00 8.48 H ATOM 67 HB2 ARG A 4 10.260 7.716 11.161 1.00 9.38 H ATOM 68 HB3 ARG A 4 9.868 6.002 11.176 1.00 8.49 H ATOM 69 HG2 ARG A 4 11.618 6.470 9.570 1.00 9.47 H ATOM 70 HG3 ARG A 4 10.158 5.915 8.750 1.00 9.13 H ATOM 71 HD2 ARG A 4 9.579 8.238 8.225 1.00 9.61 H ATOM 72 HD3 ARG A 4 11.045 8.783 9.038 1.00 9.64 H ATOM 73 HE ARG A 4 11.784 6.940 7.079 1.00 10.66 H ATOM 74 HH11 ARG A 4 10.375 10.125 7.290 1.00 10.90 H ATOM 75 HH12 ARG A 4 11.005 10.641 5.761 1.00 12.11 H ATOM 76 HH21 ARG A 4 12.613 7.616 5.068 1.00 12.30 H ATOM 77 HH22 ARG A 4 12.275 9.217 4.499 1.00 12.86 H ATOM 78 N HIS A 5 7.233 5.092 10.239 1.00 6.40 N ATOM 79 CA HIS A 5 6.581 3.967 9.582 1.00 5.38 C ATOM 80 C HIS A 5 5.248 4.409 8.981 1.00 4.78 C ATOM 81 O HIS A 5 4.865 4.005 7.868 1.00 4.11 O ATOM 82 CB HIS A 5 6.367 2.840 10.587 1.00 5.14 C ATOM 83 CG HIS A 5 7.639 2.366 11.218 1.00 5.76 C ATOM 84 ND1 HIS A 5 7.773 2.133 12.572 1.00 6.25 N ATOM 85 CD2 HIS A 5 8.847 2.093 10.672 1.00 6.22 C ATOM 86 CE1 HIS A 5 9.006 1.738 12.829 1.00 6.80 C ATOM 87 NE2 HIS A 5 9.678 1.705 11.694 1.00 6.78 N ATOM 88 H HIS A 5 7.352 5.074 11.212 1.00 6.75 H ATOM 89 HA HIS A 5 7.227 3.620 8.789 1.00 5.41 H ATOM 90 HB2 HIS A 5 5.713 3.189 11.372 1.00 5.32 H ATOM 91 HB3 HIS A 5 5.907 2.000 10.087 1.00 4.54 H ATOM 92 HD1 HIS A 5 7.070 2.246 13.244 1.00 6.37 H ATOM 93 HD2 HIS A 5 9.110 2.170 9.627 1.00 6.33 H ATOM 94 HE1 HIS A 5 9.397 1.482 13.802 1.00 7.33 H ATOM 95 HE2 HIS A 5 10.640 1.535 11.613 1.00 7.23 H ATOM 96 N LYS A 6 4.579 5.321 9.671 1.00 5.27 N ATOM 97 CA LYS A 6 3.313 5.812 9.178 1.00 5.05 C ATOM 98 C LYS A 6 3.582 7.047 8.338 1.00 5.54 C ATOM 99 O LYS A 6 2.685 7.607 7.693 1.00 5.47 O ATOM 100 CB LYS A 6 2.372 6.149 10.338 1.00 5.70 C ATOM 101 CG LYS A 6 2.043 4.957 11.220 1.00 5.45 C ATOM 102 CD LYS A 6 1.243 5.366 12.448 1.00 6.10 C ATOM 103 CE LYS A 6 -0.064 6.048 12.070 1.00 6.27 C ATOM 104 NZ LYS A 6 0.079 7.528 11.988 1.00 6.56 N1+ ATOM 105 H LYS A 6 4.944 5.662 10.514 1.00 5.90 H ATOM 106 HA LYS A 6 2.869 5.044 8.563 1.00 4.30 H ATOM 107 HB2 LYS A 6 2.834 6.909 10.952 1.00 6.47 H ATOM 108 HB3 LYS A 6 1.449 6.538 9.934 1.00 5.79 H ATOM 109 HG2 LYS A 6 1.464 4.248 10.647 1.00 5.36 H ATOM 110 HG3 LYS A 6 2.965 4.494 11.541 1.00 5.20 H ATOM 111 HD2 LYS A 6 1.020 4.485 13.030 1.00 6.33 H ATOM 112 HD3 LYS A 6 1.836 6.048 13.040 1.00 6.56 H ATOM 113 HE2 LYS A 6 -0.385 5.673 11.110 1.00 6.50 H ATOM 114 HE3 LYS A 6 -0.808 5.807 12.816 1.00 6.27 H ATOM 115 HZ1 LYS A 6 0.391 7.908 12.905 1.00 6.94 H ATOM 116 HZ2 LYS A 6 -0.832 7.962 11.740 1.00 6.86 H ATOM 117 HZ3 LYS A 6 0.780 7.782 11.264 1.00 6.38 H ATOM 118 N ALA A 7 4.853 7.444 8.328 1.00 6.18 N ATOM 119 CA ALA A 7 5.293 8.557 7.521 1.00 6.81 C ATOM 120 C ALA A 7 5.234 8.114 6.084 1.00 6.18 C ATOM 121 O ALA A 7 4.722 8.819 5.220 1.00 6.24 O ATOM 122 CB ALA A 7 6.699 9.003 7.899 1.00 7.83 C ATOM 123 H ALA A 7 5.505 6.975 8.883 1.00 6.32 H ATOM 124 HA ALA A 7 4.610 9.382 7.673 1.00 7.13 H ATOM 125 HB1 ALA A 7 6.931 9.926 7.390 1.00 8.25 H ATOM 126 HB2 ALA A 7 7.408 8.244 7.605 1.00 8.09 H ATOM 127 HB3 ALA A 7 6.755 9.156 8.965 1.00 8.08 H ATOM 128 N VAL A 8 5.751 6.907 5.847 1.00 5.69 N ATOM 129 CA VAL A 8 5.725 6.338 4.523 1.00 5.34 C ATOM 130 C VAL A 8 4.293 5.931 4.214 1.00 4.24 C ATOM 131 O VAL A 8 3.906 5.805 3.052 1.00 4.15 O ATOM 132 CB VAL A 8 6.684 5.140 4.373 1.00 5.55 C ATOM 133 CG1 VAL A 8 6.917 4.831 2.900 1.00 5.75 C ATOM 134 CG2 VAL A 8 8.007 5.423 5.074 1.00 6.55 C ATOM 135 H VAL A 8 6.151 6.400 6.583 1.00 5.72 H ATOM 136 HA VAL A 8 6.024 7.108 3.825 1.00 5.91 H ATOM 137 HB VAL A 8 6.228 4.276 4.835 1.00 4.98 H ATOM 138 HG11 VAL A 8 7.505 3.929 2.812 1.00 5.83 H ATOM 139 HG12 VAL A 8 7.447 5.652 2.440 1.00 5.75 H ATOM 140 HG13 VAL A 8 5.968 4.693 2.405 1.00 6.14 H ATOM 141 HG21 VAL A 8 7.840 5.513 6.137 1.00 6.81 H ATOM 142 HG22 VAL A 8 8.425 6.344 4.696 1.00 7.04 H ATOM 143 HG23 VAL A 8 8.694 4.611 4.885 1.00 6.75 H ATOM 144 N CYS A 9 3.498 5.724 5.280 1.00 3.54 N ATOM 145 CA CYS A 9 2.083 5.402 5.111 1.00 2.62 C ATOM 146 C CYS A 9 1.429 6.455 4.223 1.00 2.96 C ATOM 147 O CYS A 9 1.084 6.197 3.072 1.00 2.62 O ATOM 148 CB CYS A 9 1.359 5.400 6.462 1.00 2.45 C ATOM 149 SG CYS A 9 0.649 3.802 6.938 1.00 1.43 S ATOM 150 H CYS A 9 3.873 5.782 6.182 1.00 3.79 H ATOM 151 HA CYS A 9 1.997 4.432 4.648 1.00 2.29 H ATOM 152 HB2 CYS A 9 2.052 5.682 7.224 1.00 3.05 H ATOM 153 HB3 CYS A 9 0.554 6.121 6.435 1.00 2.86 H ATOM 154 N ARG A 10 1.268 7.648 4.791 1.00 3.85 N ATOM 155 CA ARG A 10 0.650 8.774 4.084 1.00 4.48 C ATOM 156 C ARG A 10 1.540 9.327 2.967 1.00 4.75 C ATOM 157 O ARG A 10 1.052 9.957 2.029 1.00 4.85 O ATOM 158 CB ARG A 10 0.309 9.890 5.073 1.00 5.52 C ATOM 159 CG ARG A 10 1.516 10.432 5.818 1.00 6.10 C ATOM 160 CD ARG A 10 1.122 11.526 6.798 1.00 6.70 C ATOM 161 NE ARG A 10 0.181 11.046 7.806 1.00 6.91 N ATOM 162 CZ ARG A 10 -0.331 11.811 8.768 1.00 7.57 C ATOM 163 NH1 ARG A 10 0.005 13.092 8.854 1.00 8.09 N1+ ATOM 164 NH2 ARG A 10 -1.180 11.294 9.645 1.00 7.93 N ATOM 165 H ARG A 10 1.574 7.779 5.712 1.00 4.18 H ATOM 166 HA ARG A 10 -0.265 8.415 3.643 1.00 4.18 H ATOM 167 HB2 ARG A 10 -0.151 10.706 4.533 1.00 5.89 H ATOM 168 HB3 ARG A 10 -0.395 9.510 5.798 1.00 5.79 H ATOM 169 HG2 ARG A 10 1.982 9.627 6.364 1.00 6.05 H ATOM 170 HG3 ARG A 10 2.216 10.838 5.102 1.00 6.49 H ATOM 171 HD2 ARG A 10 2.011 11.887 7.292 1.00 6.93 H ATOM 172 HD3 ARG A 10 0.663 12.336 6.247 1.00 7.05 H ATOM 173 HE ARG A 10 -0.084 10.103 7.765 1.00 6.72 H ATOM 174 HH11 ARG A 10 0.644 13.489 8.196 1.00 8.03 H ATOM 175 HH12 ARG A 10 -0.384 13.663 9.579 1.00 8.68 H ATOM 176 HH21 ARG A 10 -1.437 10.329 9.584 1.00 7.77 H ATOM 177 HH22 ARG A 10 -1.564 11.869 10.368 1.00 8.49 H ATOM 178 N ASP A 11 2.840 9.086 3.073 1.00 5.06 N ATOM 179 CA ASP A 11 3.807 9.571 2.084 1.00 5.61 C ATOM 180 C ASP A 11 3.911 8.640 0.879 1.00 5.08 C ATOM 181 O ASP A 11 4.817 8.785 0.057 1.00 5.61 O ATOM 182 CB ASP A 11 5.189 9.757 2.712 1.00 6.59 C ATOM 183 CG ASP A 11 5.249 10.958 3.637 1.00 7.41 C ATOM 184 OD1 ASP A 11 4.337 11.110 4.476 1.00 7.77 O ATOM 185 OD2 ASP A 11 6.210 11.749 3.519 1.00 7.89 O1- ATOM 186 H ASP A 11 3.163 8.566 3.836 1.00 5.04 H ATOM 187 HA ASP A 11 3.456 10.533 1.739 1.00 5.91 H ATOM 188 HB2 ASP A 11 5.444 8.876 3.277 1.00 6.40 H ATOM 189 HB3 ASP A 11 5.916 9.896 1.925 1.00 7.04 H ATOM 190 N GLU A 12 2.990 7.690 0.766 1.00 4.19 N ATOM 191 CA GLU A 12 3.020 6.737 -0.325 1.00 3.98 C ATOM 192 C GLU A 12 2.417 7.351 -1.594 1.00 3.29 C ATOM 193 O GLU A 12 2.596 8.540 -1.854 1.00 3.16 O ATOM 194 CB GLU A 12 2.258 5.474 0.097 1.00 3.93 C ATOM 195 CG GLU A 12 0.764 5.691 0.285 1.00 4.52 C ATOM 196 CD GLU A 12 0.057 4.452 0.801 1.00 5.23 C ATOM 197 OE1 GLU A 12 -0.223 4.391 2.017 1.00 5.69 O ATOM 198 OE2 GLU A 12 -0.216 3.543 -0.009 1.00 5.68 O1- ATOM 199 H GLU A 12 2.269 7.633 1.419 1.00 3.84 H ATOM 200 HA GLU A 12 4.051 6.481 -0.515 1.00 4.68 H ATOM 201 HB2 GLU A 12 2.399 4.712 -0.651 1.00 3.89 H ATOM 202 HB3 GLU A 12 2.667 5.121 1.033 1.00 3.99 H ATOM 203 HG2 GLU A 12 0.615 6.493 0.991 1.00 4.68 H ATOM 204 HG3 GLU A 12 0.328 5.964 -0.663 1.00 4.68 H ATOM 205 N ASP A 13 1.707 6.548 -2.376 1.00 3.08 N ATOM 206 CA ASP A 13 1.120 7.022 -3.624 1.00 2.63 C ATOM 207 C ASP A 13 -0.393 7.146 -3.495 1.00 1.80 C ATOM 208 O ASP A 13 -1.065 6.188 -3.118 1.00 1.58 O ATOM 209 CB ASP A 13 1.478 6.092 -4.800 1.00 2.89 C ATOM 210 CG ASP A 13 1.105 6.698 -6.136 1.00 3.75 C ATOM 211 OD1 ASP A 13 2.023 7.020 -6.918 1.00 4.07 O ATOM 212 OD2 ASP A 13 -0.104 6.860 -6.396 1.00 4.38 O1- ATOM 213 H ASP A 13 1.551 5.629 -2.095 1.00 3.41 H ATOM 214 HA ASP A 13 1.529 8.001 -3.821 1.00 2.97 H ATOM 215 HB2 ASP A 13 2.541 5.916 -4.800 1.00 2.94 H ATOM 216 HB3 ASP A 13 0.963 5.144 -4.696 1.00 2.80 H ATOM 217 N PRO A 14 -0.956 8.334 -3.791 1.00 1.83 N ATOM 218 CA PRO A 14 -2.399 8.553 -3.702 1.00 1.75 C ATOM 219 C PRO A 14 -3.166 7.486 -4.471 1.00 1.81 C ATOM 220 O PRO A 14 -4.331 7.214 -4.185 1.00 2.21 O ATOM 221 CB PRO A 14 -2.609 9.938 -4.334 1.00 2.45 C ATOM 222 CG PRO A 14 -1.317 10.279 -5.001 1.00 2.84 C ATOM 223 CD PRO A 14 -0.249 9.538 -4.247 1.00 2.56 C ATOM 224 HA PRO A 14 -2.734 8.565 -2.674 1.00 1.73 H ATOM 225 HB2 PRO A 14 -3.417 9.889 -5.049 1.00 2.83 H ATOM 226 HB3 PRO A 14 -2.852 10.654 -3.562 1.00 2.54 H ATOM 227 HG2 PRO A 14 -1.339 9.957 -6.030 1.00 3.11 H ATOM 228 HG3 PRO A 14 -1.143 11.343 -4.944 1.00 3.31 H ATOM 229 HD2 PRO A 14 0.569 9.283 -4.904 1.00 2.98 H ATOM 230 HD3 PRO A 14 0.100 10.122 -3.410 1.00 2.73 H ATOM 231 N GLU A 15 -2.498 6.884 -5.451 1.00 1.83 N ATOM 232 CA GLU A 15 -3.101 5.829 -6.249 1.00 2.05 C ATOM 233 C GLU A 15 -3.267 4.559 -5.411 1.00 1.84 C ATOM 234 O GLU A 15 -4.048 3.674 -5.757 1.00 2.30 O ATOM 235 CB GLU A 15 -2.253 5.555 -7.498 1.00 2.31 C ATOM 236 CG GLU A 15 -2.090 6.774 -8.394 1.00 3.05 C ATOM 237 CD GLU A 15 -3.415 7.301 -8.908 1.00 4.04 C ATOM 238 OE1 GLU A 15 -4.046 8.111 -8.197 1.00 4.57 O ATOM 239 OE2 GLU A 15 -3.820 6.905 -10.021 1.00 4.66 O1- ATOM 240 H GLU A 15 -1.580 7.162 -5.646 1.00 1.96 H ATOM 241 HA GLU A 15 -4.081 6.167 -6.555 1.00 2.57 H ATOM 242 HB2 GLU A 15 -1.266 5.218 -7.198 1.00 2.12 H ATOM 243 HB3 GLU A 15 -2.726 4.776 -8.076 1.00 2.45 H ATOM 244 HG2 GLU A 15 -1.604 7.556 -7.833 1.00 2.97 H ATOM 245 HG3 GLU A 15 -1.475 6.502 -9.240 1.00 3.37 H ATOM 246 N LEU A 16 -2.522 4.476 -4.306 1.00 1.54 N ATOM 247 CA LEU A 16 -2.608 3.328 -3.401 1.00 1.99 C ATOM 248 C LEU A 16 -3.902 3.384 -2.597 1.00 2.62 C ATOM 249 O LEU A 16 -4.280 2.416 -1.939 1.00 3.26 O ATOM 250 CB LEU A 16 -1.375 3.275 -2.476 1.00 2.13 C ATOM 251 CG LEU A 16 -0.033 3.246 -3.222 1.00 2.14 C ATOM 252 CD1 LEU A 16 0.990 2.315 -2.585 1.00 2.40 C ATOM 253 CD2 LEU A 16 -0.254 2.811 -4.638 1.00 2.38 C ATOM 254 H LEU A 16 -1.889 5.195 -4.106 1.00 1.32 H ATOM 255 HA LEU A 16 -2.625 2.436 -4.009 1.00 2.16 H ATOM 256 HB2 LEU A 16 -1.392 4.146 -1.835 1.00 2.03 H ATOM 257 HB3 LEU A 16 -1.442 2.394 -1.860 1.00 2.65 H ATOM 258 HG LEU A 16 0.384 4.239 -3.240 1.00 2.42 H ATOM 259 HD11 LEU A 16 1.295 2.706 -1.627 1.00 2.85 H ATOM 260 HD12 LEU A 16 1.859 2.236 -3.246 1.00 2.78 H ATOM 261 HD13 LEU A 16 0.553 1.337 -2.457 1.00 2.46 H ATOM 262 HD21 LEU A 16 -0.917 1.958 -4.648 1.00 2.63 H ATOM 263 HD22 LEU A 16 0.694 2.534 -5.066 1.00 2.78 H ATOM 264 HD23 LEU A 16 -0.694 3.614 -5.206 1.00 2.70 H ATOM 265 N PHE A 17 -4.576 4.529 -2.659 1.00 2.64 N ATOM 266 CA PHE A 17 -5.842 4.715 -1.967 1.00 3.41 C ATOM 267 C PHE A 17 -7.006 4.672 -2.958 1.00 3.84 C ATOM 268 O PHE A 17 -8.170 4.658 -2.557 1.00 4.59 O ATOM 269 CB PHE A 17 -5.846 6.047 -1.214 1.00 3.49 C ATOM 270 CG PHE A 17 -4.755 6.159 -0.187 1.00 3.24 C ATOM 271 CD1 PHE A 17 -4.971 5.749 1.120 1.00 3.31 C ATOM 272 CD2 PHE A 17 -3.515 6.675 -0.527 1.00 3.50 C ATOM 273 CE1 PHE A 17 -3.971 5.852 2.067 1.00 3.33 C ATOM 274 CE2 PHE A 17 -2.510 6.779 0.416 1.00 3.56 C ATOM 275 CZ PHE A 17 -2.738 6.367 1.715 1.00 3.33 C ATOM 276 H PHE A 17 -4.210 5.271 -3.182 1.00 2.26 H ATOM 277 HA PHE A 17 -5.955 3.909 -1.259 1.00 3.75 H ATOM 278 HB2 PHE A 17 -5.720 6.853 -1.920 1.00 3.25 H ATOM 279 HB3 PHE A 17 -6.793 6.163 -0.709 1.00 4.15 H ATOM 280 HD1 PHE A 17 -5.934 5.346 1.395 1.00 3.72 H ATOM 281 HD2 PHE A 17 -3.335 6.997 -1.541 1.00 3.99 H ATOM 282 HE1 PHE A 17 -4.151 5.529 3.082 1.00 3.72 H ATOM 283 HE2 PHE A 17 -1.548 7.183 0.138 1.00 4.12 H ATOM 284 HZ PHE A 17 -1.955 6.447 2.453 1.00 3.55 H ATOM 285 N PHE A 18 -6.688 4.650 -4.257 1.00 3.47 N ATOM 286 CA PHE A 18 -7.718 4.609 -5.294 1.00 3.96 C ATOM 287 C PHE A 18 -7.431 3.503 -6.312 1.00 3.55 C ATOM 288 O PHE A 18 -6.276 3.252 -6.652 1.00 2.91 O ATOM 289 CB PHE A 18 -7.808 5.961 -6.004 1.00 4.23 C ATOM 290 CG PHE A 18 -8.300 7.072 -5.121 1.00 4.89 C ATOM 291 CD1 PHE A 18 -9.555 7.624 -5.315 1.00 5.32 C ATOM 292 CD2 PHE A 18 -7.507 7.564 -4.097 1.00 5.32 C ATOM 293 CE1 PHE A 18 -10.011 8.646 -4.505 1.00 5.95 C ATOM 294 CE2 PHE A 18 -7.957 8.585 -3.283 1.00 5.93 C ATOM 295 CZ PHE A 18 -9.211 9.128 -3.487 1.00 6.17 C ATOM 296 H PHE A 18 -5.740 4.660 -4.523 1.00 2.92 H ATOM 297 HA PHE A 18 -8.660 4.404 -4.811 1.00 4.64 H ATOM 298 HB2 PHE A 18 -6.829 6.235 -6.368 1.00 3.76 H ATOM 299 HB3 PHE A 18 -8.485 5.875 -6.841 1.00 4.61 H ATOM 300 HD1 PHE A 18 -10.183 7.249 -6.111 1.00 5.32 H ATOM 301 HD2 PHE A 18 -6.527 7.141 -3.936 1.00 5.34 H ATOM 302 HE1 PHE A 18 -10.993 9.068 -4.667 1.00 6.42 H ATOM 303 HE2 PHE A 18 -7.329 8.960 -2.488 1.00 6.37 H ATOM 304 HZ PHE A 18 -9.565 9.926 -2.852 1.00 6.68 H ATOM 305 N PRO A 19 -8.482 2.827 -6.815 1.00 4.05 N ATOM 306 CA PRO A 19 -8.330 1.745 -7.791 1.00 3.82 C ATOM 307 C PRO A 19 -7.982 2.256 -9.189 1.00 3.22 C ATOM 308 O PRO A 19 -8.585 3.211 -9.678 1.00 3.47 O ATOM 309 CB PRO A 19 -9.709 1.062 -7.811 1.00 4.70 C ATOM 310 CG PRO A 19 -10.517 1.716 -6.734 1.00 5.41 C ATOM 311 CD PRO A 19 -9.893 3.058 -6.484 1.00 5.00 C ATOM 312 HA PRO A 19 -7.583 1.034 -7.473 1.00 3.73 H ATOM 313 HB2 PRO A 19 -10.166 1.202 -8.780 1.00 4.71 H ATOM 314 HB3 PRO A 19 -9.588 0.006 -7.621 1.00 4.89 H ATOM 315 HG2 PRO A 19 -11.537 1.836 -7.066 1.00 6.02 H ATOM 316 HG3 PRO A 19 -10.484 1.115 -5.839 1.00 5.68 H ATOM 317 HD2 PRO A 19 -10.328 3.805 -7.132 1.00 5.23 H ATOM 318 HD3 PRO A 19 -10.007 3.339 -5.448 1.00 5.28 H ATOM 319 N VAL A 20 -7.005 1.613 -9.827 1.00 2.75 N ATOM 320 CA VAL A 20 -6.592 1.988 -11.171 1.00 2.39 C ATOM 321 C VAL A 20 -7.506 1.364 -12.217 1.00 2.36 C ATOM 322 O VAL A 20 -8.122 0.325 -11.981 1.00 2.67 O ATOM 323 CB VAL A 20 -5.147 1.552 -11.453 1.00 2.54 C ATOM 324 CG1 VAL A 20 -4.685 2.064 -12.810 1.00 2.80 C ATOM 325 CG2 VAL A 20 -4.228 2.038 -10.349 1.00 2.90 C ATOM 326 H VAL A 20 -6.537 0.883 -9.377 1.00 2.94 H ATOM 327 HA VAL A 20 -6.646 3.063 -11.252 1.00 2.59 H ATOM 328 HB VAL A 20 -5.113 0.473 -11.471 1.00 2.73 H ATOM 329 HG11 VAL A 20 -3.653 1.790 -12.965 1.00 3.02 H ATOM 330 HG12 VAL A 20 -4.781 3.139 -12.841 1.00 2.78 H ATOM 331 HG13 VAL A 20 -5.294 1.625 -13.587 1.00 3.39 H ATOM 332 HG21 VAL A 20 -4.490 1.547 -9.423 1.00 3.32 H ATOM 333 HG22 VAL A 20 -4.337 3.106 -10.234 1.00 2.90 H ATOM 334 HG23 VAL A 20 -3.205 1.805 -10.602 1.00 3.26 H ATOM 335 N GLY A 21 -7.588 2.008 -13.372 1.00 2.42 N ATOM 336 CA GLY A 21 -8.428 1.510 -14.442 1.00 2.52 C ATOM 337 C GLY A 21 -8.501 2.472 -15.610 1.00 2.65 C ATOM 338 O GLY A 21 -8.748 2.063 -16.744 1.00 3.01 O ATOM 339 H GLY A 21 -7.065 2.825 -13.501 1.00 2.67 H ATOM 340 HA2 GLY A 21 -8.030 0.568 -14.789 1.00 2.88 H ATOM 341 HA3 GLY A 21 -9.424 1.350 -14.059 1.00 2.48 H ATOM 342 N ASN A 22 -8.287 3.754 -15.334 1.00 2.69 N ATOM 343 CA ASN A 22 -8.333 4.772 -16.372 1.00 3.11 C ATOM 344 C ASN A 22 -6.935 5.142 -16.863 1.00 3.00 C ATOM 345 O ASN A 22 -6.794 5.784 -17.904 1.00 3.47 O ATOM 346 CB ASN A 22 -9.047 6.023 -15.853 1.00 3.74 C ATOM 347 CG ASN A 22 -10.472 5.738 -15.424 1.00 3.98 C ATOM 348 OD1 ASN A 22 -11.404 5.826 -16.225 1.00 4.04 O ATOM 349 ND2 ASN A 22 -10.651 5.396 -14.153 1.00 4.46 N ATOM 350 H ASN A 22 -8.102 4.022 -14.411 1.00 2.65 H ATOM 351 HA ASN A 22 -8.896 4.370 -17.201 1.00 3.29 H ATOM 352 HB2 ASN A 22 -8.507 6.412 -15.004 1.00 3.77 H ATOM 353 HB3 ASN A 22 -9.068 6.767 -16.635 1.00 4.17 H ATOM 354 HD21 ASN A 22 -9.864 5.347 -13.572 1.00 4.76 H ATOM 355 HD22 ASN A 22 -11.563 5.207 -13.848 1.00 4.67 H ATOM 356 N SER A 23 -5.898 4.742 -16.125 1.00 2.51 N ATOM 357 CA SER A 23 -4.534 5.058 -16.530 1.00 2.53 C ATOM 358 C SER A 23 -3.561 3.922 -16.238 1.00 2.10 C ATOM 359 O SER A 23 -3.792 3.091 -15.359 1.00 1.90 O ATOM 360 CB SER A 23 -4.058 6.320 -15.810 1.00 2.85 C ATOM 361 OG SER A 23 -4.071 6.140 -14.404 1.00 2.71 O ATOM 362 H SER A 23 -6.050 4.244 -15.292 1.00 2.28 H ATOM 363 HA SER A 23 -4.539 5.247 -17.591 1.00 2.92 H ATOM 364 HB2 SER A 23 -3.047 6.544 -16.113 1.00 3.04 H ATOM 365 HB3 SER A 23 -4.706 7.147 -16.062 1.00 3.24 H ATOM 366 HG SER A 23 -3.643 6.888 -13.981 1.00 2.79 H ATOM 367 N GLY A 24 -2.470 3.907 -16.995 1.00 2.24 N ATOM 368 CA GLY A 24 -1.428 2.919 -16.802 1.00 1.95 C ATOM 369 C GLY A 24 -0.395 3.407 -15.809 1.00 1.72 C ATOM 370 O GLY A 24 0.029 2.657 -14.929 1.00 1.47 O ATOM 371 H GLY A 24 -2.381 4.570 -17.711 1.00 2.67 H ATOM 372 HA2 GLY A 24 -1.872 2.011 -16.427 1.00 1.86 H ATOM 373 HA3 GLY A 24 -0.944 2.719 -17.744 1.00 2.12 H ATOM 374 N PRO A 25 0.033 4.677 -15.930 1.00 1.91 N ATOM 375 CA PRO A 25 0.990 5.283 -15.011 1.00 1.84 C ATOM 376 C PRO A 25 0.589 5.058 -13.569 1.00 1.53 C ATOM 377 O PRO A 25 1.432 5.052 -12.680 1.00 1.42 O ATOM 378 CB PRO A 25 0.957 6.767 -15.370 1.00 2.19 C ATOM 379 CG PRO A 25 0.575 6.785 -16.807 1.00 2.48 C ATOM 380 CD PRO A 25 -0.365 5.625 -16.994 1.00 2.31 C ATOM 381 HA PRO A 25 1.978 4.887 -15.159 1.00 1.88 H ATOM 382 HB2 PRO A 25 0.226 7.275 -14.758 1.00 2.17 H ATOM 383 HB3 PRO A 25 1.932 7.202 -15.216 1.00 2.30 H ATOM 384 HG2 PRO A 25 0.077 7.714 -17.044 1.00 2.72 H ATOM 385 HG3 PRO A 25 1.452 6.658 -17.423 1.00 2.63 H ATOM 386 HD2 PRO A 25 -1.386 5.946 -16.860 1.00 2.38 H ATOM 387 HD3 PRO A 25 -0.231 5.184 -17.971 1.00 2.47 H ATOM 388 N ALA A 26 -0.704 4.876 -13.337 1.00 1.49 N ATOM 389 CA ALA A 26 -1.192 4.665 -11.979 1.00 1.32 C ATOM 390 C ALA A 26 -0.544 3.433 -11.381 1.00 1.06 C ATOM 391 O ALA A 26 -0.283 3.373 -10.186 1.00 0.93 O ATOM 392 CB ALA A 26 -2.704 4.504 -11.954 1.00 1.52 C ATOM 393 H ALA A 26 -1.335 4.873 -14.095 1.00 1.64 H ATOM 394 HA ALA A 26 -0.927 5.525 -11.389 1.00 1.37 H ATOM 395 HB1 ALA A 26 -3.122 4.804 -12.904 1.00 2.24 H ATOM 396 HB2 ALA A 26 -3.110 5.121 -11.168 1.00 1.59 H ATOM 397 HB3 ALA A 26 -2.952 3.466 -11.760 1.00 1.74 H ATOM 398 N LEU A 27 -0.288 2.453 -12.221 1.00 1.12 N ATOM 399 CA LEU A 27 0.349 1.226 -11.779 1.00 1.08 C ATOM 400 C LEU A 27 1.791 1.492 -11.407 1.00 1.01 C ATOM 401 O LEU A 27 2.294 0.973 -10.415 1.00 0.98 O ATOM 402 CB LEU A 27 0.291 0.174 -12.878 1.00 1.35 C ATOM 403 CG LEU A 27 -1.115 -0.295 -13.263 1.00 1.62 C ATOM 404 CD1 LEU A 27 -1.985 -0.441 -12.024 1.00 2.10 C ATOM 405 CD2 LEU A 27 -1.748 0.669 -14.254 1.00 2.05 C ATOM 406 H LEU A 27 -0.518 2.565 -13.163 1.00 1.28 H ATOM 407 HA LEU A 27 -0.173 0.867 -10.905 1.00 1.09 H ATOM 408 HB2 LEU A 27 0.764 0.590 -13.754 1.00 1.43 H ATOM 409 HB3 LEU A 27 0.858 -0.682 -12.554 1.00 1.38 H ATOM 410 HG LEU A 27 -1.046 -1.264 -13.735 1.00 2.19 H ATOM 411 HD11 LEU A 27 -2.975 -0.761 -12.311 1.00 2.70 H ATOM 412 HD12 LEU A 27 -2.047 0.510 -11.516 1.00 2.28 H ATOM 413 HD13 LEU A 27 -1.546 -1.172 -11.363 1.00 2.53 H ATOM 414 HD21 LEU A 27 -1.101 0.777 -15.112 1.00 2.37 H ATOM 415 HD22 LEU A 27 -1.887 1.630 -13.784 1.00 2.36 H ATOM 416 HD23 LEU A 27 -2.705 0.283 -14.571 1.00 2.61 H ATOM 417 N ALA A 28 2.456 2.291 -12.223 1.00 1.16 N ATOM 418 CA ALA A 28 3.840 2.642 -11.961 1.00 1.33 C ATOM 419 C ALA A 28 3.913 3.546 -10.745 1.00 1.26 C ATOM 420 O ALA A 28 4.852 3.477 -9.949 1.00 1.31 O ATOM 421 CB ALA A 28 4.466 3.311 -13.174 1.00 1.68 C ATOM 422 H ALA A 28 2.000 2.662 -13.010 1.00 1.26 H ATOM 423 HA ALA A 28 4.378 1.733 -11.751 1.00 1.39 H ATOM 424 HB1 ALA A 28 3.940 4.229 -13.391 1.00 1.80 H ATOM 425 HB2 ALA A 28 4.401 2.649 -14.025 1.00 1.93 H ATOM 426 HB3 ALA A 28 5.503 3.533 -12.969 1.00 2.22 H ATOM 427 N GLN A 29 2.899 4.386 -10.609 1.00 1.24 N ATOM 428 CA GLN A 29 2.823 5.314 -9.485 1.00 1.29 C ATOM 429 C GLN A 29 2.559 4.528 -8.213 1.00 1.03 C ATOM 430 O GLN A 29 3.249 4.673 -7.193 1.00 1.10 O ATOM 431 CB GLN A 29 1.691 6.324 -9.725 1.00 1.50 C ATOM 432 CG GLN A 29 2.181 7.707 -10.130 1.00 1.85 C ATOM 433 CD GLN A 29 3.147 7.669 -11.298 1.00 1.88 C ATOM 434 OE1 GLN A 29 3.072 6.787 -12.154 1.00 2.46 O ATOM 435 NE2 GLN A 29 4.062 8.630 -11.340 1.00 2.13 N ATOM 436 H GLN A 29 2.166 4.353 -11.266 1.00 1.26 H ATOM 437 HA GLN A 29 3.765 5.835 -9.402 1.00 1.49 H ATOM 438 HB2 GLN A 29 1.041 5.948 -10.510 1.00 1.75 H ATOM 439 HB3 GLN A 29 1.112 6.423 -8.818 1.00 1.89 H ATOM 440 HG2 GLN A 29 1.329 8.309 -10.408 1.00 2.39 H ATOM 441 HG3 GLN A 29 2.678 8.159 -9.284 1.00 2.43 H ATOM 442 HE21 GLN A 29 4.062 9.300 -10.624 1.00 2.32 H ATOM 443 HE22 GLN A 29 4.699 8.631 -12.084 1.00 2.57 H ATOM 444 N ILE A 30 1.562 3.666 -8.311 1.00 0.85 N ATOM 445 CA ILE A 30 1.184 2.801 -7.226 1.00 0.87 C ATOM 446 C ILE A 30 2.308 1.847 -6.850 1.00 0.85 C ATOM 447 O ILE A 30 2.591 1.623 -5.674 1.00 1.00 O ATOM 448 CB ILE A 30 -0.059 1.975 -7.603 1.00 1.07 C ATOM 449 CG1 ILE A 30 -1.310 2.849 -7.626 1.00 1.31 C ATOM 450 CG2 ILE A 30 -0.224 0.812 -6.651 1.00 1.39 C ATOM 451 CD1 ILE A 30 -2.579 2.088 -7.922 1.00 1.41 C ATOM 452 H ILE A 30 1.017 3.659 -9.124 1.00 0.88 H ATOM 453 HA ILE A 30 0.951 3.419 -6.387 1.00 1.02 H ATOM 454 HB ILE A 30 0.100 1.569 -8.591 1.00 1.00 H ATOM 455 HG12 ILE A 30 -1.431 3.325 -6.669 1.00 1.90 H ATOM 456 HG13 ILE A 30 -1.193 3.606 -8.383 1.00 1.88 H ATOM 457 HG21 ILE A 30 -1.263 0.704 -6.388 1.00 2.05 H ATOM 458 HG22 ILE A 30 0.359 1.002 -5.760 1.00 1.58 H ATOM 459 HG23 ILE A 30 0.127 -0.088 -7.131 1.00 1.68 H ATOM 460 HD11 ILE A 30 -2.814 1.442 -7.090 1.00 1.79 H ATOM 461 HD12 ILE A 30 -2.439 1.494 -8.812 1.00 2.05 H ATOM 462 HD13 ILE A 30 -3.390 2.785 -8.077 1.00 1.76 H ATOM 463 N ALA A 31 2.939 1.298 -7.863 1.00 0.86 N ATOM 464 CA ALA A 31 4.024 0.353 -7.675 1.00 1.12 C ATOM 465 C ALA A 31 5.162 1.001 -6.911 1.00 1.15 C ATOM 466 O ALA A 31 5.888 0.339 -6.175 1.00 1.34 O ATOM 467 CB ALA A 31 4.512 -0.168 -9.017 1.00 1.36 C ATOM 468 H ALA A 31 2.671 1.542 -8.774 1.00 0.82 H ATOM 469 HA ALA A 31 3.645 -0.481 -7.103 1.00 1.30 H ATOM 470 HB1 ALA A 31 3.694 -0.642 -9.538 1.00 1.73 H ATOM 471 HB2 ALA A 31 5.301 -0.888 -8.858 1.00 1.50 H ATOM 472 HB3 ALA A 31 4.889 0.653 -9.609 1.00 1.88 H ATOM 473 N ASP A 32 5.306 2.303 -7.087 1.00 1.13 N ATOM 474 CA ASP A 32 6.388 3.028 -6.449 1.00 1.35 C ATOM 475 C ASP A 32 6.123 3.144 -4.973 1.00 1.35 C ATOM 476 O ASP A 32 7.004 2.910 -4.143 1.00 1.51 O ATOM 477 CB ASP A 32 6.563 4.413 -7.075 1.00 1.57 C ATOM 478 CG ASP A 32 7.026 4.344 -8.518 1.00 1.77 C ATOM 479 OD1 ASP A 32 7.156 3.221 -9.049 1.00 1.97 O ATOM 480 OD2 ASP A 32 7.259 5.415 -9.118 1.00 2.21 O1- ATOM 481 H ASP A 32 4.605 2.798 -7.552 1.00 1.07 H ATOM 482 HA ASP A 32 7.286 2.456 -6.585 1.00 1.50 H ATOM 483 HB2 ASP A 32 5.619 4.937 -7.045 1.00 1.45 H ATOM 484 HB3 ASP A 32 7.296 4.967 -6.507 1.00 1.80 H ATOM 485 N ALA A 33 4.896 3.493 -4.649 1.00 1.25 N ATOM 486 CA ALA A 33 4.512 3.623 -3.263 1.00 1.40 C ATOM 487 C ALA A 33 4.475 2.255 -2.608 1.00 1.47 C ATOM 488 O ALA A 33 4.808 2.106 -1.436 1.00 1.68 O ATOM 489 CB ALA A 33 3.178 4.315 -3.152 1.00 1.46 C ATOM 490 H ALA A 33 4.231 3.645 -5.357 1.00 1.14 H ATOM 491 HA ALA A 33 5.254 4.231 -2.766 1.00 1.58 H ATOM 492 HB1 ALA A 33 2.713 4.049 -2.219 1.00 1.96 H ATOM 493 HB2 ALA A 33 2.544 4.016 -3.974 1.00 1.66 H ATOM 494 HB3 ALA A 33 3.331 5.381 -3.185 1.00 1.76 H ATOM 495 N LYS A 34 4.058 1.257 -3.379 1.00 1.40 N ATOM 496 CA LYS A 34 3.981 -0.109 -2.886 1.00 1.66 C ATOM 497 C LYS A 34 5.363 -0.638 -2.513 1.00 1.71 C ATOM 498 O LYS A 34 5.519 -1.307 -1.493 1.00 2.01 O ATOM 499 CB LYS A 34 3.329 -1.017 -3.937 1.00 1.75 C ATOM 500 CG LYS A 34 3.487 -2.502 -3.648 1.00 1.91 C ATOM 501 CD LYS A 34 2.326 -3.311 -4.205 1.00 2.07 C ATOM 502 CE LYS A 34 2.554 -4.802 -4.024 1.00 2.56 C ATOM 503 NZ LYS A 34 1.273 -5.558 -3.960 1.00 2.85 N1+ ATOM 504 H LYS A 34 3.797 1.446 -4.304 1.00 1.25 H ATOM 505 HA LYS A 34 3.363 -0.103 -2.001 1.00 1.87 H ATOM 506 HB2 LYS A 34 2.274 -0.792 -3.985 1.00 2.00 H ATOM 507 HB3 LYS A 34 3.775 -0.810 -4.899 1.00 1.92 H ATOM 508 HG2 LYS A 34 4.403 -2.851 -4.101 1.00 2.40 H ATOM 509 HG3 LYS A 34 3.536 -2.647 -2.579 1.00 2.26 H ATOM 510 HD2 LYS A 34 1.422 -3.029 -3.686 1.00 2.35 H ATOM 511 HD3 LYS A 34 2.223 -3.095 -5.258 1.00 2.50 H ATOM 512 HE2 LYS A 34 3.135 -5.167 -4.858 1.00 2.90 H ATOM 513 HE3 LYS A 34 3.104 -4.961 -3.108 1.00 3.02 H ATOM 514 HZ1 LYS A 34 0.740 -5.286 -3.109 1.00 3.13 H ATOM 515 HZ2 LYS A 34 1.462 -6.580 -3.924 1.00 3.19 H ATOM 516 HZ3 LYS A 34 0.694 -5.353 -4.798 1.00 3.04 H ATOM 517 N LEU A 35 6.369 -0.333 -3.332 1.00 1.51 N ATOM 518 CA LEU A 35 7.723 -0.806 -3.059 1.00 1.62 C ATOM 519 C LEU A 35 8.297 -0.112 -1.831 1.00 1.70 C ATOM 520 O LEU A 35 8.906 -0.750 -0.972 1.00 1.88 O ATOM 521 CB LEU A 35 8.626 -0.562 -4.272 1.00 1.54 C ATOM 522 CG LEU A 35 8.356 -1.450 -5.499 1.00 1.68 C ATOM 523 CD1 LEU A 35 7.029 -2.192 -5.379 1.00 2.31 C ATOM 524 CD2 LEU A 35 8.383 -0.608 -6.765 1.00 1.65 C ATOM 525 H LEU A 35 6.202 0.224 -4.128 1.00 1.35 H ATOM 526 HA LEU A 35 7.671 -1.867 -2.867 1.00 1.82 H ATOM 527 HB2 LEU A 35 8.515 0.469 -4.570 1.00 1.40 H ATOM 528 HB3 LEU A 35 9.649 -0.719 -3.964 1.00 1.64 H ATOM 529 HG LEU A 35 9.141 -2.188 -5.576 1.00 2.27 H ATOM 530 HD11 LEU A 35 6.849 -2.760 -6.280 1.00 2.74 H ATOM 531 HD12 LEU A 35 6.229 -1.483 -5.237 1.00 2.59 H ATOM 532 HD13 LEU A 35 7.067 -2.862 -4.533 1.00 2.87 H ATOM 533 HD21 LEU A 35 9.392 -0.561 -7.145 1.00 2.16 H ATOM 534 HD22 LEU A 35 8.038 0.390 -6.537 1.00 1.95 H ATOM 535 HD23 LEU A 35 7.737 -1.053 -7.508 1.00 1.98 H ATOM 536 N VAL A 36 8.100 1.199 -1.757 1.00 1.67 N ATOM 537 CA VAL A 36 8.587 1.978 -0.621 1.00 1.92 C ATOM 538 C VAL A 36 7.794 1.647 0.645 1.00 2.27 C ATOM 539 O VAL A 36 8.328 1.672 1.754 1.00 2.56 O ATOM 540 CB VAL A 36 8.498 3.493 -0.900 1.00 2.08 C ATOM 541 CG1 VAL A 36 9.058 4.289 0.269 1.00 2.44 C ATOM 542 CG2 VAL A 36 9.230 3.840 -2.186 1.00 1.96 C ATOM 543 H VAL A 36 7.622 1.650 -2.485 1.00 1.55 H ATOM 544 HA VAL A 36 9.624 1.723 -0.461 1.00 1.89 H ATOM 545 HB VAL A 36 7.457 3.757 -1.021 1.00 2.14 H ATOM 546 HG11 VAL A 36 10.106 4.061 0.390 1.00 2.71 H ATOM 547 HG12 VAL A 36 8.527 4.027 1.170 1.00 2.87 H ATOM 548 HG13 VAL A 36 8.939 5.345 0.075 1.00 2.51 H ATOM 549 HG21 VAL A 36 9.065 4.881 -2.425 1.00 2.06 H ATOM 550 HG22 VAL A 36 8.860 3.223 -2.990 1.00 2.16 H ATOM 551 HG23 VAL A 36 10.288 3.665 -2.056 1.00 2.25 H ATOM 552 N CYS A 37 6.516 1.339 0.458 1.00 2.30 N ATOM 553 CA CYS A 37 5.619 0.998 1.556 1.00 2.78 C ATOM 554 C CYS A 37 5.884 -0.422 2.060 1.00 3.05 C ATOM 555 O CYS A 37 5.558 -0.756 3.199 1.00 3.55 O ATOM 556 CB CYS A 37 4.169 1.150 1.075 1.00 2.92 C ATOM 557 SG CYS A 37 2.901 0.355 2.118 1.00 2.70 S ATOM 558 H CYS A 37 6.160 1.340 -0.455 1.00 2.05 H ATOM 559 HA CYS A 37 5.798 1.694 2.361 1.00 3.01 H ATOM 560 HB2 CYS A 37 3.928 2.200 1.023 1.00 2.99 H ATOM 561 HB3 CYS A 37 4.087 0.723 0.085 1.00 3.42 H ATOM 562 N ASN A 38 6.476 -1.253 1.205 1.00 2.91 N ATOM 563 CA ASN A 38 6.778 -2.636 1.563 1.00 3.45 C ATOM 564 C ASN A 38 8.064 -2.749 2.379 1.00 3.36 C ATOM 565 O ASN A 38 8.199 -3.652 3.206 1.00 3.83 O ATOM 566 CB ASN A 38 6.892 -3.502 0.306 1.00 3.70 C ATOM 567 CG ASN A 38 5.552 -3.762 -0.357 1.00 3.92 C ATOM 568 OD1 ASN A 38 5.450 -3.784 -1.584 1.00 4.18 O ATOM 569 ND2 ASN A 38 4.517 -3.976 0.449 1.00 4.10 N ATOM 570 H ASN A 38 6.714 -0.931 0.311 1.00 2.60 H ATOM 571 HA ASN A 38 5.961 -3.003 2.163 1.00 3.88 H ATOM 572 HB2 ASN A 38 7.531 -3.004 -0.408 1.00 3.40 H ATOM 573 HB3 ASN A 38 7.332 -4.452 0.571 1.00 4.15 H ATOM 574 HD21 ASN A 38 4.669 -3.958 1.415 1.00 4.26 H ATOM 575 HD22 ASN A 38 3.643 -4.144 0.041 1.00 4.23 H ATOM 576 N ARG A 39 9.009 -1.840 2.152 1.00 2.85 N ATOM 577 CA ARG A 39 10.279 -1.885 2.872 1.00 2.71 C ATOM 578 C ARG A 39 10.203 -1.150 4.209 1.00 2.32 C ATOM 579 O ARG A 39 11.145 -1.193 5.000 1.00 2.32 O ATOM 580 CB ARG A 39 11.391 -1.278 2.013 1.00 2.85 C ATOM 581 CG ARG A 39 11.534 -1.923 0.643 1.00 3.52 C ATOM 582 CD ARG A 39 11.994 -3.370 0.745 1.00 4.09 C ATOM 583 NE ARG A 39 10.945 -4.247 1.258 1.00 4.53 N ATOM 584 CZ ARG A 39 11.138 -5.522 1.584 1.00 5.23 C ATOM 585 NH1 ARG A 39 12.338 -6.073 1.455 1.00 5.50 N1+ ATOM 586 NH2 ARG A 39 10.129 -6.251 2.043 1.00 5.96 N ATOM 587 H ARG A 39 8.850 -1.132 1.493 1.00 2.67 H ATOM 588 HA ARG A 39 10.513 -2.920 3.062 1.00 3.01 H ATOM 589 HB2 ARG A 39 11.187 -0.227 1.872 1.00 2.80 H ATOM 590 HB3 ARG A 39 12.331 -1.384 2.536 1.00 2.74 H ATOM 591 HG2 ARG A 39 10.578 -1.896 0.143 1.00 3.84 H ATOM 592 HG3 ARG A 39 12.258 -1.364 0.067 1.00 3.66 H ATOM 593 HD2 ARG A 39 12.285 -3.711 -0.237 1.00 4.72 H ATOM 594 HD3 ARG A 39 12.845 -3.416 1.409 1.00 4.02 H ATOM 595 HE ARG A 39 10.047 -3.865 1.364 1.00 4.57 H ATOM 596 HH11 ARG A 39 13.105 -5.529 1.111 1.00 5.27 H ATOM 597 HH12 ARG A 39 12.479 -7.032 1.703 1.00 6.12 H ATOM 598 HH21 ARG A 39 9.222 -5.841 2.143 1.00 6.06 H ATOM 599 HH22 ARG A 39 10.274 -7.209 2.287 1.00 6.58 H ATOM 600 N CYS A 40 9.086 -0.475 4.464 1.00 2.21 N ATOM 601 CA CYS A 40 8.904 0.237 5.722 1.00 2.26 C ATOM 602 C CYS A 40 8.571 -0.749 6.844 1.00 2.61 C ATOM 603 O CYS A 40 7.641 -1.545 6.717 1.00 2.77 O ATOM 604 CB CYS A 40 7.811 1.308 5.567 1.00 2.34 C ATOM 605 SG CYS A 40 6.693 1.513 6.997 1.00 1.86 S ATOM 606 H CYS A 40 8.371 -0.455 3.794 1.00 2.27 H ATOM 607 HA CYS A 40 9.838 0.725 5.956 1.00 2.31 H ATOM 608 HB2 CYS A 40 8.284 2.262 5.392 1.00 2.97 H ATOM 609 HB3 CYS A 40 7.202 1.058 4.710 1.00 2.44 H ATOM 610 N PRO A 41 9.325 -0.713 7.957 1.00 2.99 N ATOM 611 CA PRO A 41 9.091 -1.614 9.090 1.00 3.58 C ATOM 612 C PRO A 41 7.630 -1.629 9.532 1.00 3.72 C ATOM 613 O PRO A 41 7.048 -0.585 9.827 1.00 4.42 O ATOM 614 CB PRO A 41 9.976 -1.036 10.194 1.00 4.16 C ATOM 615 CG PRO A 41 11.068 -0.324 9.473 1.00 3.79 C ATOM 616 CD PRO A 41 10.464 0.193 8.196 1.00 3.10 C ATOM 617 HA PRO A 41 9.405 -2.622 8.864 1.00 3.74 H ATOM 618 HB2 PRO A 41 9.397 -0.361 10.804 1.00 4.63 H ATOM 619 HB3 PRO A 41 10.365 -1.837 10.804 1.00 4.52 H ATOM 620 HG2 PRO A 41 11.429 0.498 10.075 1.00 4.16 H ATOM 621 HG3 PRO A 41 11.872 -1.011 9.255 1.00 3.79 H ATOM 622 HD2 PRO A 41 10.126 1.210 8.322 1.00 3.16 H ATOM 623 HD3 PRO A 41 11.179 0.132 7.389 1.00 2.86 H ATOM 624 N VAL A 42 7.047 -2.822 9.576 1.00 3.42 N ATOM 625 CA VAL A 42 5.657 -2.986 9.982 1.00 3.71 C ATOM 626 C VAL A 42 5.407 -2.405 11.372 1.00 3.72 C ATOM 627 O VAL A 42 6.261 -2.482 12.256 1.00 4.29 O ATOM 628 CB VAL A 42 5.245 -4.471 9.978 1.00 4.48 C ATOM 629 CG1 VAL A 42 5.339 -5.047 8.574 1.00 4.82 C ATOM 630 CG2 VAL A 42 6.106 -5.269 10.947 1.00 5.23 C ATOM 631 H VAL A 42 7.566 -3.614 9.326 1.00 3.29 H ATOM 632 HA VAL A 42 5.038 -2.462 9.269 1.00 3.73 H ATOM 633 HB VAL A 42 4.217 -4.540 10.302 1.00 4.71 H ATOM 634 HG11 VAL A 42 5.035 -6.084 8.589 1.00 5.08 H ATOM 635 HG12 VAL A 42 6.358 -4.977 8.224 1.00 5.24 H ATOM 636 HG13 VAL A 42 4.691 -4.491 7.912 1.00 4.81 H ATOM 637 HG21 VAL A 42 5.984 -4.873 11.945 1.00 5.51 H ATOM 638 HG22 VAL A 42 7.142 -5.194 10.654 1.00 5.70 H ATOM 639 HG23 VAL A 42 5.800 -6.304 10.931 1.00 5.37 H ATOM 640 N THR A 43 4.227 -1.824 11.548 1.00 3.43 N ATOM 641 CA THR A 43 3.835 -1.221 12.817 1.00 3.73 C ATOM 642 C THR A 43 2.434 -1.633 13.210 1.00 3.66 C ATOM 643 O THR A 43 1.708 -2.240 12.423 1.00 3.29 O ATOM 644 CB THR A 43 3.852 0.312 12.759 1.00 3.96 C ATOM 645 OG1 THR A 43 2.935 0.776 11.761 1.00 3.69 O ATOM 646 CG2 THR A 43 5.235 0.832 12.460 1.00 4.50 C ATOM 647 H THR A 43 3.599 -1.799 10.799 1.00 3.26 H ATOM 648 HA THR A 43 4.530 -1.543 13.578 1.00 4.30 H ATOM 649 HB THR A 43 3.542 0.695 13.721 1.00 4.38 H ATOM 650 HG1 THR A 43 3.199 0.440 10.902 1.00 3.93 H ATOM 651 HG21 THR A 43 5.250 1.897 12.617 1.00 4.59 H ATOM 652 HG22 THR A 43 5.485 0.614 11.433 1.00 4.65 H ATOM 653 HG23 THR A 43 5.947 0.358 13.116 1.00 5.03 H ATOM 654 N THR A 44 2.052 -1.287 14.432 1.00 4.35 N ATOM 655 CA THR A 44 0.719 -1.586 14.911 1.00 4.63 C ATOM 656 C THR A 44 -0.297 -1.008 13.934 1.00 3.94 C ATOM 657 O THR A 44 -1.415 -1.506 13.812 1.00 4.00 O ATOM 658 CB THR A 44 0.470 -1.001 16.315 1.00 5.70 C ATOM 659 OG1 THR A 44 1.458 -1.488 17.231 1.00 6.41 O ATOM 660 CG2 THR A 44 -0.917 -1.370 16.820 1.00 6.27 C ATOM 661 H THR A 44 2.683 -0.821 15.020 1.00 4.85 H ATOM 662 HA THR A 44 0.603 -2.661 14.954 1.00 4.83 H ATOM 663 HB THR A 44 0.542 0.076 16.259 1.00 5.79 H ATOM 664 HG1 THR A 44 1.818 -0.753 17.734 1.00 6.77 H ATOM 665 HG21 THR A 44 -1.008 -2.446 16.871 1.00 6.56 H ATOM 666 HG22 THR A 44 -1.662 -0.978 16.144 1.00 6.28 H ATOM 667 HG23 THR A 44 -1.067 -0.949 17.804 1.00 6.71 H ATOM 668 N GLU A 45 0.109 0.057 13.236 1.00 3.59 N ATOM 669 CA GLU A 45 -0.755 0.690 12.248 1.00 3.30 C ATOM 670 C GLU A 45 -1.038 -0.296 11.122 1.00 2.69 C ATOM 671 O GLU A 45 -2.157 -0.387 10.617 1.00 2.95 O ATOM 672 CB GLU A 45 -0.086 1.946 11.678 1.00 3.58 C ATOM 673 CG GLU A 45 -1.038 2.864 10.925 1.00 3.98 C ATOM 674 CD GLU A 45 -1.641 2.208 9.697 1.00 4.30 C ATOM 675 OE1 GLU A 45 -0.922 2.068 8.685 1.00 4.58 O ATOM 676 OE2 GLU A 45 -2.832 1.837 9.747 1.00 4.71 O1- ATOM 677 H GLU A 45 1.020 0.416 13.379 1.00 3.80 H ATOM 678 HA GLU A 45 -1.684 0.961 12.729 1.00 3.74 H ATOM 679 HB2 GLU A 45 0.350 2.507 12.491 1.00 4.03 H ATOM 680 HB3 GLU A 45 0.699 1.644 11.001 1.00 3.62 H ATOM 681 HG2 GLU A 45 -1.840 3.151 11.589 1.00 4.26 H ATOM 682 HG3 GLU A 45 -0.496 3.745 10.615 1.00 4.34 H ATOM 683 N CYS A 46 0.000 -1.033 10.745 1.00 2.29 N ATOM 684 CA CYS A 46 -0.096 -2.021 9.681 1.00 2.34 C ATOM 685 C CYS A 46 -0.950 -3.214 10.110 1.00 2.72 C ATOM 686 O CYS A 46 -1.812 -3.674 9.359 1.00 3.24 O ATOM 687 CB CYS A 46 1.309 -2.491 9.303 1.00 2.42 C ATOM 688 SG CYS A 46 1.658 -2.456 7.519 1.00 2.25 S ATOM 689 H CYS A 46 0.860 -0.909 11.199 1.00 2.37 H ATOM 690 HA CYS A 46 -0.552 -1.550 8.825 1.00 2.70 H ATOM 691 HB2 CYS A 46 2.031 -1.854 9.788 1.00 2.68 H ATOM 692 HB3 CYS A 46 1.448 -3.507 9.646 1.00 3.02 H ATOM 693 N LEU A 47 -0.708 -3.708 11.321 1.00 2.97 N ATOM 694 CA LEU A 47 -1.457 -4.847 11.846 1.00 3.78 C ATOM 695 C LEU A 47 -2.905 -4.463 12.111 1.00 4.19 C ATOM 696 O LEU A 47 -3.826 -5.224 11.817 1.00 4.73 O ATOM 697 CB LEU A 47 -0.820 -5.372 13.135 1.00 4.40 C ATOM 698 CG LEU A 47 0.559 -6.012 12.972 1.00 4.55 C ATOM 699 CD1 LEU A 47 0.541 -7.047 11.857 1.00 4.85 C ATOM 700 CD2 LEU A 47 1.609 -4.947 12.700 1.00 5.05 C ATOM 701 H LEU A 47 -0.018 -3.292 11.878 1.00 2.90 H ATOM 702 HA LEU A 47 -1.436 -5.627 11.101 1.00 3.99 H ATOM 703 HB2 LEU A 47 -0.730 -4.547 13.827 1.00 4.40 H ATOM 704 HB3 LEU A 47 -1.483 -6.107 13.565 1.00 5.07 H ATOM 705 HG LEU A 47 0.825 -6.517 13.889 1.00 4.52 H ATOM 706 HD11 LEU A 47 1.512 -7.516 11.786 1.00 5.11 H ATOM 707 HD12 LEU A 47 0.307 -6.563 10.921 1.00 4.92 H ATOM 708 HD13 LEU A 47 -0.207 -7.795 12.073 1.00 5.14 H ATOM 709 HD21 LEU A 47 2.593 -5.390 12.751 1.00 5.32 H ATOM 710 HD22 LEU A 47 1.526 -4.166 13.441 1.00 5.03 H ATOM 711 HD23 LEU A 47 1.451 -4.530 11.717 1.00 5.58 H ATOM 712 N SER A 48 -3.097 -3.273 12.665 1.00 4.20 N ATOM 713 CA SER A 48 -4.434 -2.784 12.978 1.00 4.87 C ATOM 714 C SER A 48 -5.275 -2.671 11.716 1.00 4.81 C ATOM 715 O SER A 48 -6.468 -2.970 11.721 1.00 5.48 O ATOM 716 CB SER A 48 -4.355 -1.427 13.679 1.00 5.23 C ATOM 717 OG SER A 48 -5.648 -0.938 13.990 1.00 5.85 O ATOM 718 H SER A 48 -2.317 -2.712 12.871 1.00 3.94 H ATOM 719 HA SER A 48 -4.896 -3.495 13.635 1.00 5.46 H ATOM 720 HB2 SER A 48 -3.794 -1.531 14.596 1.00 5.43 H ATOM 721 HB3 SER A 48 -3.860 -0.718 13.033 1.00 5.16 H ATOM 722 HG SER A 48 -6.059 -1.510 14.644 1.00 5.84 H ATOM 723 N TRP A 49 -4.640 -2.247 10.637 1.00 4.23 N ATOM 724 CA TRP A 49 -5.323 -2.095 9.360 1.00 4.59 C ATOM 725 C TRP A 49 -5.713 -3.459 8.804 1.00 4.95 C ATOM 726 O TRP A 49 -6.810 -3.636 8.273 1.00 5.71 O ATOM 727 CB TRP A 49 -4.431 -1.357 8.360 1.00 4.34 C ATOM 728 CG TRP A 49 -5.112 -1.072 7.057 1.00 5.19 C ATOM 729 CD1 TRP A 49 -5.650 0.117 6.656 1.00 5.74 C ATOM 730 CD2 TRP A 49 -5.332 -1.996 5.985 1.00 5.86 C ATOM 731 NE1 TRP A 49 -6.190 -0.011 5.399 1.00 6.60 N ATOM 732 CE2 TRP A 49 -6.007 -1.299 4.966 1.00 6.66 C ATOM 733 CE3 TRP A 49 -5.022 -3.345 5.788 1.00 6.10 C ATOM 734 CZ2 TRP A 49 -6.378 -1.905 3.768 1.00 7.52 C ATOM 735 CZ3 TRP A 49 -5.391 -3.946 4.598 1.00 7.03 C ATOM 736 CH2 TRP A 49 -6.062 -3.225 3.602 1.00 7.67 C ATOM 737 H TRP A 49 -3.688 -2.038 10.703 1.00 3.75 H ATOM 738 HA TRP A 49 -6.219 -1.518 9.528 1.00 5.14 H ATOM 739 HB2 TRP A 49 -4.125 -0.414 8.789 1.00 4.15 H ATOM 740 HB3 TRP A 49 -3.555 -1.956 8.158 1.00 4.01 H ATOM 741 HD1 TRP A 49 -5.645 1.018 7.250 1.00 5.69 H ATOM 742 HE1 TRP A 49 -6.632 0.703 4.895 1.00 7.19 H ATOM 743 HE3 TRP A 49 -4.504 -3.916 6.545 1.00 5.73 H ATOM 744 HZ2 TRP A 49 -6.895 -1.364 2.990 1.00 8.18 H ATOM 745 HZ3 TRP A 49 -5.161 -4.987 4.429 1.00 7.41 H ATOM 746 HH2 TRP A 49 -6.331 -3.736 2.689 1.00 8.41 H ATOM 747 N ALA A 50 -4.805 -4.419 8.930 1.00 4.62 N ATOM 748 CA ALA A 50 -5.050 -5.772 8.452 1.00 5.25 C ATOM 749 C ALA A 50 -6.213 -6.409 9.204 1.00 5.86 C ATOM 750 O ALA A 50 -7.018 -7.136 8.621 1.00 6.61 O ATOM 751 CB ALA A 50 -3.794 -6.617 8.599 1.00 5.08 C ATOM 752 H ALA A 50 -3.947 -4.212 9.357 1.00 4.10 H ATOM 753 HA ALA A 50 -5.300 -5.717 7.402 1.00 5.66 H ATOM 754 HB1 ALA A 50 -3.966 -7.594 8.172 1.00 5.07 H ATOM 755 HB2 ALA A 50 -3.550 -6.721 9.647 1.00 5.38 H ATOM 756 HB3 ALA A 50 -2.975 -6.139 8.084 1.00 4.97 H ATOM 757 N LEU A 51 -6.295 -6.131 10.501 1.00 5.70 N ATOM 758 CA LEU A 51 -7.360 -6.678 11.333 1.00 6.44 C ATOM 759 C LEU A 51 -8.709 -6.083 10.958 1.00 6.99 C ATOM 760 O LEU A 51 -9.737 -6.759 11.010 1.00 7.73 O ATOM 761 CB LEU A 51 -7.068 -6.423 12.814 1.00 6.49 C ATOM 762 CG LEU A 51 -5.845 -7.156 13.369 1.00 6.39 C ATOM 763 CD1 LEU A 51 -5.634 -6.807 14.834 1.00 6.17 C ATOM 764 CD2 LEU A 51 -6.001 -8.659 13.194 1.00 6.43 C ATOM 765 H LEU A 51 -5.624 -5.543 10.908 1.00 5.21 H ATOM 766 HA LEU A 51 -7.395 -7.738 11.162 1.00 6.79 H ATOM 767 HB2 LEU A 51 -6.920 -5.361 12.951 1.00 6.16 H ATOM 768 HB3 LEU A 51 -7.932 -6.726 13.387 1.00 7.15 H ATOM 769 HG LEU A 51 -4.968 -6.843 12.822 1.00 6.78 H ATOM 770 HD11 LEU A 51 -6.505 -7.098 15.402 1.00 6.28 H ATOM 771 HD12 LEU A 51 -5.480 -5.742 14.932 1.00 6.13 H ATOM 772 HD13 LEU A 51 -4.768 -7.332 15.208 1.00 6.30 H ATOM 773 HD21 LEU A 51 -6.091 -8.891 12.143 1.00 6.34 H ATOM 774 HD22 LEU A 51 -6.887 -8.991 13.713 1.00 6.36 H ATOM 775 HD23 LEU A 51 -5.137 -9.160 13.601 1.00 6.89 H ATOM 776 N ASN A 52 -8.698 -4.813 10.580 1.00 6.71 N ATOM 777 CA ASN A 52 -9.924 -4.123 10.192 1.00 7.39 C ATOM 778 C ASN A 52 -10.435 -4.625 8.847 1.00 7.94 C ATOM 779 O ASN A 52 -11.637 -4.608 8.582 1.00 8.70 O ATOM 780 CB ASN A 52 -9.698 -2.610 10.135 1.00 7.10 C ATOM 781 CG ASN A 52 -9.656 -1.978 11.512 1.00 7.03 C ATOM 782 OD1 ASN A 52 -8.593 -1.850 12.120 1.00 7.08 O ATOM 783 ND2 ASN A 52 -10.818 -1.576 12.013 1.00 7.21 N ATOM 784 H ASN A 52 -7.846 -4.333 10.557 1.00 6.12 H ATOM 785 HA ASN A 52 -10.667 -4.336 10.940 1.00 7.86 H ATOM 786 HB2 ASN A 52 -8.759 -2.412 9.640 1.00 6.53 H ATOM 787 HB3 ASN A 52 -10.499 -2.154 9.573 1.00 7.65 H ATOM 788 HD21 ASN A 52 -11.625 -1.709 11.474 1.00 7.38 H ATOM 789 HD22 ASN A 52 -10.821 -1.163 12.902 1.00 7.32 H ATOM 790 N THR A 53 -9.514 -5.071 8.006 1.00 7.71 N ATOM 791 CA THR A 53 -9.869 -5.580 6.686 1.00 8.40 C ATOM 792 C THR A 53 -9.798 -7.105 6.636 1.00 8.70 C ATOM 793 O THR A 53 -10.114 -7.717 5.615 1.00 9.31 O ATOM 794 CB THR A 53 -8.941 -5.004 5.604 1.00 8.44 C ATOM 795 OG1 THR A 53 -7.619 -5.535 5.758 1.00 7.93 O ATOM 796 CG2 THR A 53 -8.893 -3.489 5.699 1.00 8.38 C ATOM 797 H THR A 53 -8.576 -5.060 8.279 1.00 7.14 H ATOM 798 HA THR A 53 -10.880 -5.269 6.466 1.00 8.87 H ATOM 799 HB THR A 53 -9.324 -5.279 4.632 1.00 9.09 H ATOM 800 HG1 THR A 53 -7.370 -5.511 6.684 1.00 7.55 H ATOM 801 HG21 THR A 53 -9.879 -3.086 5.523 1.00 8.62 H ATOM 802 HG22 THR A 53 -8.208 -3.103 4.960 1.00 8.11 H ATOM 803 HG23 THR A 53 -8.559 -3.204 6.686 1.00 8.59 H ATOM 804 N GLY A 54 -9.383 -7.713 7.743 1.00 8.39 N ATOM 805 CA GLY A 54 -9.288 -9.160 7.803 1.00 8.75 C ATOM 806 C GLY A 54 -8.270 -9.723 6.831 1.00 8.83 C ATOM 807 O GLY A 54 -8.443 -10.825 6.312 1.00 9.34 O ATOM 808 H GLY A 54 -9.134 -7.175 8.522 1.00 8.00 H ATOM 809 HA2 GLY A 54 -9.010 -9.450 8.805 1.00 8.62 H ATOM 810 HA3 GLY A 54 -10.256 -9.582 7.575 1.00 9.23 H ATOM 811 N GLN A 55 -7.203 -8.968 6.582 1.00 8.43 N ATOM 812 CA GLN A 55 -6.159 -9.407 5.663 1.00 8.55 C ATOM 813 C GLN A 55 -4.975 -10.002 6.419 1.00 7.96 C ATOM 814 O GLN A 55 -4.664 -9.582 7.534 1.00 7.58 O ATOM 815 CB GLN A 55 -5.689 -8.239 4.794 1.00 8.86 C ATOM 816 CG GLN A 55 -6.757 -7.722 3.842 1.00 9.52 C ATOM 817 CD GLN A 55 -7.315 -8.801 2.929 1.00 10.46 C ATOM 818 OE1 GLN A 55 -8.489 -8.765 2.558 1.00 10.94 O ATOM 819 NE2 GLN A 55 -6.478 -9.763 2.551 1.00 10.88 N ATOM 820 H GLN A 55 -7.115 -8.099 7.026 1.00 8.09 H ATOM 821 HA GLN A 55 -6.580 -10.171 5.025 1.00 8.99 H ATOM 822 HB2 GLN A 55 -5.389 -7.427 5.438 1.00 8.52 H ATOM 823 HB3 GLN A 55 -4.838 -8.557 4.210 1.00 9.05 H ATOM 824 HG2 GLN A 55 -7.569 -7.312 4.423 1.00 9.54 H ATOM 825 HG3 GLN A 55 -6.326 -6.942 3.231 1.00 9.47 H ATOM 826 HE21 GLN A 55 -5.554 -9.729 2.874 1.00 10.58 H ATOM 827 HE22 GLN A 55 -6.820 -10.468 1.963 1.00 11.56 H ATOM 828 N ASP A 56 -4.323 -10.986 5.809 1.00 7.99 N ATOM 829 CA ASP A 56 -3.172 -11.636 6.423 1.00 7.51 C ATOM 830 C ASP A 56 -1.922 -10.774 6.280 1.00 7.22 C ATOM 831 O ASP A 56 -1.769 -10.045 5.300 1.00 7.41 O ATOM 832 CB ASP A 56 -2.937 -13.008 5.788 1.00 7.78 C ATOM 833 CG ASP A 56 -4.126 -13.933 5.951 1.00 8.18 C ATOM 834 OD1 ASP A 56 -4.187 -14.649 6.973 1.00 8.69 O ATOM 835 OD2 ASP A 56 -4.999 -13.941 5.057 1.00 8.18 O1- ATOM 836 H ASP A 56 -4.624 -11.282 4.924 1.00 8.41 H ATOM 837 HA ASP A 56 -3.387 -11.768 7.473 1.00 7.30 H ATOM 838 HB2 ASP A 56 -2.745 -12.881 4.733 1.00 8.11 H ATOM 839 HB3 ASP A 56 -2.078 -13.470 6.253 1.00 7.49 H ATOM 840 N SER A 57 -1.032 -10.861 7.263 1.00 6.95 N ATOM 841 CA SER A 57 0.205 -10.088 7.243 1.00 6.82 C ATOM 842 C SER A 57 1.331 -10.841 7.945 1.00 6.34 C ATOM 843 O SER A 57 1.090 -11.620 8.867 1.00 6.22 O ATOM 844 CB SER A 57 -0.009 -8.729 7.912 1.00 7.25 C ATOM 845 OG SER A 57 -1.009 -7.982 7.241 1.00 7.82 O ATOM 846 H SER A 57 -1.210 -11.461 8.018 1.00 6.93 H ATOM 847 HA SER A 57 0.480 -9.931 6.212 1.00 6.95 H ATOM 848 HB2 SER A 57 -0.318 -8.878 8.936 1.00 7.17 H ATOM 849 HB3 SER A 57 0.915 -8.171 7.891 1.00 7.43 H ATOM 850 HG SER A 57 -0.872 -8.044 6.292 1.00 8.24 H ATOM 851 N GLY A 58 2.560 -10.602 7.500 1.00 6.22 N ATOM 852 CA GLY A 58 3.706 -11.264 8.096 1.00 5.88 C ATOM 853 C GLY A 58 4.980 -10.454 7.955 1.00 5.94 C ATOM 854 O GLY A 58 5.310 -9.650 8.826 1.00 5.81 O ATOM 855 H GLY A 58 2.691 -9.972 6.761 1.00 6.47 H ATOM 856 HA2 GLY A 58 3.509 -11.426 9.145 1.00 5.93 H ATOM 857 HA3 GLY A 58 3.845 -12.221 7.615 1.00 5.71 H ATOM 858 N VAL A 59 5.696 -10.667 6.856 1.00 6.39 N ATOM 859 CA VAL A 59 6.941 -9.951 6.604 1.00 6.72 C ATOM 860 C VAL A 59 6.684 -8.672 5.814 1.00 5.91 C ATOM 861 O VAL A 59 7.401 -7.681 5.966 1.00 6.11 O ATOM 862 CB VAL A 59 7.946 -10.827 5.832 1.00 7.80 C ATOM 863 CG1 VAL A 59 9.278 -10.108 5.676 1.00 8.32 C ATOM 864 CG2 VAL A 59 8.134 -12.165 6.531 1.00 8.69 C ATOM 865 H VAL A 59 5.380 -11.322 6.199 1.00 6.65 H ATOM 866 HA VAL A 59 7.376 -9.693 7.558 1.00 6.97 H ATOM 867 HB VAL A 59 7.547 -11.015 4.846 1.00 7.73 H ATOM 868 HG11 VAL A 59 9.127 -9.187 5.132 1.00 8.03 H ATOM 869 HG12 VAL A 59 9.966 -10.738 5.134 1.00 8.77 H ATOM 870 HG13 VAL A 59 9.684 -9.886 6.652 1.00 8.71 H ATOM 871 HG21 VAL A 59 7.187 -12.681 6.581 1.00 9.13 H ATOM 872 HG22 VAL A 59 8.507 -11.999 7.531 1.00 8.96 H ATOM 873 HG23 VAL A 59 8.842 -12.764 5.978 1.00 8.78 H ATOM 874 N TRP A 60 5.658 -8.699 4.970 1.00 5.23 N ATOM 875 CA TRP A 60 5.307 -7.541 4.155 1.00 4.68 C ATOM 876 C TRP A 60 4.264 -6.677 4.858 1.00 3.77 C ATOM 877 O TRP A 60 3.331 -7.192 5.473 1.00 3.70 O ATOM 878 CB TRP A 60 4.776 -7.992 2.793 1.00 5.13 C ATOM 879 CG TRP A 60 5.769 -8.788 2.003 1.00 6.01 C ATOM 880 CD1 TRP A 60 6.012 -10.128 2.102 1.00 6.56 C ATOM 881 CD2 TRP A 60 6.655 -8.293 0.992 1.00 6.74 C ATOM 882 NE1 TRP A 60 6.993 -10.497 1.214 1.00 7.52 N ATOM 883 CE2 TRP A 60 7.404 -9.389 0.521 1.00 7.62 C ATOM 884 CE3 TRP A 60 6.886 -7.031 0.438 1.00 6.96 C ATOM 885 CZ2 TRP A 60 8.367 -9.257 -0.476 1.00 8.57 C ATOM 886 CZ3 TRP A 60 7.842 -6.902 -0.552 1.00 7.95 C ATOM 887 CH2 TRP A 60 8.572 -8.011 -1.001 1.00 8.69 C ATOM 888 H TRP A 60 5.124 -9.516 4.893 1.00 5.30 H ATOM 889 HA TRP A 60 6.201 -6.956 4.007 1.00 4.97 H ATOM 890 HB2 TRP A 60 3.900 -8.606 2.941 1.00 5.28 H ATOM 891 HB3 TRP A 60 4.507 -7.122 2.214 1.00 5.04 H ATOM 892 HD1 TRP A 60 5.499 -10.790 2.785 1.00 6.44 H ATOM 893 HE1 TRP A 60 7.342 -11.404 1.097 1.00 8.16 H ATOM 894 HE3 TRP A 60 6.332 -6.165 0.771 1.00 6.54 H ATOM 895 HZ2 TRP A 60 8.938 -10.101 -0.834 1.00 9.31 H ATOM 896 HZ3 TRP A 60 8.035 -5.935 -0.991 1.00 8.30 H ATOM 897 HH2 TRP A 60 9.310 -7.864 -1.776 1.00 9.49 H ATOM 898 N GLY A 61 4.430 -5.362 4.763 1.00 3.53 N ATOM 899 CA GLY A 61 3.495 -4.450 5.394 1.00 3.00 C ATOM 900 C GLY A 61 2.130 -4.473 4.736 1.00 2.29 C ATOM 901 O GLY A 61 2.016 -4.302 3.523 1.00 2.56 O ATOM 902 H GLY A 61 5.194 -5.008 4.261 1.00 4.04 H ATOM 903 HA2 GLY A 61 3.388 -4.725 6.433 1.00 3.57 H ATOM 904 HA3 GLY A 61 3.894 -3.448 5.338 1.00 3.02 H ATOM 905 N GLY A 62 1.092 -4.687 5.541 1.00 2.03 N ATOM 906 CA GLY A 62 -0.265 -4.727 5.020 1.00 1.67 C ATOM 907 C GLY A 62 -0.562 -3.595 4.051 1.00 1.78 C ATOM 908 O GLY A 62 -0.241 -2.437 4.317 1.00 2.57 O ATOM 909 H GLY A 62 1.249 -4.828 6.497 1.00 2.54 H ATOM 910 HA2 GLY A 62 -0.414 -5.667 4.511 1.00 2.07 H ATOM 911 HA3 GLY A 62 -0.956 -4.666 5.847 1.00 1.72 H ATOM 912 N MET A 63 -1.176 -3.940 2.926 1.00 1.47 N ATOM 913 CA MET A 63 -1.522 -2.959 1.902 1.00 1.74 C ATOM 914 C MET A 63 -3.024 -2.925 1.653 1.00 1.64 C ATOM 915 O MET A 63 -3.759 -3.817 2.076 1.00 1.80 O ATOM 916 CB MET A 63 -0.798 -3.274 0.596 1.00 2.36 C ATOM 917 CG MET A 63 0.509 -2.527 0.433 1.00 3.35 C ATOM 918 SD MET A 63 1.435 -3.070 -1.014 1.00 4.59 S ATOM 919 CE MET A 63 1.441 -4.844 -0.762 1.00 5.21 C ATOM 920 H MET A 63 -1.405 -4.881 2.778 1.00 1.51 H ATOM 921 HA MET A 63 -1.206 -1.988 2.253 1.00 2.32 H ATOM 922 HB2 MET A 63 -0.592 -4.332 0.559 1.00 2.61 H ATOM 923 HB3 MET A 63 -1.442 -3.012 -0.232 1.00 2.66 H ATOM 924 HG2 MET A 63 0.290 -1.474 0.330 1.00 3.45 H ATOM 925 HG3 MET A 63 1.113 -2.685 1.313 1.00 3.72 H ATOM 926 HE1 MET A 63 2.077 -5.311 -1.499 1.00 5.52 H ATOM 927 HE2 MET A 63 0.435 -5.225 -0.863 1.00 5.43 H ATOM 928 HE3 MET A 63 1.814 -5.066 0.227 1.00 5.49 H ATOM 929 N SER A 64 -3.468 -1.884 0.960 1.00 2.06 N ATOM 930 CA SER A 64 -4.872 -1.715 0.642 1.00 2.41 C ATOM 931 C SER A 64 -5.251 -2.520 -0.592 1.00 2.12 C ATOM 932 O SER A 64 -4.393 -2.970 -1.356 1.00 1.74 O ATOM 933 CB SER A 64 -5.194 -0.236 0.423 1.00 3.08 C ATOM 934 OG SER A 64 -4.488 0.280 -0.691 1.00 3.03 O ATOM 935 H SER A 64 -2.830 -1.219 0.643 1.00 2.41 H ATOM 936 HA SER A 64 -5.445 -2.076 1.481 1.00 2.70 H ATOM 937 HB2 SER A 64 -6.253 -0.124 0.244 1.00 3.42 H ATOM 938 HB3 SER A 64 -4.916 0.325 1.302 1.00 3.48 H ATOM 939 HG SER A 64 -4.995 0.990 -1.092 1.00 3.24 H ATOM 940 N GLU A 65 -6.547 -2.685 -0.779 1.00 2.58 N ATOM 941 CA GLU A 65 -7.075 -3.429 -1.916 1.00 2.63 C ATOM 942 C GLU A 65 -6.713 -2.737 -3.225 1.00 2.32 C ATOM 943 O GLU A 65 -6.482 -3.391 -4.242 1.00 2.22 O ATOM 944 CB GLU A 65 -8.594 -3.568 -1.802 1.00 3.25 C ATOM 945 CG GLU A 65 -9.046 -4.290 -0.543 1.00 3.84 C ATOM 946 CD GLU A 65 -8.498 -5.701 -0.453 1.00 4.32 C ATOM 947 OE1 GLU A 65 -7.395 -5.875 0.106 1.00 4.57 O ATOM 948 OE2 GLU A 65 -9.173 -6.633 -0.940 1.00 4.81 O1- ATOM 949 H GLU A 65 -7.165 -2.290 -0.135 1.00 3.00 H ATOM 950 HA GLU A 65 -6.630 -4.412 -1.906 1.00 2.59 H ATOM 951 HB2 GLU A 65 -9.036 -2.582 -1.803 1.00 3.48 H ATOM 952 HB3 GLU A 65 -8.959 -4.118 -2.657 1.00 3.51 H ATOM 953 HG2 GLU A 65 -8.707 -3.733 0.317 1.00 4.01 H ATOM 954 HG3 GLU A 65 -10.125 -4.337 -0.538 1.00 4.30 H ATOM 955 N ASP A 66 -6.664 -1.410 -3.190 1.00 2.33 N ATOM 956 CA ASP A 66 -6.325 -0.627 -4.371 1.00 2.18 C ATOM 957 C ASP A 66 -4.912 -0.953 -4.830 1.00 1.80 C ATOM 958 O ASP A 66 -4.634 -1.057 -6.025 1.00 1.73 O ATOM 959 CB ASP A 66 -6.444 0.867 -4.068 1.00 2.47 C ATOM 960 CG ASP A 66 -7.859 1.273 -3.712 1.00 2.95 C ATOM 961 OD1 ASP A 66 -8.155 1.398 -2.504 1.00 3.41 O ATOM 962 OD2 ASP A 66 -8.672 1.465 -4.637 1.00 3.23 O1- ATOM 963 H ASP A 66 -6.862 -0.945 -2.349 1.00 2.53 H ATOM 964 HA ASP A 66 -7.013 -0.888 -5.152 1.00 2.29 H ATOM 965 HB2 ASP A 66 -5.799 1.113 -3.238 1.00 2.45 H ATOM 966 HB3 ASP A 66 -6.134 1.430 -4.937 1.00 2.45 H ATOM 967 N GLU A 67 -4.030 -1.117 -3.859 1.00 1.65 N ATOM 968 CA GLU A 67 -2.636 -1.439 -4.127 1.00 1.46 C ATOM 969 C GLU A 67 -2.518 -2.836 -4.719 1.00 1.50 C ATOM 970 O GLU A 67 -1.707 -3.077 -5.614 1.00 1.58 O ATOM 971 CB GLU A 67 -1.816 -1.334 -2.841 1.00 1.46 C ATOM 972 CG GLU A 67 -1.822 0.063 -2.244 1.00 1.92 C ATOM 973 CD GLU A 67 -1.200 0.120 -0.863 1.00 2.66 C ATOM 974 OE1 GLU A 67 -1.949 0.019 0.130 1.00 3.17 O ATOM 975 OE2 GLU A 67 0.036 0.273 -0.772 1.00 3.32 O1- ATOM 976 H GLU A 67 -4.329 -1.023 -2.932 1.00 1.78 H ATOM 977 HA GLU A 67 -2.262 -0.723 -4.844 1.00 1.52 H ATOM 978 HB2 GLU A 67 -2.222 -2.018 -2.110 1.00 1.75 H ATOM 979 HB3 GLU A 67 -0.794 -1.607 -3.054 1.00 1.55 H ATOM 980 HG2 GLU A 67 -1.268 0.720 -2.897 1.00 2.31 H ATOM 981 HG3 GLU A 67 -2.843 0.407 -2.177 1.00 2.22 H ATOM 982 N ARG A 68 -3.331 -3.757 -4.213 1.00 1.69 N ATOM 983 CA ARG A 68 -3.321 -5.131 -4.701 1.00 1.98 C ATOM 984 C ARG A 68 -3.703 -5.181 -6.178 1.00 2.02 C ATOM 985 O ARG A 68 -3.073 -5.882 -6.969 1.00 2.19 O ATOM 986 CB ARG A 68 -4.285 -5.993 -3.883 1.00 2.33 C ATOM 987 CG ARG A 68 -3.934 -6.064 -2.406 1.00 2.67 C ATOM 988 CD ARG A 68 -2.575 -6.708 -2.185 1.00 3.03 C ATOM 989 NE ARG A 68 -2.220 -6.764 -0.770 1.00 3.92 N ATOM 990 CZ ARG A 68 -1.064 -7.244 -0.314 1.00 4.62 C ATOM 991 NH1 ARG A 68 -0.153 -7.711 -1.157 1.00 4.63 N1+ ATOM 992 NH2 ARG A 68 -0.820 -7.256 0.990 1.00 5.64 N ATOM 993 H ARG A 68 -3.951 -3.508 -3.495 1.00 1.75 H ATOM 994 HA ARG A 68 -2.319 -5.517 -4.586 1.00 2.04 H ATOM 995 HB2 ARG A 68 -5.281 -5.585 -3.976 1.00 2.68 H ATOM 996 HB3 ARG A 68 -4.278 -6.996 -4.281 1.00 2.54 H ATOM 997 HG2 ARG A 68 -3.917 -5.064 -2.000 1.00 2.97 H ATOM 998 HG3 ARG A 68 -4.687 -6.648 -1.895 1.00 3.03 H ATOM 999 HD2 ARG A 68 -2.599 -7.713 -2.580 1.00 3.05 H ATOM 1000 HD3 ARG A 68 -1.829 -6.133 -2.713 1.00 3.20 H ATOM 1001 HE ARG A 68 -2.875 -6.426 -0.125 1.00 4.30 H ATOM 1002 HH11 ARG A 68 -0.331 -7.705 -2.141 1.00 4.12 H ATOM 1003 HH12 ARG A 68 0.713 -8.070 -0.808 1.00 5.37 H ATOM 1004 HH21 ARG A 68 -1.505 -6.905 1.630 1.00 5.92 H ATOM 1005 HH22 ARG A 68 0.047 -7.616 1.332 1.00 6.27 H ATOM 1006 N ARG A 69 -4.737 -4.427 -6.544 1.00 1.95 N ATOM 1007 CA ARG A 69 -5.206 -4.387 -7.926 1.00 2.02 C ATOM 1008 C ARG A 69 -4.144 -3.800 -8.852 1.00 1.88 C ATOM 1009 O ARG A 69 -3.925 -4.299 -9.956 1.00 2.03 O ATOM 1010 CB ARG A 69 -6.493 -3.567 -8.025 1.00 2.06 C ATOM 1011 CG ARG A 69 -7.638 -4.128 -7.199 1.00 2.39 C ATOM 1012 CD ARG A 69 -8.014 -5.531 -7.646 1.00 2.79 C ATOM 1013 NE ARG A 69 -9.111 -6.083 -6.856 1.00 3.21 N ATOM 1014 CZ ARG A 69 -9.630 -7.294 -7.052 1.00 3.74 C ATOM 1015 NH1 ARG A 69 -9.153 -8.081 -8.008 1.00 3.98 N1+ ATOM 1016 NH2 ARG A 69 -10.627 -7.719 -6.288 1.00 4.43 N ATOM 1017 H ARG A 69 -5.194 -3.885 -5.868 1.00 1.91 H ATOM 1018 HA ARG A 69 -5.412 -5.401 -8.234 1.00 2.22 H ATOM 1019 HB2 ARG A 69 -6.292 -2.561 -7.686 1.00 2.55 H ATOM 1020 HB3 ARG A 69 -6.805 -3.533 -9.058 1.00 1.98 H ATOM 1021 HG2 ARG A 69 -7.338 -4.161 -6.162 1.00 2.61 H ATOM 1022 HG3 ARG A 69 -8.497 -3.483 -7.307 1.00 2.95 H ATOM 1023 HD2 ARG A 69 -8.312 -5.496 -8.684 1.00 3.26 H ATOM 1024 HD3 ARG A 69 -7.150 -6.171 -7.543 1.00 2.99 H ATOM 1025 HE ARG A 69 -9.482 -5.523 -6.143 1.00 3.45 H ATOM 1026 HH11 ARG A 69 -8.401 -7.766 -8.588 1.00 3.83 H ATOM 1027 HH12 ARG A 69 -9.547 -8.989 -8.150 1.00 4.57 H ATOM 1028 HH21 ARG A 69 -10.989 -7.130 -5.565 1.00 4.65 H ATOM 1029 HH22 ARG A 69 -11.016 -8.628 -6.435 1.00 4.93 H ATOM 1030 N ALA A 70 -3.487 -2.739 -8.394 1.00 1.68 N ATOM 1031 CA ALA A 70 -2.449 -2.082 -9.181 1.00 1.64 C ATOM 1032 C ALA A 70 -1.305 -3.042 -9.495 1.00 1.79 C ATOM 1033 O ALA A 70 -0.807 -3.102 -10.622 1.00 1.95 O ATOM 1034 CB ALA A 70 -1.923 -0.879 -8.424 1.00 1.49 C ATOM 1035 H ALA A 70 -3.706 -2.389 -7.505 1.00 1.60 H ATOM 1036 HA ALA A 70 -2.886 -1.733 -10.102 1.00 1.71 H ATOM 1037 HB1 ALA A 70 -1.321 -0.271 -9.083 1.00 1.59 H ATOM 1038 HB2 ALA A 70 -1.321 -1.216 -7.593 1.00 1.97 H ATOM 1039 HB3 ALA A 70 -2.753 -0.300 -8.054 1.00 1.73 H ATOM 1040 N LEU A 71 -0.918 -3.807 -8.488 1.00 1.82 N ATOM 1041 CA LEU A 71 0.169 -4.772 -8.619 1.00 2.05 C ATOM 1042 C LEU A 71 -0.240 -5.926 -9.530 1.00 2.34 C ATOM 1043 O LEU A 71 0.508 -6.319 -10.426 1.00 2.55 O ATOM 1044 CB LEU A 71 0.562 -5.306 -7.238 1.00 2.08 C ATOM 1045 CG LEU A 71 1.845 -6.143 -7.190 1.00 2.34 C ATOM 1046 CD1 LEU A 71 1.628 -7.505 -7.835 1.00 3.12 C ATOM 1047 CD2 LEU A 71 2.987 -5.406 -7.872 1.00 2.12 C ATOM 1048 H LEU A 71 -1.380 -3.719 -7.632 1.00 1.73 H ATOM 1049 HA LEU A 71 1.019 -4.263 -9.053 1.00 2.07 H ATOM 1050 HB2 LEU A 71 0.684 -4.464 -6.575 1.00 2.01 H ATOM 1051 HB3 LEU A 71 -0.251 -5.916 -6.869 1.00 2.21 H ATOM 1052 HG LEU A 71 2.120 -6.305 -6.159 1.00 2.70 H ATOM 1053 HD11 LEU A 71 2.414 -8.177 -7.525 1.00 3.26 H ATOM 1054 HD12 LEU A 71 1.649 -7.402 -8.909 1.00 3.61 H ATOM 1055 HD13 LEU A 71 0.672 -7.902 -7.528 1.00 3.60 H ATOM 1056 HD21 LEU A 71 3.890 -5.996 -7.802 1.00 2.52 H ATOM 1057 HD22 LEU A 71 3.142 -4.454 -7.386 1.00 2.42 H ATOM 1058 HD23 LEU A 71 2.743 -5.244 -8.911 1.00 2.10 H ATOM 1059 N LYS A 72 -1.437 -6.456 -9.302 1.00 2.40 N ATOM 1060 CA LYS A 72 -1.945 -7.563 -10.103 1.00 2.71 C ATOM 1061 C LYS A 72 -2.105 -7.149 -11.558 1.00 2.70 C ATOM 1062 O LYS A 72 -1.958 -7.965 -12.467 1.00 2.97 O ATOM 1063 CB LYS A 72 -3.279 -8.065 -9.546 1.00 2.82 C ATOM 1064 CG LYS A 72 -3.133 -9.211 -8.556 1.00 2.97 C ATOM 1065 CD LYS A 72 -2.244 -8.829 -7.384 1.00 3.44 C ATOM 1066 CE LYS A 72 -2.007 -10.011 -6.457 1.00 4.03 C ATOM 1067 NZ LYS A 72 -1.138 -9.649 -5.304 1.00 5.17 N1+ ATOM 1068 H LYS A 72 -1.992 -6.094 -8.580 1.00 2.26 H ATOM 1069 HA LYS A 72 -1.223 -8.359 -10.052 1.00 2.93 H ATOM 1070 HB2 LYS A 72 -3.777 -7.247 -9.046 1.00 3.01 H ATOM 1071 HB3 LYS A 72 -3.894 -8.403 -10.366 1.00 3.18 H ATOM 1072 HG2 LYS A 72 -4.110 -9.475 -8.180 1.00 3.19 H ATOM 1073 HG3 LYS A 72 -2.699 -10.059 -9.064 1.00 3.23 H ATOM 1074 HD2 LYS A 72 -1.293 -8.486 -7.762 1.00 3.70 H ATOM 1075 HD3 LYS A 72 -2.719 -8.037 -6.826 1.00 3.72 H ATOM 1076 HE2 LYS A 72 -2.961 -10.355 -6.084 1.00 4.09 H ATOM 1077 HE3 LYS A 72 -1.535 -10.803 -7.019 1.00 4.06 H ATOM 1078 HZ1 LYS A 72 -0.212 -9.320 -5.644 1.00 5.39 H ATOM 1079 HZ2 LYS A 72 -0.996 -10.475 -4.690 1.00 5.59 H ATOM 1080 HZ3 LYS A 72 -1.581 -8.890 -4.748 1.00 5.68 H ATOM 1081 N ARG A 73 -2.406 -5.877 -11.770 1.00 2.43 N ATOM 1082 CA ARG A 73 -2.576 -5.353 -13.118 1.00 2.46 C ATOM 1083 C ARG A 73 -1.230 -5.280 -13.827 1.00 2.55 C ATOM 1084 O ARG A 73 -1.143 -5.482 -15.039 1.00 2.75 O ATOM 1085 CB ARG A 73 -3.229 -3.970 -13.086 1.00 2.26 C ATOM 1086 CG ARG A 73 -3.630 -3.462 -14.462 1.00 2.46 C ATOM 1087 CD ARG A 73 -4.336 -2.118 -14.380 1.00 2.75 C ATOM 1088 NE ARG A 73 -5.496 -2.160 -13.492 1.00 2.78 N ATOM 1089 CZ ARG A 73 -6.724 -2.491 -13.887 1.00 3.40 C ATOM 1090 NH1 ARG A 73 -6.957 -2.831 -15.149 1.00 3.94 N1+ ATOM 1091 NH2 ARG A 73 -7.722 -2.490 -13.014 1.00 3.93 N ATOM 1092 H ARG A 73 -2.511 -5.279 -11.003 1.00 2.25 H ATOM 1093 HA ARG A 73 -3.217 -6.034 -13.658 1.00 2.64 H ATOM 1094 HB2 ARG A 73 -4.116 -4.018 -12.469 1.00 2.28 H ATOM 1095 HB3 ARG A 73 -2.536 -3.265 -12.652 1.00 2.37 H ATOM 1096 HG2 ARG A 73 -2.743 -3.353 -15.067 1.00 2.77 H ATOM 1097 HG3 ARG A 73 -4.295 -4.179 -14.920 1.00 2.86 H ATOM 1098 HD2 ARG A 73 -3.637 -1.383 -14.008 1.00 3.46 H ATOM 1099 HD3 ARG A 73 -4.660 -1.834 -15.370 1.00 2.95 H ATOM 1100 HE ARG A 73 -5.354 -1.925 -12.552 1.00 2.78 H ATOM 1101 HH11 ARG A 73 -6.210 -2.840 -15.812 1.00 3.97 H ATOM 1102 HH12 ARG A 73 -7.883 -3.078 -15.437 1.00 4.57 H ATOM 1103 HH21 ARG A 73 -7.552 -2.241 -12.061 1.00 3.97 H ATOM 1104 HH22 ARG A 73 -8.644 -2.739 -13.309 1.00 4.53 H ATOM 1105 N ARG A 74 -0.179 -4.991 -13.063 1.00 2.47 N ATOM 1106 CA ARG A 74 1.167 -4.905 -13.622 1.00 2.62 C ATOM 1107 C ARG A 74 1.650 -6.279 -14.074 1.00 2.91 C ATOM 1108 O ARG A 74 2.239 -6.420 -15.145 1.00 3.11 O ATOM 1109 CB ARG A 74 2.140 -4.328 -12.594 1.00 2.56 C ATOM 1110 CG ARG A 74 1.925 -2.850 -12.316 1.00 2.63 C ATOM 1111 CD ARG A 74 2.928 -2.322 -11.304 1.00 3.24 C ATOM 1112 NE ARG A 74 4.305 -2.457 -11.774 1.00 3.74 N ATOM 1113 CZ ARG A 74 5.068 -3.525 -11.550 1.00 4.48 C ATOM 1114 NH1 ARG A 74 4.588 -4.568 -10.882 1.00 4.89 N1+ ATOM 1115 NH2 ARG A 74 6.315 -3.555 -12.002 1.00 5.14 N ATOM 1116 H ARG A 74 -0.311 -4.831 -12.106 1.00 2.33 H ATOM 1117 HA ARG A 74 1.129 -4.250 -14.479 1.00 2.66 H ATOM 1118 HB2 ARG A 74 2.026 -4.867 -11.665 1.00 2.63 H ATOM 1119 HB3 ARG A 74 3.149 -4.461 -12.955 1.00 2.72 H ATOM 1120 HG2 ARG A 74 2.036 -2.301 -13.239 1.00 2.79 H ATOM 1121 HG3 ARG A 74 0.928 -2.708 -11.929 1.00 2.69 H ATOM 1122 HD2 ARG A 74 2.721 -1.276 -11.127 1.00 3.75 H ATOM 1123 HD3 ARG A 74 2.815 -2.870 -10.381 1.00 3.39 H ATOM 1124 HE ARG A 74 4.685 -1.708 -12.281 1.00 3.82 H ATOM 1125 HH11 ARG A 74 3.648 -4.557 -10.544 1.00 4.72 H ATOM 1126 HH12 ARG A 74 5.169 -5.366 -10.718 1.00 5.59 H ATOM 1127 HH21 ARG A 74 6.681 -2.775 -12.510 1.00 5.21 H ATOM 1128 HH22 ARG A 74 6.888 -4.356 -11.834 1.00 5.75 H ATOM 1129 N ASN A 75 1.396 -7.290 -13.249 1.00 2.97 N ATOM 1130 CA ASN A 75 1.804 -8.654 -13.564 1.00 3.31 C ATOM 1131 C ASN A 75 0.944 -9.232 -14.682 1.00 3.49 C ATOM 1132 O ASN A 75 1.417 -10.028 -15.494 1.00 3.76 O ATOM 1133 CB ASN A 75 1.704 -9.540 -12.319 1.00 3.37 C ATOM 1134 CG ASN A 75 2.662 -9.123 -11.216 1.00 3.32 C ATOM 1135 OD1 ASN A 75 2.333 -9.213 -10.032 1.00 3.40 O ATOM 1136 ND2 ASN A 75 3.856 -8.676 -11.591 1.00 3.55 N ATOM 1137 H ASN A 75 0.922 -7.115 -12.409 1.00 2.83 H ATOM 1138 HA ASN A 75 2.831 -8.625 -13.896 1.00 3.43 H ATOM 1139 HB2 ASN A 75 0.698 -9.491 -11.932 1.00 3.25 H ATOM 1140 HB3 ASN A 75 1.927 -10.561 -12.595 1.00 3.63 H ATOM 1141 HD21 ASN A 75 4.059 -8.639 -12.547 1.00 3.91 H ATOM 1142 HD22 ASN A 75 4.486 -8.401 -10.893 1.00 3.55 H ATOM 1143 N ALA A 76 -0.320 -8.827 -14.718 1.00 3.38 N ATOM 1144 CA ALA A 76 -1.247 -9.305 -15.738 1.00 3.59 C ATOM 1145 C ALA A 76 -1.242 -8.389 -16.957 1.00 4.38 C ATOM 1146 O ALA A 76 -1.224 -8.855 -18.096 1.00 4.92 O ATOM 1147 CB ALA A 76 -2.651 -9.414 -15.164 1.00 3.28 C ATOM 1148 H ALA A 76 -0.639 -8.191 -14.044 1.00 3.18 H ATOM 1149 HA ALA A 76 -0.930 -10.291 -16.040 1.00 3.75 H ATOM 1150 HB1 ALA A 76 -2.639 -10.065 -14.302 1.00 3.40 H ATOM 1151 HB2 ALA A 76 -3.316 -9.821 -15.912 1.00 3.34 H ATOM 1152 HB3 ALA A 76 -2.998 -8.434 -14.869 1.00 3.51 H TER 1153 ALA A 76 HETATM 1154 FE1 SF4 A 101 4.478 1.150 6.426 1.00 10.77 FE HETATM 1155 FE2 SF4 A 101 2.335 -0.484 6.747 1.00 10.52 FE HETATM 1156 FE3 SF4 A 101 1.952 2.197 6.588 1.00 10.25 FE HETATM 1157 FE4 SF4 A 101 2.806 0.778 4.309 1.00 11.02 FE HETATM 1158 S1 SF4 A 101 0.845 0.612 5.380 1.00 10.48 S HETATM 1159 S2 SF4 A 101 3.507 2.775 5.088 1.00 10.90 S HETATM 1160 S3 SF4 A 101 4.047 -0.782 5.306 1.00 9.67 S HETATM 1161 S4 SF4 A 101 3.087 1.106 8.204 1.00 9.54 S