ATOM 1 N LYS A 1 8.399 1.928 5.714 1.00 0.00 N ATOM 2 CA LYS A 1 6.998 2.296 6.054 1.00 0.00 C ATOM 3 C LYS A 1 6.384 3.184 4.969 1.00 0.00 C ATOM 4 O LYS A 1 5.261 2.936 4.522 1.00 0.00 O ATOM 5 CB LYS A 1 6.950 3.011 7.413 1.00 0.00 C ATOM 6 CG LYS A 1 7.186 2.091 8.601 1.00 0.00 C ATOM 7 CD LYS A 1 7.118 2.851 9.916 1.00 0.00 C ATOM 8 CE LYS A 1 7.348 1.930 11.104 1.00 0.00 C ATOM 9 NZ LYS A 1 7.281 2.665 12.397 1.00 0.00 N1+ ATOM 10 H1 LYS A 1 8.423 1.407 4.813 1.00 0.00 H ATOM 11 H2 LYS A 1 8.803 1.326 6.460 1.00 0.00 H ATOM 12 H3 LYS A 1 8.982 2.784 5.622 1.00 0.00 H ATOM 13 HA LYS A 1 6.420 1.385 6.118 1.00 0.00 H ATOM 14 HB2 LYS A 1 7.707 3.781 7.427 1.00 0.00 H ATOM 15 HB3 LYS A 1 5.980 3.471 7.529 1.00 0.00 H ATOM 16 HG2 LYS A 1 6.430 1.320 8.604 1.00 0.00 H ATOM 17 HG3 LYS A 1 8.163 1.639 8.506 1.00 0.00 H ATOM 18 HD2 LYS A 1 7.877 3.619 9.916 1.00 0.00 H ATOM 19 HD3 LYS A 1 6.143 3.305 10.008 1.00 0.00 H ATOM 20 HE2 LYS A 1 6.592 1.160 11.098 1.00 0.00 H ATOM 21 HE3 LYS A 1 8.324 1.477 11.007 1.00 0.00 H ATOM 22 HZ1 LYS A 1 7.443 2.011 13.189 1.00 0.00 H ATOM 23 HZ2 LYS A 1 6.345 3.104 12.511 1.00 0.00 H ATOM 24 HZ3 LYS A 1 8.006 3.411 12.423 1.00 0.00 H ATOM 25 N TYR A 2 7.139 4.210 4.544 1.00 0.00 N ATOM 26 CA TYR A 2 6.692 5.152 3.507 1.00 0.00 C ATOM 27 C TYR A 2 6.902 4.561 2.099 1.00 0.00 C ATOM 28 O TYR A 2 7.814 3.746 1.927 1.00 0.00 O ATOM 29 CB TYR A 2 7.461 6.473 3.640 1.00 0.00 C ATOM 30 CG TYR A 2 7.082 7.281 4.862 1.00 0.00 C ATOM 31 CD1 TYR A 2 6.062 8.222 4.807 1.00 0.00 C ATOM 32 CD2 TYR A 2 7.746 7.102 6.069 1.00 0.00 C ATOM 33 CE1 TYR A 2 5.713 8.962 5.921 1.00 0.00 C ATOM 34 CE2 TYR A 2 7.403 7.838 7.187 1.00 0.00 C ATOM 35 CZ TYR A 2 6.387 8.766 7.108 1.00 0.00 C ATOM 36 OH TYR A 2 6.042 9.501 8.219 1.00 0.00 O ATOM 37 H TYR A 2 8.026 4.336 4.942 1.00 0.00 H ATOM 38 HA TYR A 2 5.640 5.338 3.659 1.00 0.00 H ATOM 39 HB2 TYR A 2 8.518 6.258 3.703 1.00 0.00 H ATOM 40 HB3 TYR A 2 7.277 7.081 2.767 1.00 0.00 H ATOM 41 HD1 TYR A 2 5.536 8.373 3.876 1.00 0.00 H ATOM 42 HD2 TYR A 2 8.542 6.375 6.128 1.00 0.00 H ATOM 43 HE1 TYR A 2 4.917 9.689 5.858 1.00 0.00 H ATOM 44 HE2 TYR A 2 7.931 7.685 8.117 1.00 0.00 H ATOM 45 HH TYR A 2 5.086 9.520 8.308 1.00 0.00 H HETATM 46 N MAA A 3 6.057 4.938 1.057 1.00 0.00 N HETATM 47 CM MAA A 3 4.932 5.880 1.305 1.00 0.00 C HETATM 48 CA MAA A 3 6.206 4.406 -0.335 1.00 0.00 C HETATM 49 CB MAA A 3 7.627 4.550 -0.851 1.00 0.00 C HETATM 50 C MAA A 3 5.854 2.939 -0.419 1.00 0.00 C HETATM 51 O MAA A 3 6.014 2.180 0.538 1.00 0.00 O HETATM 52 HM1 MAA A 3 4.522 6.213 0.365 1.00 0.00 H HETATM 53 HM2 MAA A 3 5.289 6.734 1.860 1.00 0.00 H HETATM 54 HM3 MAA A 3 4.163 5.379 1.872 1.00 0.00 H HETATM 55 HA MAA A 3 5.551 4.935 -1.039 1.00 0.00 H HETATM 56 HB1 MAA A 3 8.311 4.582 -0.019 1.00 0.00 H HETATM 57 HB2 MAA A 3 7.715 5.451 -1.436 1.00 0.00 H HETATM 58 HB3 MAA A 3 7.848 3.685 -1.466 1.00 0.00 H ATOM 59 N CYS A 4 5.431 2.563 -1.611 1.00 0.00 N ATOM 60 CA CYS A 4 5.039 1.213 -1.933 1.00 0.00 C ATOM 61 C CYS A 4 6.221 0.280 -2.128 1.00 0.00 C ATOM 62 O CYS A 4 7.255 0.655 -2.687 1.00 0.00 O ATOM 63 CB CYS A 4 4.178 1.266 -3.153 1.00 0.00 C ATOM 64 SG CYS A 4 3.929 -0.319 -3.917 1.00 0.00 S ATOM 65 H CYS A 4 5.376 3.240 -2.316 1.00 0.00 H ATOM 66 HA CYS A 4 4.459 0.805 -1.128 1.00 0.00 H ATOM 67 HB2 CYS A 4 3.208 1.652 -2.880 1.00 0.00 H ATOM 68 HB3 CYS A 4 4.633 1.916 -3.879 1.00 0.00 H ATOM 69 N PRO A 5 6.043 -0.966 -1.647 1.00 0.00 N ATOM 70 CA PRO A 5 7.069 -2.013 -1.694 1.00 0.00 C ATOM 71 C PRO A 5 7.065 -2.928 -2.931 1.00 0.00 C ATOM 72 O PRO A 5 8.085 -3.561 -3.220 1.00 0.00 O ATOM 73 CB PRO A 5 6.656 -2.799 -0.461 1.00 0.00 C ATOM 74 CG PRO A 5 5.178 -2.854 -0.592 1.00 0.00 C ATOM 75 CD PRO A 5 4.813 -1.455 -0.940 1.00 0.00 C ATOM 76 HA PRO A 5 8.051 -1.611 -1.550 1.00 0.00 H ATOM 77 HB2 PRO A 5 7.101 -3.782 -0.462 1.00 0.00 H ATOM 78 HB3 PRO A 5 6.917 -2.246 0.425 1.00 0.00 H ATOM 79 HG2 PRO A 5 4.905 -3.518 -1.403 1.00 0.00 H ATOM 80 HG3 PRO A 5 4.716 -3.147 0.334 1.00 0.00 H ATOM 81 HD2 PRO A 5 3.951 -1.436 -1.593 1.00 0.00 H ATOM 82 HD3 PRO A 5 4.630 -0.883 -0.043 1.00 0.00 H ATOM 83 N GLU A 6 5.938 -3.001 -3.654 1.00 0.00 N ATOM 84 CA GLU A 6 5.870 -3.929 -4.814 1.00 0.00 C ATOM 85 C GLU A 6 5.330 -3.283 -6.084 1.00 0.00 C ATOM 86 O GLU A 6 5.498 -3.840 -7.175 1.00 0.00 O ATOM 87 CB GLU A 6 5.060 -5.217 -4.515 1.00 0.00 C ATOM 88 CG GLU A 6 4.918 -5.576 -3.042 1.00 0.00 C ATOM 89 CD GLU A 6 4.649 -7.052 -2.825 1.00 0.00 C ATOM 90 OE1 GLU A 6 3.463 -7.438 -2.772 1.00 0.00 O ATOM 91 OE2 GLU A 6 5.625 -7.823 -2.710 1.00 0.00 O1- ATOM 92 H GLU A 6 5.174 -2.394 -3.437 1.00 0.00 H ATOM 93 HA GLU A 6 6.885 -4.227 -5.016 1.00 0.00 H ATOM 94 HB2 GLU A 6 4.071 -5.109 -4.929 1.00 0.00 H ATOM 95 HB3 GLU A 6 5.546 -6.046 -5.011 1.00 0.00 H ATOM 96 HG2 GLU A 6 5.829 -5.309 -2.528 1.00 0.00 H ATOM 97 HG3 GLU A 6 4.093 -5.013 -2.632 1.00 0.00 H ATOM 98 N CYS A 7 4.695 -2.120 -5.958 1.00 0.00 N ATOM 99 CA CYS A 7 4.159 -1.431 -7.123 1.00 0.00 C ATOM 100 C CYS A 7 4.468 0.072 -7.089 1.00 0.00 C ATOM 101 O CYS A 7 4.270 0.733 -6.082 1.00 0.00 O ATOM 102 CB CYS A 7 2.661 -1.702 -7.374 1.00 0.00 C ATOM 103 SG CYS A 7 1.478 -0.556 -6.617 1.00 0.00 S ATOM 104 H CYS A 7 4.642 -1.703 -5.082 1.00 0.00 H ATOM 105 HA CYS A 7 4.696 -1.850 -7.949 1.00 0.00 H ATOM 106 HB2 CYS A 7 2.486 -1.656 -8.432 1.00 0.00 H ATOM 107 HB3 CYS A 7 2.427 -2.691 -7.019 1.00 0.00 H ATOM 108 N PRO A 8 4.991 0.602 -8.215 1.00 0.00 N ATOM 109 CA PRO A 8 5.377 2.024 -8.417 1.00 0.00 C ATOM 110 C PRO A 8 4.379 3.104 -7.930 1.00 0.00 C ATOM 111 O PRO A 8 4.387 4.227 -8.452 1.00 0.00 O ATOM 112 CB PRO A 8 5.543 2.098 -9.938 1.00 0.00 C ATOM 113 CG PRO A 8 5.999 0.741 -10.331 1.00 0.00 C ATOM 114 CD PRO A 8 5.311 -0.209 -9.390 1.00 0.00 C ATOM 115 HA PRO A 8 6.336 2.221 -7.961 1.00 0.00 H ATOM 116 HB2 PRO A 8 4.593 2.341 -10.400 1.00 0.00 H ATOM 117 HB3 PRO A 8 6.287 2.833 -10.199 1.00 0.00 H ATOM 118 HG2 PRO A 8 5.711 0.539 -11.355 1.00 0.00 H ATOM 119 HG3 PRO A 8 7.069 0.663 -10.217 1.00 0.00 H ATOM 120 HD2 PRO A 8 4.407 -0.597 -9.819 1.00 0.00 H ATOM 121 HD3 PRO A 8 5.970 -1.017 -9.099 1.00 0.00 H ATOM 122 N LYS A 9 3.537 2.785 -6.932 1.00 0.00 N ATOM 123 CA LYS A 9 2.625 3.724 -6.369 1.00 0.00 C ATOM 124 C LYS A 9 3.288 4.249 -5.079 1.00 0.00 C ATOM 125 O LYS A 9 3.232 3.586 -4.046 1.00 0.00 O ATOM 126 CB LYS A 9 1.282 3.027 -6.114 1.00 0.00 C ATOM 127 CG LYS A 9 0.065 3.813 -6.597 1.00 0.00 C ATOM 128 CD LYS A 9 -0.362 3.378 -7.993 1.00 0.00 C ATOM 129 CE LYS A 9 -1.566 4.169 -8.488 1.00 0.00 C ATOM 130 NZ LYS A 9 -1.208 5.568 -8.857 1.00 0.00 N1+ ATOM 131 H LYS A 9 3.532 1.889 -6.551 1.00 0.00 H ATOM 132 HA LYS A 9 2.489 4.530 -7.063 1.00 0.00 H ATOM 133 HB2 LYS A 9 1.289 2.078 -6.630 1.00 0.00 H ATOM 134 HB3 LYS A 9 1.178 2.843 -5.056 1.00 0.00 H ATOM 135 HG2 LYS A 9 -0.756 3.648 -5.915 1.00 0.00 H ATOM 136 HG3 LYS A 9 0.308 4.866 -6.621 1.00 0.00 H ATOM 137 HD2 LYS A 9 0.460 3.533 -8.675 1.00 0.00 H ATOM 138 HD3 LYS A 9 -0.618 2.329 -7.969 1.00 0.00 H ATOM 139 HE2 LYS A 9 -1.974 3.672 -9.356 1.00 0.00 H ATOM 140 HE3 LYS A 9 -2.311 4.191 -7.706 1.00 0.00 H ATOM 141 HZ1 LYS A 9 -2.052 6.078 -9.188 1.00 0.00 H ATOM 142 HZ2 LYS A 9 -0.498 5.568 -9.616 1.00 0.00 H ATOM 143 HZ3 LYS A 9 -0.817 6.066 -8.031 1.00 0.00 H HETATM 144 N MMO A 10 3.933 5.449 -5.113 1.00 0.00 N HETATM 145 CA MMO A 10 4.633 5.982 -3.914 1.00 0.00 C HETATM 146 C MMO A 10 4.141 7.388 -3.583 1.00 0.00 C HETATM 147 O MMO A 10 4.329 8.343 -4.348 1.00 0.00 O HETATM 148 CB MMO A 10 6.135 5.964 -4.254 1.00 0.00 C HETATM 149 CG MMO A 10 6.741 4.580 -4.157 1.00 0.00 C HETATM 150 CD MMO A 10 8.254 4.618 -4.292 1.00 0.00 C HETATM 151 NE MMO A 10 8.845 3.277 -4.235 1.00 0.00 N HETATM 152 CZ MMO A 10 10.160 3.019 -4.288 1.00 0.00 C HETATM 153 NH2 MMO A 10 10.583 1.764 -4.228 1.00 0.00 N HETATM 154 NH1 MMO A 10 11.051 4.002 -4.400 1.00 0.00 N HETATM 155 CN MMO A 10 3.836 6.303 -6.314 1.00 0.00 C HETATM 156 HA MMO A 10 4.444 5.324 -3.064 1.00 0.00 H HETATM 157 HCB1 MMO A 10 6.659 6.614 -3.569 1.00 0.00 H HETATM 158 HCB2 MMO A 10 6.274 6.327 -5.262 1.00 0.00 H HETATM 159 HCG1 MMO A 10 6.330 3.963 -4.942 1.00 0.00 H HETATM 160 HCG2 MMO A 10 6.480 4.165 -3.197 1.00 0.00 H HETATM 161 HCD1 MMO A 10 8.657 5.213 -3.486 1.00 0.00 H HETATM 162 HCD2 MMO A 10 8.507 5.074 -5.237 1.00 0.00 H HETATM 163 HH21 MMO A 10 9.924 1.017 -4.144 1.00 0.00 H HETATM 164 HH22 MMO A 10 11.563 1.564 -4.267 1.00 0.00 H HETATM 165 HH11 MMO A 10 12.028 3.790 -4.438 1.00 0.00 H HETATM 166 HC1 MMO A 10 2.797 6.506 -6.512 1.00 0.00 H HETATM 167 HC2 MMO A 10 4.290 5.804 -7.152 1.00 0.00 H HETATM 168 HC3 MMO A 10 4.349 7.228 -6.112 1.00 0.00 H HETATM 169 HE MMO A 10 8.227 2.520 -4.153 1.00 0.00 H HETATM 170 HH12 MMO A 10 10.744 4.953 -4.446 1.00 0.00 H ATOM 171 N PHE A 11 3.541 7.490 -2.426 1.00 0.00 N ATOM 172 CA PHE A 11 2.875 8.699 -1.993 1.00 0.00 C ATOM 173 C PHE A 11 3.637 9.385 -0.868 1.00 0.00 C ATOM 174 O PHE A 11 4.629 10.072 -1.130 1.00 0.00 O ATOM 175 CB PHE A 11 1.412 8.311 -1.612 1.00 0.00 C ATOM 176 CG PHE A 11 1.101 6.851 -1.921 1.00 0.00 C ATOM 177 CD1 PHE A 11 1.100 6.395 -3.242 1.00 0.00 C ATOM 178 CD2 PHE A 11 0.894 5.924 -0.904 1.00 0.00 C ATOM 179 CE1 PHE A 11 0.901 5.069 -3.536 1.00 0.00 C ATOM 180 CE2 PHE A 11 0.677 4.592 -1.207 1.00 0.00 C ATOM 181 CZ PHE A 11 0.685 4.168 -2.535 1.00 0.00 C ATOM 182 H PHE A 11 3.573 6.732 -1.821 1.00 0.00 H ATOM 183 HA PHE A 11 2.842 9.370 -2.838 1.00 0.00 H ATOM 184 HB2 PHE A 11 1.261 8.470 -0.556 1.00 0.00 H ATOM 185 HB3 PHE A 11 0.721 8.926 -2.170 1.00 0.00 H ATOM 186 HD1 PHE A 11 1.262 7.098 -4.042 1.00 0.00 H ATOM 187 HD2 PHE A 11 0.900 6.244 0.136 1.00 0.00 H ATOM 188 HE1 PHE A 11 0.942 4.719 -4.572 1.00 0.00 H ATOM 189 HE2 PHE A 11 0.499 3.889 -0.409 1.00 0.00 H ATOM 190 HZ PHE A 11 0.546 3.128 -2.794 1.00 0.00 H HETATM 191 N NLE A 12 3.187 9.191 0.378 1.00 0.00 N HETATM 192 CA NLE A 12 3.809 9.809 1.549 1.00 0.00 C HETATM 193 C NLE A 12 3.109 9.345 2.825 1.00 0.00 C HETATM 194 O NLE A 12 3.561 9.648 3.934 1.00 0.00 O HETATM 195 CB NLE A 12 3.740 11.340 1.422 1.00 0.00 C HETATM 196 CG NLE A 12 4.852 12.102 2.146 1.00 0.00 C HETATM 197 CD NLE A 12 4.435 12.508 3.552 1.00 0.00 C HETATM 198 CE NLE A 12 5.557 13.259 4.234 1.00 0.00 C HETATM 199 H NLE A 12 2.413 8.608 0.513 1.00 0.00 H HETATM 200 HA NLE A 12 4.843 9.498 1.582 1.00 0.00 H HETATM 201 HB2 NLE A 12 2.789 11.673 1.805 1.00 0.00 H HETATM 202 HB3 NLE A 12 3.794 11.579 0.368 1.00 0.00 H HETATM 203 HG2 NLE A 12 5.090 12.993 1.582 1.00 0.00 H HETATM 204 HG3 NLE A 12 5.726 11.473 2.210 1.00 0.00 H HETATM 205 HD2 NLE A 12 4.207 11.623 4.129 1.00 0.00 H HETATM 206 HD3 NLE A 12 3.568 13.150 3.500 1.00 0.00 H HETATM 207 HE1 NLE A 12 5.793 14.147 3.666 1.00 0.00 H HETATM 208 HE2 NLE A 12 6.431 12.627 4.292 1.00 0.00 H HETATM 209 HE3 NLE A 12 5.249 13.540 5.230 1.00 0.00 H ATOM 210 N ARG A 13 2.011 8.593 2.660 1.00 0.00 N ATOM 211 CA ARG A 13 1.261 8.087 3.796 1.00 0.00 C ATOM 212 C ARG A 13 1.540 6.608 3.941 1.00 0.00 C ATOM 213 O ARG A 13 1.206 5.809 3.059 1.00 0.00 O ATOM 214 CB ARG A 13 -0.237 8.354 3.638 1.00 0.00 C ATOM 215 CG ARG A 13 -0.639 9.793 3.932 1.00 0.00 C ATOM 216 CD ARG A 13 -2.067 9.872 4.442 1.00 0.00 C ATOM 217 NE ARG A 13 -2.478 11.253 4.718 1.00 0.00 N ATOM 218 CZ ARG A 13 -3.651 11.606 5.265 1.00 0.00 C ATOM 219 NH1 ARG A 13 -4.555 10.690 5.606 1.00 0.00 N1+ ATOM 220 NH2 ARG A 13 -3.917 12.888 5.470 1.00 0.00 N ATOM 221 H ARG A 13 1.726 8.338 1.747 1.00 0.00 H ATOM 222 HA ARG A 13 1.622 8.593 4.680 1.00 0.00 H ATOM 223 HB2 ARG A 13 -0.526 8.123 2.623 1.00 0.00 H ATOM 224 HB3 ARG A 13 -0.779 7.707 4.312 1.00 0.00 H ATOM 225 HG2 ARG A 13 0.022 10.198 4.683 1.00 0.00 H ATOM 226 HG3 ARG A 13 -0.557 10.375 3.025 1.00 0.00 H ATOM 227 HD2 ARG A 13 -2.725 9.452 3.697 1.00 0.00 H ATOM 228 HD3 ARG A 13 -2.139 9.295 5.353 1.00 0.00 H ATOM 229 HE ARG A 13 -1.844 11.962 4.484 1.00 0.00 H ATOM 230 HH11 ARG A 13 -4.366 9.719 5.456 1.00 0.00 H ATOM 231 HH12 ARG A 13 -5.424 10.973 6.013 1.00 0.00 H ATOM 232 HH21 ARG A 13 -4.790 13.159 5.877 1.00 0.00 H ATOM 233 HH22 ARG A 13 -3.246 13.585 5.218 1.00 0.00 H ATOM 234 N SER A 14 2.169 6.254 5.058 1.00 0.00 N ATOM 235 CA SER A 14 2.548 4.872 5.323 1.00 0.00 C ATOM 236 C SER A 14 1.374 4.035 5.829 1.00 0.00 C ATOM 237 O SER A 14 1.240 2.873 5.447 1.00 0.00 O ATOM 238 CB SER A 14 3.703 4.820 6.326 1.00 0.00 C ATOM 239 OG SER A 14 3.391 5.540 7.507 1.00 0.00 O ATOM 240 H SER A 14 2.372 6.942 5.727 1.00 0.00 H ATOM 241 HA SER A 14 2.884 4.460 4.379 1.00 0.00 H ATOM 242 HB2 SER A 14 3.899 3.792 6.589 1.00 0.00 H ATOM 243 HB3 SER A 14 4.586 5.252 5.877 1.00 0.00 H ATOM 244 HG SER A 14 3.517 4.972 8.271 1.00 0.00 H HETATM 245 OE1 B3D A 15 0.448 1.854 9.562 1.00 0.00 O HETATM 246 CD B3D A 15 0.662 3.043 9.246 1.00 0.00 C HETATM 247 OE2 B3D A 15 1.791 3.575 9.308 1.00 0.00 O HETATM 248 CG B3D A 15 -0.507 3.884 8.763 1.00 0.00 C HETATM 249 CB B3D A 15 -0.608 3.940 7.224 1.00 0.00 C HETATM 250 N B3D A 15 0.541 4.627 6.693 1.00 0.00 N HETATM 251 CA B3D A 15 -1.905 4.683 6.885 1.00 0.00 C HETATM 252 C B3D A 15 -2.489 4.292 5.555 1.00 0.00 C HETATM 253 O B3D A 15 -2.973 3.160 5.371 1.00 0.00 O HETATM 254 HG3 B3D A 15 -0.385 4.886 9.145 1.00 0.00 H HETATM 255 HG2 B3D A 15 -1.417 3.460 9.163 1.00 0.00 H HETATM 256 HB B3D A 15 -0.605 2.936 6.751 1.00 0.00 H HETATM 257 H B3D A 15 0.717 5.550 6.971 1.00 0.00 H HETATM 258 HA1 B3D A 15 -1.704 5.744 6.866 1.00 0.00 H HETATM 259 HA2 B3D A 15 -2.640 4.479 7.648 1.00 0.00 H ATOM 260 N HIS A 16 -2.409 5.240 4.603 1.00 0.00 N ATOM 261 CA HIS A 16 -2.927 5.058 3.240 1.00 0.00 C ATOM 262 C HIS A 16 -2.229 3.905 2.516 1.00 0.00 C ATOM 263 O HIS A 16 -2.866 3.205 1.732 1.00 0.00 O ATOM 264 CB HIS A 16 -2.773 6.350 2.433 1.00 0.00 C ATOM 265 CG HIS A 16 -3.830 6.540 1.387 1.00 0.00 C ATOM 266 ND1 HIS A 16 -4.915 7.375 1.555 1.00 0.00 N ATOM 267 CD2 HIS A 16 -3.962 6.000 0.152 1.00 0.00 C ATOM 268 CE1 HIS A 16 -5.669 7.339 0.471 1.00 0.00 C ATOM 269 NE2 HIS A 16 -5.112 6.513 -0.396 1.00 0.00 N ATOM 270 H HIS A 16 -1.984 6.094 4.830 1.00 0.00 H ATOM 271 HA HIS A 16 -3.978 4.825 3.321 1.00 0.00 H ATOM 272 HB2 HIS A 16 -2.816 7.193 3.105 1.00 0.00 H ATOM 273 HB3 HIS A 16 -1.813 6.341 1.937 1.00 0.00 H ATOM 274 HD1 HIS A 16 -5.105 7.913 2.352 1.00 0.00 H ATOM 275 HD2 HIS A 16 -3.287 5.297 -0.316 1.00 0.00 H ATOM 276 HE1 HIS A 16 -6.584 7.892 0.319 1.00 0.00 H ATOM 277 HE2 HIS A 16 -5.510 6.235 -1.247 1.00 0.00 H ATOM 278 N LEU A 17 -0.916 3.729 2.762 1.00 0.00 N ATOM 279 CA LEU A 17 -0.162 2.636 2.155 1.00 0.00 C ATOM 280 C LEU A 17 -0.407 1.315 2.879 1.00 0.00 C ATOM 281 O LEU A 17 -0.376 0.273 2.246 1.00 0.00 O ATOM 282 CB LEU A 17 1.352 2.906 2.105 1.00 0.00 C ATOM 283 CG LEU A 17 2.211 1.711 1.630 1.00 0.00 C ATOM 284 CD1 LEU A 17 2.172 1.544 0.114 1.00 0.00 C ATOM 285 CD2 LEU A 17 3.630 1.844 2.125 1.00 0.00 C ATOM 286 H LEU A 17 -0.449 4.361 3.329 1.00 0.00 H ATOM 287 HA LEU A 17 -0.531 2.536 1.145 1.00 0.00 H ATOM 288 HB2 LEU A 17 1.532 3.743 1.449 1.00 0.00 H ATOM 289 HB3 LEU A 17 1.674 3.175 3.097 1.00 0.00 H ATOM 290 HG LEU A 17 1.801 0.808 2.061 1.00 0.00 H ATOM 291 HD11 LEU A 17 2.813 2.276 -0.361 1.00 0.00 H ATOM 292 HD12 LEU A 17 1.152 1.681 -0.225 1.00 0.00 H ATOM 293 HD13 LEU A 17 2.501 0.536 -0.154 1.00 0.00 H ATOM 294 HD21 LEU A 17 3.625 1.936 3.201 1.00 0.00 H ATOM 295 HD22 LEU A 17 4.083 2.720 1.686 1.00 0.00 H ATOM 296 HD23 LEU A 17 4.189 0.964 1.840 1.00 0.00 H ATOM 297 N SER A 18 -0.584 1.355 4.206 1.00 0.00 N ATOM 298 CA SER A 18 -0.858 0.137 4.983 1.00 0.00 C ATOM 299 C SER A 18 -2.113 -0.545 4.442 1.00 0.00 C ATOM 300 O SER A 18 -2.052 -1.689 3.985 1.00 0.00 O ATOM 301 CB SER A 18 -1.018 0.446 6.477 1.00 0.00 C ATOM 302 OG SER A 18 0.164 1.011 7.013 1.00 0.00 O ATOM 303 H SER A 18 -0.496 2.211 4.669 1.00 0.00 H ATOM 304 HA SER A 18 -0.019 -0.531 4.849 1.00 0.00 H ATOM 305 HB2 SER A 18 -1.834 1.139 6.615 1.00 0.00 H ATOM 306 HB3 SER A 18 -1.235 -0.470 7.007 1.00 0.00 H ATOM 307 HG SER A 18 0.333 0.638 7.881 1.00 0.00 H HETATM 308 N B3K A 19 -3.231 0.190 4.442 1.00 0.00 N HETATM 309 CB B3K A 19 -4.468 -0.333 3.931 1.00 0.00 C HETATM 310 CG B3K A 19 -5.576 -0.172 4.996 1.00 0.00 C HETATM 311 CD B3K A 19 -5.360 -1.005 6.254 1.00 0.00 C HETATM 312 CE B3K A 19 -6.466 -0.773 7.271 1.00 0.00 C HETATM 313 CF B3K A 19 -6.253 -1.607 8.524 1.00 0.00 C HETATM 314 NZ B3K A 19 -7.331 -1.389 9.527 1.00 0.00 N HETATM 315 CA B3K A 19 -4.912 0.456 2.698 1.00 0.00 C HETATM 316 C B3K A 19 -4.311 -0.025 1.400 1.00 0.00 C HETATM 317 O B3K A 19 -4.717 -1.059 0.848 1.00 0.00 O HETATM 318 H B3K A 19 -3.203 1.115 4.795 1.00 0.00 H HETATM 319 HB B3K A 19 -4.268 -1.393 3.663 1.00 0.00 H HETATM 320 HG2 B3K A 19 -6.522 -0.461 4.561 1.00 0.00 H HETATM 321 HG3 B3K A 19 -5.629 0.867 5.286 1.00 0.00 H HETATM 322 HD2 B3K A 19 -4.413 -0.733 6.696 1.00 0.00 H HETATM 323 HD3 B3K A 19 -5.347 -2.049 5.985 1.00 0.00 H HETATM 324 HE2 B3K A 19 -7.413 -1.041 6.827 1.00 0.00 H HETATM 325 HE3 B3K A 19 -6.477 0.271 7.544 1.00 0.00 H HETATM 326 HF1 B3K A 19 -5.304 -1.338 8.963 1.00 0.00 H HETATM 327 HF2 B3K A 19 -6.237 -2.651 8.247 1.00 0.00 H HETATM 328 HNZ1 B3K A 19 -8.254 -1.651 9.123 1.00 0.00 H HETATM 329 HNZ2 B3K A 19 -7.361 -0.388 9.808 1.00 0.00 H HETATM 330 HA1 B3K A 19 -5.986 0.392 2.609 1.00 0.00 H HETATM 331 HA2 B3K A 19 -4.634 1.491 2.831 1.00 0.00 H HETATM 332 HZ3 B3K A 19 -7.157 -1.970 10.372 1.00 0.00 H ATOM 333 N HIS A 20 -3.272 0.700 0.942 1.00 0.00 N ATOM 334 CA HIS A 20 -2.601 0.435 -0.322 1.00 0.00 C ATOM 335 C HIS A 20 -2.045 -0.994 -0.435 1.00 0.00 C ATOM 336 O HIS A 20 -2.121 -1.626 -1.490 1.00 0.00 O ATOM 337 CB HIS A 20 -1.471 1.423 -0.504 1.00 0.00 C ATOM 338 CG HIS A 20 -0.786 1.233 -1.796 1.00 0.00 C ATOM 339 ND1 HIS A 20 -1.217 1.779 -2.976 1.00 0.00 N ATOM 340 CD2 HIS A 20 0.239 0.419 -2.097 1.00 0.00 C ATOM 341 CE1 HIS A 20 -0.462 1.268 -3.945 1.00 0.00 C ATOM 342 NE2 HIS A 20 0.441 0.448 -3.451 1.00 0.00 N ATOM 343 H HIS A 20 -2.911 1.426 1.500 1.00 0.00 H ATOM 344 HA HIS A 20 -3.295 0.611 -1.108 1.00 0.00 H ATOM 345 HB2 HIS A 20 -1.857 2.433 -0.461 1.00 0.00 H ATOM 346 HB3 HIS A 20 -0.755 1.267 0.281 1.00 0.00 H ATOM 347 HD1 HIS A 20 -1.947 2.424 -3.087 1.00 0.00 H ATOM 348 HD2 HIS A 20 0.777 -0.226 -1.396 1.00 0.00 H ATOM 349 HE1 HIS A 20 -0.625 1.436 -4.993 1.00 0.00 H ATOM 350 N ILE A 21 -1.440 -1.463 0.633 1.00 0.00 N ATOM 351 CA ILE A 21 -0.838 -2.772 0.642 1.00 0.00 C ATOM 352 C ILE A 21 -1.737 -3.819 1.302 1.00 0.00 C ATOM 353 O ILE A 21 -1.456 -5.013 1.225 1.00 0.00 O ATOM 354 CB ILE A 21 0.599 -2.739 1.231 1.00 0.00 C ATOM 355 CG1 ILE A 21 0.636 -2.522 2.757 1.00 0.00 C ATOM 356 CG2 ILE A 21 1.420 -1.695 0.531 1.00 0.00 C ATOM 357 CD1 ILE A 21 0.785 -3.802 3.552 1.00 0.00 C ATOM 358 H ILE A 21 -1.376 -0.909 1.421 1.00 0.00 H ATOM 359 HA ILE A 21 -0.745 -3.049 -0.392 1.00 0.00 H ATOM 360 HB ILE A 21 1.057 -3.650 0.989 1.00 0.00 H ATOM 361 HG12 ILE A 21 1.470 -1.882 3.002 1.00 0.00 H ATOM 362 HG13 ILE A 21 -0.281 -2.043 3.067 1.00 0.00 H ATOM 363 HG21 ILE A 21 0.910 -0.748 0.595 1.00 0.00 H ATOM 364 HG22 ILE A 21 1.538 -1.983 -0.504 1.00 0.00 H ATOM 365 HG23 ILE A 21 2.387 -1.622 0.999 1.00 0.00 H ATOM 366 HD11 ILE A 21 1.707 -4.293 3.275 1.00 0.00 H ATOM 367 HD12 ILE A 21 -0.048 -4.456 3.341 1.00 0.00 H ATOM 368 HD13 ILE A 21 0.803 -3.571 4.607 1.00 0.00 H HETATM 369 N B3K A 22 -2.779 -3.352 1.991 1.00 0.00 N HETATM 370 CB B3K A 22 -3.750 -4.222 2.573 1.00 0.00 C HETATM 371 CG B3K A 22 -3.821 -3.975 4.092 1.00 0.00 C HETATM 372 CD B3K A 22 -3.624 -5.234 4.922 1.00 0.00 C HETATM 373 CE B3K A 22 -3.686 -4.934 6.411 1.00 0.00 C HETATM 374 CF B3K A 22 -3.479 -6.191 7.241 1.00 0.00 C HETATM 375 NZ B3K A 22 -3.531 -5.907 8.701 1.00 0.00 N HETATM 376 CA B3K A 22 -5.144 -3.914 2.000 1.00 0.00 C HETATM 377 C B3K A 22 -5.293 -4.133 0.503 1.00 0.00 C HETATM 378 O B3K A 22 -6.146 -4.934 0.079 1.00 0.00 O HETATM 379 H B3K A 22 -2.858 -2.383 2.141 1.00 0.00 H HETATM 380 HB B3K A 22 -3.436 -5.254 2.311 1.00 0.00 H HETATM 381 HG2 B3K A 22 -4.789 -3.561 4.332 1.00 0.00 H HETATM 382 HG3 B3K A 22 -3.056 -3.265 4.367 1.00 0.00 H HETATM 383 HD2 B3K A 22 -2.658 -5.658 4.689 1.00 0.00 H HETATM 384 HD3 B3K A 22 -4.400 -5.942 4.674 1.00 0.00 H HETATM 385 HE2 B3K A 22 -4.655 -4.516 6.643 1.00 0.00 H HETATM 386 HE3 B3K A 22 -2.915 -4.221 6.657 1.00 0.00 H HETATM 387 HF1 B3K A 22 -2.514 -6.611 6.998 1.00 0.00 H HETATM 388 HF2 B3K A 22 -4.253 -6.902 6.994 1.00 0.00 H HETATM 389 HNZ1 B3K A 22 -2.789 -5.225 8.960 1.00 0.00 H HETATM 390 HNZ2 B3K A 22 -3.385 -6.783 9.242 1.00 0.00 H HETATM 391 HA1 B3K A 22 -5.380 -2.880 2.207 1.00 0.00 H HETATM 392 HA2 B3K A 22 -5.868 -4.541 2.500 1.00 0.00 H HETATM 393 HZ3 B3K A 22 -4.457 -5.507 8.955 1.00 0.00 H ATOM 394 N THR A 23 -4.445 -3.453 -0.316 1.00 0.00 N ATOM 395 CA THR A 23 -4.536 -3.579 -1.777 1.00 0.00 C ATOM 396 C THR A 23 -3.519 -4.586 -2.284 1.00 0.00 C ATOM 397 O THR A 23 -3.862 -5.452 -3.095 1.00 0.00 O ATOM 398 CB THR A 23 -4.391 -2.219 -2.523 1.00 0.00 C ATOM 399 OG1 THR A 23 -5.059 -1.185 -1.791 1.00 0.00 O ATOM 400 CG2 THR A 23 -4.985 -2.295 -3.922 1.00 0.00 C ATOM 401 H THR A 23 -3.718 -2.899 0.076 1.00 0.00 H ATOM 402 HA THR A 23 -5.513 -3.975 -1.991 1.00 0.00 H ATOM 403 HB THR A 23 -3.335 -1.965 -2.611 1.00 0.00 H ATOM 404 HG1 THR A 23 -4.950 -1.337 -0.849 1.00 0.00 H ATOM 405 HG21 THR A 23 -6.046 -2.476 -3.852 1.00 0.00 H ATOM 406 HG22 THR A 23 -4.516 -3.103 -4.463 1.00 0.00 H ATOM 407 HG23 THR A 23 -4.808 -1.363 -4.437 1.00 0.00 H ATOM 408 N HIS A 24 -2.266 -4.474 -1.814 1.00 0.00 N ATOM 409 CA HIS A 24 -1.225 -5.450 -2.182 1.00 0.00 C ATOM 410 C HIS A 24 -1.618 -6.813 -1.673 1.00 0.00 C ATOM 411 O HIS A 24 -1.283 -7.861 -2.233 1.00 0.00 O ATOM 412 CB HIS A 24 0.130 -5.058 -1.607 1.00 0.00 C ATOM 413 CG HIS A 24 0.886 -4.099 -2.459 1.00 0.00 C ATOM 414 ND1 HIS A 24 1.958 -4.450 -3.261 1.00 0.00 N ATOM 415 CD2 HIS A 24 0.672 -2.783 -2.690 1.00 0.00 C ATOM 416 CE1 HIS A 24 2.321 -3.361 -3.937 1.00 0.00 C ATOM 417 NE2 HIS A 24 1.571 -2.360 -3.639 1.00 0.00 N ATOM 418 H HIS A 24 -2.037 -3.712 -1.235 1.00 0.00 H ATOM 419 HA HIS A 24 -1.195 -5.483 -3.231 1.00 0.00 H ATOM 420 HB2 HIS A 24 -0.035 -4.598 -0.646 1.00 0.00 H ATOM 421 HB3 HIS A 24 0.732 -5.945 -1.479 1.00 0.00 H ATOM 422 HD1 HIS A 24 2.398 -5.323 -3.298 1.00 0.00 H ATOM 423 HD2 HIS A 24 0.020 -2.122 -2.128 1.00 0.00 H ATOM 424 HE1 HIS A 24 3.177 -3.278 -4.584 1.00 0.00 H HETATM 425 N B3Q A 25 -2.336 -6.722 -0.591 1.00 0.00 N HETATM 426 CB B3Q A 25 -2.929 -7.826 0.096 1.00 0.00 C HETATM 427 CG B3Q A 25 -2.302 -8.046 1.485 1.00 0.00 C HETATM 428 CA B3Q A 25 -4.366 -7.379 0.222 1.00 0.00 C HETATM 429 C B3Q A 25 -5.418 -8.443 0.010 1.00 0.00 C HETATM 430 O B3Q A 25 -5.137 -9.648 0.011 1.00 0.00 O HETATM 431 HN B3Q A 25 -2.505 -5.809 -0.241 1.00 0.00 H HETATM 432 HB B3Q A 25 -2.856 -8.716 -0.518 1.00 0.00 H HETATM 433 HG B3Q A 25 -2.936 -8.720 2.044 1.00 0.00 H HETATM 434 HGA B3Q A 25 -2.267 -7.100 1.999 1.00 0.00 H HETATM 435 CD B3Q A 25 -0.885 -8.626 1.476 1.00 0.00 C HETATM 436 HA B3Q A 25 -4.512 -6.944 1.196 1.00 0.00 H HETATM 437 HAA B3Q A 25 -4.505 -6.606 -0.540 1.00 0.00 H HETATM 438 CE B3Q A 25 0.183 -7.627 1.047 1.00 0.00 C HETATM 439 NF2 B3Q A 25 0.563 -6.730 1.953 1.00 0.00 N HETATM 440 H8 B3Q A 25 -0.862 -9.466 0.796 1.00 0.00 H HETATM 441 OF1 B3Q A 25 0.657 -7.659 -0.087 1.00 0.00 O HETATM 442 H9 B3Q A 25 -0.648 -8.970 2.472 1.00 0.00 H HETATM 443 H11 B3Q A 25 0.143 -6.759 2.838 1.00 0.00 H HETATM 444 H12 B3Q A 25 1.242 -6.068 1.695 1.00 0.00 H ATOM 445 N ASN A 26 -6.652 -7.962 -0.167 1.00 0.00 N ATOM 446 CA ASN A 26 -7.809 -8.833 -0.386 1.00 0.00 C ATOM 447 C ASN A 26 -8.480 -8.523 -1.720 1.00 0.00 C ATOM 448 O ASN A 26 -8.748 -7.359 -2.032 1.00 0.00 O ATOM 449 CB ASN A 26 -8.821 -8.677 0.754 1.00 0.00 C ATOM 450 CG ASN A 26 -8.323 -9.262 2.063 1.00 0.00 C ATOM 451 OD1 ASN A 26 -7.686 -8.575 2.861 1.00 0.00 O ATOM 452 ND2 ASN A 26 -8.612 -10.538 2.289 1.00 0.00 N ATOM 453 H ASN A 26 -6.785 -6.981 -0.147 1.00 0.00 H ATOM 454 HA ASN A 26 -7.456 -9.853 -0.404 1.00 0.00 H ATOM 455 HB2 ASN A 26 -9.023 -7.627 0.906 1.00 0.00 H ATOM 456 HB3 ASN A 26 -9.738 -9.179 0.482 1.00 0.00 H ATOM 457 HD21 ASN A 26 -9.124 -11.024 1.608 1.00 0.00 H ATOM 458 HD22 ASN A 26 -8.303 -10.942 3.126 1.00 0.00 H ATOM 459 N LYS A 27 -8.746 -9.578 -2.497 1.00 0.00 N ATOM 460 CA LYS A 27 -9.389 -9.444 -3.807 1.00 0.00 C ATOM 461 C LYS A 27 -10.561 -10.411 -3.936 1.00 0.00 C ATOM 462 O LYS A 27 -10.474 -11.563 -3.499 1.00 0.00 O ATOM 463 CB LYS A 27 -8.380 -9.696 -4.933 1.00 0.00 C ATOM 464 CG LYS A 27 -7.379 -8.566 -5.128 1.00 0.00 C ATOM 465 CD LYS A 27 -6.406 -8.872 -6.258 1.00 0.00 C ATOM 466 CE LYS A 27 -5.404 -7.744 -6.462 1.00 0.00 C ATOM 467 NZ LYS A 27 -4.382 -7.695 -5.377 1.00 0.00 N1+ ATOM 468 H LYS A 27 -8.502 -10.472 -2.180 1.00 0.00 H ATOM 469 HA LYS A 27 -9.762 -8.434 -3.889 1.00 0.00 H ATOM 470 HB2 LYS A 27 -7.831 -10.599 -4.712 1.00 0.00 H ATOM 471 HB3 LYS A 27 -8.920 -9.833 -5.859 1.00 0.00 H ATOM 472 HG2 LYS A 27 -7.916 -7.660 -5.366 1.00 0.00 H ATOM 473 HG3 LYS A 27 -6.823 -8.429 -4.213 1.00 0.00 H ATOM 474 HD2 LYS A 27 -5.868 -9.777 -6.019 1.00 0.00 H ATOM 475 HD3 LYS A 27 -6.965 -9.015 -7.171 1.00 0.00 H ATOM 476 HE2 LYS A 27 -4.904 -7.891 -7.407 1.00 0.00 H ATOM 477 HE3 LYS A 27 -5.939 -6.806 -6.482 1.00 0.00 H ATOM 478 HZ1 LYS A 27 -3.716 -6.914 -5.549 1.00 0.00 H ATOM 479 HZ2 LYS A 27 -3.850 -8.588 -5.346 1.00 0.00 H ATOM 480 HZ3 LYS A 27 -4.844 -7.548 -4.457 1.00 0.00 H ATOM 481 N LYS A 28 -11.653 -9.930 -4.538 1.00 0.00 N ATOM 482 CA LYS A 28 -12.856 -10.737 -4.735 1.00 0.00 C ATOM 483 C LYS A 28 -13.282 -10.715 -6.206 1.00 0.00 C ATOM 484 O LYS A 28 -13.654 -9.672 -6.747 1.00 0.00 O ATOM 485 CB LYS A 28 -13.990 -10.226 -3.834 1.00 0.00 C ATOM 486 CG LYS A 28 -14.975 -11.306 -3.404 1.00 0.00 C ATOM 487 CD LYS A 28 -16.073 -10.738 -2.519 1.00 0.00 C ATOM 488 CE LYS A 28 -17.055 -11.816 -2.089 1.00 0.00 C ATOM 489 NZ LYS A 28 -18.135 -11.270 -1.223 1.00 0.00 N1+ ATOM 490 H LYS A 28 -11.647 -9.004 -4.858 1.00 0.00 H ATOM 491 HA LYS A 28 -12.619 -11.754 -4.458 1.00 0.00 H ATOM 492 HB2 LYS A 28 -13.558 -9.791 -2.945 1.00 0.00 H ATOM 493 HB3 LYS A 28 -14.538 -9.462 -4.365 1.00 0.00 H ATOM 494 HG2 LYS A 28 -15.424 -11.740 -4.284 1.00 0.00 H ATOM 495 HG3 LYS A 28 -14.441 -12.068 -2.856 1.00 0.00 H ATOM 496 HD2 LYS A 28 -15.624 -10.303 -1.639 1.00 0.00 H ATOM 497 HD3 LYS A 28 -16.606 -9.976 -3.068 1.00 0.00 H ATOM 498 HE2 LYS A 28 -17.499 -12.253 -2.971 1.00 0.00 H ATOM 499 HE3 LYS A 28 -16.517 -12.577 -1.543 1.00 0.00 H ATOM 500 HZ1 LYS A 28 -18.789 -12.029 -0.944 1.00 0.00 H ATOM 501 HZ2 LYS A 28 -18.669 -10.539 -1.735 1.00 0.00 H ATOM 502 HZ3 LYS A 28 -17.726 -10.847 -0.365 1.00 0.00 H HETATM 503 N NH2 A 29 -13.215 -11.873 -6.853 1.00 0.00 N HETATM 504 HN1 NH2 A 29 -12.910 -12.663 -6.358 1.00 0.00 H HETATM 505 HN2 NH2 A 29 -13.472 -11.891 -7.798 1.00 0.00 H TER 506 NH2 A 29 HETATM 507 ZN ZN A 101 1.765 -0.622 -4.387 1.00 0.00 ZN