ATOM 1 N LYS A 1 9.683 1.492 5.400 1.00 0.00 N ATOM 2 CA LYS A 1 8.460 1.960 6.108 1.00 0.00 C ATOM 3 C LYS A 1 7.627 2.885 5.218 1.00 0.00 C ATOM 4 O LYS A 1 6.401 2.761 5.167 1.00 0.00 O ATOM 5 CB LYS A 1 8.837 2.684 7.407 1.00 0.00 C ATOM 6 CG LYS A 1 9.354 1.759 8.501 1.00 0.00 C ATOM 7 CD LYS A 1 9.741 2.533 9.750 1.00 0.00 C ATOM 8 CE LYS A 1 10.269 1.610 10.836 1.00 0.00 C ATOM 9 NZ LYS A 1 10.659 2.361 12.061 1.00 0.00 N1+ ATOM 10 H1 LYS A 1 10.237 0.866 6.019 1.00 0.00 H ATOM 11 H2 LYS A 1 10.274 2.305 5.131 1.00 0.00 H ATOM 12 H3 LYS A 1 9.420 0.969 4.540 1.00 0.00 H ATOM 13 HA LYS A 1 7.863 1.092 6.352 1.00 0.00 H ATOM 14 HB2 LYS A 1 9.606 3.411 7.190 1.00 0.00 H ATOM 15 HB3 LYS A 1 7.966 3.199 7.784 1.00 0.00 H ATOM 16 HG2 LYS A 1 8.580 1.051 8.755 1.00 0.00 H ATOM 17 HG3 LYS A 1 10.221 1.231 8.131 1.00 0.00 H ATOM 18 HD2 LYS A 1 10.509 3.249 9.495 1.00 0.00 H ATOM 19 HD3 LYS A 1 8.872 3.054 10.124 1.00 0.00 H ATOM 20 HE2 LYS A 1 9.498 0.899 11.091 1.00 0.00 H ATOM 21 HE3 LYS A 1 11.132 1.084 10.456 1.00 0.00 H ATOM 22 HZ1 LYS A 1 11.406 3.049 11.836 1.00 0.00 H ATOM 23 HZ2 LYS A 1 11.016 1.705 12.785 1.00 0.00 H ATOM 24 HZ3 LYS A 1 9.838 2.870 12.446 1.00 0.00 H ATOM 25 N TYR A 2 8.308 3.804 4.518 1.00 0.00 N ATOM 26 CA TYR A 2 7.648 4.762 3.623 1.00 0.00 C ATOM 27 C TYR A 2 7.571 4.212 2.187 1.00 0.00 C ATOM 28 O TYR A 2 8.445 3.430 1.798 1.00 0.00 O ATOM 29 CB TYR A 2 8.405 6.094 3.632 1.00 0.00 C ATOM 30 CG TYR A 2 8.221 6.891 4.905 1.00 0.00 C ATOM 31 CD1 TYR A 2 9.083 6.726 5.982 1.00 0.00 C ATOM 32 CD2 TYR A 2 7.183 7.808 5.029 1.00 0.00 C ATOM 33 CE1 TYR A 2 8.916 7.450 7.146 1.00 0.00 C ATOM 34 CE2 TYR A 2 7.011 8.536 6.190 1.00 0.00 C ATOM 35 CZ TYR A 2 7.880 8.354 7.245 1.00 0.00 C ATOM 36 OH TYR A 2 7.711 9.079 8.403 1.00 0.00 O ATOM 37 H TYR A 2 9.283 3.838 4.607 1.00 0.00 H ATOM 38 HA TYR A 2 6.647 4.921 3.993 1.00 0.00 H ATOM 39 HB2 TYR A 2 9.461 5.899 3.517 1.00 0.00 H ATOM 40 HB3 TYR A 2 8.067 6.701 2.807 1.00 0.00 H ATOM 41 HD1 TYR A 2 9.893 6.016 5.901 1.00 0.00 H ATOM 42 HD2 TYR A 2 6.505 7.947 4.201 1.00 0.00 H ATOM 43 HE1 TYR A 2 9.597 7.308 7.973 1.00 0.00 H ATOM 44 HE2 TYR A 2 6.199 9.245 6.267 1.00 0.00 H ATOM 45 HH TYR A 2 6.782 9.083 8.645 1.00 0.00 H HETATM 46 N MAA A 3 6.515 4.592 1.364 1.00 0.00 N HETATM 47 CM MAA A 3 5.445 5.485 1.880 1.00 0.00 C HETATM 48 CA MAA A 3 6.368 4.111 -0.044 1.00 0.00 C HETATM 49 CB MAA A 3 7.627 4.322 -0.865 1.00 0.00 C HETATM 50 C MAA A 3 6.034 2.643 -0.115 1.00 0.00 C HETATM 51 O MAA A 3 6.298 1.869 0.809 1.00 0.00 O HETATM 52 HM1 MAA A 3 4.833 4.941 2.582 1.00 0.00 H HETATM 53 HM2 MAA A 3 4.830 5.826 1.061 1.00 0.00 H HETATM 54 HM3 MAA A 3 5.888 6.336 2.373 1.00 0.00 H HETATM 55 HA MAA A 3 5.564 4.645 -0.558 1.00 0.00 H HETATM 56 HB1 MAA A 3 7.528 3.755 -1.783 1.00 0.00 H HETATM 57 HB2 MAA A 3 8.478 3.962 -0.310 1.00 0.00 H HETATM 58 HB3 MAA A 3 7.748 5.367 -1.089 1.00 0.00 H ATOM 59 N CYS A 4 5.496 2.289 -1.267 1.00 0.00 N ATOM 60 CA CYS A 4 5.083 0.948 -1.595 1.00 0.00 C ATOM 61 C CYS A 4 6.248 -0.013 -1.776 1.00 0.00 C ATOM 62 O CYS A 4 7.304 0.349 -2.301 1.00 0.00 O ATOM 63 CB CYS A 4 4.258 1.030 -2.835 1.00 0.00 C ATOM 64 SG CYS A 4 3.891 -0.558 -3.561 1.00 0.00 S ATOM 65 H CYS A 4 5.369 2.985 -1.944 1.00 0.00 H ATOM 66 HA CYS A 4 4.472 0.554 -0.808 1.00 0.00 H ATOM 67 HB2 CYS A 4 3.322 1.533 -2.612 1.00 0.00 H ATOM 68 HB3 CYS A 4 4.800 1.601 -3.565 1.00 0.00 H ATOM 69 N PRO A 5 6.030 -1.262 -1.326 1.00 0.00 N ATOM 70 CA PRO A 5 7.031 -2.334 -1.378 1.00 0.00 C ATOM 71 C PRO A 5 7.028 -3.201 -2.647 1.00 0.00 C ATOM 72 O PRO A 5 8.030 -3.855 -2.950 1.00 0.00 O ATOM 73 CB PRO A 5 6.558 -3.148 -0.184 1.00 0.00 C ATOM 74 CG PRO A 5 5.084 -3.158 -0.362 1.00 0.00 C ATOM 75 CD PRO A 5 4.772 -1.736 -0.657 1.00 0.00 C ATOM 76 HA PRO A 5 8.021 -1.964 -1.195 1.00 0.00 H ATOM 77 HB2 PRO A 5 6.977 -4.143 -0.204 1.00 0.00 H ATOM 78 HB3 PRO A 5 6.805 -2.631 0.727 1.00 0.00 H ATOM 79 HG2 PRO A 5 4.815 -3.780 -1.213 1.00 0.00 H ATOM 80 HG3 PRO A 5 4.586 -3.475 0.537 1.00 0.00 H ATOM 81 HD2 PRO A 5 3.922 -1.661 -1.321 1.00 0.00 H ATOM 82 HD3 PRO A 5 4.595 -1.195 0.259 1.00 0.00 H ATOM 83 N GLU A 6 5.908 -3.201 -3.378 1.00 0.00 N ATOM 84 CA GLU A 6 5.787 -4.059 -4.567 1.00 0.00 C ATOM 85 C GLU A 6 5.429 -3.277 -5.842 1.00 0.00 C ATOM 86 O GLU A 6 5.704 -3.751 -6.949 1.00 0.00 O ATOM 87 CB GLU A 6 4.794 -5.209 -4.279 1.00 0.00 C ATOM 88 CG GLU A 6 4.450 -6.088 -5.478 1.00 0.00 C ATOM 89 CD GLU A 6 3.451 -7.177 -5.139 1.00 0.00 C ATOM 90 OE1 GLU A 6 3.885 -8.276 -4.738 1.00 0.00 O ATOM 91 OE2 GLU A 6 2.234 -6.929 -5.273 1.00 0.00 O1- ATOM 92 H GLU A 6 5.167 -2.588 -3.127 1.00 0.00 H ATOM 93 HA GLU A 6 6.753 -4.502 -4.724 1.00 0.00 H ATOM 94 HB2 GLU A 6 5.225 -5.845 -3.520 1.00 0.00 H ATOM 95 HB3 GLU A 6 3.879 -4.791 -3.891 1.00 0.00 H ATOM 96 HG2 GLU A 6 4.030 -5.461 -6.250 1.00 0.00 H ATOM 97 HG3 GLU A 6 5.357 -6.547 -5.842 1.00 0.00 H ATOM 98 N CYS A 7 4.833 -2.092 -5.692 1.00 0.00 N ATOM 99 CA CYS A 7 4.478 -1.269 -6.860 1.00 0.00 C ATOM 100 C CYS A 7 4.766 0.227 -6.633 1.00 0.00 C ATOM 101 O CYS A 7 4.207 0.834 -5.732 1.00 0.00 O ATOM 102 CB CYS A 7 3.033 -1.478 -7.360 1.00 0.00 C ATOM 103 SG CYS A 7 1.744 -0.454 -6.595 1.00 0.00 S ATOM 104 H CYS A 7 4.676 -1.754 -4.786 1.00 0.00 H ATOM 105 HA CYS A 7 5.129 -1.607 -7.640 1.00 0.00 H ATOM 106 HB2 CYS A 7 3.012 -1.245 -8.409 1.00 0.00 H ATOM 107 HB3 CYS A 7 2.761 -2.509 -7.220 1.00 0.00 H ATOM 108 N PRO A 8 5.644 0.832 -7.485 1.00 0.00 N ATOM 109 CA PRO A 8 6.048 2.265 -7.427 1.00 0.00 C ATOM 110 C PRO A 8 4.887 3.281 -7.471 1.00 0.00 C ATOM 111 O PRO A 8 4.957 4.303 -8.167 1.00 0.00 O ATOM 112 CB PRO A 8 6.947 2.424 -8.662 1.00 0.00 C ATOM 113 CG PRO A 8 7.451 1.060 -8.952 1.00 0.00 C ATOM 114 CD PRO A 8 6.344 0.129 -8.560 1.00 0.00 C ATOM 115 HA PRO A 8 6.637 2.457 -6.541 1.00 0.00 H ATOM 116 HB2 PRO A 8 6.365 2.807 -9.492 1.00 0.00 H ATOM 117 HB3 PRO A 8 7.769 3.087 -8.444 1.00 0.00 H ATOM 118 HG2 PRO A 8 7.674 0.966 -10.007 1.00 0.00 H ATOM 119 HG3 PRO A 8 8.331 0.857 -8.360 1.00 0.00 H ATOM 120 HD2 PRO A 8 5.672 -0.042 -9.380 1.00 0.00 H ATOM 121 HD3 PRO A 8 6.741 -0.804 -8.188 1.00 0.00 H ATOM 122 N LYS A 9 3.827 2.996 -6.701 1.00 0.00 N ATOM 123 CA LYS A 9 2.672 3.871 -6.576 1.00 0.00 C ATOM 124 C LYS A 9 2.988 5.115 -5.728 1.00 0.00 C ATOM 125 O LYS A 9 2.479 6.189 -6.043 1.00 0.00 O ATOM 126 CB LYS A 9 1.462 3.063 -6.076 1.00 0.00 C ATOM 127 CG LYS A 9 0.128 3.529 -6.662 1.00 0.00 C ATOM 128 CD LYS A 9 -0.198 2.804 -7.962 1.00 0.00 C ATOM 129 CE LYS A 9 -1.526 3.265 -8.540 1.00 0.00 C ATOM 130 NZ LYS A 9 -1.837 2.586 -9.828 1.00 0.00 N1+ ATOM 131 H LYS A 9 3.814 2.149 -6.211 1.00 0.00 H ATOM 132 HA LYS A 9 2.453 4.227 -7.506 1.00 0.00 H ATOM 133 HB2 LYS A 9 1.605 2.029 -6.356 1.00 0.00 H ATOM 134 HB3 LYS A 9 1.412 3.125 -5.003 1.00 0.00 H ATOM 135 HG2 LYS A 9 -0.661 3.335 -5.952 1.00 0.00 H ATOM 136 HG3 LYS A 9 0.185 4.589 -6.859 1.00 0.00 H ATOM 137 HD2 LYS A 9 0.583 3.005 -8.680 1.00 0.00 H ATOM 138 HD3 LYS A 9 -0.248 1.742 -7.769 1.00 0.00 H ATOM 139 HE2 LYS A 9 -2.310 3.044 -7.830 1.00 0.00 H ATOM 140 HE3 LYS A 9 -1.482 4.331 -8.706 1.00 0.00 H ATOM 141 HZ1 LYS A 9 -1.883 1.556 -9.687 1.00 0.00 H ATOM 142 HZ2 LYS A 9 -1.099 2.796 -10.529 1.00 0.00 H ATOM 143 HZ3 LYS A 9 -2.753 2.916 -10.195 1.00 0.00 H HETATM 144 N MMO A 10 3.833 4.980 -4.654 1.00 0.00 N HETATM 145 CA MMO A 10 4.280 6.066 -3.755 1.00 0.00 C HETATM 146 C MMO A 10 3.412 7.326 -3.728 1.00 0.00 C HETATM 147 O MMO A 10 3.155 7.955 -4.758 1.00 0.00 O HETATM 148 CB MMO A 10 5.727 6.381 -4.187 1.00 0.00 C HETATM 149 CG MMO A 10 6.571 7.082 -3.134 1.00 0.00 C HETATM 150 CD MMO A 10 8.043 6.764 -3.330 1.00 0.00 C HETATM 151 NE MMO A 10 8.885 7.383 -2.301 1.00 0.00 N HETATM 152 CZ MMO A 10 10.217 7.249 -2.221 1.00 0.00 C HETATM 153 NH2 MMO A 10 10.878 7.856 -1.245 1.00 0.00 N HETATM 154 NH1 MMO A 10 10.889 6.514 -3.104 1.00 0.00 N HETATM 155 CN MMO A 10 4.286 3.639 -4.268 1.00 0.00 C HETATM 156 HA MMO A 10 4.284 5.650 -2.778 1.00 0.00 H HETATM 157 HCB1 MMO A 10 5.700 7.000 -5.071 1.00 0.00 H HETATM 158 HCB2 MMO A 10 6.216 5.451 -4.425 1.00 0.00 H HETATM 159 HCG1 MMO A 10 6.265 6.747 -2.155 1.00 0.00 H HETATM 160 HCG2 MMO A 10 6.428 8.149 -3.217 1.00 0.00 H HETATM 161 HCD1 MMO A 10 8.348 7.126 -4.300 1.00 0.00 H HETATM 162 HCD2 MMO A 10 8.172 5.691 -3.293 1.00 0.00 H HETATM 163 HH21 MMO A 10 10.383 8.410 -0.576 1.00 0.00 H HETATM 164 HH22 MMO A 10 11.871 7.760 -1.179 1.00 0.00 H HETATM 165 HH11 MMO A 10 11.883 6.425 -3.028 1.00 0.00 H HETATM 166 HC1 MMO A 10 4.221 3.532 -3.198 1.00 0.00 H HETATM 167 HC2 MMO A 10 5.306 3.494 -4.592 1.00 0.00 H HETATM 168 HC3 MMO A 10 3.648 2.909 -4.745 1.00 0.00 H HETATM 169 HE MMO A 10 8.434 7.933 -1.627 1.00 0.00 H HETATM 170 HH12 MMO A 10 10.402 6.052 -3.845 1.00 0.00 H ATOM 171 N PHE A 11 3.023 7.704 -2.512 1.00 0.00 N ATOM 172 CA PHE A 11 2.105 8.810 -2.296 1.00 0.00 C ATOM 173 C PHE A 11 2.680 9.820 -1.307 1.00 0.00 C ATOM 174 O PHE A 11 3.270 10.822 -1.724 1.00 0.00 O ATOM 175 CB PHE A 11 0.752 8.206 -1.816 1.00 0.00 C ATOM 176 CG PHE A 11 0.681 6.707 -2.060 1.00 0.00 C ATOM 177 CD1 PHE A 11 0.690 5.792 -1.012 1.00 0.00 C ATOM 178 CD2 PHE A 11 0.656 6.214 -3.358 1.00 0.00 C ATOM 179 CE1 PHE A 11 0.678 4.439 -1.267 1.00 0.00 C ATOM 180 CE2 PHE A 11 0.652 4.874 -3.606 1.00 0.00 C ATOM 181 CZ PHE A 11 0.668 3.983 -2.580 1.00 0.00 C ATOM 182 H PHE A 11 3.374 7.229 -1.732 1.00 0.00 H ATOM 183 HA PHE A 11 1.950 9.301 -3.244 1.00 0.00 H ATOM 184 HB2 PHE A 11 0.637 8.383 -0.758 1.00 0.00 H ATOM 185 HB3 PHE A 11 -0.061 8.673 -2.351 1.00 0.00 H ATOM 186 HD1 PHE A 11 0.733 6.137 0.010 1.00 0.00 H ATOM 187 HD2 PHE A 11 0.653 6.903 -4.181 1.00 0.00 H ATOM 188 HE1 PHE A 11 0.675 3.747 -0.444 1.00 0.00 H ATOM 189 HE2 PHE A 11 0.683 4.511 -4.626 1.00 0.00 H ATOM 190 HZ PHE A 11 0.662 2.926 -2.810 1.00 0.00 H HETATM 191 N NLE A 12 2.518 9.549 0.000 1.00 0.00 N HETATM 192 CA NLE A 12 3.012 10.433 1.067 1.00 0.00 C HETATM 193 C NLE A 12 2.704 9.847 2.449 1.00 0.00 C HETATM 194 O NLE A 12 3.160 10.382 3.466 1.00 0.00 O HETATM 195 CB NLE A 12 2.374 11.835 0.945 1.00 0.00 C HETATM 196 CG NLE A 12 3.287 12.993 1.353 1.00 0.00 C HETATM 197 CD NLE A 12 3.147 13.333 2.830 1.00 0.00 C HETATM 198 CE NLE A 12 4.076 14.471 3.195 1.00 0.00 C HETATM 199 H NLE A 12 2.052 8.725 0.255 1.00 0.00 H HETATM 200 HA NLE A 12 4.082 10.519 0.955 1.00 0.00 H HETATM 201 HB2 NLE A 12 1.491 11.864 1.565 1.00 0.00 H HETATM 202 HB3 NLE A 12 2.082 11.981 -0.084 1.00 0.00 H HETATM 203 HG2 NLE A 12 3.026 13.864 0.770 1.00 0.00 H HETATM 204 HG3 NLE A 12 4.312 12.722 1.155 1.00 0.00 H HETATM 205 HD2 NLE A 12 3.407 12.468 3.425 1.00 0.00 H HETATM 206 HD3 NLE A 12 2.131 13.634 3.037 1.00 0.00 H HETATM 207 HE1 NLE A 12 5.096 14.183 2.991 1.00 0.00 H HETATM 208 HE2 NLE A 12 3.969 14.701 4.245 1.00 0.00 H HETATM 209 HE3 NLE A 12 3.824 15.342 2.608 1.00 0.00 H ATOM 210 N ARG A 13 1.949 8.737 2.485 1.00 0.00 N ATOM 211 CA ARG A 13 1.578 8.115 3.751 1.00 0.00 C ATOM 212 C ARG A 13 1.907 6.635 3.738 1.00 0.00 C ATOM 213 O ARG A 13 1.658 5.944 2.745 1.00 0.00 O ATOM 214 CB ARG A 13 0.089 8.336 4.034 1.00 0.00 C ATOM 215 CG ARG A 13 -0.221 9.662 4.720 1.00 0.00 C ATOM 216 CD ARG A 13 -0.186 9.539 6.238 1.00 0.00 C ATOM 217 NE ARG A 13 -0.508 10.810 6.898 1.00 0.00 N ATOM 218 CZ ARG A 13 -1.012 10.923 8.135 1.00 0.00 C ATOM 219 NH1 ARG A 13 -1.263 9.845 8.878 1.00 0.00 N1+ ATOM 220 NH2 ARG A 13 -1.268 12.125 8.632 1.00 0.00 N ATOM 221 H ARG A 13 1.659 8.310 1.637 1.00 0.00 H ATOM 222 HA ARG A 13 2.155 8.589 4.531 1.00 0.00 H ATOM 223 HB2 ARG A 13 -0.444 8.312 3.097 1.00 0.00 H ATOM 224 HB3 ARG A 13 -0.269 7.535 4.664 1.00 0.00 H ATOM 225 HG2 ARG A 13 0.514 10.392 4.415 1.00 0.00 H ATOM 226 HG3 ARG A 13 -1.204 9.992 4.419 1.00 0.00 H ATOM 227 HD2 ARG A 13 -0.906 8.795 6.544 1.00 0.00 H ATOM 228 HD3 ARG A 13 0.803 9.228 6.539 1.00 0.00 H ATOM 229 HE ARG A 13 -0.339 11.631 6.390 1.00 0.00 H ATOM 230 HH11 ARG A 13 -1.076 8.933 8.514 1.00 0.00 H ATOM 231 HH12 ARG A 13 -1.639 9.949 9.799 1.00 0.00 H ATOM 232 HH21 ARG A 13 -1.643 12.216 9.554 1.00 0.00 H ATOM 233 HH22 ARG A 13 -1.085 12.941 8.084 1.00 0.00 H ATOM 234 N SER A 14 2.467 6.158 4.850 1.00 0.00 N ATOM 235 CA SER A 14 2.854 4.758 4.983 1.00 0.00 C ATOM 236 C SER A 14 1.716 3.911 5.560 1.00 0.00 C ATOM 237 O SER A 14 1.498 2.784 5.110 1.00 0.00 O ATOM 238 CB SER A 14 4.099 4.633 5.862 1.00 0.00 C ATOM 239 OG SER A 14 5.175 5.388 5.333 1.00 0.00 O ATOM 240 H SER A 14 2.625 6.767 5.602 1.00 0.00 H ATOM 241 HA SER A 14 3.085 4.397 3.990 1.00 0.00 H ATOM 242 HB2 SER A 14 3.875 4.994 6.854 1.00 0.00 H ATOM 243 HB3 SER A 14 4.396 3.595 5.915 1.00 0.00 H ATOM 244 HG SER A 14 5.163 6.270 5.711 1.00 0.00 H HETATM 245 OE1 B3D A 15 1.149 1.627 9.416 1.00 0.00 O HETATM 246 CD B3D A 15 1.345 2.806 9.051 1.00 0.00 C HETATM 247 OE2 B3D A 15 2.481 3.316 8.966 1.00 0.00 O HETATM 248 CG B3D A 15 0.141 3.661 8.694 1.00 0.00 C HETATM 249 CB B3D A 15 -0.096 3.754 7.171 1.00 0.00 C HETATM 250 N B3D A 15 1.007 4.454 6.559 1.00 0.00 N HETATM 251 CA B3D A 15 -1.416 4.506 6.968 1.00 0.00 C HETATM 252 C B3D A 15 -2.112 4.150 5.684 1.00 0.00 C HETATM 253 O B3D A 15 -2.625 3.025 5.517 1.00 0.00 O HETATM 254 HG3 B3D A 15 0.300 4.653 9.088 1.00 0.00 H HETATM 255 HG2 B3D A 15 -0.731 3.229 9.163 1.00 0.00 H HETATM 256 HB B3D A 15 -0.137 2.761 6.676 1.00 0.00 H HETATM 257 H B3D A 15 1.244 5.349 6.882 1.00 0.00 H HETATM 258 HA1 B3D A 15 -1.217 5.568 6.959 1.00 0.00 H HETATM 259 HA2 B3D A 15 -2.083 4.279 7.786 1.00 0.00 H ATOM 260 N HIS A 16 -2.103 5.116 4.749 1.00 0.00 N ATOM 261 CA HIS A 16 -2.727 4.959 3.427 1.00 0.00 C ATOM 262 C HIS A 16 -2.114 3.797 2.653 1.00 0.00 C ATOM 263 O HIS A 16 -2.824 3.105 1.930 1.00 0.00 O ATOM 264 CB HIS A 16 -2.607 6.246 2.610 1.00 0.00 C ATOM 265 CG HIS A 16 -3.459 7.372 3.119 1.00 0.00 C ATOM 266 ND1 HIS A 16 -4.609 7.791 2.483 1.00 0.00 N ATOM 267 CD2 HIS A 16 -3.324 8.168 4.209 1.00 0.00 C ATOM 268 CE1 HIS A 16 -5.142 8.795 3.156 1.00 0.00 C ATOM 269 NE2 HIS A 16 -4.382 9.043 4.207 1.00 0.00 N ATOM 270 H HIS A 16 -1.660 5.965 4.958 1.00 0.00 H ATOM 271 HA HIS A 16 -3.775 4.747 3.587 1.00 0.00 H ATOM 272 HB2 HIS A 16 -1.582 6.572 2.620 1.00 0.00 H ATOM 273 HB3 HIS A 16 -2.903 6.043 1.591 1.00 0.00 H ATOM 274 HD1 HIS A 16 -4.978 7.409 1.659 1.00 0.00 H ATOM 275 HD2 HIS A 16 -2.531 8.121 4.943 1.00 0.00 H ATOM 276 HE1 HIS A 16 -6.046 9.323 2.893 1.00 0.00 H ATOM 277 HE2 HIS A 16 -4.494 9.799 4.820 1.00 0.00 H ATOM 278 N LEU A 17 -0.786 3.605 2.792 1.00 0.00 N ATOM 279 CA LEU A 17 -0.096 2.497 2.142 1.00 0.00 C ATOM 280 C LEU A 17 -0.366 1.176 2.859 1.00 0.00 C ATOM 281 O LEU A 17 -0.410 0.142 2.214 1.00 0.00 O ATOM 282 CB LEU A 17 1.424 2.705 2.052 1.00 0.00 C ATOM 283 CG LEU A 17 2.209 1.489 1.508 1.00 0.00 C ATOM 284 CD1 LEU A 17 2.134 1.395 -0.011 1.00 0.00 C ATOM 285 CD2 LEU A 17 3.643 1.519 1.976 1.00 0.00 C ATOM 286 H LEU A 17 -0.265 4.240 3.305 1.00 0.00 H ATOM 287 HA LEU A 17 -0.500 2.427 1.142 1.00 0.00 H ATOM 288 HB2 LEU A 17 1.623 3.557 1.421 1.00 0.00 H ATOM 289 HB3 LEU A 17 1.788 2.920 3.043 1.00 0.00 H ATOM 290 HG LEU A 17 1.759 0.591 1.907 1.00 0.00 H ATOM 291 HD11 LEU A 17 2.781 2.138 -0.463 1.00 0.00 H ATOM 292 HD12 LEU A 17 1.112 1.567 -0.321 1.00 0.00 H ATOM 293 HD13 LEU A 17 2.438 0.394 -0.333 1.00 0.00 H ATOM 294 HD21 LEU A 17 4.141 0.619 1.643 1.00 0.00 H ATOM 295 HD22 LEU A 17 3.666 1.571 3.053 1.00 0.00 H ATOM 296 HD23 LEU A 17 4.139 2.383 1.558 1.00 0.00 H ATOM 297 N SER A 18 -0.479 1.208 4.195 1.00 0.00 N ATOM 298 CA SER A 18 -0.768 -0.006 4.972 1.00 0.00 C ATOM 299 C SER A 18 -2.057 -0.651 4.463 1.00 0.00 C ATOM 300 O SER A 18 -2.049 -1.808 4.030 1.00 0.00 O ATOM 301 CB SER A 18 -0.874 0.305 6.470 1.00 0.00 C ATOM 302 OG SER A 18 0.362 0.770 6.983 1.00 0.00 O ATOM 303 H SER A 18 -0.339 2.056 4.663 1.00 0.00 H ATOM 304 HA SER A 18 0.049 -0.696 4.814 1.00 0.00 H ATOM 305 HB2 SER A 18 -1.625 1.065 6.627 1.00 0.00 H ATOM 306 HB3 SER A 18 -1.154 -0.593 7.002 1.00 0.00 H ATOM 307 HG SER A 18 1.008 0.061 6.952 1.00 0.00 H HETATM 308 N B3K A 19 -3.143 0.127 4.463 1.00 0.00 N HETATM 309 CB B3K A 19 -4.405 -0.359 3.976 1.00 0.00 C HETATM 310 CG B3K A 19 -5.484 -0.178 5.067 1.00 0.00 C HETATM 311 CD B3K A 19 -5.269 -1.040 6.305 1.00 0.00 C HETATM 312 CE B3K A 19 -6.348 -0.798 7.348 1.00 0.00 C HETATM 313 CF B3K A 19 -6.141 -1.668 8.577 1.00 0.00 C HETATM 314 NZ B3K A 19 -7.195 -1.442 9.603 1.00 0.00 N HETATM 315 CA B3K A 19 -4.857 0.450 2.757 1.00 0.00 C HETATM 316 C B3K A 19 -4.302 -0.041 1.441 1.00 0.00 C HETATM 317 O B3K A 19 -4.744 -1.066 0.900 1.00 0.00 O HETATM 318 H B3K A 19 -3.076 1.056 4.802 1.00 0.00 H HETATM 319 HB B3K A 19 -4.238 -1.421 3.696 1.00 0.00 H HETATM 320 HG2 B3K A 19 -6.448 -0.430 4.649 1.00 0.00 H HETATM 321 HG3 B3K A 19 -5.497 0.856 5.375 1.00 0.00 H HETATM 322 HD2 B3K A 19 -4.306 -0.801 6.735 1.00 0.00 H HETATM 323 HD3 B3K A 19 -5.289 -2.080 6.017 1.00 0.00 H HETATM 324 HE2 B3K A 19 -7.312 -1.026 6.915 1.00 0.00 H HETATM 325 HE3 B3K A 19 -6.322 0.240 7.645 1.00 0.00 H HETATM 326 HF1 B3K A 19 -5.176 -1.437 9.007 1.00 0.00 H HETATM 327 HF2 B3K A 19 -6.160 -2.704 8.276 1.00 0.00 H HETATM 328 HNZ1 B3K A 19 -7.189 -0.449 9.910 1.00 0.00 H HETATM 329 HNZ2 B3K A 19 -7.027 -2.050 10.430 1.00 0.00 H HETATM 330 HA1 B3K A 19 -5.934 0.418 2.695 1.00 0.00 H HETATM 331 HA2 B3K A 19 -4.546 1.475 2.889 1.00 0.00 H HETATM 332 HZ3 B3K A 19 -8.132 -1.666 9.208 1.00 0.00 H ATOM 333 N HIS A 20 -3.263 0.666 0.956 1.00 0.00 N ATOM 334 CA HIS A 20 -2.629 0.393 -0.327 1.00 0.00 C ATOM 335 C HIS A 20 -2.112 -1.048 -0.470 1.00 0.00 C ATOM 336 O HIS A 20 -2.213 -1.657 -1.537 1.00 0.00 O ATOM 337 CB HIS A 20 -1.478 1.349 -0.523 1.00 0.00 C ATOM 338 CG HIS A 20 -0.811 1.133 -1.820 1.00 0.00 C ATOM 339 ND1 HIS A 20 -1.237 1.672 -3.008 1.00 0.00 N ATOM 340 CD2 HIS A 20 0.222 0.328 -2.112 1.00 0.00 C ATOM 341 CE1 HIS A 20 -0.464 1.168 -3.968 1.00 0.00 C ATOM 342 NE2 HIS A 20 0.440 0.360 -3.459 1.00 0.00 N ATOM 343 H HIS A 20 -2.877 1.380 1.506 1.00 0.00 H ATOM 344 HA HIS A 20 -3.330 0.601 -1.096 1.00 0.00 H ATOM 345 HB2 HIS A 20 -1.838 2.368 -0.482 1.00 0.00 H ATOM 346 HB3 HIS A 20 -0.760 1.178 0.257 1.00 0.00 H ATOM 347 HD1 HIS A 20 -1.974 2.306 -3.128 1.00 0.00 H ATOM 348 HD2 HIS A 20 0.753 -0.320 -1.408 1.00 0.00 H ATOM 349 HE1 HIS A 20 -0.615 1.329 -5.017 1.00 0.00 H ATOM 350 N ILE A 21 -1.509 -1.555 0.585 1.00 0.00 N ATOM 351 CA ILE A 21 -0.939 -2.881 0.562 1.00 0.00 C ATOM 352 C ILE A 21 -1.860 -3.918 1.200 1.00 0.00 C ATOM 353 O ILE A 21 -1.650 -5.118 1.034 1.00 0.00 O ATOM 354 CB ILE A 21 0.499 -2.896 1.151 1.00 0.00 C ATOM 355 CG1 ILE A 21 0.543 -2.701 2.678 1.00 0.00 C ATOM 356 CG2 ILE A 21 1.342 -1.864 0.464 1.00 0.00 C ATOM 357 CD1 ILE A 21 0.654 -3.995 3.456 1.00 0.00 C ATOM 358 H ILE A 21 -1.429 -1.021 1.386 1.00 0.00 H ATOM 359 HA ILE A 21 -0.854 -3.136 -0.478 1.00 0.00 H ATOM 360 HB ILE A 21 0.933 -3.814 0.893 1.00 0.00 H ATOM 361 HG12 ILE A 21 1.396 -2.090 2.931 1.00 0.00 H ATOM 362 HG13 ILE A 21 -0.359 -2.198 2.995 1.00 0.00 H ATOM 363 HG21 ILE A 21 2.289 -1.778 0.968 1.00 0.00 H ATOM 364 HG22 ILE A 21 0.824 -0.922 0.490 1.00 0.00 H ATOM 365 HG23 ILE A 21 1.499 -2.173 -0.559 1.00 0.00 H ATOM 366 HD11 ILE A 21 0.679 -3.778 4.514 1.00 0.00 H ATOM 367 HD12 ILE A 21 1.561 -4.509 3.173 1.00 0.00 H ATOM 368 HD13 ILE A 21 -0.197 -4.622 3.237 1.00 0.00 H HETATM 369 N B3K A 22 -2.840 -3.444 1.969 1.00 0.00 N HETATM 370 CB B3K A 22 -3.824 -4.302 2.541 1.00 0.00 C HETATM 371 CG B3K A 22 -3.851 -4.112 4.069 1.00 0.00 C HETATM 372 CD B3K A 22 -3.829 -5.421 4.844 1.00 0.00 C HETATM 373 CE B3K A 22 -3.854 -5.181 6.346 1.00 0.00 C HETATM 374 CF B3K A 22 -3.830 -6.488 7.119 1.00 0.00 C HETATM 375 NZ B3K A 22 -3.850 -6.264 8.591 1.00 0.00 N HETATM 376 CA B3K A 22 -5.217 -3.919 2.012 1.00 0.00 C HETATM 377 C B3K A 22 -5.419 -4.101 0.515 1.00 0.00 C HETATM 378 O B3K A 22 -6.314 -4.861 0.105 1.00 0.00 O HETATM 379 H B3K A 22 -2.860 -2.483 2.184 1.00 0.00 H HETATM 380 HB B3K A 22 -3.553 -5.334 2.230 1.00 0.00 H HETATM 381 HG2 B3K A 22 -4.749 -3.578 4.339 1.00 0.00 H HETATM 382 HG3 B3K A 22 -2.991 -3.529 4.365 1.00 0.00 H HETATM 383 HD2 B3K A 22 -2.930 -5.963 4.591 1.00 0.00 H HETATM 384 HD3 B3K A 22 -4.694 -6.006 4.569 1.00 0.00 H HETATM 385 HE2 B3K A 22 -4.754 -4.639 6.598 1.00 0.00 H HETATM 386 HE3 B3K A 22 -2.990 -4.595 6.621 1.00 0.00 H HETATM 387 HF1 B3K A 22 -2.933 -7.030 6.859 1.00 0.00 H HETATM 388 HF2 B3K A 22 -4.695 -7.073 6.842 1.00 0.00 H HETATM 389 HNZ1 B3K A 22 -3.021 -5.706 8.879 1.00 0.00 H HETATM 390 HNZ2 B3K A 22 -3.833 -7.174 9.093 1.00 0.00 H HETATM 391 HA1 B3K A 22 -5.400 -2.880 2.244 1.00 0.00 H HETATM 392 HA2 B3K A 22 -5.955 -4.522 2.520 1.00 0.00 H HETATM 393 HZ3 B3K A 22 -4.712 -5.748 8.862 1.00 0.00 H ATOM 394 N THR A 23 -4.572 -3.433 -0.319 1.00 0.00 N ATOM 395 CA THR A 23 -4.712 -3.524 -1.781 1.00 0.00 C ATOM 396 C THR A 23 -3.737 -4.541 -2.347 1.00 0.00 C ATOM 397 O THR A 23 -4.128 -5.373 -3.172 1.00 0.00 O ATOM 398 CB THR A 23 -4.558 -2.153 -2.503 1.00 0.00 C ATOM 399 OG1 THR A 23 -5.149 -1.111 -1.716 1.00 0.00 O ATOM 400 CG2 THR A 23 -5.228 -2.176 -3.872 1.00 0.00 C ATOM 401 H THR A 23 -3.814 -2.913 0.061 1.00 0.00 H ATOM 402 HA THR A 23 -5.707 -3.891 -1.972 1.00 0.00 H ATOM 403 HB THR A 23 -3.499 -1.933 -2.643 1.00 0.00 H ATOM 404 HG1 THR A 23 -6.026 -0.914 -2.052 1.00 0.00 H ATOM 405 HG21 THR A 23 -5.055 -1.237 -4.374 1.00 0.00 H ATOM 406 HG22 THR A 23 -6.290 -2.330 -3.748 1.00 0.00 H ATOM 407 HG23 THR A 23 -4.813 -2.983 -4.457 1.00 0.00 H ATOM 408 N HIS A 24 -2.463 -4.477 -1.916 1.00 0.00 N ATOM 409 CA HIS A 24 -1.460 -5.468 -2.353 1.00 0.00 C ATOM 410 C HIS A 24 -1.883 -6.841 -1.890 1.00 0.00 C ATOM 411 O HIS A 24 -1.576 -7.876 -2.487 1.00 0.00 O ATOM 412 CB HIS A 24 -0.078 -5.143 -1.806 1.00 0.00 C ATOM 413 CG HIS A 24 0.690 -4.201 -2.665 1.00 0.00 C ATOM 414 ND1 HIS A 24 1.640 -4.586 -3.599 1.00 0.00 N ATOM 415 CD2 HIS A 24 0.603 -2.856 -2.769 1.00 0.00 C ATOM 416 CE1 HIS A 24 2.057 -3.477 -4.216 1.00 0.00 C ATOM 417 NE2 HIS A 24 1.457 -2.444 -3.762 1.00 0.00 N ATOM 418 H HIS A 24 -2.193 -3.741 -1.322 1.00 0.00 H ATOM 419 HA HIS A 24 -1.461 -5.456 -3.403 1.00 0.00 H ATOM 420 HB2 HIS A 24 -0.200 -4.694 -0.833 1.00 0.00 H ATOM 421 HB3 HIS A 24 0.490 -6.055 -1.710 1.00 0.00 H ATOM 422 HD1 HIS A 24 1.982 -5.490 -3.749 1.00 0.00 H ATOM 423 HD2 HIS A 24 0.066 -2.185 -2.106 1.00 0.00 H ATOM 424 HE1 HIS A 24 2.852 -3.415 -4.939 1.00 0.00 H HETATM 425 N B3Q A 25 -2.595 -6.769 -0.803 1.00 0.00 N HETATM 426 CB B3Q A 25 -3.222 -7.879 -0.153 1.00 0.00 C HETATM 427 CG B3Q A 25 -2.560 -8.210 1.192 1.00 0.00 C HETATM 428 CA B3Q A 25 -4.631 -7.366 0.039 1.00 0.00 C HETATM 429 C B3Q A 25 -5.742 -8.382 -0.084 1.00 0.00 C HETATM 430 O B3Q A 25 -5.512 -9.584 -0.267 1.00 0.00 O HETATM 431 HN B3Q A 25 -2.721 -5.865 -0.411 1.00 0.00 H HETATM 432 HB B3Q A 25 -3.214 -8.736 -0.811 1.00 0.00 H HETATM 433 HG B3Q A 25 -3.141 -8.975 1.687 1.00 0.00 H HETATM 434 HGA B3Q A 25 -2.555 -7.323 1.805 1.00 0.00 H HETATM 435 CD B3Q A 25 -1.121 -8.704 1.067 1.00 0.00 C HETATM 436 HA B3Q A 25 -4.701 -6.901 1.007 1.00 0.00 H HETATM 437 HAA B3Q A 25 -4.778 -6.603 -0.731 1.00 0.00 H HETATM 438 CE B3Q A 25 -0.184 -8.021 2.045 1.00 0.00 C HETATM 439 NF2 B3Q A 25 0.392 -6.897 1.627 1.00 0.00 N HETATM 440 H8 B3Q A 25 -0.774 -8.509 0.063 1.00 0.00 H HETATM 441 OF1 B3Q A 25 0.019 -8.495 3.162 1.00 0.00 O HETATM 442 H9 B3Q A 25 -1.098 -9.768 1.254 1.00 0.00 H HETATM 443 H11 B3Q A 25 0.183 -6.576 0.725 1.00 0.00 H HETATM 444 H12 B3Q A 25 1.003 -6.433 2.239 1.00 0.00 H ATOM 445 N ASN A 26 -6.972 -7.862 0.023 1.00 0.00 N ATOM 446 CA ASN A 26 -8.191 -8.678 -0.061 1.00 0.00 C ATOM 447 C ASN A 26 -9.312 -7.910 -0.756 1.00 0.00 C ATOM 448 O ASN A 26 -9.348 -6.676 -0.714 1.00 0.00 O ATOM 449 CB ASN A 26 -8.654 -9.112 1.338 1.00 0.00 C ATOM 450 CG ASN A 26 -7.735 -10.143 1.966 1.00 0.00 C ATOM 451 OD1 ASN A 26 -7.926 -11.347 1.796 1.00 0.00 O ATOM 452 ND2 ASN A 26 -6.729 -9.673 2.696 1.00 0.00 N ATOM 453 H ASN A 26 -7.059 -6.884 0.156 1.00 0.00 H ATOM 454 HA ASN A 26 -7.959 -9.558 -0.643 1.00 0.00 H ATOM 455 HB2 ASN A 26 -8.686 -8.247 1.983 1.00 0.00 H ATOM 456 HB3 ASN A 26 -9.645 -9.537 1.265 1.00 0.00 H ATOM 457 HD21 ASN A 26 -6.639 -8.702 2.787 1.00 0.00 H ATOM 458 HD22 ASN A 26 -6.120 -10.317 3.113 1.00 0.00 H ATOM 459 N LYS A 27 -10.223 -8.654 -1.392 1.00 0.00 N ATOM 460 CA LYS A 27 -11.361 -8.060 -2.101 1.00 0.00 C ATOM 461 C LYS A 27 -12.628 -8.100 -1.243 1.00 0.00 C ATOM 462 O LYS A 27 -13.390 -7.129 -1.212 1.00 0.00 O ATOM 463 CB LYS A 27 -11.607 -8.784 -3.430 1.00 0.00 C ATOM 464 CG LYS A 27 -10.590 -8.446 -4.511 1.00 0.00 C ATOM 465 CD LYS A 27 -10.903 -9.167 -5.814 1.00 0.00 C ATOM 466 CE LYS A 27 -9.913 -8.802 -6.913 1.00 0.00 C ATOM 467 NZ LYS A 27 -8.577 -9.426 -6.697 1.00 0.00 N1+ ATOM 468 H LYS A 27 -10.127 -9.628 -1.385 1.00 0.00 H ATOM 469 HA LYS A 27 -11.117 -7.029 -2.306 1.00 0.00 H ATOM 470 HB2 LYS A 27 -11.574 -9.850 -3.257 1.00 0.00 H ATOM 471 HB3 LYS A 27 -12.588 -8.519 -3.794 1.00 0.00 H ATOM 472 HG2 LYS A 27 -10.608 -7.380 -4.687 1.00 0.00 H ATOM 473 HG3 LYS A 27 -9.608 -8.741 -4.173 1.00 0.00 H ATOM 474 HD2 LYS A 27 -10.858 -10.232 -5.644 1.00 0.00 H ATOM 475 HD3 LYS A 27 -11.898 -8.894 -6.134 1.00 0.00 H ATOM 476 HE2 LYS A 27 -10.307 -9.139 -7.859 1.00 0.00 H ATOM 477 HE3 LYS A 27 -9.800 -7.728 -6.934 1.00 0.00 H ATOM 478 HZ1 LYS A 27 -8.176 -9.110 -5.791 1.00 0.00 H ATOM 479 HZ2 LYS A 27 -7.928 -9.156 -7.463 1.00 0.00 H ATOM 480 HZ3 LYS A 27 -8.664 -10.463 -6.682 1.00 0.00 H ATOM 481 N LYS A 28 -12.841 -9.227 -0.551 1.00 0.00 N ATOM 482 CA LYS A 28 -14.010 -9.405 0.314 1.00 0.00 C ATOM 483 C LYS A 28 -13.583 -9.687 1.754 1.00 0.00 C ATOM 484 O LYS A 28 -12.946 -10.703 2.043 1.00 0.00 O ATOM 485 CB LYS A 28 -14.901 -10.540 -0.209 1.00 0.00 C ATOM 486 CG LYS A 28 -15.694 -10.175 -1.455 1.00 0.00 C ATOM 487 CD LYS A 28 -16.576 -11.328 -1.910 1.00 0.00 C ATOM 488 CE LYS A 28 -17.383 -10.957 -3.143 1.00 0.00 C ATOM 489 NZ LYS A 28 -18.256 -12.077 -3.593 1.00 0.00 N1+ ATOM 490 H LYS A 28 -12.192 -9.956 -0.625 1.00 0.00 H ATOM 491 HA LYS A 28 -14.573 -8.483 0.296 1.00 0.00 H ATOM 492 HB2 LYS A 28 -14.278 -11.391 -0.443 1.00 0.00 H ATOM 493 HB3 LYS A 28 -15.598 -10.820 0.568 1.00 0.00 H ATOM 494 HG2 LYS A 28 -16.320 -9.323 -1.235 1.00 0.00 H ATOM 495 HG3 LYS A 28 -15.006 -9.925 -2.248 1.00 0.00 H ATOM 496 HD2 LYS A 28 -15.950 -12.176 -2.143 1.00 0.00 H ATOM 497 HD3 LYS A 28 -17.254 -11.587 -1.110 1.00 0.00 H ATOM 498 HE2 LYS A 28 -18.002 -10.103 -2.910 1.00 0.00 H ATOM 499 HE3 LYS A 28 -16.701 -10.700 -3.940 1.00 0.00 H ATOM 500 HZ1 LYS A 28 -17.677 -12.908 -3.831 1.00 0.00 H ATOM 501 HZ2 LYS A 28 -18.796 -11.793 -4.435 1.00 0.00 H ATOM 502 HZ3 LYS A 28 -18.923 -12.336 -2.838 1.00 0.00 H HETATM 503 N NH2 A 29 -13.925 -8.776 2.656 1.00 0.00 N HETATM 504 HN1 NH2 A 29 -14.431 -7.993 2.353 1.00 0.00 H HETATM 505 HN2 NH2 A 29 -13.658 -8.922 3.588 1.00 0.00 H TER 506 NH2 A 29 HETATM 507 ZN ZN A 101 1.800 -0.682 -4.351 1.00 0.00 ZN