ATOM 1 N LYS A 1 9.149 1.262 5.576 1.00 0.00 N ATOM 2 CA LYS A 1 8.713 2.404 6.426 1.00 0.00 C ATOM 3 C LYS A 1 7.964 3.454 5.603 1.00 0.00 C ATOM 4 O LYS A 1 6.976 4.023 6.072 1.00 0.00 O ATOM 5 CB LYS A 1 9.920 3.048 7.116 1.00 0.00 C ATOM 6 CG LYS A 1 10.500 2.212 8.248 1.00 0.00 C ATOM 7 CD LYS A 1 11.665 2.917 8.922 1.00 0.00 C ATOM 8 CE LYS A 1 12.226 2.093 10.069 1.00 0.00 C ATOM 9 NZ LYS A 1 13.356 2.784 10.750 1.00 0.00 N1+ ATOM 10 H1 LYS A 1 9.655 0.559 6.153 1.00 0.00 H ATOM 11 H2 LYS A 1 9.783 1.598 4.824 1.00 0.00 H ATOM 12 H3 LYS A 1 8.322 0.805 5.138 1.00 0.00 H ATOM 13 HA LYS A 1 8.041 2.020 7.181 1.00 0.00 H ATOM 14 HB2 LYS A 1 10.696 3.208 6.383 1.00 0.00 H ATOM 15 HB3 LYS A 1 9.620 4.004 7.522 1.00 0.00 H ATOM 16 HG2 LYS A 1 9.729 2.033 8.982 1.00 0.00 H ATOM 17 HG3 LYS A 1 10.844 1.270 7.846 1.00 0.00 H ATOM 18 HD2 LYS A 1 12.446 3.078 8.193 1.00 0.00 H ATOM 19 HD3 LYS A 1 11.326 3.869 9.305 1.00 0.00 H ATOM 20 HE2 LYS A 1 11.438 1.917 10.788 1.00 0.00 H ATOM 21 HE3 LYS A 1 12.575 1.147 9.680 1.00 0.00 H ATOM 22 HZ1 LYS A 1 14.130 2.952 10.077 1.00 0.00 H ATOM 23 HZ2 LYS A 1 13.713 2.200 11.533 1.00 0.00 H ATOM 24 HZ3 LYS A 1 13.038 3.697 11.133 1.00 0.00 H ATOM 25 N TYR A 2 8.449 3.705 4.378 1.00 0.00 N ATOM 26 CA TYR A 2 7.835 4.684 3.478 1.00 0.00 C ATOM 27 C TYR A 2 7.715 4.116 2.052 1.00 0.00 C ATOM 28 O TYR A 2 8.558 3.306 1.656 1.00 0.00 O ATOM 29 CB TYR A 2 8.659 5.977 3.455 1.00 0.00 C ATOM 30 CG TYR A 2 8.543 6.796 4.722 1.00 0.00 C ATOM 31 CD1 TYR A 2 7.557 7.765 4.858 1.00 0.00 C ATOM 32 CD2 TYR A 2 9.420 6.600 5.781 1.00 0.00 C ATOM 33 CE1 TYR A 2 7.448 8.515 6.013 1.00 0.00 C ATOM 34 CE2 TYR A 2 9.317 7.345 6.940 1.00 0.00 C ATOM 35 CZ TYR A 2 8.330 8.301 7.051 1.00 0.00 C ATOM 36 OH TYR A 2 8.225 9.046 8.203 1.00 0.00 O ATOM 37 H TYR A 2 9.243 3.217 4.076 1.00 0.00 H ATOM 38 HA TYR A 2 6.848 4.900 3.853 1.00 0.00 H ATOM 39 HB2 TYR A 2 9.700 5.729 3.316 1.00 0.00 H ATOM 40 HB3 TYR A 2 8.330 6.592 2.630 1.00 0.00 H ATOM 41 HD1 TYR A 2 6.868 7.930 4.043 1.00 0.00 H ATOM 42 HD2 TYR A 2 10.193 5.851 5.690 1.00 0.00 H ATOM 43 HE1 TYR A 2 6.674 9.264 6.099 1.00 0.00 H ATOM 44 HE2 TYR A 2 10.009 7.178 7.752 1.00 0.00 H ATOM 45 HH TYR A 2 9.096 9.349 8.470 1.00 0.00 H HETATM 46 N MAA A 3 6.656 4.518 1.247 1.00 0.00 N HETATM 47 CM MAA A 3 5.623 5.447 1.774 1.00 0.00 C HETATM 48 CA MAA A 3 6.465 4.028 -0.152 1.00 0.00 C HETATM 49 CB MAA A 3 7.700 4.224 -1.014 1.00 0.00 C HETATM 50 C MAA A 3 6.108 2.564 -0.211 1.00 0.00 C HETATM 51 O MAA A 3 6.385 1.785 0.705 1.00 0.00 O HETATM 52 HM1 MAA A 3 5.011 4.929 2.496 1.00 0.00 H HETATM 53 HM2 MAA A 3 5.001 5.797 0.964 1.00 0.00 H HETATM 54 HM3 MAA A 3 6.100 6.291 2.248 1.00 0.00 H HETATM 55 HA MAA A 3 5.652 4.569 -0.642 1.00 0.00 H HETATM 56 HB1 MAA A 3 8.576 3.951 -0.452 1.00 0.00 H HETATM 57 HB2 MAA A 3 7.768 5.251 -1.331 1.00 0.00 H HETATM 58 HB3 MAA A 3 7.609 3.573 -1.878 1.00 0.00 H ATOM 59 N CYS A 4 5.528 2.220 -1.346 1.00 0.00 N ATOM 60 CA CYS A 4 5.076 0.887 -1.665 1.00 0.00 C ATOM 61 C CYS A 4 6.199 -0.120 -1.836 1.00 0.00 C ATOM 62 O CYS A 4 7.280 0.196 -2.341 1.00 0.00 O ATOM 63 CB CYS A 4 4.235 0.990 -2.897 1.00 0.00 C ATOM 64 SG CYS A 4 3.919 -0.580 -3.679 1.00 0.00 S ATOM 65 H CYS A 4 5.395 2.919 -2.021 1.00 0.00 H ATOM 66 HA CYS A 4 4.462 0.518 -0.873 1.00 0.00 H ATOM 67 HB2 CYS A 4 3.284 1.443 -2.643 1.00 0.00 H ATOM 68 HB3 CYS A 4 4.743 1.616 -3.612 1.00 0.00 H ATOM 69 N PRO A 5 5.912 -1.363 -1.395 1.00 0.00 N ATOM 70 CA PRO A 5 6.862 -2.476 -1.430 1.00 0.00 C ATOM 71 C PRO A 5 6.911 -3.290 -2.731 1.00 0.00 C ATOM 72 O PRO A 5 7.914 -3.962 -2.992 1.00 0.00 O ATOM 73 CB PRO A 5 6.316 -3.310 -0.283 1.00 0.00 C ATOM 74 CG PRO A 5 4.845 -3.222 -0.466 1.00 0.00 C ATOM 75 CD PRO A 5 4.619 -1.782 -0.758 1.00 0.00 C ATOM 76 HA PRO A 5 7.849 -2.145 -1.193 1.00 0.00 H ATOM 77 HB2 PRO A 5 6.671 -4.327 -0.343 1.00 0.00 H ATOM 78 HB3 PRO A 5 6.585 -2.851 0.652 1.00 0.00 H ATOM 79 HG2 PRO A 5 4.535 -3.829 -1.307 1.00 0.00 H ATOM 80 HG3 PRO A 5 4.329 -3.507 0.435 1.00 0.00 H ATOM 81 HD2 PRO A 5 3.789 -1.656 -1.440 1.00 0.00 H ATOM 82 HD3 PRO A 5 4.448 -1.238 0.158 1.00 0.00 H ATOM 83 N GLU A 6 5.848 -3.232 -3.536 1.00 0.00 N ATOM 84 CA GLU A 6 5.822 -4.028 -4.788 1.00 0.00 C ATOM 85 C GLU A 6 5.480 -3.178 -5.998 1.00 0.00 C ATOM 86 O GLU A 6 5.892 -3.497 -7.118 1.00 0.00 O ATOM 87 CB GLU A 6 4.876 -5.239 -4.702 1.00 0.00 C ATOM 88 CG GLU A 6 5.020 -6.047 -3.424 1.00 0.00 C ATOM 89 CD GLU A 6 6.097 -7.111 -3.517 1.00 0.00 C ATOM 90 OE1 GLU A 6 5.780 -8.242 -3.941 1.00 0.00 O ATOM 91 OE2 GLU A 6 7.259 -6.814 -3.166 1.00 0.00 O1- ATOM 92 H GLU A 6 5.096 -2.620 -3.309 1.00 0.00 H ATOM 93 HA GLU A 6 6.822 -4.404 -4.929 1.00 0.00 H ATOM 94 HB2 GLU A 6 3.859 -4.899 -4.773 1.00 0.00 H ATOM 95 HB3 GLU A 6 5.081 -5.893 -5.536 1.00 0.00 H ATOM 96 HG2 GLU A 6 5.276 -5.366 -2.630 1.00 0.00 H ATOM 97 HG3 GLU A 6 4.076 -6.521 -3.203 1.00 0.00 H ATOM 98 N CYS A 7 4.728 -2.101 -5.774 1.00 0.00 N ATOM 99 CA CYS A 7 4.376 -1.191 -6.878 1.00 0.00 C ATOM 100 C CYS A 7 4.606 0.290 -6.513 1.00 0.00 C ATOM 101 O CYS A 7 3.837 0.867 -5.752 1.00 0.00 O ATOM 102 CB CYS A 7 2.978 -1.412 -7.483 1.00 0.00 C ATOM 103 SG CYS A 7 1.562 -0.699 -6.602 1.00 0.00 S ATOM 104 H CYS A 7 4.455 -1.902 -4.843 1.00 0.00 H ATOM 105 HA CYS A 7 5.077 -1.439 -7.641 1.00 0.00 H ATOM 106 HB2 CYS A 7 2.979 -0.956 -8.458 1.00 0.00 H ATOM 107 HB3 CYS A 7 2.806 -2.470 -7.587 1.00 0.00 H ATOM 108 N PRO A 8 5.648 0.933 -7.118 1.00 0.00 N ATOM 109 CA PRO A 8 6.063 2.337 -6.845 1.00 0.00 C ATOM 110 C PRO A 8 4.980 3.412 -7.047 1.00 0.00 C ATOM 111 O PRO A 8 5.231 4.457 -7.666 1.00 0.00 O ATOM 112 CB PRO A 8 7.226 2.563 -7.827 1.00 0.00 C ATOM 113 CG PRO A 8 7.700 1.207 -8.194 1.00 0.00 C ATOM 114 CD PRO A 8 6.486 0.333 -8.155 1.00 0.00 C ATOM 115 HA PRO A 8 6.441 2.426 -5.837 1.00 0.00 H ATOM 116 HB2 PRO A 8 6.868 3.098 -8.699 1.00 0.00 H ATOM 117 HB3 PRO A 8 8.017 3.118 -7.348 1.00 0.00 H ATOM 118 HG2 PRO A 8 8.127 1.224 -9.189 1.00 0.00 H ATOM 119 HG3 PRO A 8 8.427 0.862 -7.475 1.00 0.00 H ATOM 120 HD2 PRO A 8 5.964 0.351 -9.093 1.00 0.00 H ATOM 121 HD3 PRO A 8 6.752 -0.673 -7.882 1.00 0.00 H ATOM 122 N LYS A 9 3.778 3.167 -6.509 1.00 0.00 N ATOM 123 CA LYS A 9 2.687 4.134 -6.569 1.00 0.00 C ATOM 124 C LYS A 9 2.969 5.367 -5.696 1.00 0.00 C ATOM 125 O LYS A 9 2.668 6.482 -6.122 1.00 0.00 O ATOM 126 CB LYS A 9 1.335 3.470 -6.281 1.00 0.00 C ATOM 127 CG LYS A 9 0.903 2.457 -7.337 1.00 0.00 C ATOM 128 CD LYS A 9 0.150 3.117 -8.487 1.00 0.00 C ATOM 129 CE LYS A 9 -0.275 2.099 -9.532 1.00 0.00 C ATOM 130 NZ LYS A 9 -1.011 2.735 -10.660 1.00 0.00 N1+ ATOM 131 H LYS A 9 3.612 2.296 -6.090 1.00 0.00 H ATOM 132 HA LYS A 9 2.670 4.486 -7.524 1.00 0.00 H ATOM 133 HB2 LYS A 9 1.389 2.961 -5.330 1.00 0.00 H ATOM 134 HB3 LYS A 9 0.579 4.238 -6.234 1.00 0.00 H ATOM 135 HG2 LYS A 9 1.781 1.970 -7.730 1.00 0.00 H ATOM 136 HG3 LYS A 9 0.262 1.724 -6.874 1.00 0.00 H ATOM 137 HD2 LYS A 9 -0.730 3.605 -8.095 1.00 0.00 H ATOM 138 HD3 LYS A 9 0.795 3.850 -8.950 1.00 0.00 H ATOM 139 HE2 LYS A 9 0.606 1.610 -9.920 1.00 0.00 H ATOM 140 HE3 LYS A 9 -0.915 1.366 -9.062 1.00 0.00 H ATOM 141 HZ1 LYS A 9 -0.407 3.441 -11.126 1.00 0.00 H ATOM 142 HZ2 LYS A 9 -1.867 3.208 -10.306 1.00 0.00 H ATOM 143 HZ3 LYS A 9 -1.288 2.016 -11.357 1.00 0.00 H HETATM 144 N MMO A 10 3.570 5.182 -4.479 1.00 0.00 N HETATM 145 CA MMO A 10 3.984 6.242 -3.554 1.00 0.00 C HETATM 146 C MMO A 10 3.031 7.430 -3.424 1.00 0.00 C HETATM 147 O MMO A 10 2.703 8.113 -4.396 1.00 0.00 O HETATM 148 CB MMO A 10 5.389 6.664 -4.030 1.00 0.00 C HETATM 149 CG MMO A 10 6.286 7.226 -2.937 1.00 0.00 C HETATM 150 CD MMO A 10 7.750 7.052 -3.300 1.00 0.00 C HETATM 151 NE MMO A 10 8.644 7.523 -2.236 1.00 0.00 N HETATM 152 CZ MMO A 10 9.982 7.555 -2.321 1.00 0.00 C HETATM 153 NH2 MMO A 10 10.693 8.003 -1.294 1.00 0.00 N HETATM 154 NH1 MMO A 10 10.613 7.143 -3.419 1.00 0.00 N HETATM 155 CN MMO A 10 3.774 3.829 -3.958 1.00 0.00 C HETATM 156 HA MMO A 10 4.061 5.774 -2.605 1.00 0.00 H HETATM 157 HCB1 MMO A 10 5.286 7.408 -4.804 1.00 0.00 H HETATM 158 HCB2 MMO A 10 5.879 5.795 -4.439 1.00 0.00 H HETATM 159 HCG1 MMO A 10 6.088 6.704 -2.012 1.00 0.00 H HETATM 160 HCG2 MMO A 10 6.077 8.278 -2.812 1.00 0.00 H HETATM 161 HCD1 MMO A 10 7.951 7.610 -4.202 1.00 0.00 H HETATM 162 HCD2 MMO A 10 7.938 6.002 -3.480 1.00 0.00 H HETATM 163 HH21 MMO A 10 10.229 8.315 -0.464 1.00 0.00 H HETATM 164 HH22 MMO A 10 11.690 8.028 -1.350 1.00 0.00 H HETATM 165 HH11 MMO A 10 11.612 7.174 -3.463 1.00 0.00 H HETATM 166 HC1 MMO A 10 3.604 3.120 -4.749 1.00 0.00 H HETATM 167 HC2 MMO A 10 3.081 3.647 -3.150 1.00 0.00 H HETATM 168 HC3 MMO A 10 4.786 3.735 -3.597 1.00 0.00 H HETATM 169 HE MMO A 10 8.224 7.837 -1.408 1.00 0.00 H HETATM 170 HH12 MMO A 10 10.089 6.803 -4.199 1.00 0.00 H ATOM 171 N PHE A 11 2.631 7.667 -2.177 1.00 0.00 N ATOM 172 CA PHE A 11 1.651 8.695 -1.825 1.00 0.00 C ATOM 173 C PHE A 11 2.120 9.514 -0.625 1.00 0.00 C ATOM 174 O PHE A 11 1.359 10.313 -0.065 1.00 0.00 O ATOM 175 CB PHE A 11 0.319 7.971 -1.513 1.00 0.00 C ATOM 176 CG PHE A 11 0.382 6.511 -1.895 1.00 0.00 C ATOM 177 CD1 PHE A 11 0.223 6.127 -3.220 1.00 0.00 C ATOM 178 CD2 PHE A 11 0.695 5.533 -0.958 1.00 0.00 C ATOM 179 CE1 PHE A 11 0.364 4.817 -3.594 1.00 0.00 C ATOM 180 CE2 PHE A 11 0.816 4.221 -1.337 1.00 0.00 C ATOM 181 CZ PHE A 11 0.650 3.865 -2.668 1.00 0.00 C ATOM 182 H PHE A 11 3.017 7.127 -1.455 1.00 0.00 H ATOM 183 HA PHE A 11 1.515 9.346 -2.676 1.00 0.00 H ATOM 184 HB2 PHE A 11 0.114 8.038 -0.454 1.00 0.00 H ATOM 185 HB3 PHE A 11 -0.485 8.432 -2.067 1.00 0.00 H ATOM 186 HD1 PHE A 11 -0.014 6.869 -3.961 1.00 0.00 H ATOM 187 HD2 PHE A 11 0.851 5.798 0.077 1.00 0.00 H ATOM 188 HE1 PHE A 11 0.265 4.528 -4.625 1.00 0.00 H ATOM 189 HE2 PHE A 11 1.031 3.481 -0.591 1.00 0.00 H ATOM 190 HZ PHE A 11 0.763 2.837 -2.999 1.00 0.00 H HETATM 191 N NLE A 12 3.401 9.313 -0.242 1.00 0.00 N HETATM 192 CA NLE A 12 4.033 9.995 0.908 1.00 0.00 C HETATM 193 C NLE A 12 3.363 9.598 2.237 1.00 0.00 C HETATM 194 O NLE A 12 3.575 10.249 3.269 1.00 0.00 O HETATM 195 CB NLE A 12 4.027 11.533 0.731 1.00 0.00 C HETATM 196 CG NLE A 12 4.974 12.044 -0.353 1.00 0.00 C HETATM 197 CD NLE A 12 4.331 12.013 -1.733 1.00 0.00 C HETATM 198 CE NLE A 12 5.298 12.534 -2.774 1.00 0.00 C HETATM 199 H NLE A 12 3.942 8.679 -0.757 1.00 0.00 H HETATM 200 HA NLE A 12 5.060 9.661 0.944 1.00 0.00 H HETATM 201 HB2 NLE A 12 4.306 11.990 1.669 1.00 0.00 H HETATM 202 HB3 NLE A 12 3.026 11.845 0.475 1.00 0.00 H HETATM 203 HG2 NLE A 12 5.858 11.424 -0.363 1.00 0.00 H HETATM 204 HG3 NLE A 12 5.252 13.063 -0.123 1.00 0.00 H HETATM 205 HD2 NLE A 12 3.449 12.636 -1.734 1.00 0.00 H HETATM 206 HD3 NLE A 12 4.067 10.996 -1.984 1.00 0.00 H HETATM 207 HE1 NLE A 12 4.831 12.505 -3.747 1.00 0.00 H HETATM 208 HE2 NLE A 12 6.186 11.919 -2.781 1.00 0.00 H HETATM 209 HE3 NLE A 12 5.568 13.553 -2.535 1.00 0.00 H ATOM 210 N ARG A 13 2.575 8.509 2.206 1.00 0.00 N ATOM 211 CA ARG A 13 1.881 8.025 3.392 1.00 0.00 C ATOM 212 C ARG A 13 2.145 6.544 3.571 1.00 0.00 C ATOM 213 O ARG A 13 1.981 5.764 2.629 1.00 0.00 O ATOM 214 CB ARG A 13 0.376 8.293 3.279 1.00 0.00 C ATOM 215 CG ARG A 13 -0.028 9.735 3.590 1.00 0.00 C ATOM 216 CD ARG A 13 -0.244 9.971 5.084 1.00 0.00 C ATOM 217 NE ARG A 13 1.015 9.955 5.841 1.00 0.00 N ATOM 218 CZ ARG A 13 1.101 9.970 7.180 1.00 0.00 C ATOM 219 NH1 ARG A 13 0.008 10.003 7.941 1.00 0.00 N1+ ATOM 220 NH2 ARG A 13 2.294 9.952 7.759 1.00 0.00 N ATOM 221 H ARG A 13 2.469 8.006 1.356 1.00 0.00 H ATOM 222 HA ARG A 13 2.273 8.556 4.247 1.00 0.00 H ATOM 223 HB2 ARG A 13 0.064 8.068 2.270 1.00 0.00 H ATOM 224 HB3 ARG A 13 -0.146 7.638 3.961 1.00 0.00 H ATOM 225 HG2 ARG A 13 0.753 10.396 3.246 1.00 0.00 H ATOM 226 HG3 ARG A 13 -0.946 9.961 3.065 1.00 0.00 H ATOM 227 HD2 ARG A 13 -0.717 10.933 5.216 1.00 0.00 H ATOM 228 HD3 ARG A 13 -0.894 9.198 5.468 1.00 0.00 H ATOM 229 HE ARG A 13 1.846 9.931 5.324 1.00 0.00 H ATOM 230 HH11 ARG A 13 -0.897 10.015 7.515 1.00 0.00 H ATOM 231 HH12 ARG A 13 0.093 10.013 8.937 1.00 0.00 H ATOM 232 HH21 ARG A 13 2.366 9.964 8.756 1.00 0.00 H ATOM 233 HH22 ARG A 13 3.122 9.927 7.198 1.00 0.00 H ATOM 234 N SER A 14 2.561 6.161 4.781 1.00 0.00 N ATOM 235 CA SER A 14 2.867 4.766 5.081 1.00 0.00 C ATOM 236 C SER A 14 1.623 4.001 5.537 1.00 0.00 C ATOM 237 O SER A 14 1.395 2.876 5.088 1.00 0.00 O ATOM 238 CB SER A 14 3.971 4.676 6.141 1.00 0.00 C ATOM 239 OG SER A 14 4.401 3.336 6.328 1.00 0.00 O ATOM 240 H SER A 14 2.662 6.834 5.486 1.00 0.00 H ATOM 241 HA SER A 14 3.225 4.319 4.162 1.00 0.00 H ATOM 242 HB2 SER A 14 4.816 5.269 5.828 1.00 0.00 H ATOM 243 HB3 SER A 14 3.594 5.054 7.081 1.00 0.00 H ATOM 244 HG SER A 14 3.752 2.862 6.854 1.00 0.00 H HETATM 245 OE1 B3D A 15 0.515 1.650 8.995 1.00 0.00 O HETATM 246 CD B3D A 15 0.788 2.864 8.886 1.00 0.00 C HETATM 247 OE2 B3D A 15 1.921 3.335 9.122 1.00 0.00 O HETATM 248 CG B3D A 15 -0.311 3.814 8.442 1.00 0.00 C HETATM 249 CB B3D A 15 -0.379 3.977 6.911 1.00 0.00 C HETATM 250 N B3D A 15 0.829 4.607 6.431 1.00 0.00 N HETATM 251 CA B3D A 15 -1.615 4.821 6.593 1.00 0.00 C HETATM 252 C B3D A 15 -2.285 4.398 5.317 1.00 0.00 C HETATM 253 O B3D A 15 -2.808 3.270 5.200 1.00 0.00 O HETATM 254 HG3 B3D A 15 -0.128 4.778 8.893 1.00 0.00 H HETATM 255 HG2 B3D A 15 -1.255 3.430 8.801 1.00 0.00 H HETATM 256 HB B3D A 15 -0.442 3.009 6.379 1.00 0.00 H HETATM 257 H B3D A 15 1.073 5.496 6.765 1.00 0.00 H HETATM 258 HA1 B3D A 15 -1.319 5.855 6.496 1.00 0.00 H HETATM 259 HA2 B3D A 15 -2.328 4.731 7.398 1.00 0.00 H ATOM 260 N HIS A 16 -2.232 5.308 4.329 1.00 0.00 N ATOM 261 CA HIS A 16 -2.813 5.083 3.000 1.00 0.00 C ATOM 262 C HIS A 16 -2.151 3.893 2.308 1.00 0.00 C ATOM 263 O HIS A 16 -2.811 3.172 1.564 1.00 0.00 O ATOM 264 CB HIS A 16 -2.676 6.334 2.128 1.00 0.00 C ATOM 265 CG HIS A 16 -3.506 7.492 2.593 1.00 0.00 C ATOM 266 ND1 HIS A 16 -2.993 8.537 3.333 1.00 0.00 N ATOM 267 CD2 HIS A 16 -4.821 7.767 2.419 1.00 0.00 C ATOM 268 CE1 HIS A 16 -3.955 9.404 3.594 1.00 0.00 C ATOM 269 NE2 HIS A 16 -5.073 8.960 3.049 1.00 0.00 N ATOM 270 H HIS A 16 -1.785 6.163 4.504 1.00 0.00 H ATOM 271 HA HIS A 16 -3.862 4.864 3.133 1.00 0.00 H ATOM 272 HB2 HIS A 16 -1.646 6.646 2.122 1.00 0.00 H ATOM 273 HB3 HIS A 16 -2.979 6.093 1.119 1.00 0.00 H ATOM 274 HD1 HIS A 16 -2.062 8.629 3.623 1.00 0.00 H ATOM 275 HD2 HIS A 16 -5.537 7.160 1.883 1.00 0.00 H ATOM 276 HE1 HIS A 16 -3.845 10.319 4.154 1.00 0.00 H ATOM 277 HE2 HIS A 16 -5.919 9.455 3.013 1.00 0.00 H ATOM 278 N LEU A 17 -0.833 3.718 2.536 1.00 0.00 N ATOM 279 CA LEU A 17 -0.089 2.595 1.980 1.00 0.00 C ATOM 280 C LEU A 17 -0.378 1.291 2.725 1.00 0.00 C ATOM 281 O LEU A 17 -0.383 0.237 2.110 1.00 0.00 O ATOM 282 CB LEU A 17 1.426 2.849 1.995 1.00 0.00 C ATOM 283 CG LEU A 17 2.305 1.636 1.616 1.00 0.00 C ATOM 284 CD1 LEU A 17 2.187 1.288 0.134 1.00 0.00 C ATOM 285 CD2 LEU A 17 3.741 1.895 1.997 1.00 0.00 C ATOM 286 H LEU A 17 -0.348 4.387 3.042 1.00 0.00 H ATOM 287 HA LEU A 17 -0.416 2.483 0.957 1.00 0.00 H ATOM 288 HB2 LEU A 17 1.647 3.660 1.321 1.00 0.00 H ATOM 289 HB3 LEU A 17 1.699 3.156 2.992 1.00 0.00 H ATOM 290 HG LEU A 17 1.966 0.777 2.177 1.00 0.00 H ATOM 291 HD11 LEU A 17 1.147 1.338 -0.155 1.00 0.00 H ATOM 292 HD12 LEU A 17 2.548 0.271 -0.039 1.00 0.00 H ATOM 293 HD13 LEU A 17 2.763 1.987 -0.460 1.00 0.00 H ATOM 294 HD21 LEU A 17 3.795 2.119 3.052 1.00 0.00 H ATOM 295 HD22 LEU A 17 4.118 2.733 1.426 1.00 0.00 H ATOM 296 HD23 LEU A 17 4.330 1.016 1.783 1.00 0.00 H ATOM 297 N SER A 18 -0.547 1.359 4.053 1.00 0.00 N ATOM 298 CA SER A 18 -0.848 0.161 4.851 1.00 0.00 C ATOM 299 C SER A 18 -2.140 -0.491 4.352 1.00 0.00 C ATOM 300 O SER A 18 -2.128 -1.650 3.927 1.00 0.00 O ATOM 301 CB SER A 18 -0.944 0.498 6.348 1.00 0.00 C ATOM 302 OG SER A 18 -1.182 -0.665 7.126 1.00 0.00 O ATOM 303 H SER A 18 -0.433 2.220 4.503 1.00 0.00 H ATOM 304 HA SER A 18 -0.036 -0.537 4.704 1.00 0.00 H ATOM 305 HB2 SER A 18 -0.017 0.941 6.674 1.00 0.00 H ATOM 306 HB3 SER A 18 -1.755 1.193 6.508 1.00 0.00 H ATOM 307 HG SER A 18 -1.213 -1.435 6.552 1.00 0.00 H HETATM 308 N B3K A 19 -3.235 0.278 4.351 1.00 0.00 N HETATM 309 CB B3K A 19 -4.496 -0.234 3.883 1.00 0.00 C HETATM 310 CG B3K A 19 -5.578 0.014 4.957 1.00 0.00 C HETATM 311 CD B3K A 19 -5.403 -0.824 6.218 1.00 0.00 C HETATM 312 CE B3K A 19 -6.495 -0.535 7.236 1.00 0.00 C HETATM 313 CF B3K A 19 -6.317 -1.366 8.495 1.00 0.00 C HETATM 314 NZ B3K A 19 -7.381 -1.088 9.500 1.00 0.00 N HETATM 315 CA B3K A 19 -4.946 0.494 2.613 1.00 0.00 C HETATM 316 C B3K A 19 -4.342 -0.042 1.337 1.00 0.00 C HETATM 317 O B3K A 19 -4.753 -1.093 0.821 1.00 0.00 O HETATM 318 H B3K A 19 -3.174 1.215 4.672 1.00 0.00 H HETATM 319 HB B3K A 19 -4.329 -1.313 3.672 1.00 0.00 H HETATM 320 HG2 B3K A 19 -6.547 -0.214 4.538 1.00 0.00 H HETATM 321 HG3 B3K A 19 -5.555 1.055 5.239 1.00 0.00 H HETATM 322 HD2 B3K A 19 -4.442 -0.597 6.659 1.00 0.00 H HETATM 323 HD3 B3K A 19 -5.441 -1.870 5.953 1.00 0.00 H HETATM 324 HE2 B3K A 19 -7.454 -0.765 6.795 1.00 0.00 H HETATM 325 HE3 B3K A 19 -6.460 0.512 7.500 1.00 0.00 H HETATM 326 HF1 B3K A 19 -5.355 -1.138 8.929 1.00 0.00 H HETATM 327 HF2 B3K A 19 -6.351 -2.412 8.229 1.00 0.00 H HETATM 328 HNZ1 B3K A 19 -7.232 -1.671 10.349 1.00 0.00 H HETATM 329 HNZ2 B3K A 19 -8.315 -1.309 9.102 1.00 0.00 H HETATM 330 HA1 B3K A 19 -6.019 0.419 2.528 1.00 0.00 H HETATM 331 HA2 B3K A 19 -4.675 1.536 2.698 1.00 0.00 H HETATM 332 HZ3 B3K A 19 -7.362 -0.085 9.772 1.00 0.00 H ATOM 333 N HIS A 20 -3.296 0.658 0.864 1.00 0.00 N ATOM 334 CA HIS A 20 -2.611 0.349 -0.382 1.00 0.00 C ATOM 335 C HIS A 20 -2.093 -1.097 -0.471 1.00 0.00 C ATOM 336 O HIS A 20 -2.183 -1.742 -1.515 1.00 0.00 O ATOM 337 CB HIS A 20 -1.457 1.291 -0.550 1.00 0.00 C ATOM 338 CG HIS A 20 -0.780 1.070 -1.833 1.00 0.00 C ATOM 339 ND1 HIS A 20 -1.214 1.592 -3.023 1.00 0.00 N ATOM 340 CD2 HIS A 20 0.251 0.262 -2.115 1.00 0.00 C ATOM 341 CE1 HIS A 20 -0.448 1.076 -3.979 1.00 0.00 C ATOM 342 NE2 HIS A 20 0.459 0.276 -3.465 1.00 0.00 N ATOM 343 H HIS A 20 -2.938 1.398 1.400 1.00 0.00 H ATOM 344 HA HIS A 20 -3.270 0.545 -1.192 1.00 0.00 H ATOM 345 HB2 HIS A 20 -1.811 2.313 -0.516 1.00 0.00 H ATOM 346 HB3 HIS A 20 -0.753 1.112 0.240 1.00 0.00 H ATOM 347 HD1 HIS A 20 -1.952 2.224 -3.147 1.00 0.00 H ATOM 348 HD2 HIS A 20 0.783 -0.380 -1.403 1.00 0.00 H ATOM 349 HE1 HIS A 20 -0.600 1.234 -5.028 1.00 0.00 H ATOM 350 N ILE A 21 -1.500 -1.566 0.607 1.00 0.00 N ATOM 351 CA ILE A 21 -0.929 -2.892 0.637 1.00 0.00 C ATOM 352 C ILE A 21 -1.858 -3.905 1.305 1.00 0.00 C ATOM 353 O ILE A 21 -1.615 -5.109 1.237 1.00 0.00 O ATOM 354 CB ILE A 21 0.500 -2.887 1.243 1.00 0.00 C ATOM 355 CG1 ILE A 21 0.522 -2.629 2.762 1.00 0.00 C ATOM 356 CG2 ILE A 21 1.357 -1.885 0.532 1.00 0.00 C ATOM 357 CD1 ILE A 21 0.642 -3.890 3.592 1.00 0.00 C ATOM 358 H ILE A 21 -1.421 -1.000 1.389 1.00 0.00 H ATOM 359 HA ILE A 21 -0.833 -3.185 -0.393 1.00 0.00 H ATOM 360 HB ILE A 21 0.935 -3.814 1.030 1.00 0.00 H ATOM 361 HG12 ILE A 21 1.363 -1.995 3.001 1.00 0.00 H ATOM 362 HG13 ILE A 21 -0.392 -2.129 3.047 1.00 0.00 H ATOM 363 HG21 ILE A 21 1.482 -2.201 -0.493 1.00 0.00 H ATOM 364 HG22 ILE A 21 2.318 -1.824 1.015 1.00 0.00 H ATOM 365 HG23 ILE A 21 0.869 -0.926 0.561 1.00 0.00 H ATOM 366 HD11 ILE A 21 1.558 -4.402 3.339 1.00 0.00 H ATOM 367 HD12 ILE A 21 -0.199 -4.536 3.388 1.00 0.00 H ATOM 368 HD13 ILE A 21 0.651 -3.632 4.640 1.00 0.00 H HETATM 369 N B3K A 22 -2.885 -3.397 1.986 1.00 0.00 N HETATM 370 CB B3K A 22 -3.880 -4.228 2.581 1.00 0.00 C HETATM 371 CG B3K A 22 -3.958 -3.929 4.091 1.00 0.00 C HETATM 372 CD B3K A 22 -3.813 -5.166 4.962 1.00 0.00 C HETATM 373 CE B3K A 22 -3.855 -4.813 6.441 1.00 0.00 C HETATM 374 CF B3K A 22 -3.697 -6.048 7.313 1.00 0.00 C HETATM 375 NZ B3K A 22 -3.717 -5.710 8.763 1.00 0.00 N HETATM 376 CA B3K A 22 -5.262 -3.904 1.984 1.00 0.00 C HETATM 377 C B3K A 22 -5.401 -4.139 0.485 1.00 0.00 C HETATM 378 O B3K A 22 -6.272 -4.920 0.065 1.00 0.00 O HETATM 379 H B3K A 22 -2.935 -2.424 2.121 1.00 0.00 H HETATM 380 HB B3K A 22 -3.587 -5.275 2.354 1.00 0.00 H HETATM 381 HG2 B3K A 22 -4.913 -3.474 4.309 1.00 0.00 H HETATM 382 HG3 B3K A 22 -3.171 -3.238 4.351 1.00 0.00 H HETATM 383 HD2 B3K A 22 -2.870 -5.643 4.741 1.00 0.00 H HETATM 384 HD3 B3K A 22 -4.622 -5.847 4.743 1.00 0.00 H HETATM 385 HE2 B3K A 22 -4.803 -4.345 6.663 1.00 0.00 H HETATM 386 HE3 B3K A 22 -3.051 -4.125 6.660 1.00 0.00 H HETATM 387 HF1 B3K A 22 -2.757 -6.524 7.075 1.00 0.00 H HETATM 388 HF2 B3K A 22 -4.507 -6.729 7.102 1.00 0.00 H HETATM 389 HNZ1 B3K A 22 -2.938 -5.058 8.989 1.00 0.00 H HETATM 390 HNZ2 B3K A 22 -3.606 -6.573 9.334 1.00 0.00 H HETATM 391 HA1 B3K A 22 -5.483 -2.865 2.174 1.00 0.00 H HETATM 392 HA2 B3K A 22 -6.001 -4.513 2.483 1.00 0.00 H HETATM 393 HZ3 B3K A 22 -4.618 -5.256 9.013 1.00 0.00 H ATOM 394 N THR A 23 -4.530 -3.495 -0.337 1.00 0.00 N ATOM 395 CA THR A 23 -4.620 -3.638 -1.798 1.00 0.00 C ATOM 396 C THR A 23 -3.619 -4.669 -2.295 1.00 0.00 C ATOM 397 O THR A 23 -3.977 -5.536 -3.097 1.00 0.00 O ATOM 398 CB THR A 23 -4.449 -2.290 -2.556 1.00 0.00 C ATOM 399 OG1 THR A 23 -5.075 -1.230 -1.822 1.00 0.00 O ATOM 400 CG2 THR A 23 -5.067 -2.358 -3.946 1.00 0.00 C ATOM 401 H THR A 23 -3.788 -2.958 0.050 1.00 0.00 H ATOM 402 HA THR A 23 -5.606 -4.018 -2.010 1.00 0.00 H ATOM 403 HB THR A 23 -3.390 -2.069 -2.662 1.00 0.00 H ATOM 404 HG1 THR A 23 -5.297 -1.539 -0.941 1.00 0.00 H ATOM 405 HG21 THR A 23 -6.130 -2.522 -3.859 1.00 0.00 H ATOM 406 HG22 THR A 23 -4.620 -3.174 -4.495 1.00 0.00 H ATOM 407 HG23 THR A 23 -4.886 -1.429 -4.466 1.00 0.00 H ATOM 408 N HIS A 24 -2.361 -4.576 -1.826 1.00 0.00 N ATOM 409 CA HIS A 24 -1.338 -5.575 -2.192 1.00 0.00 C ATOM 410 C HIS A 24 -1.747 -6.927 -1.661 1.00 0.00 C ATOM 411 O HIS A 24 -1.398 -7.988 -2.186 1.00 0.00 O ATOM 412 CB HIS A 24 0.034 -5.199 -1.646 1.00 0.00 C ATOM 413 CG HIS A 24 0.793 -4.252 -2.517 1.00 0.00 C ATOM 414 ND1 HIS A 24 1.827 -4.618 -3.370 1.00 0.00 N ATOM 415 CD2 HIS A 24 0.626 -2.925 -2.701 1.00 0.00 C ATOM 416 CE1 HIS A 24 2.209 -3.515 -4.023 1.00 0.00 C ATOM 417 NE2 HIS A 24 1.513 -2.509 -3.664 1.00 0.00 N ATOM 418 H HIS A 24 -2.117 -3.818 -1.250 1.00 0.00 H ATOM 419 HA HIS A 24 -1.327 -5.623 -3.241 1.00 0.00 H ATOM 420 HB2 HIS A 24 -0.110 -4.728 -0.685 1.00 0.00 H ATOM 421 HB3 HIS A 24 0.624 -6.093 -1.521 1.00 0.00 H ATOM 422 HD1 HIS A 24 2.233 -5.504 -3.450 1.00 0.00 H ATOM 423 HD2 HIS A 24 0.012 -2.257 -2.106 1.00 0.00 H ATOM 424 HE1 HIS A 24 3.047 -3.427 -4.702 1.00 0.00 H HETATM 425 N B3Q A 25 -2.495 -6.812 -0.602 1.00 0.00 N HETATM 426 CB B3Q A 25 -3.111 -7.899 0.093 1.00 0.00 C HETATM 427 CG B3Q A 25 -2.454 -8.153 1.458 1.00 0.00 C HETATM 428 CA B3Q A 25 -4.528 -7.408 0.256 1.00 0.00 C HETATM 429 C B3Q A 25 -5.615 -8.439 0.052 1.00 0.00 C HETATM 430 O B3Q A 25 -5.390 -9.650 0.147 1.00 0.00 O HETATM 431 HN B3Q A 25 -2.661 -5.892 -0.269 1.00 0.00 H HETATM 432 HB B3Q A 25 -3.081 -8.785 -0.531 1.00 0.00 H HETATM 433 HG B3Q A 25 -3.019 -8.913 1.979 1.00 0.00 H HETATM 434 HGA B3Q A 25 -2.484 -7.240 2.034 1.00 0.00 H HETATM 435 CD B3Q A 25 -1.001 -8.609 1.372 1.00 0.00 C HETATM 436 HA B3Q A 25 -4.640 -6.978 1.235 1.00 0.00 H HETATM 437 HAA B3Q A 25 -4.657 -6.623 -0.496 1.00 0.00 H HETATM 438 CE B3Q A 25 -0.128 -7.968 2.434 1.00 0.00 C HETATM 439 NF2 B3Q A 25 0.435 -6.806 2.116 1.00 0.00 N HETATM 440 H8 B3Q A 25 -0.612 -8.344 0.400 1.00 0.00 H HETATM 441 OF1 B3Q A 25 0.037 -8.508 3.528 1.00 0.00 O HETATM 442 H9 B3Q A 25 -0.961 -9.681 1.494 1.00 0.00 H HETATM 443 H11 B3Q A 25 0.257 -6.432 1.226 1.00 0.00 H HETATM 444 H12 B3Q A 25 1.004 -6.368 2.783 1.00 0.00 H ATOM 445 N ASN A 26 -6.829 -7.916 -0.225 1.00 0.00 N ATOM 446 CA ASN A 26 -8.048 -8.728 -0.461 1.00 0.00 C ATOM 447 C ASN A 26 -8.462 -9.510 0.789 1.00 0.00 C ATOM 448 O ASN A 26 -7.674 -10.291 1.333 1.00 0.00 O ATOM 449 CB ASN A 26 -7.877 -9.692 -1.652 1.00 0.00 C ATOM 450 CG ASN A 26 -7.760 -8.964 -2.978 1.00 0.00 C ATOM 451 OD1 ASN A 26 -6.662 -8.619 -3.416 1.00 0.00 O ATOM 452 ND2 ASN A 26 -8.895 -8.725 -3.625 1.00 0.00 N ATOM 453 H ASN A 26 -6.908 -6.931 -0.269 1.00 0.00 H ATOM 454 HA ASN A 26 -8.844 -8.036 -0.697 1.00 0.00 H ATOM 455 HB2 ASN A 26 -6.983 -10.278 -1.506 1.00 0.00 H ATOM 456 HB3 ASN A 26 -8.732 -10.351 -1.698 1.00 0.00 H ATOM 457 HD21 ASN A 26 -9.733 -9.028 -3.217 1.00 0.00 H ATOM 458 HD22 ASN A 26 -8.848 -8.257 -4.485 1.00 0.00 H ATOM 459 N LYS A 27 -9.702 -9.281 1.234 1.00 0.00 N ATOM 460 CA LYS A 27 -10.246 -9.948 2.419 1.00 0.00 C ATOM 461 C LYS A 27 -11.609 -10.568 2.121 1.00 0.00 C ATOM 462 O LYS A 27 -12.330 -10.100 1.234 1.00 0.00 O ATOM 463 CB LYS A 27 -10.368 -8.958 3.585 1.00 0.00 C ATOM 464 CG LYS A 27 -9.033 -8.564 4.202 1.00 0.00 C ATOM 465 CD LYS A 27 -9.217 -7.570 5.340 1.00 0.00 C ATOM 466 CE LYS A 27 -7.885 -7.164 5.957 1.00 0.00 C ATOM 467 NZ LYS A 27 -7.296 -8.249 6.791 1.00 0.00 N1+ ATOM 468 H LYS A 27 -10.267 -8.645 0.749 1.00 0.00 H ATOM 469 HA LYS A 27 -9.561 -10.735 2.699 1.00 0.00 H ATOM 470 HB2 LYS A 27 -10.851 -8.060 3.228 1.00 0.00 H ATOM 471 HB3 LYS A 27 -10.979 -9.401 4.356 1.00 0.00 H ATOM 472 HG2 LYS A 27 -8.551 -9.450 4.587 1.00 0.00 H ATOM 473 HG3 LYS A 27 -8.413 -8.115 3.440 1.00 0.00 H ATOM 474 HD2 LYS A 27 -9.708 -6.687 4.958 1.00 0.00 H ATOM 475 HD3 LYS A 27 -9.832 -8.022 6.104 1.00 0.00 H ATOM 476 HE2 LYS A 27 -7.195 -6.921 5.161 1.00 0.00 H ATOM 477 HE3 LYS A 27 -8.041 -6.291 6.573 1.00 0.00 H ATOM 478 HZ1 LYS A 27 -7.943 -8.493 7.568 1.00 0.00 H ATOM 479 HZ2 LYS A 27 -6.390 -7.937 7.196 1.00 0.00 H ATOM 480 HZ3 LYS A 27 -7.131 -9.096 6.211 1.00 0.00 H ATOM 481 N LYS A 28 -11.949 -11.623 2.871 1.00 0.00 N ATOM 482 CA LYS A 28 -13.225 -12.326 2.704 1.00 0.00 C ATOM 483 C LYS A 28 -14.272 -11.811 3.696 1.00 0.00 C ATOM 484 O LYS A 28 -15.390 -11.470 3.310 1.00 0.00 O ATOM 485 CB LYS A 28 -13.035 -13.840 2.869 1.00 0.00 C ATOM 486 CG LYS A 28 -12.323 -14.504 1.700 1.00 0.00 C ATOM 487 CD LYS A 28 -12.156 -16.001 1.925 1.00 0.00 C ATOM 488 CE LYS A 28 -11.450 -16.673 0.756 1.00 0.00 C ATOM 489 NZ LYS A 28 -12.330 -16.793 -0.440 1.00 0.00 N1+ ATOM 490 H LYS A 28 -11.323 -11.937 3.557 1.00 0.00 H ATOM 491 HA LYS A 28 -13.577 -12.127 1.702 1.00 0.00 H ATOM 492 HB2 LYS A 28 -12.457 -14.022 3.763 1.00 0.00 H ATOM 493 HB3 LYS A 28 -14.005 -14.302 2.980 1.00 0.00 H ATOM 494 HG2 LYS A 28 -12.902 -14.349 0.803 1.00 0.00 H ATOM 495 HG3 LYS A 28 -11.347 -14.056 1.584 1.00 0.00 H ATOM 496 HD2 LYS A 28 -11.573 -16.156 2.821 1.00 0.00 H ATOM 497 HD3 LYS A 28 -13.132 -16.446 2.048 1.00 0.00 H ATOM 498 HE2 LYS A 28 -10.581 -16.088 0.494 1.00 0.00 H ATOM 499 HE3 LYS A 28 -11.136 -17.661 1.063 1.00 0.00 H ATOM 500 HZ1 LYS A 28 -13.172 -17.359 -0.210 1.00 0.00 H ATOM 501 HZ2 LYS A 28 -11.817 -17.258 -1.217 1.00 0.00 H ATOM 502 HZ3 LYS A 28 -12.634 -15.850 -0.757 1.00 0.00 H HETATM 503 N NH2 A 29 -13.907 -11.755 4.976 1.00 0.00 N HETATM 504 HN1 NH2 A 29 -13.001 -12.042 5.212 1.00 0.00 H HETATM 505 HN2 NH2 A 29 -14.561 -11.428 5.628 1.00 0.00 H TER 506 NH2 A 29 HETATM 507 ZN ZN A 101 1.794 -0.782 -4.358 1.00 0.00 ZN