ATOM 1 N LYS A 1 7.484 2.147 6.824 1.00 0.00 N ATOM 2 CA LYS A 1 8.320 2.581 5.673 1.00 0.00 C ATOM 3 C LYS A 1 7.510 3.435 4.702 1.00 0.00 C ATOM 4 O LYS A 1 6.293 3.270 4.587 1.00 0.00 O ATOM 5 CB LYS A 1 8.891 1.362 4.939 1.00 0.00 C ATOM 6 CG LYS A 1 10.009 0.657 5.695 1.00 0.00 C ATOM 7 CD LYS A 1 10.557 -0.521 4.906 1.00 0.00 C ATOM 8 CE LYS A 1 11.684 -1.215 5.655 1.00 0.00 C ATOM 9 NZ LYS A 1 12.235 -2.366 4.886 1.00 0.00 N1+ ATOM 10 H1 LYS A 1 6.676 1.586 6.488 1.00 0.00 H ATOM 11 H2 LYS A 1 7.125 2.978 7.338 1.00 0.00 H ATOM 12 H3 LYS A 1 8.048 1.567 7.478 1.00 0.00 H ATOM 13 HA LYS A 1 9.137 3.176 6.056 1.00 0.00 H ATOM 14 HB2 LYS A 1 8.095 0.651 4.773 1.00 0.00 H ATOM 15 HB3 LYS A 1 9.279 1.682 3.984 1.00 0.00 H ATOM 16 HG2 LYS A 1 10.808 1.361 5.874 1.00 0.00 H ATOM 17 HG3 LYS A 1 9.622 0.300 6.637 1.00 0.00 H ATOM 18 HD2 LYS A 1 9.761 -1.230 4.736 1.00 0.00 H ATOM 19 HD3 LYS A 1 10.933 -0.164 3.958 1.00 0.00 H ATOM 20 HE2 LYS A 1 12.473 -0.502 5.833 1.00 0.00 H ATOM 21 HE3 LYS A 1 11.302 -1.574 6.600 1.00 0.00 H ATOM 22 HZ1 LYS A 1 12.611 -2.038 3.973 1.00 0.00 H ATOM 23 HZ2 LYS A 1 11.490 -3.068 4.709 1.00 0.00 H ATOM 24 HZ3 LYS A 1 13.003 -2.818 5.423 1.00 0.00 H ATOM 25 N TYR A 2 8.205 4.343 4.004 1.00 0.00 N ATOM 26 CA TYR A 2 7.575 5.243 3.032 1.00 0.00 C ATOM 27 C TYR A 2 7.536 4.604 1.628 1.00 0.00 C ATOM 28 O TYR A 2 8.411 3.789 1.320 1.00 0.00 O ATOM 29 CB TYR A 2 8.330 6.577 2.988 1.00 0.00 C ATOM 30 CG TYR A 2 8.093 7.451 4.202 1.00 0.00 C ATOM 31 CD1 TYR A 2 9.001 7.471 5.254 1.00 0.00 C ATOM 32 CD2 TYR A 2 6.960 8.252 4.298 1.00 0.00 C ATOM 33 CE1 TYR A 2 8.788 8.266 6.365 1.00 0.00 C ATOM 34 CE2 TYR A 2 6.740 9.048 5.406 1.00 0.00 C ATOM 35 CZ TYR A 2 7.656 9.051 6.436 1.00 0.00 C ATOM 36 OH TYR A 2 7.441 9.843 7.541 1.00 0.00 O ATOM 37 H TYR A 2 9.172 4.408 4.148 1.00 0.00 H ATOM 38 HA TYR A 2 6.562 5.422 3.362 1.00 0.00 H ATOM 39 HB2 TYR A 2 9.390 6.378 2.928 1.00 0.00 H ATOM 40 HB3 TYR A 2 8.026 7.131 2.113 1.00 0.00 H ATOM 41 HD1 TYR A 2 9.885 6.855 5.196 1.00 0.00 H ATOM 42 HD2 TYR A 2 6.244 8.247 3.490 1.00 0.00 H ATOM 43 HE1 TYR A 2 9.506 8.268 7.172 1.00 0.00 H ATOM 44 HE2 TYR A 2 5.854 9.662 5.461 1.00 0.00 H ATOM 45 HH TYR A 2 6.529 9.754 7.825 1.00 0.00 H HETATM 46 N MAA A 3 6.510 4.945 0.750 1.00 0.00 N HETATM 47 CM MAA A 3 5.443 5.878 1.182 1.00 0.00 C HETATM 48 CA MAA A 3 6.394 4.374 -0.630 1.00 0.00 C HETATM 49 CB MAA A 3 7.704 4.450 -1.399 1.00 0.00 C HETATM 50 C MAA A 3 5.981 2.921 -0.586 1.00 0.00 C HETATM 51 O MAA A 3 6.073 2.247 0.444 1.00 0.00 O HETATM 52 HM1 MAA A 3 4.799 5.383 1.893 1.00 0.00 H HETATM 53 HM2 MAA A 3 4.859 6.184 0.326 1.00 0.00 H HETATM 54 HM3 MAA A 3 5.883 6.747 1.643 1.00 0.00 H HETATM 55 HA MAA A 3 5.634 4.910 -1.233 1.00 0.00 H HETATM 56 HB1 MAA A 3 7.788 5.409 -1.883 1.00 0.00 H HETATM 57 HB2 MAA A 3 7.708 3.657 -2.138 1.00 0.00 H HETATM 58 HB3 MAA A 3 8.527 4.308 -0.716 1.00 0.00 H ATOM 59 N CYS A 4 5.529 2.472 -1.739 1.00 0.00 N ATOM 60 CA CYS A 4 5.067 1.127 -1.961 1.00 0.00 C ATOM 61 C CYS A 4 6.199 0.130 -2.122 1.00 0.00 C ATOM 62 O CYS A 4 7.252 0.436 -2.689 1.00 0.00 O ATOM 63 CB CYS A 4 4.182 1.161 -3.162 1.00 0.00 C ATOM 64 SG CYS A 4 3.955 -0.433 -3.906 1.00 0.00 S ATOM 65 H CYS A 4 5.506 3.094 -2.495 1.00 0.00 H ATOM 66 HA CYS A 4 4.482 0.785 -1.126 1.00 0.00 H ATOM 67 HB2 CYS A 4 3.208 1.531 -2.870 1.00 0.00 H ATOM 68 HB3 CYS A 4 4.608 1.819 -3.900 1.00 0.00 H ATOM 69 N PRO A 5 5.958 -1.089 -1.601 1.00 0.00 N ATOM 70 CA PRO A 5 6.933 -2.181 -1.606 1.00 0.00 C ATOM 71 C PRO A 5 6.946 -3.078 -2.851 1.00 0.00 C ATOM 72 O PRO A 5 7.957 -3.738 -3.113 1.00 0.00 O ATOM 73 CB PRO A 5 6.443 -2.954 -0.392 1.00 0.00 C ATOM 74 CG PRO A 5 4.969 -2.917 -0.548 1.00 0.00 C ATOM 75 CD PRO A 5 4.697 -1.499 -0.899 1.00 0.00 C ATOM 76 HA PRO A 5 7.923 -1.820 -1.424 1.00 0.00 H ATOM 77 HB2 PRO A 5 6.828 -3.962 -0.396 1.00 0.00 H ATOM 78 HB3 PRO A 5 6.720 -2.426 0.505 1.00 0.00 H ATOM 79 HG2 PRO A 5 4.667 -3.566 -1.360 1.00 0.00 H ATOM 80 HG3 PRO A 5 4.476 -3.179 0.372 1.00 0.00 H ATOM 81 HD2 PRO A 5 3.842 -1.425 -1.556 1.00 0.00 H ATOM 82 HD3 PRO A 5 4.546 -0.915 -0.004 1.00 0.00 H ATOM 83 N GLU A 6 5.845 -3.106 -3.614 1.00 0.00 N ATOM 84 CA GLU A 6 5.797 -4.003 -4.799 1.00 0.00 C ATOM 85 C GLU A 6 5.310 -3.304 -6.062 1.00 0.00 C ATOM 86 O GLU A 6 5.541 -3.806 -7.167 1.00 0.00 O ATOM 87 CB GLU A 6 4.967 -5.289 -4.563 1.00 0.00 C ATOM 88 CG GLU A 6 4.840 -5.729 -3.111 1.00 0.00 C ATOM 89 CD GLU A 6 4.524 -7.204 -2.972 1.00 0.00 C ATOM 90 OE1 GLU A 6 5.474 -8.008 -2.867 1.00 0.00 O ATOM 91 OE2 GLU A 6 3.326 -7.558 -2.971 1.00 0.00 O1- ATOM 92 H GLU A 6 5.088 -2.487 -3.406 1.00 0.00 H ATOM 93 HA GLU A 6 6.815 -4.306 -4.979 1.00 0.00 H ATOM 94 HB2 GLU A 6 3.975 -5.143 -4.957 1.00 0.00 H ATOM 95 HB3 GLU A 6 5.432 -6.097 -5.112 1.00 0.00 H ATOM 96 HG2 GLU A 6 5.768 -5.521 -2.601 1.00 0.00 H ATOM 97 HG3 GLU A 6 4.043 -5.162 -2.652 1.00 0.00 H ATOM 98 N CYS A 7 4.645 -2.158 -5.912 1.00 0.00 N ATOM 99 CA CYS A 7 4.170 -1.414 -7.082 1.00 0.00 C ATOM 100 C CYS A 7 4.494 0.083 -6.981 1.00 0.00 C ATOM 101 O CYS A 7 4.004 0.755 -6.089 1.00 0.00 O ATOM 102 CB CYS A 7 2.685 -1.639 -7.432 1.00 0.00 C ATOM 103 SG CYS A 7 1.453 -0.638 -6.552 1.00 0.00 S ATOM 104 H CYS A 7 4.527 -1.791 -5.010 1.00 0.00 H ATOM 105 HA CYS A 7 4.743 -1.813 -7.888 1.00 0.00 H ATOM 106 HB2 CYS A 7 2.563 -1.402 -8.471 1.00 0.00 H ATOM 107 HB3 CYS A 7 2.443 -2.674 -7.272 1.00 0.00 H ATOM 108 N PRO A 8 5.324 0.607 -7.928 1.00 0.00 N ATOM 109 CA PRO A 8 5.791 2.021 -8.011 1.00 0.00 C ATOM 110 C PRO A 8 4.766 3.120 -7.657 1.00 0.00 C ATOM 111 O PRO A 8 4.810 4.228 -8.212 1.00 0.00 O ATOM 112 CB PRO A 8 6.216 2.125 -9.475 1.00 0.00 C ATOM 113 CG PRO A 8 6.756 0.781 -9.791 1.00 0.00 C ATOM 114 CD PRO A 8 5.908 -0.191 -9.011 1.00 0.00 C ATOM 115 HA PRO A 8 6.664 2.165 -7.393 1.00 0.00 H ATOM 116 HB2 PRO A 8 5.357 2.359 -10.094 1.00 0.00 H ATOM 117 HB3 PRO A 8 6.983 2.873 -9.593 1.00 0.00 H ATOM 118 HG2 PRO A 8 6.673 0.592 -10.854 1.00 0.00 H ATOM 119 HG3 PRO A 8 7.784 0.711 -9.472 1.00 0.00 H ATOM 120 HD2 PRO A 8 5.124 -0.591 -9.624 1.00 0.00 H ATOM 121 HD3 PRO A 8 6.510 -0.984 -8.594 1.00 0.00 H ATOM 122 N LYS A 9 3.866 2.817 -6.719 1.00 0.00 N ATOM 123 CA LYS A 9 2.898 3.743 -6.235 1.00 0.00 C ATOM 124 C LYS A 9 3.550 4.446 -5.022 1.00 0.00 C ATOM 125 O LYS A 9 3.707 3.829 -3.969 1.00 0.00 O ATOM 126 CB LYS A 9 1.615 2.969 -5.890 1.00 0.00 C ATOM 127 CG LYS A 9 0.341 3.597 -6.451 1.00 0.00 C ATOM 128 CD LYS A 9 -0.046 2.979 -7.787 1.00 0.00 C ATOM 129 CE LYS A 9 -1.309 3.613 -8.349 1.00 0.00 C ATOM 130 NZ LYS A 9 -1.696 3.014 -9.656 1.00 0.00 N1+ ATOM 131 H LYS A 9 3.851 1.925 -6.333 1.00 0.00 H ATOM 132 HA LYS A 9 2.692 4.458 -7.003 1.00 0.00 H ATOM 133 HB2 LYS A 9 1.701 1.973 -6.301 1.00 0.00 H ATOM 134 HB3 LYS A 9 1.524 2.891 -4.819 1.00 0.00 H ATOM 135 HG2 LYS A 9 -0.467 3.446 -5.750 1.00 0.00 H ATOM 136 HG3 LYS A 9 0.499 4.656 -6.591 1.00 0.00 H ATOM 137 HD2 LYS A 9 0.761 3.127 -8.488 1.00 0.00 H ATOM 138 HD3 LYS A 9 -0.216 1.922 -7.648 1.00 0.00 H ATOM 139 HE2 LYS A 9 -2.114 3.467 -7.644 1.00 0.00 H ATOM 140 HE3 LYS A 9 -1.135 4.670 -8.484 1.00 0.00 H ATOM 141 HZ1 LYS A 9 -0.934 3.149 -10.350 1.00 0.00 H ATOM 142 HZ2 LYS A 9 -2.560 3.467 -10.015 1.00 0.00 H ATOM 143 HZ3 LYS A 9 -1.873 1.995 -9.544 1.00 0.00 H HETATM 144 N MMO A 10 3.947 5.745 -5.145 1.00 0.00 N HETATM 145 CA MMO A 10 4.643 6.436 -4.032 1.00 0.00 C HETATM 146 C MMO A 10 3.919 7.703 -3.578 1.00 0.00 C HETATM 147 O MMO A 10 3.697 8.648 -4.345 1.00 0.00 O HETATM 148 CB MMO A 10 6.070 6.736 -4.532 1.00 0.00 C HETATM 149 CG MMO A 10 6.937 5.489 -4.625 1.00 0.00 C HETATM 150 CD MMO A 10 8.421 5.809 -4.549 1.00 0.00 C HETATM 151 NE MMO A 10 8.920 6.458 -5.769 1.00 0.00 N HETATM 152 CZ MMO A 10 10.198 6.798 -5.985 1.00 0.00 C HETATM 153 NH2 MMO A 10 10.536 7.381 -7.128 1.00 0.00 N HETATM 154 NH1 MMO A 10 11.139 6.561 -5.073 1.00 0.00 N HETATM 155 CN MMO A 10 3.580 6.514 -6.340 1.00 0.00 C HETATM 156 HA MMO A 10 4.704 5.756 -3.193 1.00 0.00 H HETATM 157 HCB1 MMO A 10 6.540 7.429 -3.850 1.00 0.00 H HETATM 158 HCB2 MMO A 10 6.013 7.189 -5.511 1.00 0.00 H HETATM 159 HCG1 MMO A 10 6.732 4.992 -5.563 1.00 0.00 H HETATM 160 HCG2 MMO A 10 6.679 4.834 -3.808 1.00 0.00 H HETATM 161 HCD1 MMO A 10 8.961 4.885 -4.398 1.00 0.00 H HETATM 162 HCD2 MMO A 10 8.591 6.464 -3.709 1.00 0.00 H HETATM 163 HH21 MMO A 10 9.839 7.564 -7.821 1.00 0.00 H HETATM 164 HH22 MMO A 10 11.488 7.637 -7.296 1.00 0.00 H HETATM 165 HH11 MMO A 10 12.087 6.823 -5.252 1.00 0.00 H HETATM 166 HC1 MMO A 10 4.092 6.114 -7.196 1.00 0.00 H HETATM 167 HC2 MMO A 10 3.868 7.539 -6.176 1.00 0.00 H HETATM 168 HC3 MMO A 10 2.515 6.454 -6.477 1.00 0.00 H HETATM 169 HE MMO A 10 8.263 6.652 -6.471 1.00 0.00 H HETATM 170 HH12 MMO A 10 10.895 6.122 -4.207 1.00 0.00 H ATOM 171 N PHE A 11 3.589 7.687 -2.305 1.00 0.00 N ATOM 172 CA PHE A 11 2.796 8.708 -1.639 1.00 0.00 C ATOM 173 C PHE A 11 3.206 8.715 -0.192 1.00 0.00 C ATOM 174 O PHE A 11 3.317 7.658 0.426 1.00 0.00 O ATOM 175 CB PHE A 11 1.285 8.378 -1.768 1.00 0.00 C ATOM 176 CG PHE A 11 1.022 6.910 -2.023 1.00 0.00 C ATOM 177 CD1 PHE A 11 0.605 6.067 -1.011 1.00 0.00 C ATOM 178 CD2 PHE A 11 1.243 6.368 -3.280 1.00 0.00 C ATOM 179 CE1 PHE A 11 0.417 4.723 -1.253 1.00 0.00 C ATOM 180 CE2 PHE A 11 1.062 5.040 -3.522 1.00 0.00 C ATOM 181 CZ PHE A 11 0.655 4.206 -2.527 1.00 0.00 C ATOM 182 H PHE A 11 3.951 6.977 -1.760 1.00 0.00 H ATOM 183 HA PHE A 11 3.008 9.667 -2.088 1.00 0.00 H ATOM 184 HB2 PHE A 11 0.782 8.653 -0.852 1.00 0.00 H ATOM 185 HB3 PHE A 11 0.865 8.942 -2.588 1.00 0.00 H ATOM 186 HD1 PHE A 11 0.435 6.463 -0.021 1.00 0.00 H ATOM 187 HD2 PHE A 11 1.576 7.010 -4.077 1.00 0.00 H ATOM 188 HE1 PHE A 11 0.100 4.084 -0.448 1.00 0.00 H ATOM 189 HE2 PHE A 11 1.280 4.634 -4.509 1.00 0.00 H ATOM 190 HZ PHE A 11 0.526 3.151 -2.750 1.00 0.00 H HETATM 191 N NLE A 12 3.404 9.900 0.347 1.00 0.00 N HETATM 192 CA NLE A 12 3.865 10.068 1.716 1.00 0.00 C HETATM 193 C NLE A 12 2.770 9.779 2.772 1.00 0.00 C HETATM 194 O NLE A 12 2.555 10.554 3.712 1.00 0.00 O HETATM 195 CB NLE A 12 4.449 11.471 1.805 1.00 0.00 C HETATM 196 CG NLE A 12 5.414 11.704 2.968 1.00 0.00 C HETATM 197 CD NLE A 12 4.778 12.550 4.061 1.00 0.00 C HETATM 198 CE NLE A 12 5.795 12.871 5.135 1.00 0.00 C HETATM 199 H NLE A 12 3.232 10.699 -0.194 1.00 0.00 H HETATM 200 HA NLE A 12 4.666 9.361 1.868 1.00 0.00 H HETATM 201 HB2 NLE A 12 3.638 12.175 1.878 1.00 0.00 H HETATM 202 HB3 NLE A 12 4.981 11.644 0.878 1.00 0.00 H HETATM 203 HG2 NLE A 12 6.295 12.212 2.600 1.00 0.00 H HETATM 204 HG3 NLE A 12 5.696 10.751 3.387 1.00 0.00 H HETATM 205 HD2 NLE A 12 3.961 12.002 4.508 1.00 0.00 H HETATM 206 HD3 NLE A 12 4.418 13.475 3.637 1.00 0.00 H HETATM 207 HE1 NLE A 12 6.162 11.954 5.569 1.00 0.00 H HETATM 208 HE2 NLE A 12 5.329 13.472 5.903 1.00 0.00 H HETATM 209 HE3 NLE A 12 6.618 13.417 4.699 1.00 0.00 H ATOM 210 N ARG A 13 2.090 8.637 2.592 1.00 0.00 N ATOM 211 CA ARG A 13 1.065 8.163 3.515 1.00 0.00 C ATOM 212 C ARG A 13 1.244 6.653 3.659 1.00 0.00 C ATOM 213 O ARG A 13 0.703 5.869 2.871 1.00 0.00 O ATOM 214 CB ARG A 13 -0.351 8.517 3.024 1.00 0.00 C ATOM 215 CG ARG A 13 -0.683 10.007 3.080 1.00 0.00 C ATOM 216 CD ARG A 13 -1.208 10.422 4.449 1.00 0.00 C ATOM 217 NE ARG A 13 -1.526 11.853 4.505 1.00 0.00 N ATOM 218 CZ ARG A 13 -2.010 12.488 5.583 1.00 0.00 C ATOM 219 NH1 ARG A 13 -2.242 11.834 6.721 1.00 0.00 N1+ ATOM 220 NH2 ARG A 13 -2.262 13.787 5.519 1.00 0.00 N ATOM 221 H ARG A 13 2.280 8.090 1.791 1.00 0.00 H ATOM 222 HA ARG A 13 1.242 8.629 4.475 1.00 0.00 H ATOM 223 HB2 ARG A 13 -0.454 8.186 2.001 1.00 0.00 H ATOM 224 HB3 ARG A 13 -1.068 7.988 3.635 1.00 0.00 H ATOM 225 HG2 ARG A 13 0.211 10.572 2.866 1.00 0.00 H ATOM 226 HG3 ARG A 13 -1.435 10.228 2.336 1.00 0.00 H ATOM 227 HD2 ARG A 13 -2.102 9.856 4.664 1.00 0.00 H ATOM 228 HD3 ARG A 13 -0.455 10.202 5.191 1.00 0.00 H ATOM 229 HE ARG A 13 -1.373 12.377 3.690 1.00 0.00 H ATOM 230 HH11 ARG A 13 -2.055 10.853 6.781 1.00 0.00 H ATOM 231 HH12 ARG A 13 -2.602 12.324 7.514 1.00 0.00 H ATOM 232 HH21 ARG A 13 -2.622 14.267 6.320 1.00 0.00 H ATOM 233 HH22 ARG A 13 -2.092 14.289 4.671 1.00 0.00 H ATOM 234 N SER A 14 2.040 6.261 4.658 1.00 0.00 N ATOM 235 CA SER A 14 2.370 4.852 4.894 1.00 0.00 C ATOM 236 C SER A 14 1.299 4.089 5.682 1.00 0.00 C ATOM 237 O SER A 14 1.240 2.859 5.598 1.00 0.00 O ATOM 238 CB SER A 14 3.710 4.749 5.623 1.00 0.00 C ATOM 239 OG SER A 14 4.731 5.426 4.911 1.00 0.00 O ATOM 240 H SER A 14 2.419 6.941 5.256 1.00 0.00 H ATOM 241 HA SER A 14 2.474 4.390 3.925 1.00 0.00 H ATOM 242 HB2 SER A 14 3.619 5.191 6.604 1.00 0.00 H ATOM 243 HB3 SER A 14 3.985 3.709 5.721 1.00 0.00 H ATOM 244 HG SER A 14 5.404 4.797 4.640 1.00 0.00 H HETATM 245 OE1 B3D A 15 0.809 2.611 9.723 1.00 0.00 O HETATM 246 CD B3D A 15 0.940 3.756 9.242 1.00 0.00 C HETATM 247 OE2 B3D A 15 2.037 4.347 9.168 1.00 0.00 O HETATM 248 CG B3D A 15 -0.298 4.464 8.718 1.00 0.00 C HETATM 249 CB B3D A 15 -0.565 4.175 7.225 1.00 0.00 C HETATM 250 N B3D A 15 0.467 4.805 6.442 1.00 0.00 N HETATM 251 CA B3D A 15 -1.952 4.742 6.908 1.00 0.00 C HETATM 252 C B3D A 15 -2.509 4.301 5.582 1.00 0.00 C HETATM 253 O B3D A 15 -2.907 3.135 5.405 1.00 0.00 O HETATM 254 HG3 B3D A 15 -0.163 5.526 8.853 1.00 0.00 H HETATM 255 HG2 B3D A 15 -1.148 4.138 9.300 1.00 0.00 H HETATM 256 HB B3D A 15 -0.521 3.094 6.975 1.00 0.00 H HETATM 257 H B3D A 15 0.557 5.782 6.463 1.00 0.00 H HETATM 258 HA1 B3D A 15 -1.894 5.821 6.904 1.00 0.00 H HETATM 259 HA2 B3D A 15 -2.642 4.432 7.678 1.00 0.00 H ATOM 260 N HIS A 16 -2.506 5.245 4.626 1.00 0.00 N ATOM 261 CA HIS A 16 -3.035 5.025 3.274 1.00 0.00 C ATOM 262 C HIS A 16 -2.302 3.909 2.517 1.00 0.00 C ATOM 263 O HIS A 16 -2.927 3.213 1.716 1.00 0.00 O ATOM 264 CB HIS A 16 -2.978 6.329 2.470 1.00 0.00 C ATOM 265 CG HIS A 16 -3.981 6.405 1.356 1.00 0.00 C ATOM 266 ND1 HIS A 16 -5.160 7.114 1.452 1.00 0.00 N ATOM 267 CD2 HIS A 16 -3.972 5.858 0.116 1.00 0.00 C ATOM 268 CE1 HIS A 16 -5.834 6.999 0.321 1.00 0.00 C ATOM 269 NE2 HIS A 16 -5.134 6.242 -0.505 1.00 0.00 N ATOM 270 H HIS A 16 -2.132 6.124 4.842 1.00 0.00 H ATOM 271 HA HIS A 16 -4.070 4.736 3.378 1.00 0.00 H ATOM 272 HB2 HIS A 16 -3.162 7.159 3.134 1.00 0.00 H ATOM 273 HB3 HIS A 16 -1.993 6.433 2.039 1.00 0.00 H ATOM 274 HD1 HIS A 16 -5.459 7.624 2.232 1.00 0.00 H ATOM 275 HD2 HIS A 16 -3.196 5.235 -0.304 1.00 0.00 H ATOM 276 HE1 HIS A 16 -6.793 7.447 0.108 1.00 0.00 H ATOM 277 HE2 HIS A 16 -5.443 5.926 -1.380 1.00 0.00 H ATOM 278 N LEU A 17 -0.985 3.742 2.754 1.00 0.00 N ATOM 279 CA LEU A 17 -0.234 2.691 2.076 1.00 0.00 C ATOM 280 C LEU A 17 -0.349 1.345 2.784 1.00 0.00 C ATOM 281 O LEU A 17 -0.307 0.307 2.135 1.00 0.00 O ATOM 282 CB LEU A 17 1.243 3.033 1.861 1.00 0.00 C ATOM 283 CG LEU A 17 1.870 2.348 0.631 1.00 0.00 C ATOM 284 CD1 LEU A 17 2.953 3.205 0.026 1.00 0.00 C ATOM 285 CD2 LEU A 17 2.418 0.978 0.979 1.00 0.00 C ATOM 286 H LEU A 17 -0.524 4.343 3.360 1.00 0.00 H ATOM 287 HA LEU A 17 -0.696 2.591 1.114 1.00 0.00 H ATOM 288 HB2 LEU A 17 1.338 4.103 1.751 1.00 0.00 H ATOM 289 HB3 LEU A 17 1.793 2.721 2.734 1.00 0.00 H ATOM 290 HG LEU A 17 1.107 2.206 -0.112 1.00 0.00 H ATOM 291 HD11 LEU A 17 3.757 3.324 0.736 1.00 0.00 H ATOM 292 HD12 LEU A 17 2.547 4.171 -0.228 1.00 0.00 H ATOM 293 HD13 LEU A 17 3.328 2.725 -0.868 1.00 0.00 H ATOM 294 HD21 LEU A 17 3.349 1.078 1.511 1.00 0.00 H ATOM 295 HD22 LEU A 17 2.576 0.402 0.064 1.00 0.00 H ATOM 296 HD23 LEU A 17 1.694 0.465 1.604 1.00 0.00 H ATOM 297 N SER A 18 -0.444 1.362 4.111 1.00 0.00 N ATOM 298 CA SER A 18 -0.606 0.128 4.891 1.00 0.00 C ATOM 299 C SER A 18 -1.895 -0.582 4.455 1.00 0.00 C ATOM 300 O SER A 18 -1.869 -1.755 4.061 1.00 0.00 O ATOM 301 CB SER A 18 -0.627 0.433 6.395 1.00 0.00 C ATOM 302 OG SER A 18 -0.663 -0.760 7.164 1.00 0.00 O ATOM 303 H SER A 18 -0.373 2.214 4.570 1.00 0.00 H ATOM 304 HA SER A 18 0.234 -0.514 4.670 1.00 0.00 H ATOM 305 HB2 SER A 18 0.264 0.984 6.660 1.00 0.00 H ATOM 306 HB3 SER A 18 -1.499 1.024 6.629 1.00 0.00 H ATOM 307 HG SER A 18 -0.896 -0.550 8.071 1.00 0.00 H HETATM 308 N B3K A 19 -3.009 0.158 4.479 1.00 0.00 N HETATM 309 CB B3K A 19 -4.270 -0.382 4.060 1.00 0.00 C HETATM 310 CG B3K A 19 -5.305 -0.216 5.197 1.00 0.00 C HETATM 311 CD B3K A 19 -5.002 -1.043 6.441 1.00 0.00 C HETATM 312 CE B3K A 19 -6.038 -0.813 7.528 1.00 0.00 C HETATM 313 CF B3K A 19 -5.738 -1.639 8.768 1.00 0.00 C HETATM 314 NZ B3K A 19 -6.748 -1.421 9.841 1.00 0.00 N HETATM 315 CA B3K A 19 -4.805 0.390 2.850 1.00 0.00 C HETATM 316 C B3K A 19 -4.255 -0.065 1.520 1.00 0.00 C HETATM 317 O B3K A 19 -4.725 -1.055 0.939 1.00 0.00 O HETATM 318 H B3K A 19 -2.961 1.096 4.790 1.00 0.00 H HETATM 319 HB B3K A 19 -4.080 -1.443 3.791 1.00 0.00 H HETATM 320 HG2 B3K A 19 -6.277 -0.509 4.830 1.00 0.00 H HETATM 321 HG3 B3K A 19 -5.340 0.824 5.485 1.00 0.00 H HETATM 322 HD2 B3K A 19 -4.029 -0.763 6.819 1.00 0.00 H HETATM 323 HD3 B3K A 19 -5.000 -2.089 6.176 1.00 0.00 H HETATM 324 HE2 B3K A 19 -7.011 -1.090 7.149 1.00 0.00 H HETATM 325 HE3 B3K A 19 -6.040 0.233 7.797 1.00 0.00 H HETATM 326 HF1 B3K A 19 -4.762 -1.362 9.142 1.00 0.00 H HETATM 327 HF2 B3K A 19 -5.734 -2.684 8.498 1.00 0.00 H HETATM 328 HNZ1 B3K A 19 -6.515 -1.997 10.675 1.00 0.00 H HETATM 329 HNZ2 B3K A 19 -7.693 -1.690 9.502 1.00 0.00 H HETATM 330 HA1 B3K A 19 -5.879 0.286 2.817 1.00 0.00 H HETATM 331 HA2 B3K A 19 -4.560 1.434 2.973 1.00 0.00 H HETATM 332 HZ3 B3K A 19 -6.763 -0.419 10.119 1.00 0.00 H ATOM 333 N HIS A 20 -3.185 0.617 1.066 1.00 0.00 N ATOM 334 CA HIS A 20 -2.569 0.364 -0.236 1.00 0.00 C ATOM 335 C HIS A 20 -2.037 -1.068 -0.376 1.00 0.00 C ATOM 336 O HIS A 20 -2.142 -1.684 -1.437 1.00 0.00 O ATOM 337 CB HIS A 20 -1.438 1.353 -0.447 1.00 0.00 C ATOM 338 CG HIS A 20 -0.736 1.150 -1.726 1.00 0.00 C ATOM 339 ND1 HIS A 20 -1.150 1.696 -2.913 1.00 0.00 N ATOM 340 CD2 HIS A 20 0.292 0.328 -2.012 1.00 0.00 C ATOM 341 CE1 HIS A 20 -0.391 1.177 -3.872 1.00 0.00 C ATOM 342 NE2 HIS A 20 0.502 0.354 -3.370 1.00 0.00 N ATOM 343 H HIS A 20 -2.754 1.281 1.654 1.00 0.00 H ATOM 344 HA HIS A 20 -3.301 0.546 -0.996 1.00 0.00 H ATOM 345 HB2 HIS A 20 -1.832 2.360 -0.433 1.00 0.00 H ATOM 346 HB3 HIS A 20 -0.722 1.223 0.347 1.00 0.00 H ATOM 347 HD1 HIS A 20 -1.873 2.346 -3.032 1.00 0.00 H ATOM 348 HD2 HIS A 20 0.822 -0.318 -1.302 1.00 0.00 H ATOM 349 HE1 HIS A 20 -0.540 1.346 -4.921 1.00 0.00 H ATOM 350 N ILE A 21 -1.418 -1.563 0.675 1.00 0.00 N ATOM 351 CA ILE A 21 -0.852 -2.889 0.650 1.00 0.00 C ATOM 352 C ILE A 21 -1.770 -3.919 1.302 1.00 0.00 C ATOM 353 O ILE A 21 -1.552 -5.122 1.164 1.00 0.00 O ATOM 354 CB ILE A 21 0.590 -2.911 1.212 1.00 0.00 C ATOM 355 CG1 ILE A 21 0.665 -2.658 2.730 1.00 0.00 C ATOM 356 CG2 ILE A 21 1.426 -1.903 0.474 1.00 0.00 C ATOM 357 CD1 ILE A 21 0.758 -3.924 3.555 1.00 0.00 C ATOM 358 H ILE A 21 -1.314 -1.016 1.467 1.00 0.00 H ATOM 359 HA ILE A 21 -0.784 -3.148 -0.391 1.00 0.00 H ATOM 360 HB ILE A 21 1.003 -3.851 0.983 1.00 0.00 H ATOM 361 HG12 ILE A 21 1.537 -2.060 2.946 1.00 0.00 H ATOM 362 HG13 ILE A 21 -0.219 -2.122 3.041 1.00 0.00 H ATOM 363 HG21 ILE A 21 2.361 -1.758 0.989 1.00 0.00 H ATOM 364 HG22 ILE A 21 0.885 -0.970 0.434 1.00 0.00 H ATOM 365 HG23 ILE A 21 1.612 -2.261 -0.528 1.00 0.00 H ATOM 366 HD11 ILE A 21 0.809 -3.668 4.603 1.00 0.00 H ATOM 367 HD12 ILE A 21 1.645 -4.473 3.274 1.00 0.00 H ATOM 368 HD13 ILE A 21 -0.116 -4.535 3.376 1.00 0.00 H HETATM 369 N B3K A 22 -2.756 -3.430 2.054 1.00 0.00 N HETATM 370 CB B3K A 22 -3.745 -4.275 2.635 1.00 0.00 C HETATM 371 CG B3K A 22 -3.783 -4.044 4.158 1.00 0.00 C HETATM 372 CD B3K A 22 -3.659 -5.324 4.968 1.00 0.00 C HETATM 373 CE B3K A 22 -3.685 -5.043 6.462 1.00 0.00 C HETATM 374 CF B3K A 22 -3.551 -6.323 7.271 1.00 0.00 C HETATM 375 NZ B3K A 22 -3.572 -6.058 8.737 1.00 0.00 N HETATM 376 CA B3K A 22 -5.137 -3.905 2.085 1.00 0.00 C HETATM 377 C B3K A 22 -5.321 -4.098 0.586 1.00 0.00 C HETATM 378 O B3K A 22 -6.211 -4.861 0.169 1.00 0.00 O HETATM 379 H B3K A 22 -2.774 -2.465 2.252 1.00 0.00 H HETATM 380 HB B3K A 22 -3.473 -5.315 2.352 1.00 0.00 H HETATM 381 HG2 B3K A 22 -4.717 -3.570 4.417 1.00 0.00 H HETATM 382 HG3 B3K A 22 -2.968 -3.390 4.432 1.00 0.00 H HETATM 383 HD2 B3K A 22 -2.728 -5.810 4.717 1.00 0.00 H HETATM 384 HD3 B3K A 22 -4.485 -5.976 4.721 1.00 0.00 H HETATM 385 HE2 B3K A 22 -4.620 -4.564 6.712 1.00 0.00 H HETATM 386 HE3 B3K A 22 -2.864 -4.385 6.708 1.00 0.00 H HETATM 387 HF1 B3K A 22 -2.618 -6.801 7.014 1.00 0.00 H HETATM 388 HF2 B3K A 22 -4.372 -6.978 7.023 1.00 0.00 H HETATM 389 HNZ1 B3K A 22 -4.466 -5.600 9.005 1.00 0.00 H HETATM 390 HNZ2 B3K A 22 -2.784 -5.432 8.998 1.00 0.00 H HETATM 391 HA1 B3K A 22 -5.328 -2.865 2.308 1.00 0.00 H HETATM 392 HA2 B3K A 22 -5.877 -4.508 2.590 1.00 0.00 H HETATM 393 HZ3 B3K A 22 -3.480 -6.950 9.263 1.00 0.00 H ATOM 394 N THR A 23 -4.474 -3.432 -0.244 1.00 0.00 N ATOM 395 CA THR A 23 -4.601 -3.542 -1.707 1.00 0.00 C ATOM 396 C THR A 23 -3.616 -4.565 -2.250 1.00 0.00 C ATOM 397 O THR A 23 -3.990 -5.396 -3.083 1.00 0.00 O ATOM 398 CB THR A 23 -4.447 -2.181 -2.446 1.00 0.00 C ATOM 399 OG1 THR A 23 -5.065 -1.135 -1.686 1.00 0.00 O ATOM 400 CG2 THR A 23 -5.088 -2.232 -3.827 1.00 0.00 C ATOM 401 H THR A 23 -3.728 -2.899 0.137 1.00 0.00 H ATOM 402 HA THR A 23 -5.592 -3.916 -1.902 1.00 0.00 H ATOM 403 HB THR A 23 -3.388 -1.952 -2.567 1.00 0.00 H ATOM 404 HG1 THR A 23 -5.913 -1.440 -1.352 1.00 0.00 H ATOM 405 HG21 THR A 23 -6.151 -2.386 -3.722 1.00 0.00 H ATOM 406 HG22 THR A 23 -4.660 -3.049 -4.388 1.00 0.00 H ATOM 407 HG23 THR A 23 -4.906 -1.302 -4.344 1.00 0.00 H ATOM 408 N HIS A 24 -2.353 -4.503 -1.788 1.00 0.00 N ATOM 409 CA HIS A 24 -1.342 -5.499 -2.196 1.00 0.00 C ATOM 410 C HIS A 24 -1.776 -6.868 -1.729 1.00 0.00 C ATOM 411 O HIS A 24 -1.453 -7.907 -2.312 1.00 0.00 O ATOM 412 CB HIS A 24 0.033 -5.163 -1.624 1.00 0.00 C ATOM 413 CG HIS A 24 0.822 -4.201 -2.455 1.00 0.00 C ATOM 414 ND1 HIS A 24 1.906 -4.556 -3.242 1.00 0.00 N ATOM 415 CD2 HIS A 24 0.637 -2.875 -2.673 1.00 0.00 C ATOM 416 CE1 HIS A 24 2.299 -3.461 -3.896 1.00 0.00 C ATOM 417 NE2 HIS A 24 1.561 -2.458 -3.598 1.00 0.00 N ATOM 418 H HIS A 24 -2.097 -3.768 -1.189 1.00 0.00 H ATOM 419 HA HIS A 24 -1.328 -5.502 -3.248 1.00 0.00 H ATOM 420 HB2 HIS A 24 -0.112 -4.724 -0.650 1.00 0.00 H ATOM 421 HB3 HIS A 24 0.606 -6.072 -1.524 1.00 0.00 H ATOM 422 HD1 HIS A 24 2.333 -5.434 -3.285 1.00 0.00 H ATOM 423 HD2 HIS A 24 0.005 -2.204 -2.103 1.00 0.00 H ATOM 424 HE1 HIS A 24 3.175 -3.372 -4.520 1.00 0.00 H HETATM 425 N B3Q A 25 -2.513 -6.792 -0.659 1.00 0.00 N HETATM 426 CB B3Q A 25 -3.157 -7.903 -0.029 1.00 0.00 C HETATM 427 CG B3Q A 25 -2.529 -8.252 1.328 1.00 0.00 C HETATM 428 CA B3Q A 25 -4.563 -7.390 0.154 1.00 0.00 C HETATM 429 C B3Q A 25 -5.669 -8.371 -0.163 1.00 0.00 C HETATM 430 O B3Q A 25 -5.463 -9.589 -0.217 1.00 0.00 O HETATM 431 HN B3Q A 25 -2.649 -5.890 -0.270 1.00 0.00 H HETATM 432 HB B3Q A 25 -3.145 -8.751 -0.702 1.00 0.00 H HETATM 433 HG B3Q A 25 -3.168 -8.965 1.831 1.00 0.00 H HETATM 434 HGA B3Q A 25 -2.472 -7.354 1.925 1.00 0.00 H HETATM 435 CD B3Q A 25 -1.128 -8.846 1.231 1.00 0.00 C HETATM 436 HA B3Q A 25 -4.684 -7.047 1.168 1.00 0.00 H HETATM 437 HAA B3Q A 25 -4.659 -6.538 -0.527 1.00 0.00 H HETATM 438 CE B3Q A 25 -0.061 -7.910 1.765 1.00 0.00 C HETATM 439 NF2 B3Q A 25 0.479 -7.067 0.894 1.00 0.00 N HETATM 440 H8 B3Q A 25 -0.914 -9.058 0.194 1.00 0.00 H HETATM 441 OF1 B3Q A 25 0.273 -7.944 2.950 1.00 0.00 O HETATM 442 H9 B3Q A 25 -1.095 -9.766 1.798 1.00 0.00 H HETATM 443 H11 B3Q A 25 0.165 -7.096 -0.034 1.00 0.00 H HETATM 444 H12 B3Q A 25 1.170 -6.450 1.214 1.00 0.00 H ATOM 445 N ASN A 26 -6.874 -7.801 -0.375 1.00 0.00 N ATOM 446 CA ASN A 26 -8.107 -8.559 -0.705 1.00 0.00 C ATOM 447 C ASN A 26 -8.530 -9.497 0.429 1.00 0.00 C ATOM 448 O ASN A 26 -7.712 -10.256 0.957 1.00 0.00 O ATOM 449 CB ASN A 26 -7.953 -9.359 -2.012 1.00 0.00 C ATOM 450 CG ASN A 26 -7.842 -8.465 -3.233 1.00 0.00 C ATOM 451 OD1 ASN A 26 -8.845 -8.113 -3.853 1.00 0.00 O ATOM 452 ND2 ASN A 26 -6.616 -8.094 -3.585 1.00 0.00 N ATOM 453 H ASN A 26 -6.937 -6.816 -0.301 1.00 0.00 H ATOM 454 HA ASN A 26 -8.894 -7.833 -0.844 1.00 0.00 H ATOM 455 HB2 ASN A 26 -7.062 -9.965 -1.952 1.00 0.00 H ATOM 456 HB3 ASN A 26 -8.812 -10.001 -2.136 1.00 0.00 H ATOM 457 HD21 ASN A 26 -5.863 -8.413 -3.046 1.00 0.00 H ATOM 458 HD22 ASN A 26 -6.514 -7.516 -4.371 1.00 0.00 H ATOM 459 N LYS A 27 -9.816 -9.433 0.789 1.00 0.00 N ATOM 460 CA LYS A 27 -10.374 -10.269 1.858 1.00 0.00 C ATOM 461 C LYS A 27 -11.326 -11.332 1.293 1.00 0.00 C ATOM 462 O LYS A 27 -11.259 -12.500 1.687 1.00 0.00 O ATOM 463 CB LYS A 27 -11.084 -9.405 2.927 1.00 0.00 C ATOM 464 CG LYS A 27 -12.112 -8.408 2.387 1.00 0.00 C ATOM 465 CD LYS A 27 -12.751 -7.606 3.509 1.00 0.00 C ATOM 466 CE LYS A 27 -13.770 -6.612 2.972 1.00 0.00 C ATOM 467 NZ LYS A 27 -14.400 -5.819 4.064 1.00 0.00 N1+ ATOM 468 H LYS A 27 -10.406 -8.805 0.322 1.00 0.00 H ATOM 469 HA LYS A 27 -9.544 -10.779 2.327 1.00 0.00 H ATOM 470 HB2 LYS A 27 -11.591 -10.063 3.616 1.00 0.00 H ATOM 471 HB3 LYS A 27 -10.333 -8.850 3.471 1.00 0.00 H ATOM 472 HG2 LYS A 27 -11.619 -7.728 1.708 1.00 0.00 H ATOM 473 HG3 LYS A 27 -12.883 -8.951 1.859 1.00 0.00 H ATOM 474 HD2 LYS A 27 -13.248 -8.283 4.185 1.00 0.00 H ATOM 475 HD3 LYS A 27 -11.979 -7.067 4.037 1.00 0.00 H ATOM 476 HE2 LYS A 27 -13.271 -5.938 2.291 1.00 0.00 H ATOM 477 HE3 LYS A 27 -14.538 -7.154 2.442 1.00 0.00 H ATOM 478 HZ1 LYS A 27 -13.673 -5.285 4.583 1.00 0.00 H ATOM 479 HZ2 LYS A 27 -14.890 -6.451 4.727 1.00 0.00 H ATOM 480 HZ3 LYS A 27 -15.089 -5.150 3.666 1.00 0.00 H ATOM 481 N LYS A 28 -12.204 -10.912 0.375 1.00 0.00 N ATOM 482 CA LYS A 28 -13.173 -11.814 -0.251 1.00 0.00 C ATOM 483 C LYS A 28 -12.859 -12.004 -1.734 1.00 0.00 C ATOM 484 O LYS A 28 -12.909 -11.058 -2.524 1.00 0.00 O ATOM 485 CB LYS A 28 -14.601 -11.279 -0.076 1.00 0.00 C ATOM 486 CG LYS A 28 -15.143 -11.423 1.340 1.00 0.00 C ATOM 487 CD LYS A 28 -16.560 -10.878 1.452 1.00 0.00 C ATOM 488 CE LYS A 28 -17.114 -11.032 2.862 1.00 0.00 C ATOM 489 NZ LYS A 28 -17.464 -12.447 3.178 1.00 0.00 N1+ ATOM 490 H LYS A 28 -12.199 -9.968 0.112 1.00 0.00 H ATOM 491 HA LYS A 28 -13.096 -12.771 0.243 1.00 0.00 H ATOM 492 HB2 LYS A 28 -14.615 -10.231 -0.336 1.00 0.00 H ATOM 493 HB3 LYS A 28 -15.258 -11.815 -0.745 1.00 0.00 H ATOM 494 HG2 LYS A 28 -15.149 -12.469 1.607 1.00 0.00 H ATOM 495 HG3 LYS A 28 -14.502 -10.879 2.018 1.00 0.00 H ATOM 496 HD2 LYS A 28 -16.553 -9.830 1.194 1.00 0.00 H ATOM 497 HD3 LYS A 28 -17.197 -11.416 0.764 1.00 0.00 H ATOM 498 HE2 LYS A 28 -16.371 -10.691 3.566 1.00 0.00 H ATOM 499 HE3 LYS A 28 -18.001 -10.423 2.954 1.00 0.00 H ATOM 500 HZ1 LYS A 28 -17.838 -12.515 4.147 1.00 0.00 H ATOM 501 HZ2 LYS A 28 -16.619 -13.050 3.102 1.00 0.00 H ATOM 502 HZ3 LYS A 28 -18.184 -12.795 2.514 1.00 0.00 H HETATM 503 N NH2 A 29 -12.522 -13.232 -2.109 1.00 0.00 N HETATM 504 HN1 NH2 A 29 -12.503 -13.935 -1.427 1.00 0.00 H HETATM 505 HN2 NH2 A 29 -12.305 -13.385 -3.052 1.00 0.00 H TER 506 NH2 A 29 HETATM 507 ZN ZN A 101 1.792 -0.728 -4.329 1.00 0.00 ZN