ATOM 1 N ALA A 1 -2.652 -11.444 -7.651 1.00 0.00 N ATOM 2 CA ALA A 1 -3.671 -10.724 -8.426 1.00 0.00 C ATOM 3 C ALA A 1 -2.985 -9.437 -8.823 1.00 0.00 C ATOM 4 O ALA A 1 -2.180 -9.004 -7.998 1.00 0.00 O ATOM 5 CB ALA A 1 -4.246 -11.504 -9.607 1.00 0.00 C ATOM 6 H1 ALA A 1 -1.838 -11.608 -8.233 1.00 0.00 H ATOM 7 H2 ALA A 1 -2.385 -10.889 -6.846 1.00 0.00 H ATOM 8 H3 ALA A 1 -3.029 -12.332 -7.339 1.00 0.00 H ATOM 9 HA ALA A 1 -4.490 -10.472 -7.753 1.00 0.00 H ATOM 10 HB1 ALA A 1 -4.708 -12.427 -9.261 1.00 0.00 H ATOM 11 HB2 ALA A 1 -5.010 -10.871 -10.072 1.00 0.00 H ATOM 12 HB3 ALA A 1 -3.467 -11.732 -10.335 1.00 0.00 H ATOM 13 N ASP A 2 -3.231 -8.901 -10.019 1.00 0.00 N ATOM 14 CA ASP A 2 -2.873 -7.558 -10.449 1.00 0.00 C ATOM 15 C ASP A 2 -3.485 -6.536 -9.501 1.00 0.00 C ATOM 16 O ASP A 2 -2.876 -5.504 -9.208 1.00 0.00 O ATOM 17 CB ASP A 2 -3.447 -7.331 -11.853 1.00 0.00 C ATOM 18 CG ASP A 2 -2.975 -8.385 -12.838 1.00 0.00 C ATOM 19 OD1 ASP A 2 -3.346 -9.557 -12.600 1.00 0.00 O ATOM 20 OD2 ASP A 2 -2.249 -7.999 -13.778 1.00 0.00 O ATOM 21 H ASP A 2 -3.665 -9.459 -10.757 1.00 0.00 H ATOM 22 HA ASP A 2 -1.788 -7.461 -10.458 1.00 0.00 H ATOM 23 HB2 ASP A 2 -4.536 -7.382 -11.820 1.00 0.00 H ATOM 24 HB3 ASP A 2 -3.172 -6.342 -12.212 1.00 0.00 H ATOM 25 N VAL A 3 -4.691 -6.864 -9.040 1.00 0.00 N ATOM 26 CA VAL A 3 -5.419 -6.183 -7.987 1.00 0.00 C ATOM 27 C VAL A 3 -5.702 -7.225 -6.905 1.00 0.00 C ATOM 28 O VAL A 3 -5.807 -8.417 -7.205 1.00 0.00 O ATOM 29 CB VAL A 3 -6.690 -5.535 -8.565 1.00 0.00 C ATOM 30 CG1 VAL A 3 -7.661 -6.568 -9.152 1.00 0.00 C ATOM 31 CG2 VAL A 3 -7.421 -4.681 -7.521 1.00 0.00 C ATOM 32 H VAL A 3 -5.055 -7.767 -9.324 1.00 0.00 H ATOM 33 HA VAL A 3 -4.794 -5.396 -7.563 1.00 0.00 H ATOM 34 HB VAL A 3 -6.384 -4.866 -9.371 1.00 0.00 H ATOM 35 HG11 VAL A 3 -7.168 -7.153 -9.927 1.00 0.00 H ATOM 36 HG12 VAL A 3 -8.025 -7.236 -8.371 1.00 0.00 H ATOM 37 HG13 VAL A 3 -8.512 -6.051 -9.596 1.00 0.00 H ATOM 38 HG21 VAL A 3 -6.741 -3.933 -7.113 1.00 0.00 H ATOM 39 HG22 VAL A 3 -8.258 -4.167 -7.992 1.00 0.00 H ATOM 40 HG23 VAL A 3 -7.804 -5.302 -6.710 1.00 0.00 H ATOM 41 N VAL A 4 -5.765 -6.781 -5.653 1.00 0.00 N ATOM 42 CA VAL A 4 -6.039 -7.560 -4.453 1.00 0.00 C ATOM 43 C VAL A 4 -6.960 -6.700 -3.562 1.00 0.00 C ATOM 44 O VAL A 4 -7.251 -5.544 -3.871 1.00 0.00 O ATOM 45 CB VAL A 4 -4.685 -7.964 -3.810 1.00 0.00 C ATOM 46 CG1 VAL A 4 -4.794 -8.548 -2.394 1.00 0.00 C ATOM 47 CG2 VAL A 4 -3.957 -8.997 -4.684 1.00 0.00 C ATOM 48 H VAL A 4 -5.667 -5.779 -5.519 1.00 0.00 H ATOM 49 HA VAL A 4 -6.593 -8.462 -4.716 1.00 0.00 H ATOM 50 HB VAL A 4 -4.038 -7.089 -3.759 1.00 0.00 H ATOM 51 HG11 VAL A 4 -5.496 -9.382 -2.380 1.00 0.00 H ATOM 52 HG12 VAL A 4 -3.818 -8.908 -2.066 1.00 0.00 H ATOM 53 HG13 VAL A 4 -5.108 -7.784 -1.684 1.00 0.00 H ATOM 54 HG21 VAL A 4 -4.594 -9.866 -4.846 1.00 0.00 H ATOM 55 HG22 VAL A 4 -3.685 -8.560 -5.643 1.00 0.00 H ATOM 56 HG23 VAL A 4 -3.037 -9.318 -4.195 1.00 0.00 H ATOM 57 N THR A 5 -7.480 -7.239 -2.462 1.00 0.00 N ATOM 58 CA THR A 5 -8.284 -6.490 -1.506 1.00 0.00 C ATOM 59 C THR A 5 -8.044 -7.144 -0.149 1.00 0.00 C ATOM 60 O THR A 5 -7.995 -8.370 -0.075 1.00 0.00 O ATOM 61 CB THR A 5 -9.763 -6.542 -1.922 1.00 0.00 C ATOM 62 OG1 THR A 5 -9.909 -6.082 -3.252 1.00 0.00 O ATOM 63 CG2 THR A 5 -10.649 -5.683 -1.016 1.00 0.00 C ATOM 64 H THR A 5 -7.274 -8.197 -2.206 1.00 0.00 H ATOM 65 HA THR A 5 -7.964 -5.443 -1.467 1.00 0.00 H ATOM 66 HB THR A 5 -10.115 -7.575 -1.875 1.00 0.00 H ATOM 67 HG1 THR A 5 -9.096 -5.634 -3.521 1.00 0.00 H ATOM 68 HG21 THR A 5 -10.318 -4.645 -1.033 1.00 0.00 H ATOM 69 HG22 THR A 5 -11.678 -5.727 -1.375 1.00 0.00 H ATOM 70 HG23 THR A 5 -10.623 -6.053 0.009 1.00 0.00 H ATOM 71 N TYR A 6 -7.849 -6.339 0.897 1.00 0.00 N ATOM 72 CA TYR A 6 -7.617 -6.799 2.256 1.00 0.00 C ATOM 73 C TYR A 6 -8.732 -6.257 3.150 1.00 0.00 C ATOM 74 O TYR A 6 -8.714 -5.095 3.567 1.00 0.00 O ATOM 75 CB TYR A 6 -6.212 -6.390 2.724 1.00 0.00 C ATOM 76 CG TYR A 6 -5.213 -7.532 2.696 1.00 0.00 C ATOM 77 CD1 TYR A 6 -5.199 -8.454 3.758 1.00 0.00 C ATOM 78 CD2 TYR A 6 -4.302 -7.679 1.631 1.00 0.00 C ATOM 79 CE1 TYR A 6 -4.275 -9.511 3.761 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.341 -8.707 1.664 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.314 -9.609 2.744 1.00 0.00 C ATOM 82 OH TYR A 6 -2.436 -10.649 2.766 1.00 0.00 O ATOM 83 H TYR A 6 -7.900 -5.336 0.751 1.00 0.00 H ATOM 84 HA TYR A 6 -7.671 -7.889 2.303 1.00 0.00 H ATOM 85 HB2 TYR A 6 -5.837 -5.568 2.116 1.00 0.00 H ATOM 86 HB3 TYR A 6 -6.260 -6.034 3.753 1.00 0.00 H ATOM 87 HD1 TYR A 6 -5.878 -8.339 4.590 1.00 0.00 H ATOM 88 HD2 TYR A 6 -4.330 -6.999 0.794 1.00 0.00 H ATOM 89 HE1 TYR A 6 -4.241 -10.195 4.595 1.00 0.00 H ATOM 90 HE2 TYR A 6 -2.623 -8.799 0.863 1.00 0.00 H ATOM 91 HH TYR A 6 -1.589 -10.444 2.338 1.00 0.00 H ATOM 92 N GLU A 7 -9.719 -7.108 3.431 1.00 0.00 N ATOM 93 CA GLU A 7 -10.818 -6.809 4.328 1.00 0.00 C ATOM 94 C GLU A 7 -10.312 -6.771 5.770 1.00 0.00 C ATOM 95 O GLU A 7 -10.051 -7.807 6.375 1.00 0.00 O ATOM 96 CB GLU A 7 -11.947 -7.821 4.125 1.00 0.00 C ATOM 97 CG GLU A 7 -12.405 -7.838 2.659 1.00 0.00 C ATOM 98 CD GLU A 7 -13.727 -8.574 2.511 1.00 0.00 C ATOM 99 OE1 GLU A 7 -14.745 -7.977 2.921 1.00 0.00 O ATOM 100 OE2 GLU A 7 -13.691 -9.715 2.005 1.00 0.00 O ATOM 101 H GLU A 7 -9.693 -8.037 3.035 1.00 0.00 H ATOM 102 HA GLU A 7 -11.228 -5.837 4.078 1.00 0.00 H ATOM 103 HB2 GLU A 7 -11.621 -8.818 4.421 1.00 0.00 H ATOM 104 HB3 GLU A 7 -12.792 -7.533 4.752 1.00 0.00 H ATOM 105 HG2 GLU A 7 -12.559 -6.821 2.301 1.00 0.00 H ATOM 106 HG3 GLU A 7 -11.660 -8.324 2.027 1.00 0.00 H ATOM 107 N ASN A 8 -10.163 -5.560 6.313 1.00 0.00 N ATOM 108 CA ASN A 8 -9.774 -5.323 7.693 1.00 0.00 C ATOM 109 C ASN A 8 -11.037 -5.008 8.479 1.00 0.00 C ATOM 110 O ASN A 8 -11.959 -4.382 7.955 1.00 0.00 O ATOM 111 CB ASN A 8 -8.844 -4.108 7.808 1.00 0.00 C ATOM 112 CG ASN A 8 -7.450 -4.303 7.226 1.00 0.00 C ATOM 113 OD1 ASN A 8 -6.469 -4.211 7.957 1.00 0.00 O ATOM 114 ND2 ASN A 8 -7.329 -4.521 5.920 1.00 0.00 N ATOM 115 H ASN A 8 -10.495 -4.768 5.791 1.00 0.00 H ATOM 116 HA ASN A 8 -9.274 -6.197 8.115 1.00 0.00 H ATOM 117 HB2 ASN A 8 -9.312 -3.247 7.346 1.00 0.00 H ATOM 118 HB3 ASN A 8 -8.718 -3.879 8.867 1.00 0.00 H ATOM 119 HD21 ASN A 8 -8.129 -4.617 5.300 1.00 0.00 H ATOM 120 HD22 ASN A 8 -6.405 -4.650 5.542 1.00 0.00 H ATOM 121 N LYS A 9 -11.042 -5.348 9.769 1.00 0.00 N ATOM 122 CA LYS A 9 -12.125 -4.983 10.674 1.00 0.00 C ATOM 123 C LYS A 9 -12.333 -3.459 10.743 1.00 0.00 C ATOM 124 O LYS A 9 -13.411 -3.009 11.125 1.00 0.00 O ATOM 125 CB LYS A 9 -11.892 -5.605 12.058 1.00 0.00 C ATOM 126 CG LYS A 9 -10.557 -5.168 12.678 1.00 0.00 C ATOM 127 CD LYS A 9 -10.726 -4.621 14.099 1.00 0.00 C ATOM 128 CE LYS A 9 -10.999 -5.744 15.107 1.00 0.00 C ATOM 129 NZ LYS A 9 -11.016 -5.236 16.493 1.00 0.00 N ATOM 130 H LYS A 9 -10.246 -5.845 10.137 1.00 0.00 H ATOM 131 HA LYS A 9 -13.049 -5.412 10.284 1.00 0.00 H ATOM 132 HB2 LYS A 9 -12.725 -5.316 12.699 1.00 0.00 H ATOM 133 HB3 LYS A 9 -11.901 -6.692 11.967 1.00 0.00 H ATOM 134 HG2 LYS A 9 -9.844 -5.995 12.674 1.00 0.00 H ATOM 135 HG3 LYS A 9 -10.124 -4.374 12.076 1.00 0.00 H ATOM 136 HD2 LYS A 9 -9.794 -4.120 14.369 1.00 0.00 H ATOM 137 HD3 LYS A 9 -11.527 -3.881 14.099 1.00 0.00 H ATOM 138 HE2 LYS A 9 -11.954 -6.221 14.879 1.00 0.00 H ATOM 139 HE3 LYS A 9 -10.208 -6.493 15.025 1.00 0.00 H ATOM 140 HZ1 LYS A 9 -10.127 -4.804 16.707 1.00 0.00 H ATOM 141 HZ2 LYS A 9 -11.755 -4.557 16.606 1.00 0.00 H ATOM 142 HZ3 LYS A 9 -11.171 -6.000 17.137 1.00 0.00 H ATOM 143 N LYS A 10 -11.313 -2.666 10.385 1.00 0.00 N ATOM 144 CA LYS A 10 -11.397 -1.211 10.319 1.00 0.00 C ATOM 145 C LYS A 10 -11.777 -0.691 8.928 1.00 0.00 C ATOM 146 O LYS A 10 -11.627 0.504 8.700 1.00 0.00 O ATOM 147 CB LYS A 10 -10.078 -0.578 10.821 1.00 0.00 C ATOM 148 CG LYS A 10 -10.347 0.369 11.994 1.00 0.00 C ATOM 149 CD LYS A 10 -10.728 -0.421 13.257 1.00 0.00 C ATOM 150 CE LYS A 10 -11.668 0.373 14.174 1.00 0.00 C ATOM 151 NZ LYS A 10 -11.108 1.681 14.568 1.00 0.00 N ATOM 152 H LYS A 10 -10.439 -3.091 10.119 1.00 0.00 H ATOM 153 HA LYS A 10 -12.210 -0.880 10.965 1.00 0.00 H ATOM 154 HB2 LYS A 10 -9.368 -1.341 11.130 1.00 0.00 H ATOM 155 HB3 LYS A 10 -9.595 0.000 10.029 1.00 0.00 H ATOM 156 HG2 LYS A 10 -9.440 0.948 12.179 1.00 0.00 H ATOM 157 HG3 LYS A 10 -11.142 1.050 11.685 1.00 0.00 H ATOM 158 HD2 LYS A 10 -11.244 -1.340 12.975 1.00 0.00 H ATOM 159 HD3 LYS A 10 -9.818 -0.725 13.782 1.00 0.00 H ATOM 160 HE2 LYS A 10 -12.614 0.533 13.652 1.00 0.00 H ATOM 161 HE3 LYS A 10 -11.872 -0.218 15.069 1.00 0.00 H ATOM 162 HZ1 LYS A 10 -10.940 2.246 13.747 1.00 0.00 H ATOM 163 HZ2 LYS A 10 -11.764 2.168 15.165 1.00 0.00 H ATOM 164 HZ3 LYS A 10 -10.241 1.554 15.070 1.00 0.00 H ATOM 165 N GLY A 11 -12.260 -1.553 8.022 1.00 0.00 N ATOM 166 CA GLY A 11 -12.677 -1.169 6.677 1.00 0.00 C ATOM 167 C GLY A 11 -11.702 -1.749 5.657 1.00 0.00 C ATOM 168 O GLY A 11 -10.489 -1.725 5.873 1.00 0.00 O ATOM 169 H GLY A 11 -12.299 -2.542 8.243 1.00 0.00 H ATOM 170 HA2 GLY A 11 -13.675 -1.574 6.506 1.00 0.00 H ATOM 171 HA3 GLY A 11 -12.724 -0.087 6.554 1.00 0.00 H ATOM 172 N ASN A 12 -12.210 -2.322 4.561 1.00 0.00 N ATOM 173 CA ASN A 12 -11.356 -3.007 3.595 1.00 0.00 C ATOM 174 C ASN A 12 -10.459 -2.022 2.864 1.00 0.00 C ATOM 175 O ASN A 12 -10.903 -0.923 2.544 1.00 0.00 O ATOM 176 CB ASN A 12 -12.160 -3.859 2.599 1.00 0.00 C ATOM 177 CG ASN A 12 -12.737 -3.058 1.434 1.00 0.00 C ATOM 178 OD1 ASN A 12 -12.048 -2.802 0.451 1.00 0.00 O ATOM 179 ND2 ASN A 12 -14.009 -2.679 1.518 1.00 0.00 N ATOM 180 H ASN A 12 -13.202 -2.251 4.388 1.00 0.00 H ATOM 181 HA ASN A 12 -10.706 -3.669 4.159 1.00 0.00 H ATOM 182 HB2 ASN A 12 -11.476 -4.584 2.156 1.00 0.00 H ATOM 183 HB3 ASN A 12 -12.949 -4.405 3.117 1.00 0.00 H ATOM 184 HD21 ASN A 12 -14.574 -2.931 2.314 1.00 0.00 H ATOM 185 HD22 ASN A 12 -14.400 -2.153 0.753 1.00 0.00 H ATOM 186 N VAL A 13 -9.218 -2.422 2.582 1.00 0.00 N ATOM 187 CA VAL A 13 -8.360 -1.685 1.671 1.00 0.00 C ATOM 188 C VAL A 13 -8.385 -2.421 0.331 1.00 0.00 C ATOM 189 O VAL A 13 -8.044 -3.601 0.262 1.00 0.00 O ATOM 190 CB VAL A 13 -6.942 -1.493 2.251 1.00 0.00 C ATOM 191 CG1 VAL A 13 -7.011 -0.879 3.652 1.00 0.00 C ATOM 192 CG2 VAL A 13 -6.113 -2.776 2.349 1.00 0.00 C ATOM 193 H VAL A 13 -8.923 -3.354 2.861 1.00 0.00 H ATOM 194 HA VAL A 13 -8.753 -0.680 1.513 1.00 0.00 H ATOM 195 HB VAL A 13 -6.408 -0.798 1.601 1.00 0.00 H ATOM 196 HG11 VAL A 13 -7.640 0.009 3.640 1.00 0.00 H ATOM 197 HG12 VAL A 13 -7.420 -1.606 4.353 1.00 0.00 H ATOM 198 HG13 VAL A 13 -6.011 -0.598 3.983 1.00 0.00 H ATOM 199 HG21 VAL A 13 -6.653 -3.526 2.924 1.00 0.00 H ATOM 200 HG22 VAL A 13 -5.895 -3.154 1.353 1.00 0.00 H ATOM 201 HG23 VAL A 13 -5.166 -2.566 2.846 1.00 0.00 H ATOM 202 N THR A 14 -8.791 -1.738 -0.740 1.00 0.00 N ATOM 203 CA THR A 14 -8.448 -2.175 -2.082 1.00 0.00 C ATOM 204 C THR A 14 -6.926 -2.078 -2.187 1.00 0.00 C ATOM 205 O THR A 14 -6.333 -1.114 -1.701 1.00 0.00 O ATOM 206 CB THR A 14 -9.174 -1.311 -3.120 1.00 0.00 C ATOM 207 OG1 THR A 14 -10.567 -1.382 -2.884 1.00 0.00 O ATOM 208 CG2 THR A 14 -8.905 -1.796 -4.547 1.00 0.00 C ATOM 209 H THR A 14 -9.076 -0.783 -0.620 1.00 0.00 H ATOM 210 HA THR A 14 -8.764 -3.210 -2.216 1.00 0.00 H ATOM 211 HB THR A 14 -8.846 -0.274 -3.027 1.00 0.00 H ATOM 212 HG1 THR A 14 -10.729 -1.509 -1.944 1.00 0.00 H ATOM 213 HG21 THR A 14 -9.204 -2.839 -4.652 1.00 0.00 H ATOM 214 HG22 THR A 14 -9.481 -1.192 -5.250 1.00 0.00 H ATOM 215 HG23 THR A 14 -7.847 -1.700 -4.796 1.00 0.00 H ATOM 216 N PHE A 15 -6.296 -3.109 -2.742 1.00 0.00 N ATOM 217 CA PHE A 15 -4.857 -3.283 -2.741 1.00 0.00 C ATOM 218 C PHE A 15 -4.464 -3.490 -4.196 1.00 0.00 C ATOM 219 O PHE A 15 -5.175 -4.177 -4.921 1.00 0.00 O ATOM 220 CB PHE A 15 -4.542 -4.511 -1.881 1.00 0.00 C ATOM 221 CG PHE A 15 -3.204 -4.503 -1.174 1.00 0.00 C ATOM 222 CD1 PHE A 15 -2.013 -4.727 -1.891 1.00 0.00 C ATOM 223 CD2 PHE A 15 -3.179 -4.496 0.233 1.00 0.00 C ATOM 224 CE1 PHE A 15 -0.823 -5.017 -1.200 1.00 0.00 C ATOM 225 CE2 PHE A 15 -2.001 -4.816 0.920 1.00 0.00 C ATOM 226 CZ PHE A 15 -0.830 -5.103 0.205 1.00 0.00 C ATOM 227 H PHE A 15 -6.825 -3.841 -3.211 1.00 0.00 H ATOM 228 HA PHE A 15 -4.351 -2.406 -2.335 1.00 0.00 H ATOM 229 HB2 PHE A 15 -5.319 -4.605 -1.121 1.00 0.00 H ATOM 230 HB3 PHE A 15 -4.606 -5.400 -2.498 1.00 0.00 H ATOM 231 HD1 PHE A 15 -2.017 -4.760 -2.971 1.00 0.00 H ATOM 232 HD2 PHE A 15 -4.087 -4.385 0.803 1.00 0.00 H ATOM 233 HE1 PHE A 15 0.071 -5.260 -1.757 1.00 0.00 H ATOM 234 HE2 PHE A 15 -2.022 -4.937 1.993 1.00 0.00 H ATOM 235 HZ PHE A 15 0.031 -5.449 0.751 1.00 0.00 H ATOM 236 N ASP A 16 -3.365 -2.907 -4.653 1.00 0.00 N ATOM 237 CA ASP A 16 -3.019 -2.932 -6.056 1.00 0.00 C ATOM 238 C ASP A 16 -1.640 -3.540 -6.110 1.00 0.00 C ATOM 239 O ASP A 16 -0.820 -3.291 -5.224 1.00 0.00 O ATOM 240 CB ASP A 16 -2.957 -1.494 -6.556 1.00 0.00 C ATOM 241 CG ASP A 16 -4.045 -1.050 -7.512 1.00 0.00 C ATOM 242 OD1 ASP A 16 -5.070 -1.751 -7.626 1.00 0.00 O ATOM 243 OD2 ASP A 16 -3.777 0.001 -8.136 1.00 0.00 O ATOM 244 H ASP A 16 -2.681 -2.455 -4.057 1.00 0.00 H ATOM 245 HA ASP A 16 -3.680 -3.540 -6.682 1.00 0.00 H ATOM 246 HB2 ASP A 16 -2.951 -0.821 -5.702 1.00 0.00 H ATOM 247 HB3 ASP A 16 -2.035 -1.389 -7.114 1.00 0.00 H ATOM 248 N HIS A 17 -1.396 -4.332 -7.147 1.00 0.00 N ATOM 249 CA HIS A 17 -0.128 -4.984 -7.331 1.00 0.00 C ATOM 250 C HIS A 17 0.400 -4.601 -8.704 1.00 0.00 C ATOM 251 O HIS A 17 1.282 -3.748 -8.805 1.00 0.00 O ATOM 252 CB HIS A 17 -0.325 -6.488 -7.093 1.00 0.00 C ATOM 253 CG HIS A 17 0.935 -7.184 -6.668 1.00 0.00 C ATOM 254 ND1 HIS A 17 1.467 -8.316 -7.238 1.00 0.00 N ATOM 255 CD2 HIS A 17 1.845 -6.697 -5.770 1.00 0.00 C ATOM 256 CE1 HIS A 17 2.696 -8.476 -6.724 1.00 0.00 C ATOM 257 NE2 HIS A 17 2.982 -7.495 -5.848 1.00 0.00 N ATOM 258 H HIS A 17 -2.135 -4.541 -7.810 1.00 0.00 H ATOM 259 HA HIS A 17 0.588 -4.583 -6.618 1.00 0.00 H ATOM 260 HB2 HIS A 17 -1.054 -6.627 -6.293 1.00 0.00 H ATOM 261 HB3 HIS A 17 -0.726 -6.958 -7.988 1.00 0.00 H ATOM 262 HD1 HIS A 17 1.041 -8.889 -7.952 1.00 0.00 H ATOM 263 HD2 HIS A 17 1.739 -5.801 -5.178 1.00 0.00 H ATOM 264 HE1 HIS A 17 3.375 -9.253 -7.040 1.00 0.00 H ATOM 265 N LYS A 18 -0.189 -5.144 -9.771 1.00 0.00 N ATOM 266 CA LYS A 18 0.251 -4.778 -11.114 1.00 0.00 C ATOM 267 C LYS A 18 -0.353 -3.434 -11.515 1.00 0.00 C ATOM 268 O LYS A 18 0.190 -2.748 -12.384 1.00 0.00 O ATOM 269 CB LYS A 18 -0.054 -5.845 -12.175 1.00 0.00 C ATOM 270 CG LYS A 18 0.999 -5.816 -13.304 1.00 0.00 C ATOM 271 CD LYS A 18 0.411 -6.024 -14.710 1.00 0.00 C ATOM 272 CE LYS A 18 0.158 -4.711 -15.472 1.00 0.00 C ATOM 273 NZ LYS A 18 -0.724 -3.777 -14.743 1.00 0.00 N ATOM 274 H LYS A 18 -1.070 -5.633 -9.616 1.00 0.00 H ATOM 275 HA LYS A 18 1.335 -4.696 -11.071 1.00 0.00 H ATOM 276 HB2 LYS A 18 -0.024 -6.838 -11.727 1.00 0.00 H ATOM 277 HB3 LYS A 18 -1.052 -5.678 -12.576 1.00 0.00 H ATOM 278 HG2 LYS A 18 1.585 -4.896 -13.295 1.00 0.00 H ATOM 279 HG3 LYS A 18 1.692 -6.636 -13.106 1.00 0.00 H ATOM 280 HD2 LYS A 18 1.131 -6.600 -15.295 1.00 0.00 H ATOM 281 HD3 LYS A 18 -0.499 -6.623 -14.656 1.00 0.00 H ATOM 282 HE2 LYS A 18 1.111 -4.218 -15.671 1.00 0.00 H ATOM 283 HE3 LYS A 18 -0.304 -4.959 -16.429 1.00 0.00 H ATOM 284 HZ1 LYS A 18 -1.572 -4.249 -14.462 1.00 0.00 H ATOM 285 HZ2 LYS A 18 -0.253 -3.414 -13.917 1.00 0.00 H ATOM 286 HZ3 LYS A 18 -0.960 -2.991 -15.331 1.00 0.00 H ATOM 287 N ALA A 19 -1.519 -3.098 -10.958 1.00 0.00 N ATOM 288 CA ALA A 19 -2.197 -1.837 -11.226 1.00 0.00 C ATOM 289 C ALA A 19 -1.497 -0.671 -10.522 1.00 0.00 C ATOM 290 O ALA A 19 -1.501 0.436 -11.045 1.00 0.00 O ATOM 291 CB ALA A 19 -3.670 -1.963 -10.837 1.00 0.00 C ATOM 292 H ALA A 19 -1.961 -3.743 -10.313 1.00 0.00 H ATOM 293 HA ALA A 19 -2.152 -1.624 -12.299 1.00 0.00 H ATOM 294 HB1 ALA A 19 -3.756 -2.341 -9.821 1.00 0.00 H ATOM 295 HB2 ALA A 19 -4.159 -0.990 -10.906 1.00 0.00 H ATOM 296 HB3 ALA A 19 -4.170 -2.660 -11.511 1.00 0.00 H ATOM 297 N HIS A 20 -0.822 -0.916 -9.393 1.00 0.00 N ATOM 298 CA HIS A 20 0.106 0.064 -8.835 1.00 0.00 C ATOM 299 C HIS A 20 1.416 0.026 -9.629 1.00 0.00 C ATOM 300 O HIS A 20 1.946 1.072 -10.007 1.00 0.00 O ATOM 301 CB HIS A 20 0.327 -0.165 -7.328 1.00 0.00 C ATOM 302 CG HIS A 20 -0.518 0.723 -6.438 1.00 0.00 C ATOM 303 ND1 HIS A 20 -1.800 1.144 -6.708 1.00 0.00 N ATOM 304 CD2 HIS A 20 -0.151 1.281 -5.236 1.00 0.00 C ATOM 305 CE1 HIS A 20 -2.201 1.896 -5.674 1.00 0.00 C ATOM 306 NE2 HIS A 20 -1.231 2.029 -4.748 1.00 0.00 N ATOM 307 H HIS A 20 -0.869 -1.836 -8.983 1.00 0.00 H ATOM 308 HA HIS A 20 -0.299 1.069 -8.963 1.00 0.00 H ATOM 309 HB2 HIS A 20 0.181 -1.213 -7.069 1.00 0.00 H ATOM 310 HB3 HIS A 20 1.357 0.066 -7.096 1.00 0.00 H ATOM 311 HD1 HIS A 20 -2.408 0.836 -7.475 1.00 0.00 H ATOM 312 HD2 HIS A 20 0.813 1.189 -4.765 1.00 0.00 H ATOM 313 HE1 HIS A 20 -3.180 2.341 -5.645 1.00 0.00 H ATOM 314 N ALA A 21 1.957 -1.176 -9.877 1.00 0.00 N ATOM 315 CA ALA A 21 3.251 -1.346 -10.531 1.00 0.00 C ATOM 316 C ALA A 21 3.427 -0.490 -11.783 1.00 0.00 C ATOM 317 O ALA A 21 4.529 -0.002 -12.008 1.00 0.00 O ATOM 318 CB ALA A 21 3.494 -2.803 -10.902 1.00 0.00 C ATOM 319 H ALA A 21 1.506 -2.007 -9.505 1.00 0.00 H ATOM 320 HA ALA A 21 4.020 -1.055 -9.816 1.00 0.00 H ATOM 321 HB1 ALA A 21 3.430 -3.443 -10.025 1.00 0.00 H ATOM 322 HB2 ALA A 21 2.776 -3.117 -11.656 1.00 0.00 H ATOM 323 HB3 ALA A 21 4.494 -2.875 -11.327 1.00 0.00 H ATOM 324 N GLU A 22 2.375 -0.331 -12.593 1.00 0.00 N ATOM 325 CA GLU A 22 2.435 0.483 -13.802 1.00 0.00 C ATOM 326 C GLU A 22 3.032 1.874 -13.518 1.00 0.00 C ATOM 327 O GLU A 22 3.866 2.356 -14.283 1.00 0.00 O ATOM 328 CB GLU A 22 1.057 0.495 -14.487 1.00 0.00 C ATOM 329 CG GLU A 22 -0.021 1.307 -13.751 1.00 0.00 C ATOM 330 CD GLU A 22 -0.072 2.786 -14.138 1.00 0.00 C ATOM 331 OE1 GLU A 22 0.765 3.203 -14.965 1.00 0.00 O ATOM 332 OE2 GLU A 22 -0.948 3.488 -13.590 1.00 0.00 O ATOM 333 H GLU A 22 1.496 -0.768 -12.350 1.00 0.00 H ATOM 334 HA GLU A 22 3.121 -0.019 -14.486 1.00 0.00 H ATOM 335 HB2 GLU A 22 1.155 0.870 -15.505 1.00 0.00 H ATOM 336 HB3 GLU A 22 0.715 -0.537 -14.557 1.00 0.00 H ATOM 337 HG2 GLU A 22 -0.999 0.889 -13.989 1.00 0.00 H ATOM 338 HG3 GLU A 22 0.129 1.238 -12.677 1.00 0.00 H ATOM 339 N LYS A 23 2.674 2.468 -12.373 1.00 0.00 N ATOM 340 CA LYS A 23 3.282 3.696 -11.885 1.00 0.00 C ATOM 341 C LYS A 23 4.540 3.376 -11.073 1.00 0.00 C ATOM 342 O LYS A 23 5.622 3.872 -11.373 1.00 0.00 O ATOM 343 CB LYS A 23 2.264 4.481 -11.045 1.00 0.00 C ATOM 344 CG LYS A 23 1.143 5.081 -11.905 1.00 0.00 C ATOM 345 CD LYS A 23 0.973 6.579 -11.624 1.00 0.00 C ATOM 346 CE LYS A 23 -0.146 7.155 -12.502 1.00 0.00 C ATOM 347 NZ LYS A 23 -0.487 8.542 -12.125 1.00 0.00 N ATOM 348 H LYS A 23 2.045 1.972 -11.752 1.00 0.00 H ATOM 349 HA LYS A 23 3.583 4.325 -12.724 1.00 0.00 H ATOM 350 HB2 LYS A 23 1.810 3.822 -10.304 1.00 0.00 H ATOM 351 HB3 LYS A 23 2.791 5.277 -10.517 1.00 0.00 H ATOM 352 HG2 LYS A 23 1.353 4.927 -12.966 1.00 0.00 H ATOM 353 HG3 LYS A 23 0.211 4.560 -11.672 1.00 0.00 H ATOM 354 HD2 LYS A 23 0.723 6.707 -10.569 1.00 0.00 H ATOM 355 HD3 LYS A 23 1.914 7.091 -11.836 1.00 0.00 H ATOM 356 HE2 LYS A 23 0.159 7.119 -13.550 1.00 0.00 H ATOM 357 HE3 LYS A 23 -1.041 6.540 -12.385 1.00 0.00 H ATOM 358 HZ1 LYS A 23 -0.762 8.568 -11.145 1.00 0.00 H ATOM 359 HZ2 LYS A 23 0.290 9.171 -12.254 1.00 0.00 H ATOM 360 HZ3 LYS A 23 -1.290 8.857 -12.649 1.00 0.00 H ATOM 361 N LEU A 24 4.391 2.596 -10.000 1.00 0.00 N ATOM 362 CA LEU A 24 5.415 2.425 -8.987 1.00 0.00 C ATOM 363 C LEU A 24 6.693 1.746 -9.475 1.00 0.00 C ATOM 364 O LEU A 24 7.783 2.151 -9.079 1.00 0.00 O ATOM 365 CB LEU A 24 4.831 1.603 -7.846 1.00 0.00 C ATOM 366 CG LEU A 24 3.990 2.453 -6.894 1.00 0.00 C ATOM 367 CD1 LEU A 24 2.615 2.828 -7.435 1.00 0.00 C ATOM 368 CD2 LEU A 24 3.740 1.625 -5.644 1.00 0.00 C ATOM 369 H LEU A 24 3.471 2.243 -9.764 1.00 0.00 H ATOM 370 HA LEU A 24 5.703 3.408 -8.612 1.00 0.00 H ATOM 371 HB2 LEU A 24 4.206 0.799 -8.213 1.00 0.00 H ATOM 372 HB3 LEU A 24 5.686 1.153 -7.340 1.00 0.00 H ATOM 373 HG LEU A 24 4.528 3.367 -6.683 1.00 0.00 H ATOM 374 HD11 LEU A 24 2.123 1.914 -7.742 1.00 0.00 H ATOM 375 HD12 LEU A 24 2.017 3.296 -6.656 1.00 0.00 H ATOM 376 HD13 LEU A 24 2.703 3.521 -8.265 1.00 0.00 H ATOM 377 HD21 LEU A 24 4.681 1.317 -5.192 1.00 0.00 H ATOM 378 HD22 LEU A 24 3.153 2.184 -4.940 1.00 0.00 H ATOM 379 HD23 LEU A 24 3.144 0.764 -5.906 1.00 0.00 H ATOM 380 N GLY A 25 6.569 0.670 -10.251 1.00 0.00 N ATOM 381 CA GLY A 25 7.727 -0.011 -10.806 1.00 0.00 C ATOM 382 C GLY A 25 8.388 -1.026 -9.867 1.00 0.00 C ATOM 383 O GLY A 25 9.611 -1.116 -9.840 1.00 0.00 O ATOM 384 H GLY A 25 5.660 0.459 -10.646 1.00 0.00 H ATOM 385 HA2 GLY A 25 7.437 -0.505 -11.732 1.00 0.00 H ATOM 386 HA3 GLY A 25 8.458 0.762 -11.023 1.00 0.00 H ATOM 387 N CYS A 26 7.583 -1.799 -9.126 1.00 0.00 N ATOM 388 CA CYS A 26 7.995 -2.879 -8.219 1.00 0.00 C ATOM 389 C CYS A 26 8.850 -2.370 -7.049 1.00 0.00 C ATOM 390 O CYS A 26 8.384 -2.321 -5.906 1.00 0.00 O ATOM 391 CB CYS A 26 8.663 -4.062 -8.905 1.00 0.00 C ATOM 392 SG CYS A 26 7.959 -4.651 -10.477 1.00 0.00 S ATOM 393 H CYS A 26 6.597 -1.621 -9.216 1.00 0.00 H ATOM 394 HA CYS A 26 7.081 -3.256 -7.772 1.00 0.00 H ATOM 395 HB2 CYS A 26 9.701 -3.816 -9.121 1.00 0.00 H ATOM 396 HB3 CYS A 26 8.670 -4.897 -8.202 1.00 0.00 H ATOM 397 N ASP A 27 10.089 -1.956 -7.328 1.00 0.00 N ATOM 398 CA ASP A 27 11.120 -1.618 -6.350 1.00 0.00 C ATOM 399 C ASP A 27 10.856 -0.279 -5.634 1.00 0.00 C ATOM 400 O ASP A 27 11.756 0.296 -5.026 1.00 0.00 O ATOM 401 CB ASP A 27 12.505 -1.646 -7.022 1.00 0.00 C ATOM 402 CG ASP A 27 12.905 -3.037 -7.505 1.00 0.00 C ATOM 403 OD1 ASP A 27 12.393 -3.428 -8.575 1.00 0.00 O ATOM 404 OD2 ASP A 27 13.714 -3.692 -6.809 1.00 0.00 O ATOM 405 H ASP A 27 10.372 -1.979 -8.305 1.00 0.00 H ATOM 406 HA ASP A 27 11.118 -2.405 -5.599 1.00 0.00 H ATOM 407 HB2 ASP A 27 12.519 -0.954 -7.864 1.00 0.00 H ATOM 408 HB3 ASP A 27 13.256 -1.323 -6.301 1.00 0.00 H ATOM 409 N ALA A 28 9.621 0.232 -5.698 1.00 0.00 N ATOM 410 CA ALA A 28 9.133 1.314 -4.854 1.00 0.00 C ATOM 411 C ALA A 28 8.424 0.751 -3.617 1.00 0.00 C ATOM 412 O ALA A 28 8.298 1.454 -2.617 1.00 0.00 O ATOM 413 CB ALA A 28 8.174 2.191 -5.659 1.00 0.00 C ATOM 414 H ALA A 28 8.941 -0.264 -6.247 1.00 0.00 H ATOM 415 HA ALA A 28 9.962 1.942 -4.524 1.00 0.00 H ATOM 416 HB1 ALA A 28 8.665 2.546 -6.566 1.00 0.00 H ATOM 417 HB2 ALA A 28 7.290 1.614 -5.921 1.00 0.00 H ATOM 418 HB3 ALA A 28 7.878 3.050 -5.058 1.00 0.00 H ATOM 419 N CYS A 29 7.932 -0.492 -3.696 1.00 0.00 N ATOM 420 CA CYS A 29 7.376 -1.223 -2.561 1.00 0.00 C ATOM 421 C CYS A 29 8.390 -2.279 -2.131 1.00 0.00 C ATOM 422 O CYS A 29 8.725 -2.394 -0.953 1.00 0.00 O ATOM 423 CB CYS A 29 6.081 -1.897 -2.935 1.00 0.00 C ATOM 424 SG CYS A 29 4.738 -0.714 -3.237 1.00 0.00 S ATOM 425 H CYS A 29 8.081 -1.022 -4.548 1.00 0.00 H ATOM 426 HA CYS A 29 7.185 -0.561 -1.715 1.00 0.00 H ATOM 427 HB2 CYS A 29 6.237 -2.512 -3.822 1.00 0.00 H ATOM 428 HB3 CYS A 29 5.780 -2.541 -2.108 1.00 0.00 H ATOM 429 N HIS A 30 8.858 -3.071 -3.099 1.00 0.00 N ATOM 430 CA HIS A 30 9.911 -4.049 -2.905 1.00 0.00 C ATOM 431 C HIS A 30 11.272 -3.363 -3.012 1.00 0.00 C ATOM 432 O HIS A 30 11.345 -2.147 -3.174 1.00 0.00 O ATOM 433 CB HIS A 30 9.744 -5.116 -3.989 1.00 0.00 C ATOM 434 CG HIS A 30 8.456 -5.877 -3.847 1.00 0.00 C ATOM 435 ND1 HIS A 30 8.186 -6.832 -2.894 1.00 0.00 N ATOM 436 CD2 HIS A 30 7.369 -5.786 -4.672 1.00 0.00 C ATOM 437 CE1 HIS A 30 6.962 -7.314 -3.154 1.00 0.00 C ATOM 438 NE2 HIS A 30 6.425 -6.713 -4.226 1.00 0.00 N ATOM 439 H HIS A 30 8.560 -2.910 -4.054 1.00 0.00 H ATOM 440 HA HIS A 30 9.825 -4.514 -1.922 1.00 0.00 H ATOM 441 HB2 HIS A 30 9.775 -4.639 -4.971 1.00 0.00 H ATOM 442 HB3 HIS A 30 10.560 -5.831 -3.951 1.00 0.00 H ATOM 443 HD1 HIS A 30 8.784 -7.101 -2.126 1.00 0.00 H ATOM 444 HD2 HIS A 30 7.278 -5.135 -5.530 1.00 0.00 H ATOM 445 HE1 HIS A 30 6.477 -8.091 -2.587 1.00 0.00 H ATOM 446 N GLU A 31 12.341 -4.160 -2.977 1.00 0.00 N ATOM 447 CA GLU A 31 13.650 -3.784 -3.479 1.00 0.00 C ATOM 448 C GLU A 31 14.399 -5.086 -3.760 1.00 0.00 C ATOM 449 O GLU A 31 14.492 -5.916 -2.859 1.00 0.00 O ATOM 450 CB GLU A 31 14.404 -2.922 -2.454 1.00 0.00 C ATOM 451 CG GLU A 31 15.641 -2.271 -3.093 1.00 0.00 C ATOM 452 CD GLU A 31 16.487 -1.488 -2.094 1.00 0.00 C ATOM 453 OE1 GLU A 31 16.050 -1.367 -0.929 1.00 0.00 O ATOM 454 OE2 GLU A 31 17.571 -1.033 -2.516 1.00 0.00 O ATOM 455 H GLU A 31 12.230 -5.140 -2.762 1.00 0.00 H ATOM 456 HA GLU A 31 13.519 -3.208 -4.393 1.00 0.00 H ATOM 457 HB2 GLU A 31 13.759 -2.123 -2.086 1.00 0.00 H ATOM 458 HB3 GLU A 31 14.713 -3.537 -1.607 1.00 0.00 H ATOM 459 HG2 GLU A 31 16.278 -3.035 -3.539 1.00 0.00 H ATOM 460 HG3 GLU A 31 15.318 -1.584 -3.876 1.00 0.00 H ATOM 461 N GLY A 32 14.903 -5.284 -4.981 1.00 0.00 N ATOM 462 CA GLY A 32 15.886 -6.315 -5.290 1.00 0.00 C ATOM 463 C GLY A 32 15.397 -7.734 -4.980 1.00 0.00 C ATOM 464 O GLY A 32 15.727 -8.287 -3.934 1.00 0.00 O ATOM 465 H GLY A 32 14.644 -4.612 -5.712 1.00 0.00 H ATOM 466 HA2 GLY A 32 16.150 -6.246 -6.345 1.00 0.00 H ATOM 467 HA3 GLY A 32 16.785 -6.120 -4.702 1.00 0.00 H ATOM 468 N THR A 33 14.650 -8.326 -5.919 1.00 0.00 N ATOM 469 CA THR A 33 14.049 -9.654 -5.836 1.00 0.00 C ATOM 470 C THR A 33 12.813 -9.608 -4.926 1.00 0.00 C ATOM 471 O THR A 33 12.927 -9.794 -3.716 1.00 0.00 O ATOM 472 CB THR A 33 15.069 -10.725 -5.412 1.00 0.00 C ATOM 473 OG1 THR A 33 16.221 -10.643 -6.230 1.00 0.00 O ATOM 474 CG2 THR A 33 14.487 -12.137 -5.538 1.00 0.00 C ATOM 475 H THR A 33 14.454 -7.789 -6.745 1.00 0.00 H ATOM 476 HA THR A 33 13.757 -9.920 -6.849 1.00 0.00 H ATOM 477 HB THR A 33 15.357 -10.570 -4.376 1.00 0.00 H ATOM 478 HG1 THR A 33 15.956 -10.681 -7.151 1.00 0.00 H ATOM 479 HG21 THR A 33 14.172 -12.331 -6.564 1.00 0.00 H ATOM 480 HG22 THR A 33 15.246 -12.866 -5.255 1.00 0.00 H ATOM 481 HG23 THR A 33 13.631 -12.255 -4.873 1.00 0.00 H ATOM 482 N PRO A 34 11.621 -9.347 -5.485 1.00 0.00 N ATOM 483 CA PRO A 34 10.419 -9.165 -4.695 1.00 0.00 C ATOM 484 C PRO A 34 9.934 -10.506 -4.139 1.00 0.00 C ATOM 485 O PRO A 34 10.150 -11.558 -4.739 1.00 0.00 O ATOM 486 CB PRO A 34 9.407 -8.540 -5.654 1.00 0.00 C ATOM 487 CG PRO A 34 9.806 -9.119 -7.007 1.00 0.00 C ATOM 488 CD PRO A 34 11.328 -9.209 -6.904 1.00 0.00 C ATOM 489 HA PRO A 34 10.613 -8.477 -3.871 1.00 0.00 H ATOM 490 HB2 PRO A 34 8.377 -8.760 -5.377 1.00 0.00 H ATOM 491 HB3 PRO A 34 9.567 -7.464 -5.697 1.00 0.00 H ATOM 492 HG2 PRO A 34 9.386 -10.121 -7.116 1.00 0.00 H ATOM 493 HG3 PRO A 34 9.493 -8.474 -7.828 1.00 0.00 H ATOM 494 HD2 PRO A 34 11.664 -10.073 -7.479 1.00 0.00 H ATOM 495 HD3 PRO A 34 11.783 -8.293 -7.285 1.00 0.00 H ATOM 496 N ALA A 35 9.265 -10.456 -2.987 1.00 0.00 N ATOM 497 CA ALA A 35 8.724 -11.601 -2.276 1.00 0.00 C ATOM 498 C ALA A 35 7.667 -11.063 -1.314 1.00 0.00 C ATOM 499 O ALA A 35 7.459 -9.852 -1.251 1.00 0.00 O ATOM 500 CB ALA A 35 9.847 -12.327 -1.525 1.00 0.00 C ATOM 501 H ALA A 35 9.050 -9.562 -2.568 1.00 0.00 H ATOM 502 HA ALA A 35 8.251 -12.284 -2.983 1.00 0.00 H ATOM 503 HB1 ALA A 35 10.603 -12.671 -2.231 1.00 0.00 H ATOM 504 HB2 ALA A 35 10.311 -11.650 -0.807 1.00 0.00 H ATOM 505 HB3 ALA A 35 9.447 -13.191 -0.995 1.00 0.00 H ATOM 506 N LYS A 36 6.993 -11.945 -0.574 1.00 0.00 N ATOM 507 CA LYS A 36 5.914 -11.542 0.314 1.00 0.00 C ATOM 508 C LYS A 36 6.382 -10.596 1.430 1.00 0.00 C ATOM 509 O LYS A 36 6.966 -11.033 2.421 1.00 0.00 O ATOM 510 CB LYS A 36 5.116 -12.747 0.801 1.00 0.00 C ATOM 511 CG LYS A 36 5.980 -13.793 1.503 1.00 0.00 C ATOM 512 CD LYS A 36 5.305 -14.212 2.806 1.00 0.00 C ATOM 513 CE LYS A 36 5.456 -13.151 3.909 1.00 0.00 C ATOM 514 NZ LYS A 36 4.829 -13.569 5.177 1.00 0.00 N ATOM 515 H LYS A 36 7.210 -12.926 -0.656 1.00 0.00 H ATOM 516 HA LYS A 36 5.186 -11.023 -0.279 1.00 0.00 H ATOM 517 HB2 LYS A 36 4.325 -12.379 1.455 1.00 0.00 H ATOM 518 HB3 LYS A 36 4.630 -13.220 -0.054 1.00 0.00 H ATOM 519 HG2 LYS A 36 6.067 -14.663 0.848 1.00 0.00 H ATOM 520 HG3 LYS A 36 6.986 -13.425 1.710 1.00 0.00 H ATOM 521 HD2 LYS A 36 4.254 -14.434 2.609 1.00 0.00 H ATOM 522 HD3 LYS A 36 5.813 -15.119 3.096 1.00 0.00 H ATOM 523 HE2 LYS A 36 6.518 -12.965 4.084 1.00 0.00 H ATOM 524 HE3 LYS A 36 4.991 -12.214 3.598 1.00 0.00 H ATOM 525 HZ1 LYS A 36 5.242 -14.430 5.507 1.00 0.00 H ATOM 526 HZ2 LYS A 36 4.968 -12.850 5.874 1.00 0.00 H ATOM 527 HZ3 LYS A 36 3.835 -13.700 5.043 1.00 0.00 H ATOM 528 N ILE A 37 6.119 -9.295 1.281 1.00 0.00 N ATOM 529 CA ILE A 37 6.417 -8.306 2.311 1.00 0.00 C ATOM 530 C ILE A 37 5.531 -8.591 3.528 1.00 0.00 C ATOM 531 O ILE A 37 4.346 -8.884 3.381 1.00 0.00 O ATOM 532 CB ILE A 37 6.185 -6.875 1.783 1.00 0.00 C ATOM 533 CG1 ILE A 37 6.960 -6.628 0.473 1.00 0.00 C ATOM 534 CG2 ILE A 37 6.579 -5.835 2.847 1.00 0.00 C ATOM 535 CD1 ILE A 37 6.811 -5.199 -0.065 1.00 0.00 C ATOM 536 H ILE A 37 5.673 -8.987 0.430 1.00 0.00 H ATOM 537 HA ILE A 37 7.467 -8.410 2.589 1.00 0.00 H ATOM 538 HB ILE A 37 5.121 -6.766 1.583 1.00 0.00 H ATOM 539 HG12 ILE A 37 8.019 -6.838 0.625 1.00 0.00 H ATOM 540 HG13 ILE A 37 6.579 -7.298 -0.295 1.00 0.00 H ATOM 541 HG21 ILE A 37 6.037 -5.999 3.776 1.00 0.00 H ATOM 542 HG22 ILE A 37 7.650 -5.889 3.043 1.00 0.00 H ATOM 543 HG23 ILE A 37 6.326 -4.831 2.511 1.00 0.00 H ATOM 544 HD11 ILE A 37 5.759 -4.922 -0.115 1.00 0.00 H ATOM 545 HD12 ILE A 37 7.346 -4.491 0.566 1.00 0.00 H ATOM 546 HD13 ILE A 37 7.233 -5.137 -1.066 1.00 0.00 H ATOM 547 N ALA A 38 6.088 -8.473 4.736 1.00 0.00 N ATOM 548 CA ALA A 38 5.331 -8.596 5.976 1.00 0.00 C ATOM 549 C ALA A 38 4.480 -7.341 6.209 1.00 0.00 C ATOM 550 O ALA A 38 4.727 -6.574 7.140 1.00 0.00 O ATOM 551 CB ALA A 38 6.292 -8.869 7.138 1.00 0.00 C ATOM 552 H ALA A 38 7.058 -8.207 4.793 1.00 0.00 H ATOM 553 HA ALA A 38 4.656 -9.452 5.904 1.00 0.00 H ATOM 554 HB1 ALA A 38 6.850 -9.786 6.948 1.00 0.00 H ATOM 555 HB2 ALA A 38 6.991 -8.040 7.252 1.00 0.00 H ATOM 556 HB3 ALA A 38 5.724 -8.986 8.061 1.00 0.00 H ATOM 557 N ILE A 39 3.479 -7.129 5.353 1.00 0.00 N ATOM 558 CA ILE A 39 2.438 -6.139 5.589 1.00 0.00 C ATOM 559 C ILE A 39 1.528 -6.633 6.719 1.00 0.00 C ATOM 560 O ILE A 39 1.413 -7.836 6.946 1.00 0.00 O ATOM 561 CB ILE A 39 1.699 -5.825 4.273 1.00 0.00 C ATOM 562 CG1 ILE A 39 2.559 -4.957 3.335 1.00 0.00 C ATOM 563 CG2 ILE A 39 0.326 -5.173 4.472 1.00 0.00 C ATOM 564 CD1 ILE A 39 2.848 -3.526 3.806 1.00 0.00 C ATOM 565 H ILE A 39 3.345 -7.804 4.606 1.00 0.00 H ATOM 566 HA ILE A 39 2.912 -5.230 5.955 1.00 0.00 H ATOM 567 HB ILE A 39 1.510 -6.772 3.763 1.00 0.00 H ATOM 568 HG12 ILE A 39 3.505 -5.465 3.147 1.00 0.00 H ATOM 569 HG13 ILE A 39 2.021 -4.859 2.396 1.00 0.00 H ATOM 570 HG21 ILE A 39 0.404 -4.278 5.084 1.00 0.00 H ATOM 571 HG22 ILE A 39 -0.099 -4.904 3.505 1.00 0.00 H ATOM 572 HG23 ILE A 39 -0.350 -5.879 4.953 1.00 0.00 H ATOM 573 HD11 ILE A 39 3.383 -3.515 4.752 1.00 0.00 H ATOM 574 HD12 ILE A 39 3.471 -3.032 3.060 1.00 0.00 H ATOM 575 HD13 ILE A 39 1.921 -2.964 3.903 1.00 0.00 H ATOM 576 N ASP A 40 0.953 -5.667 7.440 1.00 0.00 N ATOM 577 CA ASP A 40 0.136 -5.763 8.642 1.00 0.00 C ATOM 578 C ASP A 40 -0.109 -4.288 9.005 1.00 0.00 C ATOM 579 O ASP A 40 -0.317 -3.482 8.102 1.00 0.00 O ATOM 580 CB ASP A 40 0.860 -6.592 9.725 1.00 0.00 C ATOM 581 CG ASP A 40 0.081 -6.709 11.028 1.00 0.00 C ATOM 582 OD1 ASP A 40 -0.892 -7.487 11.068 1.00 0.00 O ATOM 583 OD2 ASP A 40 0.456 -5.943 11.945 1.00 0.00 O ATOM 584 H ASP A 40 1.041 -4.720 7.097 1.00 0.00 H ATOM 585 HA ASP A 40 -0.818 -6.236 8.399 1.00 0.00 H ATOM 586 HB2 ASP A 40 0.993 -7.612 9.367 1.00 0.00 H ATOM 587 HB3 ASP A 40 1.843 -6.169 9.928 1.00 0.00 H ATOM 588 N LYS A 41 0.042 -3.888 10.265 1.00 0.00 N ATOM 589 CA LYS A 41 0.041 -2.526 10.770 1.00 0.00 C ATOM 590 C LYS A 41 1.500 -2.101 11.032 1.00 0.00 C ATOM 591 O LYS A 41 1.761 -1.122 11.729 1.00 0.00 O ATOM 592 CB LYS A 41 -0.913 -2.530 11.989 1.00 0.00 C ATOM 593 CG LYS A 41 -0.711 -1.487 13.096 1.00 0.00 C ATOM 594 CD LYS A 41 0.264 -2.034 14.158 1.00 0.00 C ATOM 595 CE LYS A 41 0.814 -0.939 15.080 1.00 0.00 C ATOM 596 NZ LYS A 41 -0.244 -0.308 15.893 1.00 0.00 N ATOM 597 H LYS A 41 0.292 -4.585 10.953 1.00 0.00 H ATOM 598 HA LYS A 41 -0.357 -1.841 10.021 1.00 0.00 H ATOM 599 HB2 LYS A 41 -1.919 -2.401 11.589 1.00 0.00 H ATOM 600 HB3 LYS A 41 -0.887 -3.512 12.467 1.00 0.00 H ATOM 601 HG2 LYS A 41 -0.377 -0.545 12.659 1.00 0.00 H ATOM 602 HG3 LYS A 41 -1.682 -1.319 13.564 1.00 0.00 H ATOM 603 HD2 LYS A 41 -0.234 -2.814 14.739 1.00 0.00 H ATOM 604 HD3 LYS A 41 1.115 -2.510 13.670 1.00 0.00 H ATOM 605 HE2 LYS A 41 1.553 -1.388 15.747 1.00 0.00 H ATOM 606 HE3 LYS A 41 1.319 -0.185 14.473 1.00 0.00 H ATOM 607 HZ1 LYS A 41 -0.702 -1.004 16.464 1.00 0.00 H ATOM 608 HZ2 LYS A 41 0.162 0.395 16.495 1.00 0.00 H ATOM 609 HZ3 LYS A 41 -0.926 0.130 15.290 1.00 0.00 H ATOM 610 N LYS A 42 2.467 -2.827 10.459 1.00 0.00 N ATOM 611 CA LYS A 42 3.885 -2.568 10.636 1.00 0.00 C ATOM 612 C LYS A 42 4.353 -1.592 9.550 1.00 0.00 C ATOM 613 O LYS A 42 4.293 -0.380 9.743 1.00 0.00 O ATOM 614 CB LYS A 42 4.627 -3.922 10.660 1.00 0.00 C ATOM 615 CG LYS A 42 6.092 -3.859 11.124 1.00 0.00 C ATOM 616 CD LYS A 42 6.200 -3.904 12.658 1.00 0.00 C ATOM 617 CE LYS A 42 7.667 -4.019 13.104 1.00 0.00 C ATOM 618 NZ LYS A 42 7.796 -4.235 14.562 1.00 0.00 N ATOM 619 H LYS A 42 2.198 -3.619 9.896 1.00 0.00 H ATOM 620 HA LYS A 42 4.022 -2.070 11.596 1.00 0.00 H ATOM 621 HB2 LYS A 42 4.089 -4.597 11.328 1.00 0.00 H ATOM 622 HB3 LYS A 42 4.592 -4.384 9.673 1.00 0.00 H ATOM 623 HG2 LYS A 42 6.595 -4.742 10.720 1.00 0.00 H ATOM 624 HG3 LYS A 42 6.584 -2.972 10.724 1.00 0.00 H ATOM 625 HD2 LYS A 42 5.743 -3.005 13.077 1.00 0.00 H ATOM 626 HD3 LYS A 42 5.647 -4.777 13.014 1.00 0.00 H ATOM 627 HE2 LYS A 42 8.135 -4.863 12.592 1.00 0.00 H ATOM 628 HE3 LYS A 42 8.202 -3.108 12.825 1.00 0.00 H ATOM 629 HZ1 LYS A 42 7.384 -3.465 15.073 1.00 0.00 H ATOM 630 HZ2 LYS A 42 7.335 -5.093 14.832 1.00 0.00 H ATOM 631 HZ3 LYS A 42 8.773 -4.305 14.814 1.00 0.00 H ATOM 632 N SER A 43 4.812 -2.097 8.403 1.00 0.00 N ATOM 633 CA SER A 43 5.364 -1.257 7.346 1.00 0.00 C ATOM 634 C SER A 43 4.271 -0.361 6.753 1.00 0.00 C ATOM 635 O SER A 43 4.446 0.856 6.648 1.00 0.00 O ATOM 636 CB SER A 43 6.056 -2.143 6.301 1.00 0.00 C ATOM 637 OG SER A 43 6.571 -1.376 5.237 1.00 0.00 O ATOM 638 H SER A 43 4.805 -3.096 8.265 1.00 0.00 H ATOM 639 HA SER A 43 6.122 -0.616 7.796 1.00 0.00 H ATOM 640 HB2 SER A 43 6.886 -2.672 6.771 1.00 0.00 H ATOM 641 HB3 SER A 43 5.361 -2.874 5.891 1.00 0.00 H ATOM 642 HG SER A 43 6.973 -0.561 5.592 1.00 0.00 H ATOM 643 N ALA A 44 3.119 -0.968 6.422 1.00 0.00 N ATOM 644 CA ALA A 44 1.887 -0.347 5.913 1.00 0.00 C ATOM 645 C ALA A 44 1.620 1.041 6.497 1.00 0.00 C ATOM 646 O ALA A 44 1.136 1.971 5.854 1.00 0.00 O ATOM 647 CB ALA A 44 0.716 -1.248 6.311 1.00 0.00 C ATOM 648 H ALA A 44 3.088 -1.966 6.562 1.00 0.00 H ATOM 649 HA ALA A 44 1.915 -0.298 4.828 1.00 0.00 H ATOM 650 HB1 ALA A 44 0.854 -2.247 5.907 1.00 0.00 H ATOM 651 HB2 ALA A 44 0.654 -1.320 7.400 1.00 0.00 H ATOM 652 HB3 ALA A 44 -0.217 -0.834 5.931 1.00 0.00 H ATOM 653 N HIS A 45 1.892 1.119 7.787 1.00 0.00 N ATOM 654 CA HIS A 45 1.442 2.142 8.702 1.00 0.00 C ATOM 655 C HIS A 45 2.625 2.960 9.206 1.00 0.00 C ATOM 656 O HIS A 45 2.506 3.652 10.215 1.00 0.00 O ATOM 657 CB HIS A 45 0.745 1.402 9.843 1.00 0.00 C ATOM 658 CG HIS A 45 -0.762 1.440 9.766 1.00 0.00 C ATOM 659 ND1 HIS A 45 -1.542 1.962 10.763 1.00 0.00 N ATOM 660 CD2 HIS A 45 -1.593 1.088 8.725 1.00 0.00 C ATOM 661 CE1 HIS A 45 -2.812 1.907 10.350 1.00 0.00 C ATOM 662 NE2 HIS A 45 -2.911 1.390 9.112 1.00 0.00 N ATOM 663 H HIS A 45 2.457 0.364 8.144 1.00 0.00 H ATOM 664 HA HIS A 45 0.744 2.827 8.221 1.00 0.00 H ATOM 665 HB2 HIS A 45 1.138 0.386 9.865 1.00 0.00 H ATOM 666 HB3 HIS A 45 1.012 1.847 10.801 1.00 0.00 H ATOM 667 HD1 HIS A 45 -1.216 2.327 11.646 1.00 0.00 H ATOM 668 HD2 HIS A 45 -1.290 0.659 7.781 1.00 0.00 H ATOM 669 HE1 HIS A 45 -3.629 2.228 10.970 1.00 0.00 H ATOM 670 N LYS A 46 3.759 2.893 8.509 1.00 0.00 N ATOM 671 CA LYS A 46 4.983 3.542 8.927 1.00 0.00 C ATOM 672 C LYS A 46 5.695 4.144 7.719 1.00 0.00 C ATOM 673 O LYS A 46 5.737 5.364 7.575 1.00 0.00 O ATOM 674 CB LYS A 46 5.846 2.516 9.672 1.00 0.00 C ATOM 675 CG LYS A 46 7.036 3.203 10.349 1.00 0.00 C ATOM 676 CD LYS A 46 8.394 2.746 9.802 1.00 0.00 C ATOM 677 CE LYS A 46 8.722 1.293 10.180 1.00 0.00 C ATOM 678 NZ LYS A 46 9.928 0.808 9.478 1.00 0.00 N ATOM 679 H LYS A 46 3.807 2.264 7.715 1.00 0.00 H ATOM 680 HA LYS A 46 4.749 4.359 9.610 1.00 0.00 H ATOM 681 HB2 LYS A 46 5.233 2.056 10.445 1.00 0.00 H ATOM 682 HB3 LYS A 46 6.167 1.726 8.994 1.00 0.00 H ATOM 683 HG2 LYS A 46 6.940 4.274 10.178 1.00 0.00 H ATOM 684 HG3 LYS A 46 6.976 3.025 11.421 1.00 0.00 H ATOM 685 HD2 LYS A 46 8.379 2.862 8.719 1.00 0.00 H ATOM 686 HD3 LYS A 46 9.166 3.407 10.202 1.00 0.00 H ATOM 687 HE2 LYS A 46 8.875 1.228 11.259 1.00 0.00 H ATOM 688 HE3 LYS A 46 7.892 0.640 9.907 1.00 0.00 H ATOM 689 HZ1 LYS A 46 10.727 1.392 9.666 1.00 0.00 H ATOM 690 HZ2 LYS A 46 10.135 -0.146 9.725 1.00 0.00 H ATOM 691 HZ3 LYS A 46 9.764 0.831 8.472 1.00 0.00 H ATOM 692 N ASP A 47 6.272 3.288 6.879 1.00 0.00 N ATOM 693 CA ASP A 47 7.113 3.636 5.741 1.00 0.00 C ATOM 694 C ASP A 47 6.436 3.252 4.425 1.00 0.00 C ATOM 695 O ASP A 47 6.658 3.919 3.418 1.00 0.00 O ATOM 696 CB ASP A 47 8.495 2.973 5.875 1.00 0.00 C ATOM 697 CG ASP A 47 8.450 1.525 6.345 1.00 0.00 C ATOM 698 OD1 ASP A 47 7.364 0.911 6.274 1.00 0.00 O ATOM 699 OD2 ASP A 47 9.477 1.082 6.904 1.00 0.00 O ATOM 700 H ASP A 47 6.177 2.287 7.048 1.00 0.00 H ATOM 701 HA ASP A 47 7.278 4.714 5.708 1.00 0.00 H ATOM 702 HB2 ASP A 47 9.007 3.008 4.913 1.00 0.00 H ATOM 703 HB3 ASP A 47 9.087 3.546 6.588 1.00 0.00 H ATOM 704 N ALA A 48 5.599 2.212 4.428 1.00 0.00 N ATOM 705 CA ALA A 48 4.816 1.821 3.267 1.00 0.00 C ATOM 706 C ALA A 48 3.551 2.680 3.151 1.00 0.00 C ATOM 707 O ALA A 48 3.653 3.894 2.958 1.00 0.00 O ATOM 708 CB ALA A 48 4.528 0.319 3.329 1.00 0.00 C ATOM 709 H ALA A 48 5.535 1.651 5.274 1.00 0.00 H ATOM 710 HA ALA A 48 5.406 1.991 2.364 1.00 0.00 H ATOM 711 HB1 ALA A 48 3.997 0.091 4.249 1.00 0.00 H ATOM 712 HB2 ALA A 48 3.933 0.006 2.471 1.00 0.00 H ATOM 713 HB3 ALA A 48 5.469 -0.226 3.312 1.00 0.00 H ATOM 714 N CYS A 49 2.364 2.054 3.215 1.00 0.00 N ATOM 715 CA CYS A 49 1.141 2.610 2.654 1.00 0.00 C ATOM 716 C CYS A 49 0.947 4.088 3.028 1.00 0.00 C ATOM 717 O CYS A 49 0.862 4.930 2.134 1.00 0.00 O ATOM 718 CB CYS A 49 -0.120 1.795 2.918 1.00 0.00 C ATOM 719 SG CYS A 49 -0.119 -0.021 2.766 1.00 0.00 S ATOM 720 H CYS A 49 2.338 1.075 3.443 1.00 0.00 H ATOM 721 HA CYS A 49 1.327 2.574 1.589 1.00 0.00 H ATOM 722 HB2 CYS A 49 -0.479 2.016 3.922 1.00 0.00 H ATOM 723 HB3 CYS A 49 -0.869 2.130 2.210 1.00 0.00 H ATOM 724 N LYS A 50 0.863 4.432 4.322 1.00 0.00 N ATOM 725 CA LYS A 50 0.553 5.807 4.721 1.00 0.00 C ATOM 726 C LYS A 50 1.534 6.866 4.189 1.00 0.00 C ATOM 727 O LYS A 50 1.199 8.051 4.189 1.00 0.00 O ATOM 728 CB LYS A 50 0.385 5.916 6.248 1.00 0.00 C ATOM 729 CG LYS A 50 1.707 6.039 7.028 1.00 0.00 C ATOM 730 CD LYS A 50 1.420 6.287 8.517 1.00 0.00 C ATOM 731 CE LYS A 50 2.695 6.704 9.278 1.00 0.00 C ATOM 732 NZ LYS A 50 2.570 8.031 9.910 1.00 0.00 N ATOM 733 H LYS A 50 0.849 3.702 5.034 1.00 0.00 H ATOM 734 HA LYS A 50 -0.417 6.043 4.284 1.00 0.00 H ATOM 735 HB2 LYS A 50 -0.202 6.816 6.439 1.00 0.00 H ATOM 736 HB3 LYS A 50 -0.183 5.059 6.614 1.00 0.00 H ATOM 737 HG2 LYS A 50 2.301 5.132 6.897 1.00 0.00 H ATOM 738 HG3 LYS A 50 2.279 6.887 6.649 1.00 0.00 H ATOM 739 HD2 LYS A 50 0.653 7.060 8.603 1.00 0.00 H ATOM 740 HD3 LYS A 50 1.011 5.374 8.952 1.00 0.00 H ATOM 741 HE2 LYS A 50 2.895 5.991 10.077 1.00 0.00 H ATOM 742 HE3 LYS A 50 3.557 6.703 8.608 1.00 0.00 H ATOM 743 HZ1 LYS A 50 2.397 8.738 9.210 1.00 0.00 H ATOM 744 HZ2 LYS A 50 1.811 8.024 10.578 1.00 0.00 H ATOM 745 HZ3 LYS A 50 3.427 8.255 10.398 1.00 0.00 H ATOM 746 N THR A 51 2.760 6.470 3.834 1.00 0.00 N ATOM 747 CA THR A 51 3.857 7.391 3.565 1.00 0.00 C ATOM 748 C THR A 51 4.001 7.704 2.075 1.00 0.00 C ATOM 749 O THR A 51 4.310 8.849 1.740 1.00 0.00 O ATOM 750 CB THR A 51 5.123 6.866 4.243 1.00 0.00 C ATOM 751 OG1 THR A 51 4.918 7.037 5.634 1.00 0.00 O ATOM 752 CG2 THR A 51 6.399 7.606 3.827 1.00 0.00 C ATOM 753 H THR A 51 2.966 5.477 3.785 1.00 0.00 H ATOM 754 HA THR A 51 3.646 8.345 4.044 1.00 0.00 H ATOM 755 HB THR A 51 5.237 5.809 4.009 1.00 0.00 H ATOM 756 HG1 THR A 51 5.487 6.429 6.126 1.00 0.00 H ATOM 757 HG21 THR A 51 6.282 8.678 3.982 1.00 0.00 H ATOM 758 HG22 THR A 51 7.240 7.246 4.420 1.00 0.00 H ATOM 759 HG23 THR A 51 6.617 7.415 2.776 1.00 0.00 H ATOM 760 N CYS A 52 3.732 6.743 1.184 1.00 0.00 N ATOM 761 CA CYS A 52 3.517 7.074 -0.226 1.00 0.00 C ATOM 762 C CYS A 52 2.141 7.764 -0.347 1.00 0.00 C ATOM 763 O CYS A 52 1.588 8.204 0.663 1.00 0.00 O ATOM 764 CB CYS A 52 3.688 5.840 -1.083 1.00 0.00 C ATOM 765 SG CYS A 52 4.078 6.277 -2.817 1.00 0.00 S ATOM 766 H CYS A 52 3.465 5.824 1.514 1.00 0.00 H ATOM 767 HA CYS A 52 4.283 7.789 -0.537 1.00 0.00 H ATOM 768 HB2 CYS A 52 4.521 5.251 -0.700 1.00 0.00 H ATOM 769 HB3 CYS A 52 2.774 5.252 -1.016 1.00 0.00 H ATOM 770 N HIS A 53 1.567 7.906 -1.547 1.00 0.00 N ATOM 771 CA HIS A 53 0.311 8.627 -1.809 1.00 0.00 C ATOM 772 C HIS A 53 0.471 10.146 -1.719 1.00 0.00 C ATOM 773 O HIS A 53 0.098 10.849 -2.664 1.00 0.00 O ATOM 774 CB HIS A 53 -0.854 8.176 -0.909 1.00 0.00 C ATOM 775 CG HIS A 53 -1.050 6.690 -0.910 1.00 0.00 C ATOM 776 ND1 HIS A 53 -0.456 5.796 -0.052 1.00 0.00 N ATOM 777 CD2 HIS A 53 -1.530 5.985 -1.976 1.00 0.00 C ATOM 778 CE1 HIS A 53 -0.548 4.584 -0.616 1.00 0.00 C ATOM 779 NE2 HIS A 53 -1.179 4.645 -1.801 1.00 0.00 N ATOM 780 H HIS A 53 2.035 7.484 -2.336 1.00 0.00 H ATOM 781 HA HIS A 53 0.033 8.391 -2.837 1.00 0.00 H ATOM 782 HB2 HIS A 53 -0.730 8.519 0.117 1.00 0.00 H ATOM 783 HB3 HIS A 53 -1.762 8.635 -1.296 1.00 0.00 H ATOM 784 HD1 HIS A 53 0.089 5.998 0.784 1.00 0.00 H ATOM 785 HD2 HIS A 53 -1.962 6.434 -2.854 1.00 0.00 H ATOM 786 HE1 HIS A 53 -0.076 3.713 -0.195 1.00 0.00 H ATOM 787 N LYS A 54 0.992 10.622 -0.578 1.00 0.00 N ATOM 788 CA LYS A 54 1.161 12.017 -0.182 1.00 0.00 C ATOM 789 C LYS A 54 2.001 12.802 -1.193 1.00 0.00 C ATOM 790 O LYS A 54 3.163 13.117 -0.948 1.00 0.00 O ATOM 791 CB LYS A 54 1.812 12.082 1.207 1.00 0.00 C ATOM 792 CG LYS A 54 0.947 11.469 2.319 1.00 0.00 C ATOM 793 CD LYS A 54 1.499 11.860 3.699 1.00 0.00 C ATOM 794 CE LYS A 54 2.797 11.105 4.029 1.00 0.00 C ATOM 795 NZ LYS A 54 3.791 11.956 4.713 1.00 0.00 N ATOM 796 H LYS A 54 1.251 9.924 0.109 1.00 0.00 H ATOM 797 HA LYS A 54 0.178 12.486 -0.119 1.00 0.00 H ATOM 798 HB2 LYS A 54 2.780 11.581 1.160 1.00 0.00 H ATOM 799 HB3 LYS A 54 1.979 13.135 1.441 1.00 0.00 H ATOM 800 HG2 LYS A 54 -0.065 11.867 2.226 1.00 0.00 H ATOM 801 HG3 LYS A 54 0.904 10.381 2.224 1.00 0.00 H ATOM 802 HD2 LYS A 54 1.643 12.942 3.714 1.00 0.00 H ATOM 803 HD3 LYS A 54 0.751 11.616 4.456 1.00 0.00 H ATOM 804 HE2 LYS A 54 2.549 10.254 4.665 1.00 0.00 H ATOM 805 HE3 LYS A 54 3.259 10.719 3.121 1.00 0.00 H ATOM 806 HZ1 LYS A 54 3.413 12.320 5.576 1.00 0.00 H ATOM 807 HZ2 LYS A 54 4.617 11.409 4.916 1.00 0.00 H ATOM 808 HZ3 LYS A 54 4.056 12.724 4.111 1.00 0.00 H ATOM 809 N SER A 55 1.384 13.114 -2.327 1.00 0.00 N ATOM 810 CA SER A 55 1.959 13.769 -3.491 1.00 0.00 C ATOM 811 C SER A 55 0.855 13.870 -4.541 1.00 0.00 C ATOM 812 O SER A 55 0.678 14.918 -5.155 1.00 0.00 O ATOM 813 CB SER A 55 3.159 12.976 -4.038 1.00 0.00 C ATOM 814 OG SER A 55 3.773 13.658 -5.116 1.00 0.00 O ATOM 815 H SER A 55 0.445 12.742 -2.416 1.00 0.00 H ATOM 816 HA SER A 55 2.289 14.772 -3.209 1.00 0.00 H ATOM 817 HB2 SER A 55 3.920 12.851 -3.267 1.00 0.00 H ATOM 818 HB3 SER A 55 2.836 11.988 -4.369 1.00 0.00 H ATOM 819 HG SER A 55 3.116 13.891 -5.779 1.00 0.00 H ATOM 820 N ASN A 56 0.123 12.766 -4.745 1.00 0.00 N ATOM 821 CA ASN A 56 -0.972 12.677 -5.705 1.00 0.00 C ATOM 822 C ASN A 56 -2.315 12.588 -4.979 1.00 0.00 C ATOM 823 O ASN A 56 -3.281 13.218 -5.399 1.00 0.00 O ATOM 824 CB ASN A 56 -0.756 11.470 -6.629 1.00 0.00 C ATOM 825 CG ASN A 56 -1.541 11.606 -7.933 1.00 0.00 C ATOM 826 OD1 ASN A 56 -0.971 11.947 -8.965 1.00 0.00 O ATOM 827 ND2 ASN A 56 -2.843 11.348 -7.916 1.00 0.00 N ATOM 828 H ASN A 56 0.317 11.949 -4.178 1.00 0.00 H ATOM 829 HA ASN A 56 -0.987 13.571 -6.332 1.00 0.00 H ATOM 830 HB2 ASN A 56 0.301 11.414 -6.891 1.00 0.00 H ATOM 831 HB3 ASN A 56 -1.032 10.545 -6.119 1.00 0.00 H ATOM 832 HD21 ASN A 56 -3.315 11.065 -7.062 1.00 0.00 H ATOM 833 HD22 ASN A 56 -3.357 11.414 -8.780 1.00 0.00 H ATOM 834 N ASN A 57 -2.383 11.802 -3.895 1.00 0.00 N ATOM 835 CA ASN A 57 -3.609 11.570 -3.134 1.00 0.00 C ATOM 836 C ASN A 57 -3.332 11.889 -1.663 1.00 0.00 C ATOM 837 O ASN A 57 -2.178 11.872 -1.238 1.00 0.00 O ATOM 838 CB ASN A 57 -4.073 10.105 -3.265 1.00 0.00 C ATOM 839 CG ASN A 57 -4.515 9.679 -4.666 1.00 0.00 C ATOM 840 OD1 ASN A 57 -4.026 10.178 -5.672 1.00 0.00 O ATOM 841 ND2 ASN A 57 -5.437 8.723 -4.750 1.00 0.00 N ATOM 842 H ASN A 57 -1.532 11.394 -3.519 1.00 0.00 H ATOM 843 HA ASN A 57 -4.413 12.222 -3.479 1.00 0.00 H ATOM 844 HB2 ASN A 57 -3.270 9.442 -2.945 1.00 0.00 H ATOM 845 HB3 ASN A 57 -4.928 9.967 -2.603 1.00 0.00 H ATOM 846 HD21 ASN A 57 -5.839 8.311 -3.924 1.00 0.00 H ATOM 847 HD22 ASN A 57 -5.769 8.453 -5.665 1.00 0.00 H ATOM 848 N GLY A 58 -4.382 12.136 -0.871 1.00 0.00 N ATOM 849 CA GLY A 58 -4.269 12.400 0.562 1.00 0.00 C ATOM 850 C GLY A 58 -5.072 11.411 1.414 1.00 0.00 C ATOM 851 O GLY A 58 -5.943 11.836 2.172 1.00 0.00 O ATOM 852 H GLY A 58 -5.306 12.147 -1.278 1.00 0.00 H ATOM 853 HA2 GLY A 58 -3.233 12.380 0.901 1.00 0.00 H ATOM 854 HA3 GLY A 58 -4.654 13.404 0.744 1.00 0.00 H ATOM 855 N PRO A 59 -4.779 10.100 1.357 1.00 0.00 N ATOM 856 CA PRO A 59 -5.465 9.095 2.157 1.00 0.00 C ATOM 857 C PRO A 59 -4.926 9.032 3.588 1.00 0.00 C ATOM 858 O PRO A 59 -5.315 8.150 4.344 1.00 0.00 O ATOM 859 CB PRO A 59 -5.206 7.780 1.420 1.00 0.00 C ATOM 860 CG PRO A 59 -3.783 7.982 0.902 1.00 0.00 C ATOM 861 CD PRO A 59 -3.779 9.463 0.515 1.00 0.00 C ATOM 862 HA PRO A 59 -6.534 9.299 2.222 1.00 0.00 H ATOM 863 HB2 PRO A 59 -5.296 6.899 2.056 1.00 0.00 H ATOM 864 HB3 PRO A 59 -5.891 7.696 0.575 1.00 0.00 H ATOM 865 HG2 PRO A 59 -3.066 7.806 1.705 1.00 0.00 H ATOM 866 HG3 PRO A 59 -3.570 7.328 0.057 1.00 0.00 H ATOM 867 HD2 PRO A 59 -2.790 9.902 0.650 1.00 0.00 H ATOM 868 HD3 PRO A 59 -4.090 9.529 -0.523 1.00 0.00 H ATOM 869 N THR A 60 -4.032 9.946 3.972 1.00 0.00 N ATOM 870 CA THR A 60 -3.478 10.052 5.309 1.00 0.00 C ATOM 871 C THR A 60 -4.579 10.024 6.373 1.00 0.00 C ATOM 872 O THR A 60 -4.440 9.349 7.391 1.00 0.00 O ATOM 873 CB THR A 60 -2.674 11.356 5.351 1.00 0.00 C ATOM 874 OG1 THR A 60 -1.890 11.425 4.174 1.00 0.00 O ATOM 875 CG2 THR A 60 -1.766 11.447 6.580 1.00 0.00 C ATOM 876 H THR A 60 -3.694 10.631 3.312 1.00 0.00 H ATOM 877 HA THR A 60 -2.808 9.206 5.471 1.00 0.00 H ATOM 878 HB THR A 60 -3.365 12.201 5.351 1.00 0.00 H ATOM 879 HG1 THR A 60 -1.405 10.598 4.085 1.00 0.00 H ATOM 880 HG21 THR A 60 -1.066 10.612 6.597 1.00 0.00 H ATOM 881 HG22 THR A 60 -1.210 12.385 6.548 1.00 0.00 H ATOM 882 HG23 THR A 60 -2.368 11.430 7.489 1.00 0.00 H ATOM 883 N LYS A 61 -5.673 10.756 6.132 1.00 0.00 N ATOM 884 CA LYS A 61 -6.828 10.701 7.009 1.00 0.00 C ATOM 885 C LYS A 61 -7.471 9.312 6.922 1.00 0.00 C ATOM 886 O LYS A 61 -7.715 8.798 5.827 1.00 0.00 O ATOM 887 CB LYS A 61 -7.785 11.869 6.738 1.00 0.00 C ATOM 888 CG LYS A 61 -8.687 11.568 5.550 1.00 0.00 C ATOM 889 CD LYS A 61 -9.544 12.781 5.167 1.00 0.00 C ATOM 890 CE LYS A 61 -10.581 12.420 4.094 1.00 0.00 C ATOM 891 NZ LYS A 61 -11.576 11.436 4.576 1.00 0.00 N ATOM 892 H LYS A 61 -5.753 11.242 5.251 1.00 0.00 H ATOM 893 HA LYS A 61 -6.495 10.859 8.023 1.00 0.00 H ATOM 894 HB2 LYS A 61 -8.413 12.020 7.617 1.00 0.00 H ATOM 895 HB3 LYS A 61 -7.211 12.780 6.561 1.00 0.00 H ATOM 896 HG2 LYS A 61 -8.057 11.252 4.718 1.00 0.00 H ATOM 897 HG3 LYS A 61 -9.316 10.741 5.868 1.00 0.00 H ATOM 898 HD2 LYS A 61 -10.042 13.178 6.054 1.00 0.00 H ATOM 899 HD3 LYS A 61 -8.885 13.560 4.775 1.00 0.00 H ATOM 900 HE2 LYS A 61 -11.102 13.333 3.795 1.00 0.00 H ATOM 901 HE3 LYS A 61 -10.067 12.019 3.217 1.00 0.00 H ATOM 902 HZ1 LYS A 61 -12.065 11.799 5.383 1.00 0.00 H ATOM 903 HZ2 LYS A 61 -12.250 11.245 3.847 1.00 0.00 H ATOM 904 HZ3 LYS A 61 -11.125 10.568 4.834 1.00 0.00 H ATOM 905 N CYS A 62 -7.771 8.710 8.072 1.00 0.00 N ATOM 906 CA CYS A 62 -8.449 7.425 8.116 1.00 0.00 C ATOM 907 C CYS A 62 -9.757 7.522 7.319 1.00 0.00 C ATOM 908 O CYS A 62 -10.351 8.598 7.200 1.00 0.00 O ATOM 909 CB CYS A 62 -8.670 6.968 9.540 1.00 0.00 C ATOM 910 SG CYS A 62 -7.245 7.239 10.652 1.00 0.00 S ATOM 911 H CYS A 62 -7.543 9.153 8.950 1.00 0.00 H ATOM 912 HA CYS A 62 -7.812 6.697 7.614 1.00 0.00 H ATOM 913 HB2 CYS A 62 -9.514 7.522 9.949 1.00 0.00 H ATOM 914 HB3 CYS A 62 -8.919 5.907 9.519 1.00 0.00 H ATOM 915 N GLY A 63 -10.142 6.419 6.675 1.00 0.00 N ATOM 916 CA GLY A 63 -11.143 6.429 5.618 1.00 0.00 C ATOM 917 C GLY A 63 -10.484 6.478 4.236 1.00 0.00 C ATOM 918 O GLY A 63 -11.090 6.060 3.256 1.00 0.00 O ATOM 919 H GLY A 63 -9.638 5.560 6.832 1.00 0.00 H ATOM 920 HA2 GLY A 63 -11.745 5.528 5.704 1.00 0.00 H ATOM 921 HA3 GLY A 63 -11.813 7.284 5.713 1.00 0.00 H ATOM 922 N GLY A 64 -9.256 7.007 4.140 1.00 0.00 N ATOM 923 CA GLY A 64 -8.529 7.108 2.883 1.00 0.00 C ATOM 924 C GLY A 64 -8.396 5.764 2.162 1.00 0.00 C ATOM 925 O GLY A 64 -8.801 5.634 1.010 1.00 0.00 O ATOM 926 H GLY A 64 -8.809 7.422 4.953 1.00 0.00 H ATOM 927 HA2 GLY A 64 -9.023 7.829 2.231 1.00 0.00 H ATOM 928 HA3 GLY A 64 -7.530 7.472 3.114 1.00 0.00 H ATOM 929 N CYS A 65 -7.790 4.783 2.835 1.00 0.00 N ATOM 930 CA CYS A 65 -7.582 3.436 2.305 1.00 0.00 C ATOM 931 C CYS A 65 -8.752 2.556 2.719 1.00 0.00 C ATOM 932 O CYS A 65 -9.403 1.926 1.889 1.00 0.00 O ATOM 933 CB CYS A 65 -6.288 2.874 2.841 1.00 0.00 C ATOM 934 SG CYS A 65 -4.922 3.784 2.094 1.00 0.00 S ATOM 935 H CYS A 65 -7.444 4.987 3.759 1.00 0.00 H ATOM 936 HA CYS A 65 -7.528 3.452 1.215 1.00 0.00 H ATOM 937 HB2 CYS A 65 -6.267 2.975 3.925 1.00 0.00 H ATOM 938 HB3 CYS A 65 -6.189 1.821 2.574 1.00 0.00 H ATOM 939 N HIS A 66 -8.984 2.506 4.030 1.00 0.00 N ATOM 940 CA HIS A 66 -10.001 1.683 4.650 1.00 0.00 C ATOM 941 C HIS A 66 -11.395 2.189 4.286 1.00 0.00 C ATOM 942 O HIS A 66 -11.811 3.253 4.739 1.00 0.00 O ATOM 943 CB HIS A 66 -9.782 1.693 6.160 1.00 0.00 C ATOM 944 CG HIS A 66 -8.478 1.060 6.572 1.00 0.00 C ATOM 945 ND1 HIS A 66 -8.237 -0.290 6.651 1.00 0.00 N ATOM 946 CD2 HIS A 66 -7.354 1.711 6.998 1.00 0.00 C ATOM 947 CE1 HIS A 66 -6.993 -0.448 7.136 1.00 0.00 C ATOM 948 NE2 HIS A 66 -6.412 0.744 7.369 1.00 0.00 N ATOM 949 H HIS A 66 -8.378 3.039 4.631 1.00 0.00 H ATOM 950 HA HIS A 66 -9.885 0.656 4.304 1.00 0.00 H ATOM 951 HB2 HIS A 66 -9.836 2.715 6.540 1.00 0.00 H ATOM 952 HB3 HIS A 66 -10.592 1.125 6.609 1.00 0.00 H ATOM 953 HD1 HIS A 66 -8.902 -1.018 6.406 1.00 0.00 H ATOM 954 HD2 HIS A 66 -7.244 2.781 7.079 1.00 0.00 H ATOM 955 HE1 HIS A 66 -6.545 -1.407 7.346 1.00 0.00 H ATOM 956 N ILE A 67 -12.117 1.427 3.468 1.00 0.00 N ATOM 957 CA ILE A 67 -13.467 1.755 3.054 1.00 0.00 C ATOM 958 C ILE A 67 -14.426 1.467 4.215 1.00 0.00 C ATOM 959 O ILE A 67 -14.744 0.308 4.491 1.00 0.00 O ATOM 960 CB ILE A 67 -13.828 0.983 1.770 1.00 0.00 C ATOM 961 CG1 ILE A 67 -12.837 1.345 0.645 1.00 0.00 C ATOM 962 CG2 ILE A 67 -15.270 1.298 1.339 1.00 0.00 C ATOM 963 CD1 ILE A 67 -13.102 0.603 -0.669 1.00 0.00 C ATOM 964 H ILE A 67 -11.694 0.589 3.089 1.00 0.00 H ATOM 965 HA ILE A 67 -13.508 2.818 2.812 1.00 0.00 H ATOM 966 HB ILE A 67 -13.752 -0.084 1.975 1.00 0.00 H ATOM 967 HG12 ILE A 67 -12.871 2.419 0.455 1.00 0.00 H ATOM 968 HG13 ILE A 67 -11.824 1.085 0.952 1.00 0.00 H ATOM 969 HG21 ILE A 67 -15.973 1.062 2.137 1.00 0.00 H ATOM 970 HG22 ILE A 67 -15.361 2.355 1.086 1.00 0.00 H ATOM 971 HG23 ILE A 67 -15.547 0.696 0.475 1.00 0.00 H ATOM 972 HD11 ILE A 67 -13.177 -0.468 -0.485 1.00 0.00 H ATOM 973 HD12 ILE A 67 -14.018 0.961 -1.137 1.00 0.00 H ATOM 974 HD13 ILE A 67 -12.273 0.786 -1.354 1.00 0.00 H ATOM 975 N LYS A 68 -14.910 2.545 4.840 1.00 0.00 N ATOM 976 CA LYS A 68 -15.937 2.573 5.875 1.00 0.00 C ATOM 977 C LYS A 68 -15.370 2.187 7.245 1.00 0.00 C ATOM 978 O LYS A 68 -16.200 1.904 8.140 1.00 0.00 O ATOM 979 CB LYS A 68 -17.159 1.717 5.489 1.00 0.00 C ATOM 980 CG LYS A 68 -18.463 2.326 6.034 1.00 0.00 C ATOM 981 CD LYS A 68 -19.545 1.264 6.287 1.00 0.00 C ATOM 982 CE LYS A 68 -19.584 0.811 7.756 1.00 0.00 C ATOM 983 NZ LYS A 68 -18.276 0.326 8.240 1.00 0.00 N ATOM 984 OXT LYS A 68 -14.131 2.183 7.386 1.00 0.00 O ATOM 985 H LYS A 68 -14.442 3.418 4.651 1.00 0.00 H ATOM 986 HA LYS A 68 -16.254 3.614 5.941 1.00 0.00 H ATOM 987 HB2 LYS A 68 -17.253 1.665 4.403 1.00 0.00 H ATOM 988 HB3 LYS A 68 -17.009 0.704 5.862 1.00 0.00 H ATOM 989 HG2 LYS A 68 -18.277 2.893 6.948 1.00 0.00 H ATOM 990 HG3 LYS A 68 -18.825 3.031 5.284 1.00 0.00 H ATOM 991 HD2 LYS A 68 -20.518 1.703 6.052 1.00 0.00 H ATOM 992 HD3 LYS A 68 -19.400 0.413 5.618 1.00 0.00 H ATOM 993 HE2 LYS A 68 -19.891 1.658 8.375 1.00 0.00 H ATOM 994 HE3 LYS A 68 -20.329 0.021 7.866 1.00 0.00 H ATOM 995 HZ1 LYS A 68 -17.938 -0.448 7.689 1.00 0.00 H ATOM 996 HZ2 LYS A 68 -17.580 1.066 8.168 1.00 0.00 H ATOM 997 HZ3 LYS A 68 -18.319 0.061 9.211 1.00 0.00 H TER 998 LYS A 68 HETATM 999 FE HEC A 69 4.715 -7.134 -5.036 1.00 0.00 FE HETATM 1000 CHA HEC A 69 4.064 -9.739 -2.840 1.00 0.00 C HETATM 1001 CHB HEC A 69 6.323 -9.239 -7.194 1.00 0.00 C HETATM 1002 CHC HEC A 69 4.839 -4.550 -7.310 1.00 0.00 C HETATM 1003 CHD HEC A 69 3.529 -4.887 -2.633 1.00 0.00 C HETATM 1004 NA HEC A 69 5.149 -9.124 -5.003 1.00 0.00 N HETATM 1005 C1A HEC A 69 4.761 -9.999 -4.027 1.00 0.00 C HETATM 1006 C2A HEC A 69 5.198 -11.312 -4.433 1.00 0.00 C HETATM 1007 C3A HEC A 69 5.878 -11.173 -5.626 1.00 0.00 C HETATM 1008 C4A HEC A 69 5.818 -9.777 -5.998 1.00 0.00 C HETATM 1009 CMA HEC A 69 6.509 -12.283 -6.435 1.00 0.00 C HETATM 1010 CAA HEC A 69 4.849 -12.604 -3.728 1.00 0.00 C HETATM 1011 CBA HEC A 69 3.358 -12.954 -3.831 1.00 0.00 C HETATM 1012 CGA HEC A 69 2.892 -12.973 -5.283 1.00 0.00 C HETATM 1013 O1A HEC A 69 2.050 -12.115 -5.630 1.00 0.00 O HETATM 1014 O2A HEC A 69 3.403 -13.841 -6.024 1.00 0.00 O HETATM 1015 NB HEC A 69 5.494 -6.916 -6.896 1.00 0.00 N HETATM 1016 C1B HEC A 69 6.129 -7.904 -7.585 1.00 0.00 C HETATM 1017 C2B HEC A 69 6.533 -7.347 -8.858 1.00 0.00 C HETATM 1018 C3B HEC A 69 6.095 -6.037 -8.897 1.00 0.00 C HETATM 1019 C4B HEC A 69 5.421 -5.776 -7.647 1.00 0.00 C HETATM 1020 CMB HEC A 69 7.219 -8.100 -9.973 1.00 0.00 C HETATM 1021 CAB HEC A 69 6.244 -5.050 -10.044 1.00 0.00 C HETATM 1022 CBB HEC A 69 5.459 -5.472 -11.285 1.00 0.00 C HETATM 1023 NC HEC A 69 4.259 -5.077 -4.984 1.00 0.00 N HETATM 1024 C1C HEC A 69 4.373 -4.240 -6.044 1.00 0.00 C HETATM 1025 C2C HEC A 69 3.959 -2.921 -5.618 1.00 0.00 C HETATM 1026 C3C HEC A 69 3.657 -3.010 -4.277 1.00 0.00 C HETATM 1027 C4C HEC A 69 3.810 -4.393 -3.898 1.00 0.00 C HETATM 1028 CMC HEC A 69 3.915 -1.657 -6.455 1.00 0.00 C HETATM 1029 CAC HEC A 69 3.339 -1.863 -3.338 1.00 0.00 C HETATM 1030 CBC HEC A 69 2.014 -1.166 -3.641 1.00 0.00 C HETATM 1031 ND HEC A 69 3.909 -7.287 -3.092 1.00 0.00 N HETATM 1032 C1D HEC A 69 3.536 -6.233 -2.322 1.00 0.00 C HETATM 1033 C2D HEC A 69 3.108 -6.743 -1.049 1.00 0.00 C HETATM 1034 C3D HEC A 69 3.187 -8.116 -1.111 1.00 0.00 C HETATM 1035 C4D HEC A 69 3.737 -8.452 -2.408 1.00 0.00 C HETATM 1036 CMD HEC A 69 2.681 -5.898 0.125 1.00 0.00 C HETATM 1037 CAD HEC A 69 2.805 -9.071 -0.006 1.00 0.00 C HETATM 1038 CBD HEC A 69 1.308 -9.361 0.064 1.00 0.00 C HETATM 1039 CGD HEC A 69 1.008 -10.350 1.182 1.00 0.00 C HETATM 1040 O1D HEC A 69 -0.017 -10.132 1.859 1.00 0.00 O HETATM 1041 O2D HEC A 69 1.806 -11.301 1.341 1.00 0.00 O HETATM 1042 HHA HEC A 69 3.840 -10.569 -2.195 1.00 0.00 H HETATM 1043 HHB HEC A 69 6.827 -9.902 -7.879 1.00 0.00 H HETATM 1044 HHC HEC A 69 4.829 -3.762 -8.032 1.00 0.00 H HETATM 1045 HHD HEC A 69 3.195 -4.214 -1.869 1.00 0.00 H HETATM 1046 HMA1 HEC A 69 6.018 -13.235 -6.237 1.00 0.00 H HETATM 1047 HMA2 HEC A 69 6.399 -12.090 -7.500 1.00 0.00 H HETATM 1048 HMA3 HEC A 69 7.568 -12.359 -6.185 1.00 0.00 H HETATM 1049 HAA1 HEC A 69 5.416 -13.429 -4.154 1.00 0.00 H HETATM 1050 HAA2 HEC A 69 5.123 -12.529 -2.677 1.00 0.00 H HETATM 1051 HBA1 HEC A 69 3.190 -13.941 -3.399 1.00 0.00 H HETATM 1052 HBA2 HEC A 69 2.756 -12.235 -3.275 1.00 0.00 H HETATM 1053 HMB1 HEC A 69 7.946 -8.802 -9.572 1.00 0.00 H HETATM 1054 HMB2 HEC A 69 6.473 -8.647 -10.551 1.00 0.00 H HETATM 1055 HMB3 HEC A 69 7.751 -7.417 -10.632 1.00 0.00 H HETATM 1056 HAB HEC A 69 5.855 -4.080 -9.773 1.00 0.00 H HETATM 1057 HBB1 HEC A 69 4.402 -5.526 -11.023 1.00 0.00 H HETATM 1058 HBB2 HEC A 69 5.604 -4.729 -12.069 1.00 0.00 H HETATM 1059 HBB3 HEC A 69 5.801 -6.438 -11.647 1.00 0.00 H HETATM 1060 HMC1 HEC A 69 4.294 -1.803 -7.462 1.00 0.00 H HETATM 1061 HMC2 HEC A 69 2.876 -1.340 -6.543 1.00 0.00 H HETATM 1062 HMC3 HEC A 69 4.511 -0.868 -5.984 1.00 0.00 H HETATM 1063 HAC HEC A 69 3.256 -2.209 -2.315 1.00 0.00 H HETATM 1064 HBC1 HEC A 69 1.189 -1.869 -3.527 1.00 0.00 H HETATM 1065 HBC2 HEC A 69 1.884 -0.342 -2.947 1.00 0.00 H HETATM 1066 HBC3 HEC A 69 2.007 -0.777 -4.651 1.00 0.00 H HETATM 1067 HMD1 HEC A 69 3.557 -5.438 0.579 1.00 0.00 H HETATM 1068 HMD2 HEC A 69 2.022 -5.087 -0.191 1.00 0.00 H HETATM 1069 HMD3 HEC A 69 2.168 -6.517 0.859 1.00 0.00 H HETATM 1070 HAD1 HEC A 69 3.297 -10.026 -0.152 1.00 0.00 H HETATM 1071 HAD2 HEC A 69 3.131 -8.677 0.958 1.00 0.00 H HETATM 1072 HBD1 HEC A 69 0.758 -8.437 0.247 1.00 0.00 H HETATM 1073 HBD2 HEC A 69 0.971 -9.793 -0.879 1.00 0.00 H HETATM 1074 FE HEC A 70 -1.290 3.245 -3.170 1.00 0.00 FE HETATM 1075 CHA HEC A 70 -3.633 5.029 -5.017 1.00 0.00 C HETATM 1076 CHB HEC A 70 -3.812 1.602 -1.426 1.00 0.00 C HETATM 1077 CHC HEC A 70 1.077 1.494 -1.294 1.00 0.00 C HETATM 1078 CHD HEC A 70 1.262 5.080 -4.608 1.00 0.00 C HETATM 1079 NA HEC A 70 -3.346 3.326 -3.187 1.00 0.00 N HETATM 1080 C1A HEC A 70 -4.084 4.127 -4.028 1.00 0.00 C HETATM 1081 C2A HEC A 70 -5.474 3.857 -3.746 1.00 0.00 C HETATM 1082 C3A HEC A 70 -5.531 2.907 -2.750 1.00 0.00 C HETATM 1083 C4A HEC A 70 -4.171 2.559 -2.396 1.00 0.00 C HETATM 1084 CMA HEC A 70 -6.809 2.342 -2.173 1.00 0.00 C HETATM 1085 CAA HEC A 70 -6.661 4.482 -4.436 1.00 0.00 C HETATM 1086 CBA HEC A 70 -6.984 3.840 -5.787 1.00 0.00 C HETATM 1087 CGA HEC A 70 -8.163 4.530 -6.464 1.00 0.00 C HETATM 1088 O1A HEC A 70 -8.787 3.873 -7.323 1.00 0.00 O HETATM 1089 O2A HEC A 70 -8.418 5.702 -6.111 1.00 0.00 O HETATM 1090 NB HEC A 70 -1.350 1.772 -1.664 1.00 0.00 N HETATM 1091 C1B HEC A 70 -2.486 1.277 -1.104 1.00 0.00 C HETATM 1092 C2B HEC A 70 -2.092 0.320 -0.088 1.00 0.00 C HETATM 1093 C3B HEC A 70 -0.712 0.343 0.003 1.00 0.00 C HETATM 1094 C4B HEC A 70 -0.258 1.223 -1.050 1.00 0.00 C HETATM 1095 CMB HEC A 70 -3.042 -0.540 0.705 1.00 0.00 C HETATM 1096 CAB HEC A 70 0.202 -0.368 1.009 1.00 0.00 C HETATM 1097 CBB HEC A 70 0.327 -1.881 0.778 1.00 0.00 C HETATM 1098 NC HEC A 70 0.793 3.247 -3.011 1.00 0.00 N HETATM 1099 C1C HEC A 70 1.527 2.448 -2.184 1.00 0.00 C HETATM 1100 C2C HEC A 70 2.919 2.791 -2.336 1.00 0.00 C HETATM 1101 C3C HEC A 70 2.960 3.849 -3.223 1.00 0.00 C HETATM 1102 C4C HEC A 70 1.609 4.100 -3.672 1.00 0.00 C HETATM 1103 CMC HEC A 70 4.079 2.167 -1.575 1.00 0.00 C HETATM 1104 CAC HEC A 70 4.157 4.655 -3.666 1.00 0.00 C HETATM 1105 CBC HEC A 70 5.529 3.983 -3.546 1.00 0.00 C HETATM 1106 ND HEC A 70 -1.197 4.755 -4.614 1.00 0.00 N HETATM 1107 C1D HEC A 70 -0.042 5.329 -5.033 1.00 0.00 C HETATM 1108 C2D HEC A 70 -0.387 6.314 -6.024 1.00 0.00 C HETATM 1109 C3D HEC A 70 -1.755 6.285 -6.188 1.00 0.00 C HETATM 1110 C4D HEC A 70 -2.277 5.312 -5.247 1.00 0.00 C HETATM 1111 CMD HEC A 70 0.598 7.201 -6.743 1.00 0.00 C HETATM 1112 CAD HEC A 70 -2.520 7.127 -7.191 1.00 0.00 C HETATM 1113 CBD HEC A 70 -2.333 6.641 -8.638 1.00 0.00 C HETATM 1114 CGD HEC A 70 -2.048 7.776 -9.618 1.00 0.00 C HETATM 1115 O1D HEC A 70 -2.819 7.950 -10.582 1.00 0.00 O HETATM 1116 O2D HEC A 70 -0.990 8.426 -9.473 1.00 0.00 O HETATM 1117 HHA HEC A 70 -4.374 5.548 -5.604 1.00 0.00 H HETATM 1118 HHB HEC A 70 -4.594 1.094 -0.884 1.00 0.00 H HETATM 1119 HHC HEC A 70 1.816 0.972 -0.727 1.00 0.00 H HETATM 1120 HHD HEC A 70 2.046 5.677 -5.042 1.00 0.00 H HETATM 1121 HMA1 HEC A 70 -7.318 3.115 -1.596 1.00 0.00 H HETATM 1122 HMA2 HEC A 70 -7.457 2.022 -2.989 1.00 0.00 H HETATM 1123 HMA3 HEC A 70 -6.631 1.485 -1.528 1.00 0.00 H HETATM 1124 HAA1 HEC A 70 -7.545 4.399 -3.803 1.00 0.00 H HETATM 1125 HAA2 HEC A 70 -6.471 5.544 -4.580 1.00 0.00 H HETATM 1126 HBA1 HEC A 70 -6.124 3.902 -6.453 1.00 0.00 H HETATM 1127 HBA2 HEC A 70 -7.232 2.788 -5.640 1.00 0.00 H HETATM 1128 HMB1 HEC A 70 -2.505 -1.354 1.178 1.00 0.00 H HETATM 1129 HMB2 HEC A 70 -3.539 0.062 1.465 1.00 0.00 H HETATM 1130 HMB3 HEC A 70 -3.791 -0.973 0.041 1.00 0.00 H HETATM 1131 HAB HEC A 70 1.213 0.007 0.931 1.00 0.00 H HETATM 1132 HBB1 HEC A 70 -0.598 -2.387 1.039 1.00 0.00 H HETATM 1133 HBB2 HEC A 70 0.561 -2.089 -0.266 1.00 0.00 H HETATM 1134 HBB3 HEC A 70 1.125 -2.289 1.401 1.00 0.00 H HETATM 1135 HMC1 HEC A 70 3.825 1.227 -1.087 1.00 0.00 H HETATM 1136 HMC2 HEC A 70 4.893 1.914 -2.245 1.00 0.00 H HETATM 1137 HMC3 HEC A 70 4.434 2.861 -0.815 1.00 0.00 H HETATM 1138 HAC HEC A 70 4.061 4.803 -4.744 1.00 0.00 H HETATM 1139 HBC1 HEC A 70 6.262 4.608 -4.054 1.00 0.00 H HETATM 1140 HBC2 HEC A 70 5.833 3.898 -2.504 1.00 0.00 H HETATM 1141 HBC3 HEC A 70 5.513 3.001 -4.037 1.00 0.00 H HETATM 1142 HMD1 HEC A 70 0.092 7.897 -7.402 1.00 0.00 H HETATM 1143 HMD2 HEC A 70 1.174 7.777 -6.019 1.00 0.00 H HETATM 1144 HMD3 HEC A 70 1.272 6.586 -7.340 1.00 0.00 H HETATM 1145 HAD1 HEC A 70 -3.585 7.150 -6.969 1.00 0.00 H HETATM 1146 HAD2 HEC A 70 -2.166 8.156 -7.112 1.00 0.00 H HETATM 1147 HBD1 HEC A 70 -1.484 5.959 -8.694 1.00 0.00 H HETATM 1148 HBD2 HEC A 70 -3.221 6.097 -8.961 1.00 0.00 H HETATM 1149 FE HEC A 71 -4.674 1.075 8.224 1.00 0.00 FE HETATM 1150 CHA HEC A 71 -4.204 -2.299 8.872 1.00 0.00 C HETATM 1151 CHB HEC A 71 -6.290 1.490 11.238 1.00 0.00 C HETATM 1152 CHC HEC A 71 -4.878 4.482 7.620 1.00 0.00 C HETATM 1153 CHD HEC A 71 -3.375 0.645 4.978 1.00 0.00 C HETATM 1154 NA HEC A 71 -5.152 -0.178 9.781 1.00 0.00 N HETATM 1155 C1A HEC A 71 -4.835 -1.512 9.852 1.00 0.00 C HETATM 1156 C2A HEC A 71 -5.304 -1.991 11.141 1.00 0.00 C HETATM 1157 C3A HEC A 71 -5.829 -0.905 11.809 1.00 0.00 C HETATM 1158 C4A HEC A 71 -5.797 0.221 10.912 1.00 0.00 C HETATM 1159 CMA HEC A 71 -6.254 -0.848 13.257 1.00 0.00 C HETATM 1160 CAA HEC A 71 -5.247 -3.413 11.667 1.00 0.00 C HETATM 1161 CBA HEC A 71 -6.596 -4.146 11.645 1.00 0.00 C HETATM 1162 CGA HEC A 71 -7.477 -3.794 12.840 1.00 0.00 C HETATM 1163 O1A HEC A 71 -8.328 -2.893 12.689 1.00 0.00 O HETATM 1164 O2A HEC A 71 -7.293 -4.431 13.898 1.00 0.00 O HETATM 1165 NB HEC A 71 -5.497 2.690 9.219 1.00 0.00 N HETATM 1166 C1B HEC A 71 -6.117 2.624 10.433 1.00 0.00 C HETATM 1167 C2B HEC A 71 -6.512 3.972 10.789 1.00 0.00 C HETATM 1168 C3B HEC A 71 -6.050 4.814 9.794 1.00 0.00 C HETATM 1169 C4B HEC A 71 -5.438 3.980 8.791 1.00 0.00 C HETATM 1170 CMB HEC A 71 -7.277 4.385 12.026 1.00 0.00 C HETATM 1171 CAB HEC A 71 -5.914 6.329 9.813 1.00 0.00 C HETATM 1172 CBB HEC A 71 -4.527 6.751 10.314 1.00 0.00 C HETATM 1173 NC HEC A 71 -4.196 2.347 6.590 1.00 0.00 N HETATM 1174 C1C HEC A 71 -4.371 3.694 6.601 1.00 0.00 C HETATM 1175 C2C HEC A 71 -3.940 4.208 5.325 1.00 0.00 C HETATM 1176 C3C HEC A 71 -3.676 3.127 4.517 1.00 0.00 C HETATM 1177 C4C HEC A 71 -3.719 1.946 5.366 1.00 0.00 C HETATM 1178 CMC HEC A 71 -3.850 5.657 4.912 1.00 0.00 C HETATM 1179 CAC HEC A 71 -3.467 3.195 3.008 1.00 0.00 C HETATM 1180 CBC HEC A 71 -2.366 4.169 2.591 1.00 0.00 C HETATM 1181 ND HEC A 71 -3.891 -0.529 7.136 1.00 0.00 N HETATM 1182 C1D HEC A 71 -3.438 -0.466 5.839 1.00 0.00 C HETATM 1183 C2D HEC A 71 -3.025 -1.803 5.479 1.00 0.00 C HETATM 1184 C3D HEC A 71 -3.216 -2.613 6.573 1.00 0.00 C HETATM 1185 C4D HEC A 71 -3.799 -1.809 7.621 1.00 0.00 C HETATM 1186 CMD HEC A 71 -2.472 -2.259 4.152 1.00 0.00 C HETATM 1187 CAD HEC A 71 -2.882 -4.084 6.610 1.00 0.00 C HETATM 1188 CBD HEC A 71 -3.909 -4.963 5.895 1.00 0.00 C HETATM 1189 CGD HEC A 71 -3.218 -6.133 5.223 1.00 0.00 C HETATM 1190 O1D HEC A 71 -2.839 -5.951 4.047 1.00 0.00 O HETATM 1191 O2D HEC A 71 -3.049 -7.162 5.907 1.00 0.00 O HETATM 1192 HHA HEC A 71 -4.072 -3.352 9.059 1.00 0.00 H HETATM 1193 HHB HEC A 71 -6.769 1.592 12.195 1.00 0.00 H HETATM 1194 HHC HEC A 71 -4.921 5.539 7.453 1.00 0.00 H HETATM 1195 HHD HEC A 71 -2.992 0.496 3.983 1.00 0.00 H HETATM 1196 HMA1 HEC A 71 -5.729 -0.038 13.761 1.00 0.00 H HETATM 1197 HMA2 HEC A 71 -7.327 -0.674 13.311 1.00 0.00 H HETATM 1198 HMA3 HEC A 71 -6.022 -1.776 13.776 1.00 0.00 H HETATM 1199 HAA1 HEC A 71 -4.548 -4.000 11.075 1.00 0.00 H HETATM 1200 HAA2 HEC A 71 -4.865 -3.418 12.688 1.00 0.00 H HETATM 1201 HBA1 HEC A 71 -7.119 -3.921 10.717 1.00 0.00 H HETATM 1202 HBA2 HEC A 71 -6.408 -5.220 11.680 1.00 0.00 H HETATM 1203 HMB1 HEC A 71 -8.252 4.766 11.723 1.00 0.00 H HETATM 1204 HMB2 HEC A 71 -7.438 3.556 12.709 1.00 0.00 H HETATM 1205 HMB3 HEC A 71 -6.727 5.164 12.552 1.00 0.00 H HETATM 1206 HAB HEC A 71 -5.971 6.719 8.805 1.00 0.00 H HETATM 1207 HBB1 HEC A 71 -3.748 6.289 9.697 1.00 0.00 H HETATM 1208 HBB2 HEC A 71 -4.430 7.835 10.239 1.00 0.00 H HETATM 1209 HBB3 HEC A 71 -4.398 6.443 11.350 1.00 0.00 H HETATM 1210 HMC1 HEC A 71 -4.451 5.809 4.019 1.00 0.00 H HETATM 1211 HMC2 HEC A 71 -4.207 6.344 5.672 1.00 0.00 H HETATM 1212 HMC3 HEC A 71 -2.813 5.911 4.706 1.00 0.00 H HETATM 1213 HAC HEC A 71 -3.232 2.207 2.624 1.00 0.00 H HETATM 1214 HBC1 HEC A 71 -2.737 5.191 2.543 1.00 0.00 H HETATM 1215 HBC2 HEC A 71 -1.570 4.117 3.321 1.00 0.00 H HETATM 1216 HBC3 HEC A 71 -2.011 3.908 1.597 1.00 0.00 H HETATM 1217 HMD1 HEC A 71 -2.736 -3.299 3.965 1.00 0.00 H HETATM 1218 HMD2 HEC A 71 -2.886 -1.660 3.348 1.00 0.00 H HETATM 1219 HMD3 HEC A 71 -1.387 -2.177 4.161 1.00 0.00 H HETATM 1220 HAD1 HEC A 71 -1.921 -4.206 6.109 1.00 0.00 H HETATM 1221 HAD2 HEC A 71 -2.753 -4.453 7.625 1.00 0.00 H HETATM 1222 HBD1 HEC A 71 -4.632 -5.344 6.614 1.00 0.00 H HETATM 1223 HBD2 HEC A 71 -4.427 -4.391 5.125 1.00 0.00 H