ATOM 1 N ALA A 1 -2.528 -11.066 -9.118 1.00 0.00 N ATOM 2 CA ALA A 1 -3.834 -10.880 -9.779 1.00 0.00 C ATOM 3 C ALA A 1 -4.154 -9.399 -9.996 1.00 0.00 C ATOM 4 O ALA A 1 -5.314 -9.020 -9.880 1.00 0.00 O ATOM 5 CB ALA A 1 -4.936 -11.511 -8.922 1.00 0.00 C ATOM 6 H1 ALA A 1 -2.538 -10.606 -8.214 1.00 0.00 H ATOM 7 H2 ALA A 1 -2.351 -12.056 -8.992 1.00 0.00 H ATOM 8 H3 ALA A 1 -1.797 -10.663 -9.694 1.00 0.00 H ATOM 9 HA ALA A 1 -3.816 -11.382 -10.748 1.00 0.00 H ATOM 10 HB1 ALA A 1 -4.683 -12.541 -8.670 1.00 0.00 H ATOM 11 HB2 ALA A 1 -5.055 -10.923 -8.007 1.00 0.00 H ATOM 12 HB3 ALA A 1 -5.882 -11.502 -9.466 1.00 0.00 H ATOM 13 N ASP A 2 -3.143 -8.556 -10.249 1.00 0.00 N ATOM 14 CA ASP A 2 -3.279 -7.123 -10.518 1.00 0.00 C ATOM 15 C ASP A 2 -3.799 -6.261 -9.352 1.00 0.00 C ATOM 16 O ASP A 2 -3.379 -5.112 -9.213 1.00 0.00 O ATOM 17 CB ASP A 2 -4.034 -6.910 -11.838 1.00 0.00 C ATOM 18 CG ASP A 2 -3.308 -7.524 -13.032 1.00 0.00 C ATOM 19 OD1 ASP A 2 -2.334 -8.281 -12.809 1.00 0.00 O ATOM 20 OD2 ASP A 2 -3.719 -7.209 -14.170 1.00 0.00 O ATOM 21 H ASP A 2 -2.321 -8.915 -10.716 1.00 0.00 H ATOM 22 HA ASP A 2 -2.262 -6.767 -10.688 1.00 0.00 H ATOM 23 HB2 ASP A 2 -5.035 -7.335 -11.780 1.00 0.00 H ATOM 24 HB3 ASP A 2 -4.143 -5.842 -12.020 1.00 0.00 H ATOM 25 N VAL A 3 -4.646 -6.811 -8.488 1.00 0.00 N ATOM 26 CA VAL A 3 -5.174 -6.220 -7.273 1.00 0.00 C ATOM 27 C VAL A 3 -5.130 -7.328 -6.216 1.00 0.00 C ATOM 28 O VAL A 3 -5.172 -8.507 -6.575 1.00 0.00 O ATOM 29 CB VAL A 3 -6.598 -5.696 -7.550 1.00 0.00 C ATOM 30 CG1 VAL A 3 -7.585 -6.816 -7.912 1.00 0.00 C ATOM 31 CG2 VAL A 3 -7.156 -4.884 -6.378 1.00 0.00 C ATOM 32 H VAL A 3 -4.940 -7.765 -8.643 1.00 0.00 H ATOM 33 HA VAL A 3 -4.537 -5.395 -6.955 1.00 0.00 H ATOM 34 HB VAL A 3 -6.540 -5.019 -8.405 1.00 0.00 H ATOM 35 HG11 VAL A 3 -7.225 -7.381 -8.771 1.00 0.00 H ATOM 36 HG12 VAL A 3 -7.725 -7.494 -7.069 1.00 0.00 H ATOM 37 HG13 VAL A 3 -8.550 -6.380 -8.170 1.00 0.00 H ATOM 38 HG21 VAL A 3 -6.506 -4.030 -6.187 1.00 0.00 H ATOM 39 HG22 VAL A 3 -8.147 -4.510 -6.634 1.00 0.00 H ATOM 40 HG23 VAL A 3 -7.232 -5.497 -5.479 1.00 0.00 H ATOM 41 N VAL A 4 -4.998 -6.968 -4.937 1.00 0.00 N ATOM 42 CA VAL A 4 -4.986 -7.899 -3.814 1.00 0.00 C ATOM 43 C VAL A 4 -5.767 -7.257 -2.658 1.00 0.00 C ATOM 44 O VAL A 4 -5.189 -6.737 -1.708 1.00 0.00 O ATOM 45 CB VAL A 4 -3.540 -8.286 -3.427 1.00 0.00 C ATOM 46 CG1 VAL A 4 -3.556 -9.459 -2.438 1.00 0.00 C ATOM 47 CG2 VAL A 4 -2.682 -8.704 -4.630 1.00 0.00 C ATOM 48 H VAL A 4 -4.941 -5.978 -4.726 1.00 0.00 H ATOM 49 HA VAL A 4 -5.510 -8.812 -4.099 1.00 0.00 H ATOM 50 HB VAL A 4 -3.045 -7.438 -2.953 1.00 0.00 H ATOM 51 HG11 VAL A 4 -4.181 -9.225 -1.578 1.00 0.00 H ATOM 52 HG12 VAL A 4 -3.951 -10.352 -2.923 1.00 0.00 H ATOM 53 HG13 VAL A 4 -2.543 -9.663 -2.089 1.00 0.00 H ATOM 54 HG21 VAL A 4 -3.153 -9.533 -5.158 1.00 0.00 H ATOM 55 HG22 VAL A 4 -2.545 -7.867 -5.314 1.00 0.00 H ATOM 56 HG23 VAL A 4 -1.697 -9.021 -4.285 1.00 0.00 H ATOM 57 N THR A 5 -7.096 -7.245 -2.760 1.00 0.00 N ATOM 58 CA THR A 5 -7.976 -6.746 -1.714 1.00 0.00 C ATOM 59 C THR A 5 -7.792 -7.532 -0.409 1.00 0.00 C ATOM 60 O THR A 5 -7.472 -8.719 -0.452 1.00 0.00 O ATOM 61 CB THR A 5 -9.418 -6.848 -2.232 1.00 0.00 C ATOM 62 OG1 THR A 5 -9.446 -6.393 -3.574 1.00 0.00 O ATOM 63 CG2 THR A 5 -10.408 -6.027 -1.401 1.00 0.00 C ATOM 64 H THR A 5 -7.546 -7.578 -3.599 1.00 0.00 H ATOM 65 HA THR A 5 -7.725 -5.701 -1.537 1.00 0.00 H ATOM 66 HB THR A 5 -9.726 -7.897 -2.211 1.00 0.00 H ATOM 67 HG1 THR A 5 -10.343 -6.472 -3.908 1.00 0.00 H ATOM 68 HG21 THR A 5 -10.113 -4.979 -1.391 1.00 0.00 H ATOM 69 HG22 THR A 5 -11.407 -6.112 -1.830 1.00 0.00 H ATOM 70 HG23 THR A 5 -10.445 -6.402 -0.377 1.00 0.00 H ATOM 71 N TYR A 6 -8.012 -6.872 0.732 1.00 0.00 N ATOM 72 CA TYR A 6 -8.075 -7.501 2.045 1.00 0.00 C ATOM 73 C TYR A 6 -9.158 -6.812 2.879 1.00 0.00 C ATOM 74 O TYR A 6 -9.548 -5.676 2.599 1.00 0.00 O ATOM 75 CB TYR A 6 -6.718 -7.395 2.751 1.00 0.00 C ATOM 76 CG TYR A 6 -5.621 -8.282 2.197 1.00 0.00 C ATOM 77 CD1 TYR A 6 -5.533 -9.623 2.612 1.00 0.00 C ATOM 78 CD2 TYR A 6 -4.627 -7.744 1.360 1.00 0.00 C ATOM 79 CE1 TYR A 6 -4.438 -10.414 2.219 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.527 -8.531 0.978 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.428 -9.861 1.413 1.00 0.00 C ATOM 82 OH TYR A 6 -2.359 -10.620 1.039 1.00 0.00 O ATOM 83 H TYR A 6 -8.288 -5.894 0.699 1.00 0.00 H ATOM 84 HA TYR A 6 -8.351 -8.552 1.940 1.00 0.00 H ATOM 85 HB2 TYR A 6 -6.389 -6.359 2.710 1.00 0.00 H ATOM 86 HB3 TYR A 6 -6.842 -7.646 3.806 1.00 0.00 H ATOM 87 HD1 TYR A 6 -6.292 -10.042 3.256 1.00 0.00 H ATOM 88 HD2 TYR A 6 -4.699 -6.722 1.020 1.00 0.00 H ATOM 89 HE1 TYR A 6 -4.376 -11.438 2.556 1.00 0.00 H ATOM 90 HE2 TYR A 6 -2.767 -8.116 0.334 1.00 0.00 H ATOM 91 HH TYR A 6 -2.405 -11.510 1.390 1.00 0.00 H ATOM 92 N GLU A 7 -9.612 -7.497 3.931 1.00 0.00 N ATOM 93 CA GLU A 7 -10.637 -7.042 4.854 1.00 0.00 C ATOM 94 C GLU A 7 -10.013 -6.962 6.247 1.00 0.00 C ATOM 95 O GLU A 7 -9.230 -7.838 6.612 1.00 0.00 O ATOM 96 CB GLU A 7 -11.824 -8.014 4.822 1.00 0.00 C ATOM 97 CG GLU A 7 -12.422 -8.174 3.411 1.00 0.00 C ATOM 98 CD GLU A 7 -11.572 -9.034 2.482 1.00 0.00 C ATOM 99 OE1 GLU A 7 -11.208 -10.148 2.915 1.00 0.00 O ATOM 100 OE2 GLU A 7 -11.278 -8.548 1.368 1.00 0.00 O ATOM 101 H GLU A 7 -9.254 -8.428 4.088 1.00 0.00 H ATOM 102 HA GLU A 7 -10.999 -6.059 4.568 1.00 0.00 H ATOM 103 HB2 GLU A 7 -11.516 -8.992 5.196 1.00 0.00 H ATOM 104 HB3 GLU A 7 -12.598 -7.619 5.482 1.00 0.00 H ATOM 105 HG2 GLU A 7 -13.398 -8.650 3.492 1.00 0.00 H ATOM 106 HG3 GLU A 7 -12.546 -7.194 2.956 1.00 0.00 H ATOM 107 N ASN A 8 -10.317 -5.913 7.019 1.00 0.00 N ATOM 108 CA ASN A 8 -9.705 -5.674 8.320 1.00 0.00 C ATOM 109 C ASN A 8 -10.698 -5.017 9.279 1.00 0.00 C ATOM 110 O ASN A 8 -11.749 -4.522 8.878 1.00 0.00 O ATOM 111 CB ASN A 8 -8.425 -4.841 8.151 1.00 0.00 C ATOM 112 CG ASN A 8 -8.693 -3.411 7.682 1.00 0.00 C ATOM 113 OD1 ASN A 8 -9.111 -2.567 8.475 1.00 0.00 O ATOM 114 ND2 ASN A 8 -8.431 -3.116 6.408 1.00 0.00 N ATOM 115 H ASN A 8 -10.964 -5.200 6.689 1.00 0.00 H ATOM 116 HA ASN A 8 -9.421 -6.631 8.761 1.00 0.00 H ATOM 117 HB2 ASN A 8 -7.908 -4.788 9.110 1.00 0.00 H ATOM 118 HB3 ASN A 8 -7.766 -5.343 7.444 1.00 0.00 H ATOM 119 HD21 ASN A 8 -8.188 -3.857 5.767 1.00 0.00 H ATOM 120 HD22 ASN A 8 -8.583 -2.185 6.043 1.00 0.00 H ATOM 121 N LYS A 9 -10.377 -5.014 10.575 1.00 0.00 N ATOM 122 CA LYS A 9 -11.269 -4.509 11.616 1.00 0.00 C ATOM 123 C LYS A 9 -11.698 -3.060 11.357 1.00 0.00 C ATOM 124 O LYS A 9 -12.842 -2.703 11.639 1.00 0.00 O ATOM 125 CB LYS A 9 -10.592 -4.655 12.990 1.00 0.00 C ATOM 126 CG LYS A 9 -11.166 -5.783 13.862 1.00 0.00 C ATOM 127 CD LYS A 9 -12.124 -5.276 14.952 1.00 0.00 C ATOM 128 CE LYS A 9 -13.323 -4.508 14.379 1.00 0.00 C ATOM 129 NZ LYS A 9 -14.294 -4.128 15.426 1.00 0.00 N ATOM 130 H LYS A 9 -9.502 -5.434 10.857 1.00 0.00 H ATOM 131 HA LYS A 9 -12.178 -5.112 11.592 1.00 0.00 H ATOM 132 HB2 LYS A 9 -9.551 -4.901 12.814 1.00 0.00 H ATOM 133 HB3 LYS A 9 -10.604 -3.713 13.541 1.00 0.00 H ATOM 134 HG2 LYS A 9 -11.639 -6.549 13.245 1.00 0.00 H ATOM 135 HG3 LYS A 9 -10.322 -6.257 14.371 1.00 0.00 H ATOM 136 HD2 LYS A 9 -12.469 -6.146 15.516 1.00 0.00 H ATOM 137 HD3 LYS A 9 -11.556 -4.631 15.627 1.00 0.00 H ATOM 138 HE2 LYS A 9 -12.967 -3.590 13.914 1.00 0.00 H ATOM 139 HE3 LYS A 9 -13.823 -5.116 13.623 1.00 0.00 H ATOM 140 HZ1 LYS A 9 -13.847 -3.543 16.117 1.00 0.00 H ATOM 141 HZ2 LYS A 9 -15.056 -3.613 15.007 1.00 0.00 H ATOM 142 HZ3 LYS A 9 -14.665 -4.953 15.877 1.00 0.00 H ATOM 143 N LYS A 10 -10.796 -2.217 10.844 1.00 0.00 N ATOM 144 CA LYS A 10 -11.119 -0.826 10.565 1.00 0.00 C ATOM 145 C LYS A 10 -11.876 -0.658 9.247 1.00 0.00 C ATOM 146 O LYS A 10 -12.371 0.445 9.022 1.00 0.00 O ATOM 147 CB LYS A 10 -9.860 0.060 10.644 1.00 0.00 C ATOM 148 CG LYS A 10 -9.671 0.640 12.049 1.00 0.00 C ATOM 149 CD LYS A 10 -10.132 2.106 12.180 1.00 0.00 C ATOM 150 CE LYS A 10 -11.643 2.371 12.016 1.00 0.00 C ATOM 151 NZ LYS A 10 -12.078 2.567 10.611 1.00 0.00 N ATOM 152 H LYS A 10 -9.902 -2.575 10.530 1.00 0.00 H ATOM 153 HA LYS A 10 -11.812 -0.474 11.329 1.00 0.00 H ATOM 154 HB2 LYS A 10 -8.981 -0.535 10.388 1.00 0.00 H ATOM 155 HB3 LYS A 10 -9.902 0.897 9.949 1.00 0.00 H ATOM 156 HG2 LYS A 10 -10.147 0.006 12.800 1.00 0.00 H ATOM 157 HG3 LYS A 10 -8.601 0.620 12.254 1.00 0.00 H ATOM 158 HD2 LYS A 10 -9.865 2.413 13.194 1.00 0.00 H ATOM 159 HD3 LYS A 10 -9.559 2.731 11.492 1.00 0.00 H ATOM 160 HE2 LYS A 10 -12.216 1.569 12.483 1.00 0.00 H ATOM 161 HE3 LYS A 10 -11.873 3.295 12.551 1.00 0.00 H ATOM 162 HZ1 LYS A 10 -11.544 3.291 10.153 1.00 0.00 H ATOM 163 HZ2 LYS A 10 -11.993 1.716 10.064 1.00 0.00 H ATOM 164 HZ3 LYS A 10 -13.055 2.827 10.578 1.00 0.00 H ATOM 165 N GLY A 11 -11.994 -1.685 8.404 1.00 0.00 N ATOM 166 CA GLY A 11 -12.752 -1.615 7.165 1.00 0.00 C ATOM 167 C GLY A 11 -12.119 -2.524 6.124 1.00 0.00 C ATOM 168 O GLY A 11 -11.315 -3.384 6.467 1.00 0.00 O ATOM 169 H GLY A 11 -11.559 -2.584 8.602 1.00 0.00 H ATOM 170 HA2 GLY A 11 -13.772 -1.950 7.346 1.00 0.00 H ATOM 171 HA3 GLY A 11 -12.759 -0.597 6.783 1.00 0.00 H ATOM 172 N ASN A 12 -12.446 -2.331 4.849 1.00 0.00 N ATOM 173 CA ASN A 12 -11.810 -3.092 3.777 1.00 0.00 C ATOM 174 C ASN A 12 -10.789 -2.209 3.076 1.00 0.00 C ATOM 175 O ASN A 12 -10.958 -0.987 3.048 1.00 0.00 O ATOM 176 CB ASN A 12 -12.858 -3.646 2.802 1.00 0.00 C ATOM 177 CG ASN A 12 -13.744 -4.723 3.426 1.00 0.00 C ATOM 178 OD1 ASN A 12 -13.726 -4.956 4.632 1.00 0.00 O ATOM 179 ND2 ASN A 12 -14.544 -5.399 2.607 1.00 0.00 N ATOM 180 H ASN A 12 -13.106 -1.602 4.611 1.00 0.00 H ATOM 181 HA ASN A 12 -11.247 -3.933 4.180 1.00 0.00 H ATOM 182 HB2 ASN A 12 -13.482 -2.831 2.434 1.00 0.00 H ATOM 183 HB3 ASN A 12 -12.334 -4.095 1.955 1.00 0.00 H ATOM 184 HD21 ASN A 12 -14.524 -5.232 1.614 1.00 0.00 H ATOM 185 HD22 ASN A 12 -15.092 -6.153 2.995 1.00 0.00 H ATOM 186 N VAL A 13 -9.734 -2.836 2.541 1.00 0.00 N ATOM 187 CA VAL A 13 -8.630 -2.178 1.863 1.00 0.00 C ATOM 188 C VAL A 13 -8.390 -2.847 0.509 1.00 0.00 C ATOM 189 O VAL A 13 -8.437 -4.070 0.394 1.00 0.00 O ATOM 190 CB VAL A 13 -7.360 -2.223 2.733 1.00 0.00 C ATOM 191 CG1 VAL A 13 -6.860 -3.635 3.051 1.00 0.00 C ATOM 192 CG2 VAL A 13 -6.236 -1.424 2.064 1.00 0.00 C ATOM 193 H VAL A 13 -9.695 -3.853 2.563 1.00 0.00 H ATOM 194 HA VAL A 13 -8.893 -1.127 1.718 1.00 0.00 H ATOM 195 HB VAL A 13 -7.583 -1.767 3.690 1.00 0.00 H ATOM 196 HG11 VAL A 13 -7.645 -4.221 3.525 1.00 0.00 H ATOM 197 HG12 VAL A 13 -6.521 -4.137 2.145 1.00 0.00 H ATOM 198 HG13 VAL A 13 -6.026 -3.562 3.746 1.00 0.00 H ATOM 199 HG21 VAL A 13 -6.606 -0.450 1.747 1.00 0.00 H ATOM 200 HG22 VAL A 13 -5.420 -1.282 2.770 1.00 0.00 H ATOM 201 HG23 VAL A 13 -5.858 -1.953 1.191 1.00 0.00 H ATOM 202 N THR A 14 -8.097 -2.040 -0.510 1.00 0.00 N ATOM 203 CA THR A 14 -7.644 -2.498 -1.813 1.00 0.00 C ATOM 204 C THR A 14 -6.134 -2.268 -1.888 1.00 0.00 C ATOM 205 O THR A 14 -5.699 -1.117 -1.873 1.00 0.00 O ATOM 206 CB THR A 14 -8.405 -1.722 -2.899 1.00 0.00 C ATOM 207 OG1 THR A 14 -9.789 -1.754 -2.610 1.00 0.00 O ATOM 208 CG2 THR A 14 -8.180 -2.323 -4.288 1.00 0.00 C ATOM 209 H THR A 14 -8.105 -1.044 -0.362 1.00 0.00 H ATOM 210 HA THR A 14 -7.864 -3.554 -1.949 1.00 0.00 H ATOM 211 HB THR A 14 -8.081 -0.680 -2.912 1.00 0.00 H ATOM 212 HG1 THR A 14 -10.063 -2.668 -2.506 1.00 0.00 H ATOM 213 HG21 THR A 14 -8.484 -3.370 -4.301 1.00 0.00 H ATOM 214 HG22 THR A 14 -8.771 -1.773 -5.022 1.00 0.00 H ATOM 215 HG23 THR A 14 -7.129 -2.244 -4.567 1.00 0.00 H ATOM 216 N PHE A 15 -5.322 -3.330 -1.958 1.00 0.00 N ATOM 217 CA PHE A 15 -3.958 -3.172 -2.452 1.00 0.00 C ATOM 218 C PHE A 15 -4.084 -3.233 -3.963 1.00 0.00 C ATOM 219 O PHE A 15 -4.570 -4.238 -4.480 1.00 0.00 O ATOM 220 CB PHE A 15 -3.012 -4.312 -2.046 1.00 0.00 C ATOM 221 CG PHE A 15 -2.610 -4.480 -0.595 1.00 0.00 C ATOM 222 CD1 PHE A 15 -3.412 -3.994 0.453 1.00 0.00 C ATOM 223 CD2 PHE A 15 -1.547 -5.356 -0.304 1.00 0.00 C ATOM 224 CE1 PHE A 15 -3.207 -4.449 1.763 1.00 0.00 C ATOM 225 CE2 PHE A 15 -1.343 -5.810 1.010 1.00 0.00 C ATOM 226 CZ PHE A 15 -2.207 -5.393 2.034 1.00 0.00 C ATOM 227 H PHE A 15 -5.701 -4.268 -1.925 1.00 0.00 H ATOM 228 HA PHE A 15 -3.519 -2.225 -2.137 1.00 0.00 H ATOM 229 HB2 PHE A 15 -3.439 -5.252 -2.382 1.00 0.00 H ATOM 230 HB3 PHE A 15 -2.092 -4.165 -2.612 1.00 0.00 H ATOM 231 HD1 PHE A 15 -4.272 -3.379 0.263 1.00 0.00 H ATOM 232 HD2 PHE A 15 -0.974 -5.796 -1.108 1.00 0.00 H ATOM 233 HE1 PHE A 15 -3.933 -4.210 2.523 1.00 0.00 H ATOM 234 HE2 PHE A 15 -0.628 -6.594 1.205 1.00 0.00 H ATOM 235 HZ PHE A 15 -2.196 -5.890 2.995 1.00 0.00 H ATOM 236 N ASP A 16 -3.607 -2.217 -4.672 1.00 0.00 N ATOM 237 CA ASP A 16 -3.416 -2.342 -6.100 1.00 0.00 C ATOM 238 C ASP A 16 -2.032 -2.951 -6.268 1.00 0.00 C ATOM 239 O ASP A 16 -1.148 -2.669 -5.458 1.00 0.00 O ATOM 240 CB ASP A 16 -3.558 -0.967 -6.751 1.00 0.00 C ATOM 241 CG ASP A 16 -5.020 -0.550 -6.777 1.00 0.00 C ATOM 242 OD1 ASP A 16 -5.765 -1.170 -7.567 1.00 0.00 O ATOM 243 OD2 ASP A 16 -5.365 0.351 -5.984 1.00 0.00 O ATOM 244 H ASP A 16 -3.126 -1.453 -4.220 1.00 0.00 H ATOM 245 HA ASP A 16 -4.156 -3.006 -6.549 1.00 0.00 H ATOM 246 HB2 ASP A 16 -3.004 -0.206 -6.214 1.00 0.00 H ATOM 247 HB3 ASP A 16 -3.176 -1.013 -7.765 1.00 0.00 H ATOM 248 N HIS A 17 -1.832 -3.808 -7.265 1.00 0.00 N ATOM 249 CA HIS A 17 -0.530 -4.403 -7.513 1.00 0.00 C ATOM 250 C HIS A 17 -0.065 -3.939 -8.886 1.00 0.00 C ATOM 251 O HIS A 17 0.906 -3.189 -8.983 1.00 0.00 O ATOM 252 CB HIS A 17 -0.616 -5.926 -7.313 1.00 0.00 C ATOM 253 CG HIS A 17 0.674 -6.582 -6.869 1.00 0.00 C ATOM 254 ND1 HIS A 17 1.191 -7.761 -7.355 1.00 0.00 N ATOM 255 CD2 HIS A 17 1.562 -6.102 -5.940 1.00 0.00 C ATOM 256 CE1 HIS A 17 2.382 -7.958 -6.765 1.00 0.00 C ATOM 257 NE2 HIS A 17 2.666 -6.963 -5.908 1.00 0.00 N ATOM 258 H HIS A 17 -2.600 -4.069 -7.876 1.00 0.00 H ATOM 259 HA HIS A 17 0.199 -4.005 -6.811 1.00 0.00 H ATOM 260 HB2 HIS A 17 -1.349 -6.119 -6.530 1.00 0.00 H ATOM 261 HB3 HIS A 17 -0.978 -6.397 -8.226 1.00 0.00 H ATOM 262 HD1 HIS A 17 0.784 -8.347 -8.068 1.00 0.00 H ATOM 263 HD2 HIS A 17 1.457 -5.186 -5.380 1.00 0.00 H ATOM 264 HE1 HIS A 17 3.049 -8.772 -7.010 1.00 0.00 H ATOM 265 N LYS A 18 -0.816 -4.281 -9.937 1.00 0.00 N ATOM 266 CA LYS A 18 -0.573 -3.720 -11.257 1.00 0.00 C ATOM 267 C LYS A 18 -0.881 -2.233 -11.205 1.00 0.00 C ATOM 268 O LYS A 18 -0.017 -1.425 -11.513 1.00 0.00 O ATOM 269 CB LYS A 18 -1.404 -4.408 -12.346 1.00 0.00 C ATOM 270 CG LYS A 18 -1.190 -3.722 -13.710 1.00 0.00 C ATOM 271 CD LYS A 18 -2.014 -4.374 -14.823 1.00 0.00 C ATOM 272 CE LYS A 18 -1.333 -5.635 -15.371 1.00 0.00 C ATOM 273 NZ LYS A 18 -2.268 -6.432 -16.186 1.00 0.00 N ATOM 274 H LYS A 18 -1.700 -4.743 -9.753 1.00 0.00 H ATOM 275 HA LYS A 18 0.478 -3.862 -11.508 1.00 0.00 H ATOM 276 HB2 LYS A 18 -1.111 -5.456 -12.403 1.00 0.00 H ATOM 277 HB3 LYS A 18 -2.460 -4.345 -12.081 1.00 0.00 H ATOM 278 HG2 LYS A 18 -1.527 -2.683 -13.660 1.00 0.00 H ATOM 279 HG3 LYS A 18 -0.133 -3.715 -13.979 1.00 0.00 H ATOM 280 HD2 LYS A 18 -3.008 -4.604 -14.431 1.00 0.00 H ATOM 281 HD3 LYS A 18 -2.124 -3.643 -15.630 1.00 0.00 H ATOM 282 HE2 LYS A 18 -0.468 -5.345 -15.971 1.00 0.00 H ATOM 283 HE3 LYS A 18 -0.996 -6.265 -14.546 1.00 0.00 H ATOM 284 HZ1 LYS A 18 -2.678 -5.880 -16.923 1.00 0.00 H ATOM 285 HZ2 LYS A 18 -1.807 -7.246 -16.563 1.00 0.00 H ATOM 286 HZ3 LYS A 18 -3.007 -6.760 -15.563 1.00 0.00 H ATOM 287 N ALA A 19 -2.112 -1.876 -10.826 1.00 0.00 N ATOM 288 CA ALA A 19 -2.595 -0.502 -10.899 1.00 0.00 C ATOM 289 C ALA A 19 -1.686 0.483 -10.151 1.00 0.00 C ATOM 290 O ALA A 19 -1.563 1.630 -10.573 1.00 0.00 O ATOM 291 CB ALA A 19 -4.062 -0.434 -10.464 1.00 0.00 C ATOM 292 H ALA A 19 -2.770 -2.600 -10.573 1.00 0.00 H ATOM 293 HA ALA A 19 -2.578 -0.200 -11.947 1.00 0.00 H ATOM 294 HB1 ALA A 19 -4.243 -1.075 -9.607 1.00 0.00 H ATOM 295 HB2 ALA A 19 -4.340 0.591 -10.218 1.00 0.00 H ATOM 296 HB3 ALA A 19 -4.696 -0.785 -11.280 1.00 0.00 H ATOM 297 N HIS A 20 -0.999 0.040 -9.090 1.00 0.00 N ATOM 298 CA HIS A 20 0.115 0.810 -8.531 1.00 0.00 C ATOM 299 C HIS A 20 1.345 0.673 -9.441 1.00 0.00 C ATOM 300 O HIS A 20 1.907 1.682 -9.864 1.00 0.00 O ATOM 301 CB HIS A 20 0.481 0.327 -7.120 1.00 0.00 C ATOM 302 CG HIS A 20 -0.304 0.845 -5.936 1.00 0.00 C ATOM 303 ND1 HIS A 20 -0.854 0.026 -4.984 1.00 0.00 N ATOM 304 CD2 HIS A 20 -0.231 2.099 -5.374 1.00 0.00 C ATOM 305 CE1 HIS A 20 -1.169 0.763 -3.914 1.00 0.00 C ATOM 306 NE2 HIS A 20 -0.793 2.039 -4.086 1.00 0.00 N ATOM 307 H HIS A 20 -1.123 -0.927 -8.816 1.00 0.00 H ATOM 308 HA HIS A 20 -0.120 1.880 -8.496 1.00 0.00 H ATOM 309 HB2 HIS A 20 0.482 -0.764 -7.103 1.00 0.00 H ATOM 310 HB3 HIS A 20 1.494 0.660 -6.940 1.00 0.00 H ATOM 311 HD1 HIS A 20 -0.953 -0.975 -5.057 1.00 0.00 H ATOM 312 HD2 HIS A 20 0.259 2.953 -5.811 1.00 0.00 H ATOM 313 HE1 HIS A 20 -1.616 0.345 -3.028 1.00 0.00 H ATOM 314 N ALA A 21 1.813 -0.552 -9.706 1.00 0.00 N ATOM 315 CA ALA A 21 3.014 -0.792 -10.502 1.00 0.00 C ATOM 316 C ALA A 21 3.097 0.049 -11.778 1.00 0.00 C ATOM 317 O ALA A 21 4.194 0.481 -12.115 1.00 0.00 O ATOM 318 CB ALA A 21 3.163 -2.269 -10.853 1.00 0.00 C ATOM 319 H ALA A 21 1.294 -1.368 -9.395 1.00 0.00 H ATOM 320 HA ALA A 21 3.868 -0.529 -9.878 1.00 0.00 H ATOM 321 HB1 ALA A 21 3.195 -2.873 -9.948 1.00 0.00 H ATOM 322 HB2 ALA A 21 2.342 -2.590 -11.489 1.00 0.00 H ATOM 323 HB3 ALA A 21 4.096 -2.395 -11.400 1.00 0.00 H ATOM 324 N GLU A 22 1.982 0.295 -12.474 1.00 0.00 N ATOM 325 CA GLU A 22 1.980 1.125 -13.676 1.00 0.00 C ATOM 326 C GLU A 22 2.684 2.465 -13.443 1.00 0.00 C ATOM 327 O GLU A 22 3.359 2.966 -14.340 1.00 0.00 O ATOM 328 CB GLU A 22 0.556 1.353 -14.205 1.00 0.00 C ATOM 329 CG GLU A 22 -0.246 0.049 -14.267 1.00 0.00 C ATOM 330 CD GLU A 22 -1.376 0.070 -15.288 1.00 0.00 C ATOM 331 OE1 GLU A 22 -1.871 1.181 -15.573 1.00 0.00 O ATOM 332 OE2 GLU A 22 -1.732 -1.040 -15.742 1.00 0.00 O ATOM 333 H GLU A 22 1.114 -0.142 -12.181 1.00 0.00 H ATOM 334 HA GLU A 22 2.535 0.586 -14.446 1.00 0.00 H ATOM 335 HB2 GLU A 22 0.018 2.066 -13.577 1.00 0.00 H ATOM 336 HB3 GLU A 22 0.634 1.777 -15.208 1.00 0.00 H ATOM 337 HG2 GLU A 22 0.412 -0.789 -14.493 1.00 0.00 H ATOM 338 HG3 GLU A 22 -0.714 -0.093 -13.303 1.00 0.00 H ATOM 339 N LYS A 23 2.519 3.047 -12.248 1.00 0.00 N ATOM 340 CA LYS A 23 3.123 4.309 -11.879 1.00 0.00 C ATOM 341 C LYS A 23 4.365 4.113 -10.994 1.00 0.00 C ATOM 342 O LYS A 23 5.354 4.820 -11.166 1.00 0.00 O ATOM 343 CB LYS A 23 2.019 5.241 -11.357 1.00 0.00 C ATOM 344 CG LYS A 23 1.435 4.997 -9.967 1.00 0.00 C ATOM 345 CD LYS A 23 0.007 5.537 -9.849 1.00 0.00 C ATOM 346 CE LYS A 23 -1.030 4.527 -10.368 1.00 0.00 C ATOM 347 NZ LYS A 23 -2.314 5.143 -10.768 1.00 0.00 N ATOM 348 H LYS A 23 1.979 2.579 -11.532 1.00 0.00 H ATOM 349 HA LYS A 23 3.492 4.799 -12.778 1.00 0.00 H ATOM 350 HB2 LYS A 23 2.421 6.238 -11.335 1.00 0.00 H ATOM 351 HB3 LYS A 23 1.209 5.219 -12.083 1.00 0.00 H ATOM 352 HG2 LYS A 23 1.422 3.944 -9.716 1.00 0.00 H ATOM 353 HG3 LYS A 23 2.057 5.545 -9.260 1.00 0.00 H ATOM 354 HD2 LYS A 23 -0.162 5.672 -8.782 1.00 0.00 H ATOM 355 HD3 LYS A 23 -0.066 6.501 -10.357 1.00 0.00 H ATOM 356 HE2 LYS A 23 -0.631 3.982 -11.226 1.00 0.00 H ATOM 357 HE3 LYS A 23 -1.225 3.816 -9.565 1.00 0.00 H ATOM 358 HZ1 LYS A 23 -2.699 5.766 -10.058 1.00 0.00 H ATOM 359 HZ2 LYS A 23 -2.202 5.704 -11.599 1.00 0.00 H ATOM 360 HZ3 LYS A 23 -2.995 4.421 -10.952 1.00 0.00 H ATOM 361 N LEU A 24 4.347 3.149 -10.068 1.00 0.00 N ATOM 362 CA LEU A 24 5.458 2.841 -9.185 1.00 0.00 C ATOM 363 C LEU A 24 6.635 2.115 -9.843 1.00 0.00 C ATOM 364 O LEU A 24 7.781 2.506 -9.643 1.00 0.00 O ATOM 365 CB LEU A 24 4.929 1.980 -8.041 1.00 0.00 C ATOM 366 CG LEU A 24 4.310 2.854 -6.955 1.00 0.00 C ATOM 367 CD1 LEU A 24 2.919 3.362 -7.291 1.00 0.00 C ATOM 368 CD2 LEU A 24 4.156 2.044 -5.684 1.00 0.00 C ATOM 369 H LEU A 24 3.477 2.687 -9.837 1.00 0.00 H ATOM 370 HA LEU A 24 5.862 3.775 -8.791 1.00 0.00 H ATOM 371 HB2 LEU A 24 4.177 1.272 -8.367 1.00 0.00 H ATOM 372 HB3 LEU A 24 5.772 1.401 -7.667 1.00 0.00 H ATOM 373 HG LEU A 24 4.943 3.719 -6.826 1.00 0.00 H ATOM 374 HD11 LEU A 24 2.289 2.517 -7.548 1.00 0.00 H ATOM 375 HD12 LEU A 24 2.490 3.883 -6.439 1.00 0.00 H ATOM 376 HD13 LEU A 24 3.005 4.053 -8.113 1.00 0.00 H ATOM 377 HD21 LEU A 24 5.108 1.611 -5.392 1.00 0.00 H ATOM 378 HD22 LEU A 24 3.762 2.662 -4.897 1.00 0.00 H ATOM 379 HD23 LEU A 24 3.421 1.276 -5.863 1.00 0.00 H ATOM 380 N GLY A 25 6.373 1.002 -10.530 1.00 0.00 N ATOM 381 CA GLY A 25 7.418 0.189 -11.136 1.00 0.00 C ATOM 382 C GLY A 25 8.133 -0.747 -10.154 1.00 0.00 C ATOM 383 O GLY A 25 9.356 -0.836 -10.180 1.00 0.00 O ATOM 384 H GLY A 25 5.415 0.809 -10.790 1.00 0.00 H ATOM 385 HA2 GLY A 25 6.986 -0.406 -11.941 1.00 0.00 H ATOM 386 HA3 GLY A 25 8.154 0.869 -11.554 1.00 0.00 H ATOM 387 N CYS A 26 7.368 -1.461 -9.317 1.00 0.00 N ATOM 388 CA CYS A 26 7.814 -2.501 -8.377 1.00 0.00 C ATOM 389 C CYS A 26 8.727 -1.956 -7.272 1.00 0.00 C ATOM 390 O CYS A 26 8.329 -1.915 -6.105 1.00 0.00 O ATOM 391 CB CYS A 26 8.432 -3.728 -9.032 1.00 0.00 C ATOM 392 SG CYS A 26 7.666 -4.330 -10.571 1.00 0.00 S ATOM 393 H CYS A 26 6.378 -1.286 -9.369 1.00 0.00 H ATOM 394 HA CYS A 26 6.918 -2.845 -7.872 1.00 0.00 H ATOM 395 HB2 CYS A 26 9.481 -3.535 -9.255 1.00 0.00 H ATOM 396 HB3 CYS A 26 8.410 -4.539 -8.304 1.00 0.00 H ATOM 397 N ASP A 27 9.935 -1.519 -7.636 1.00 0.00 N ATOM 398 CA ASP A 27 11.026 -1.159 -6.732 1.00 0.00 C ATOM 399 C ASP A 27 10.756 0.129 -5.940 1.00 0.00 C ATOM 400 O ASP A 27 11.602 0.594 -5.182 1.00 0.00 O ATOM 401 CB ASP A 27 12.337 -1.057 -7.526 1.00 0.00 C ATOM 402 CG ASP A 27 12.778 -2.404 -8.087 1.00 0.00 C ATOM 403 OD1 ASP A 27 13.035 -3.311 -7.267 1.00 0.00 O ATOM 404 OD2 ASP A 27 12.843 -2.504 -9.331 1.00 0.00 O ATOM 405 H ASP A 27 10.141 -1.525 -8.633 1.00 0.00 H ATOM 406 HA ASP A 27 11.142 -1.968 -6.014 1.00 0.00 H ATOM 407 HB2 ASP A 27 12.222 -0.338 -8.339 1.00 0.00 H ATOM 408 HB3 ASP A 27 13.131 -0.708 -6.865 1.00 0.00 H ATOM 409 N ALA A 28 9.575 0.728 -6.112 1.00 0.00 N ATOM 410 CA ALA A 28 9.087 1.789 -5.247 1.00 0.00 C ATOM 411 C ALA A 28 8.491 1.205 -3.960 1.00 0.00 C ATOM 412 O ALA A 28 8.538 1.858 -2.920 1.00 0.00 O ATOM 413 CB ALA A 28 8.045 2.603 -6.008 1.00 0.00 C ATOM 414 H ALA A 28 8.947 0.348 -6.800 1.00 0.00 H ATOM 415 HA ALA A 28 9.908 2.458 -4.984 1.00 0.00 H ATOM 416 HB1 ALA A 28 8.450 2.938 -6.963 1.00 0.00 H ATOM 417 HB2 ALA A 28 7.177 1.973 -6.179 1.00 0.00 H ATOM 418 HB3 ALA A 28 7.750 3.473 -5.424 1.00 0.00 H ATOM 419 N CYS A 29 7.899 0.005 -4.033 1.00 0.00 N ATOM 420 CA CYS A 29 7.372 -0.712 -2.874 1.00 0.00 C ATOM 421 C CYS A 29 8.402 -1.745 -2.424 1.00 0.00 C ATOM 422 O CYS A 29 8.771 -1.803 -1.253 1.00 0.00 O ATOM 423 CB CYS A 29 6.075 -1.418 -3.200 1.00 0.00 C ATOM 424 SG CYS A 29 4.680 -0.272 -3.356 1.00 0.00 S ATOM 425 H CYS A 29 7.954 -0.510 -4.905 1.00 0.00 H ATOM 426 HA CYS A 29 7.186 -0.032 -2.042 1.00 0.00 H ATOM 427 HB2 CYS A 29 6.182 -2.007 -4.112 1.00 0.00 H ATOM 428 HB3 CYS A 29 5.848 -2.093 -2.375 1.00 0.00 H ATOM 429 N HIS A 30 8.826 -2.593 -3.362 1.00 0.00 N ATOM 430 CA HIS A 30 9.818 -3.625 -3.138 1.00 0.00 C ATOM 431 C HIS A 30 11.222 -3.044 -3.335 1.00 0.00 C ATOM 432 O HIS A 30 11.380 -1.843 -3.527 1.00 0.00 O ATOM 433 CB HIS A 30 9.524 -4.761 -4.124 1.00 0.00 C ATOM 434 CG HIS A 30 8.198 -5.438 -3.885 1.00 0.00 C ATOM 435 ND1 HIS A 30 7.931 -6.365 -2.903 1.00 0.00 N ATOM 436 CD2 HIS A 30 7.098 -5.365 -4.695 1.00 0.00 C ATOM 437 CE1 HIS A 30 6.694 -6.841 -3.124 1.00 0.00 C ATOM 438 NE2 HIS A 30 6.144 -6.268 -4.208 1.00 0.00 N ATOM 439 H HIS A 30 8.513 -2.464 -4.317 1.00 0.00 H ATOM 440 HA HIS A 30 9.742 -4.010 -2.120 1.00 0.00 H ATOM 441 HB2 HIS A 30 9.556 -4.369 -5.141 1.00 0.00 H ATOM 442 HB3 HIS A 30 10.292 -5.520 -4.041 1.00 0.00 H ATOM 443 HD1 HIS A 30 8.549 -6.633 -2.150 1.00 0.00 H ATOM 444 HD2 HIS A 30 7.014 -4.755 -5.582 1.00 0.00 H ATOM 445 HE1 HIS A 30 6.230 -7.605 -2.520 1.00 0.00 H ATOM 446 N GLU A 31 12.233 -3.913 -3.298 1.00 0.00 N ATOM 447 CA GLU A 31 13.606 -3.674 -3.721 1.00 0.00 C ATOM 448 C GLU A 31 14.169 -5.080 -3.988 1.00 0.00 C ATOM 449 O GLU A 31 13.494 -6.055 -3.643 1.00 0.00 O ATOM 450 CB GLU A 31 14.351 -2.879 -2.625 1.00 0.00 C ATOM 451 CG GLU A 31 15.620 -2.147 -3.093 1.00 0.00 C ATOM 452 CD GLU A 31 16.849 -3.040 -3.138 1.00 0.00 C ATOM 453 OE1 GLU A 31 17.325 -3.417 -2.047 1.00 0.00 O ATOM 454 OE2 GLU A 31 17.257 -3.361 -4.275 1.00 0.00 O ATOM 455 H GLU A 31 12.042 -4.893 -3.125 1.00 0.00 H ATOM 456 HA GLU A 31 13.590 -3.103 -4.651 1.00 0.00 H ATOM 457 HB2 GLU A 31 13.680 -2.094 -2.276 1.00 0.00 H ATOM 458 HB3 GLU A 31 14.586 -3.526 -1.779 1.00 0.00 H ATOM 459 HG2 GLU A 31 15.455 -1.699 -4.074 1.00 0.00 H ATOM 460 HG3 GLU A 31 15.840 -1.345 -2.388 1.00 0.00 H ATOM 461 N GLY A 32 15.353 -5.189 -4.601 1.00 0.00 N ATOM 462 CA GLY A 32 16.155 -6.393 -4.794 1.00 0.00 C ATOM 463 C GLY A 32 15.412 -7.718 -4.624 1.00 0.00 C ATOM 464 O GLY A 32 15.572 -8.383 -3.604 1.00 0.00 O ATOM 465 H GLY A 32 15.865 -4.322 -4.774 1.00 0.00 H ATOM 466 HA2 GLY A 32 16.589 -6.357 -5.793 1.00 0.00 H ATOM 467 HA3 GLY A 32 16.974 -6.360 -4.074 1.00 0.00 H ATOM 468 N THR A 33 14.638 -8.100 -5.648 1.00 0.00 N ATOM 469 CA THR A 33 13.864 -9.334 -5.724 1.00 0.00 C ATOM 470 C THR A 33 12.617 -9.251 -4.824 1.00 0.00 C ATOM 471 O THR A 33 12.719 -9.440 -3.613 1.00 0.00 O ATOM 472 CB THR A 33 14.741 -10.560 -5.421 1.00 0.00 C ATOM 473 OG1 THR A 33 15.914 -10.517 -6.214 1.00 0.00 O ATOM 474 CG2 THR A 33 14.006 -11.871 -5.717 1.00 0.00 C ATOM 475 H THR A 33 14.565 -7.461 -6.420 1.00 0.00 H ATOM 476 HA THR A 33 13.574 -9.428 -6.767 1.00 0.00 H ATOM 477 HB THR A 33 15.025 -10.563 -4.371 1.00 0.00 H ATOM 478 HG1 THR A 33 15.669 -10.347 -7.125 1.00 0.00 H ATOM 479 HG21 THR A 33 13.690 -11.905 -6.760 1.00 0.00 H ATOM 480 HG22 THR A 33 14.676 -12.708 -5.520 1.00 0.00 H ATOM 481 HG23 THR A 33 13.132 -11.966 -5.072 1.00 0.00 H ATOM 482 N PRO A 34 11.426 -8.989 -5.390 1.00 0.00 N ATOM 483 CA PRO A 34 10.218 -8.805 -4.603 1.00 0.00 C ATOM 484 C PRO A 34 9.768 -10.133 -3.989 1.00 0.00 C ATOM 485 O PRO A 34 9.995 -11.200 -4.560 1.00 0.00 O ATOM 486 CB PRO A 34 9.183 -8.255 -5.586 1.00 0.00 C ATOM 487 CG PRO A 34 9.598 -8.898 -6.906 1.00 0.00 C ATOM 488 CD PRO A 34 11.123 -8.899 -6.810 1.00 0.00 C ATOM 489 HA PRO A 34 10.397 -8.076 -3.811 1.00 0.00 H ATOM 490 HB2 PRO A 34 8.162 -8.493 -5.292 1.00 0.00 H ATOM 491 HB3 PRO A 34 9.309 -7.178 -5.682 1.00 0.00 H ATOM 492 HG2 PRO A 34 9.232 -9.925 -6.943 1.00 0.00 H ATOM 493 HG3 PRO A 34 9.243 -8.335 -7.767 1.00 0.00 H ATOM 494 HD2 PRO A 34 11.506 -9.752 -7.373 1.00 0.00 H ATOM 495 HD3 PRO A 34 11.525 -7.966 -7.210 1.00 0.00 H ATOM 496 N ALA A 35 9.117 -10.063 -2.825 1.00 0.00 N ATOM 497 CA ALA A 35 8.666 -11.211 -2.058 1.00 0.00 C ATOM 498 C ALA A 35 7.616 -10.723 -1.058 1.00 0.00 C ATOM 499 O ALA A 35 7.242 -9.549 -1.080 1.00 0.00 O ATOM 500 CB ALA A 35 9.865 -11.857 -1.351 1.00 0.00 C ATOM 501 H ALA A 35 8.888 -9.163 -2.429 1.00 0.00 H ATOM 502 HA ALA A 35 8.204 -11.938 -2.726 1.00 0.00 H ATOM 503 HB1 ALA A 35 10.611 -12.161 -2.085 1.00 0.00 H ATOM 504 HB2 ALA A 35 10.317 -11.146 -0.659 1.00 0.00 H ATOM 505 HB3 ALA A 35 9.549 -12.743 -0.798 1.00 0.00 H ATOM 506 N LYS A 36 7.132 -11.615 -0.189 1.00 0.00 N ATOM 507 CA LYS A 36 6.162 -11.267 0.838 1.00 0.00 C ATOM 508 C LYS A 36 6.791 -10.320 1.867 1.00 0.00 C ATOM 509 O LYS A 36 7.735 -10.683 2.564 1.00 0.00 O ATOM 510 CB LYS A 36 5.508 -12.537 1.418 1.00 0.00 C ATOM 511 CG LYS A 36 5.269 -12.550 2.939 1.00 0.00 C ATOM 512 CD LYS A 36 4.163 -13.543 3.335 1.00 0.00 C ATOM 513 CE LYS A 36 2.735 -13.030 3.056 1.00 0.00 C ATOM 514 NZ LYS A 36 2.371 -11.873 3.897 1.00 0.00 N ATOM 515 H LYS A 36 7.495 -12.555 -0.200 1.00 0.00 H ATOM 516 HA LYS A 36 5.363 -10.726 0.336 1.00 0.00 H ATOM 517 HB2 LYS A 36 4.556 -12.640 0.901 1.00 0.00 H ATOM 518 HB3 LYS A 36 6.110 -13.413 1.176 1.00 0.00 H ATOM 519 HG2 LYS A 36 6.209 -12.857 3.403 1.00 0.00 H ATOM 520 HG3 LYS A 36 5.029 -11.563 3.320 1.00 0.00 H ATOM 521 HD2 LYS A 36 4.319 -14.472 2.782 1.00 0.00 H ATOM 522 HD3 LYS A 36 4.260 -13.775 4.398 1.00 0.00 H ATOM 523 HE2 LYS A 36 2.643 -12.721 2.015 1.00 0.00 H ATOM 524 HE3 LYS A 36 2.025 -13.835 3.244 1.00 0.00 H ATOM 525 HZ1 LYS A 36 2.441 -12.065 4.884 1.00 0.00 H ATOM 526 HZ2 LYS A 36 2.976 -11.094 3.640 1.00 0.00 H ATOM 527 HZ3 LYS A 36 1.447 -11.517 3.680 1.00 0.00 H ATOM 528 N ILE A 37 6.238 -9.109 1.955 1.00 0.00 N ATOM 529 CA ILE A 37 6.669 -8.039 2.852 1.00 0.00 C ATOM 530 C ILE A 37 6.141 -8.247 4.275 1.00 0.00 C ATOM 531 O ILE A 37 6.750 -7.794 5.240 1.00 0.00 O ATOM 532 CB ILE A 37 6.275 -6.670 2.250 1.00 0.00 C ATOM 533 CG1 ILE A 37 7.115 -6.367 0.990 1.00 0.00 C ATOM 534 CG2 ILE A 37 6.430 -5.542 3.280 1.00 0.00 C ATOM 535 CD1 ILE A 37 6.493 -5.275 0.111 1.00 0.00 C ATOM 536 H ILE A 37 5.438 -8.941 1.367 1.00 0.00 H ATOM 537 HA ILE A 37 7.742 -8.099 2.941 1.00 0.00 H ATOM 538 HB ILE A 37 5.223 -6.705 1.970 1.00 0.00 H ATOM 539 HG12 ILE A 37 8.120 -6.058 1.283 1.00 0.00 H ATOM 540 HG13 ILE A 37 7.207 -7.258 0.370 1.00 0.00 H ATOM 541 HG21 ILE A 37 7.439 -5.552 3.691 1.00 0.00 H ATOM 542 HG22 ILE A 37 6.240 -4.571 2.827 1.00 0.00 H ATOM 543 HG23 ILE A 37 5.707 -5.672 4.084 1.00 0.00 H ATOM 544 HD11 ILE A 37 6.335 -4.353 0.665 1.00 0.00 H ATOM 545 HD12 ILE A 37 7.164 -5.055 -0.717 1.00 0.00 H ATOM 546 HD13 ILE A 37 5.541 -5.625 -0.289 1.00 0.00 H ATOM 547 N ALA A 38 5.003 -8.928 4.378 1.00 0.00 N ATOM 548 CA ALA A 38 4.231 -9.172 5.592 1.00 0.00 C ATOM 549 C ALA A 38 3.480 -7.911 6.021 1.00 0.00 C ATOM 550 O ALA A 38 3.898 -7.203 6.937 1.00 0.00 O ATOM 551 CB ALA A 38 5.082 -9.783 6.714 1.00 0.00 C ATOM 552 H ALA A 38 4.620 -9.221 3.487 1.00 0.00 H ATOM 553 HA ALA A 38 3.478 -9.916 5.349 1.00 0.00 H ATOM 554 HB1 ALA A 38 5.624 -10.649 6.336 1.00 0.00 H ATOM 555 HB2 ALA A 38 5.790 -9.060 7.116 1.00 0.00 H ATOM 556 HB3 ALA A 38 4.424 -10.101 7.523 1.00 0.00 H ATOM 557 N ILE A 39 2.352 -7.640 5.361 1.00 0.00 N ATOM 558 CA ILE A 39 1.457 -6.567 5.768 1.00 0.00 C ATOM 559 C ILE A 39 0.571 -7.035 6.928 1.00 0.00 C ATOM 560 O ILE A 39 0.290 -8.224 7.066 1.00 0.00 O ATOM 561 CB ILE A 39 0.660 -6.052 4.557 1.00 0.00 C ATOM 562 CG1 ILE A 39 1.586 -5.436 3.494 1.00 0.00 C ATOM 563 CG2 ILE A 39 -0.401 -5.029 4.972 1.00 0.00 C ATOM 564 CD1 ILE A 39 2.284 -4.134 3.900 1.00 0.00 C ATOM 565 H ILE A 39 2.027 -8.270 4.626 1.00 0.00 H ATOM 566 HA ILE A 39 2.058 -5.743 6.150 1.00 0.00 H ATOM 567 HB ILE A 39 0.143 -6.896 4.096 1.00 0.00 H ATOM 568 HG12 ILE A 39 2.351 -6.166 3.229 1.00 0.00 H ATOM 569 HG13 ILE A 39 0.985 -5.222 2.611 1.00 0.00 H ATOM 570 HG21 ILE A 39 0.009 -4.363 5.724 1.00 0.00 H ATOM 571 HG22 ILE A 39 -0.720 -4.437 4.115 1.00 0.00 H ATOM 572 HG23 ILE A 39 -1.263 -5.547 5.388 1.00 0.00 H ATOM 573 HD11 ILE A 39 2.917 -4.296 4.769 1.00 0.00 H ATOM 574 HD12 ILE A 39 2.912 -3.795 3.076 1.00 0.00 H ATOM 575 HD13 ILE A 39 1.555 -3.355 4.118 1.00 0.00 H ATOM 576 N ASP A 40 0.194 -6.066 7.767 1.00 0.00 N ATOM 577 CA ASP A 40 -0.628 -6.156 8.965 1.00 0.00 C ATOM 578 C ASP A 40 -0.706 -4.711 9.477 1.00 0.00 C ATOM 579 O ASP A 40 -1.384 -3.882 8.880 1.00 0.00 O ATOM 580 CB ASP A 40 -0.025 -7.168 9.959 1.00 0.00 C ATOM 581 CG ASP A 40 -0.518 -6.976 11.385 1.00 0.00 C ATOM 582 OD1 ASP A 40 -1.692 -7.293 11.651 1.00 0.00 O ATOM 583 OD2 ASP A 40 0.296 -6.413 12.153 1.00 0.00 O ATOM 584 H ASP A 40 0.463 -5.127 7.517 1.00 0.00 H ATOM 585 HA ASP A 40 -1.635 -6.480 8.695 1.00 0.00 H ATOM 586 HB2 ASP A 40 -0.299 -8.176 9.644 1.00 0.00 H ATOM 587 HB3 ASP A 40 1.062 -7.093 9.957 1.00 0.00 H ATOM 588 N LYS A 41 0.075 -4.348 10.490 1.00 0.00 N ATOM 589 CA LYS A 41 0.115 -3.021 11.073 1.00 0.00 C ATOM 590 C LYS A 41 1.573 -2.663 11.387 1.00 0.00 C ATOM 591 O LYS A 41 1.842 -1.838 12.259 1.00 0.00 O ATOM 592 CB LYS A 41 -0.768 -3.031 12.330 1.00 0.00 C ATOM 593 CG LYS A 41 -1.285 -1.630 12.677 1.00 0.00 C ATOM 594 CD LYS A 41 -1.651 -1.527 14.161 1.00 0.00 C ATOM 595 CE LYS A 41 -0.381 -1.305 15.000 1.00 0.00 C ATOM 596 NZ LYS A 41 -0.666 -1.259 16.449 1.00 0.00 N ATOM 597 H LYS A 41 0.551 -5.083 11.006 1.00 0.00 H ATOM 598 HA LYS A 41 -0.276 -2.289 10.364 1.00 0.00 H ATOM 599 HB2 LYS A 41 -1.638 -3.669 12.161 1.00 0.00 H ATOM 600 HB3 LYS A 41 -0.195 -3.471 13.147 1.00 0.00 H ATOM 601 HG2 LYS A 41 -0.534 -0.876 12.441 1.00 0.00 H ATOM 602 HG3 LYS A 41 -2.167 -1.435 12.062 1.00 0.00 H ATOM 603 HD2 LYS A 41 -2.330 -0.681 14.287 1.00 0.00 H ATOM 604 HD3 LYS A 41 -2.171 -2.441 14.460 1.00 0.00 H ATOM 605 HE2 LYS A 41 0.337 -2.105 14.815 1.00 0.00 H ATOM 606 HE3 LYS A 41 0.083 -0.362 14.699 1.00 0.00 H ATOM 607 HZ1 LYS A 41 -1.320 -0.516 16.656 1.00 0.00 H ATOM 608 HZ2 LYS A 41 -1.055 -2.141 16.754 1.00 0.00 H ATOM 609 HZ3 LYS A 41 0.191 -1.089 16.957 1.00 0.00 H ATOM 610 N LYS A 42 2.513 -3.287 10.667 1.00 0.00 N ATOM 611 CA LYS A 42 3.945 -3.137 10.871 1.00 0.00 C ATOM 612 C LYS A 42 4.517 -2.182 9.828 1.00 0.00 C ATOM 613 O LYS A 42 5.114 -1.161 10.178 1.00 0.00 O ATOM 614 CB LYS A 42 4.600 -4.531 10.786 1.00 0.00 C ATOM 615 CG LYS A 42 6.139 -4.539 10.892 1.00 0.00 C ATOM 616 CD LYS A 42 6.648 -4.879 12.300 1.00 0.00 C ATOM 617 CE LYS A 42 6.606 -6.398 12.547 1.00 0.00 C ATOM 618 NZ LYS A 42 7.137 -6.768 13.877 1.00 0.00 N ATOM 619 H LYS A 42 2.202 -3.971 9.993 1.00 0.00 H ATOM 620 HA LYS A 42 4.103 -2.687 11.850 1.00 0.00 H ATOM 621 HB2 LYS A 42 4.169 -5.170 11.557 1.00 0.00 H ATOM 622 HB3 LYS A 42 4.339 -4.973 9.823 1.00 0.00 H ATOM 623 HG2 LYS A 42 6.530 -5.279 10.189 1.00 0.00 H ATOM 624 HG3 LYS A 42 6.551 -3.577 10.592 1.00 0.00 H ATOM 625 HD2 LYS A 42 7.683 -4.537 12.371 1.00 0.00 H ATOM 626 HD3 LYS A 42 6.048 -4.342 13.040 1.00 0.00 H ATOM 627 HE2 LYS A 42 5.579 -6.761 12.465 1.00 0.00 H ATOM 628 HE3 LYS A 42 7.207 -6.901 11.787 1.00 0.00 H ATOM 629 HZ1 LYS A 42 8.094 -6.459 13.973 1.00 0.00 H ATOM 630 HZ2 LYS A 42 6.576 -6.354 14.608 1.00 0.00 H ATOM 631 HZ3 LYS A 42 7.112 -7.774 13.983 1.00 0.00 H ATOM 632 N SER A 43 4.384 -2.560 8.555 1.00 0.00 N ATOM 633 CA SER A 43 4.943 -1.830 7.427 1.00 0.00 C ATOM 634 C SER A 43 3.881 -0.863 6.899 1.00 0.00 C ATOM 635 O SER A 43 4.114 0.346 6.826 1.00 0.00 O ATOM 636 CB SER A 43 5.447 -2.833 6.377 1.00 0.00 C ATOM 637 OG SER A 43 6.327 -2.190 5.486 1.00 0.00 O ATOM 638 H SER A 43 3.908 -3.429 8.369 1.00 0.00 H ATOM 639 HA SER A 43 5.806 -1.248 7.758 1.00 0.00 H ATOM 640 HB2 SER A 43 5.999 -3.635 6.872 1.00 0.00 H ATOM 641 HB3 SER A 43 4.620 -3.266 5.819 1.00 0.00 H ATOM 642 HG SER A 43 6.786 -2.839 4.945 1.00 0.00 H ATOM 643 N ALA A 44 2.679 -1.393 6.599 1.00 0.00 N ATOM 644 CA ALA A 44 1.481 -0.644 6.189 1.00 0.00 C ATOM 645 C ALA A 44 1.361 0.682 6.928 1.00 0.00 C ATOM 646 O ALA A 44 1.120 1.753 6.375 1.00 0.00 O ATOM 647 CB ALA A 44 0.237 -1.488 6.488 1.00 0.00 C ATOM 648 H ALA A 44 2.580 -2.393 6.676 1.00 0.00 H ATOM 649 HA ALA A 44 1.490 -0.453 5.124 1.00 0.00 H ATOM 650 HB1 ALA A 44 0.286 -1.943 7.483 1.00 0.00 H ATOM 651 HB2 ALA A 44 -0.657 -0.867 6.423 1.00 0.00 H ATOM 652 HB3 ALA A 44 0.157 -2.263 5.736 1.00 0.00 H ATOM 653 N HIS A 45 1.551 0.543 8.227 1.00 0.00 N ATOM 654 CA HIS A 45 1.255 1.529 9.242 1.00 0.00 C ATOM 655 C HIS A 45 2.459 2.375 9.617 1.00 0.00 C ATOM 656 O HIS A 45 2.437 3.089 10.618 1.00 0.00 O ATOM 657 CB HIS A 45 0.655 0.790 10.427 1.00 0.00 C ATOM 658 CG HIS A 45 -0.837 0.986 10.408 1.00 0.00 C ATOM 659 ND1 HIS A 45 -1.441 1.970 11.145 1.00 0.00 N ATOM 660 CD2 HIS A 45 -1.715 0.615 9.413 1.00 0.00 C ATOM 661 CE1 HIS A 45 -2.662 2.160 10.639 1.00 0.00 C ATOM 662 NE2 HIS A 45 -2.894 1.361 9.580 1.00 0.00 N ATOM 663 H HIS A 45 1.940 -0.351 8.475 1.00 0.00 H ATOM 664 HA HIS A 45 0.521 2.227 8.848 1.00 0.00 H ATOM 665 HB2 HIS A 45 0.995 -0.246 10.397 1.00 0.00 H ATOM 666 HB3 HIS A 45 1.021 1.210 11.365 1.00 0.00 H ATOM 667 HD1 HIS A 45 -1.028 2.478 11.913 1.00 0.00 H ATOM 668 HD2 HIS A 45 -1.516 -0.087 8.617 1.00 0.00 H ATOM 669 HE1 HIS A 45 -3.351 2.854 11.087 1.00 0.00 H ATOM 670 N LYS A 46 3.491 2.306 8.791 1.00 0.00 N ATOM 671 CA LYS A 46 4.712 3.055 8.937 1.00 0.00 C ATOM 672 C LYS A 46 4.986 3.697 7.577 1.00 0.00 C ATOM 673 O LYS A 46 4.339 4.685 7.223 1.00 0.00 O ATOM 674 CB LYS A 46 5.750 2.048 9.454 1.00 0.00 C ATOM 675 CG LYS A 46 7.137 2.622 9.766 1.00 0.00 C ATOM 676 CD LYS A 46 8.169 1.509 10.023 1.00 0.00 C ATOM 677 CE LYS A 46 8.112 0.838 11.404 1.00 0.00 C ATOM 678 NZ LYS A 46 6.811 0.206 11.703 1.00 0.00 N ATOM 679 H LYS A 46 3.446 1.644 8.024 1.00 0.00 H ATOM 680 HA LYS A 46 4.602 3.854 9.670 1.00 0.00 H ATOM 681 HB2 LYS A 46 5.315 1.663 10.369 1.00 0.00 H ATOM 682 HB3 LYS A 46 5.840 1.216 8.755 1.00 0.00 H ATOM 683 HG2 LYS A 46 7.484 3.170 8.888 1.00 0.00 H ATOM 684 HG3 LYS A 46 7.087 3.318 10.602 1.00 0.00 H ATOM 685 HD2 LYS A 46 8.091 0.755 9.235 1.00 0.00 H ATOM 686 HD3 LYS A 46 9.161 1.958 9.921 1.00 0.00 H ATOM 687 HE2 LYS A 46 8.887 0.069 11.432 1.00 0.00 H ATOM 688 HE3 LYS A 46 8.338 1.575 12.178 1.00 0.00 H ATOM 689 HZ1 LYS A 46 6.445 -0.322 10.910 1.00 0.00 H ATOM 690 HZ2 LYS A 46 6.893 -0.414 12.495 1.00 0.00 H ATOM 691 HZ3 LYS A 46 6.132 0.917 11.926 1.00 0.00 H ATOM 692 N ASP A 47 5.911 3.115 6.823 1.00 0.00 N ATOM 693 CA ASP A 47 6.456 3.602 5.572 1.00 0.00 C ATOM 694 C ASP A 47 5.695 3.037 4.373 1.00 0.00 C ATOM 695 O ASP A 47 5.702 3.653 3.310 1.00 0.00 O ATOM 696 CB ASP A 47 7.940 3.206 5.515 1.00 0.00 C ATOM 697 CG ASP A 47 8.154 1.708 5.713 1.00 0.00 C ATOM 698 OD1 ASP A 47 7.743 1.230 6.799 1.00 0.00 O ATOM 699 OD2 ASP A 47 8.707 1.077 4.792 1.00 0.00 O ATOM 700 H ASP A 47 6.366 2.262 7.148 1.00 0.00 H ATOM 701 HA ASP A 47 6.399 4.690 5.543 1.00 0.00 H ATOM 702 HB2 ASP A 47 8.351 3.499 4.548 1.00 0.00 H ATOM 703 HB3 ASP A 47 8.486 3.735 6.295 1.00 0.00 H ATOM 704 N ALA A 48 5.033 1.884 4.516 1.00 0.00 N ATOM 705 CA ALA A 48 4.420 1.235 3.368 1.00 0.00 C ATOM 706 C ALA A 48 3.157 1.962 2.909 1.00 0.00 C ATOM 707 O ALA A 48 3.150 2.535 1.824 1.00 0.00 O ATOM 708 CB ALA A 48 4.145 -0.233 3.668 1.00 0.00 C ATOM 709 H ALA A 48 5.037 1.405 5.412 1.00 0.00 H ATOM 710 HA ALA A 48 5.137 1.253 2.542 1.00 0.00 H ATOM 711 HB1 ALA A 48 5.073 -0.730 3.938 1.00 0.00 H ATOM 712 HB2 ALA A 48 3.454 -0.294 4.497 1.00 0.00 H ATOM 713 HB3 ALA A 48 3.709 -0.723 2.799 1.00 0.00 H ATOM 714 N CYS A 49 2.061 1.897 3.676 1.00 0.00 N ATOM 715 CA CYS A 49 0.785 2.403 3.192 1.00 0.00 C ATOM 716 C CYS A 49 0.642 3.884 3.568 1.00 0.00 C ATOM 717 O CYS A 49 0.696 4.746 2.689 1.00 0.00 O ATOM 718 CB CYS A 49 -0.411 1.570 3.599 1.00 0.00 C ATOM 719 SG CYS A 49 -0.437 -0.208 3.213 1.00 0.00 S ATOM 720 H CYS A 49 2.102 1.529 4.618 1.00 0.00 H ATOM 721 HA CYS A 49 0.793 2.361 2.108 1.00 0.00 H ATOM 722 HB2 CYS A 49 -0.648 1.700 4.653 1.00 0.00 H ATOM 723 HB3 CYS A 49 -1.227 1.962 3.020 1.00 0.00 H ATOM 724 N LYS A 50 0.456 4.230 4.850 1.00 0.00 N ATOM 725 CA LYS A 50 0.335 5.629 5.253 1.00 0.00 C ATOM 726 C LYS A 50 1.678 6.380 5.201 1.00 0.00 C ATOM 727 O LYS A 50 2.136 6.867 6.233 1.00 0.00 O ATOM 728 CB LYS A 50 -0.323 5.732 6.641 1.00 0.00 C ATOM 729 CG LYS A 50 0.302 4.774 7.669 1.00 0.00 C ATOM 730 CD LYS A 50 0.172 5.280 9.116 1.00 0.00 C ATOM 731 CE LYS A 50 1.437 5.996 9.625 1.00 0.00 C ATOM 732 NZ LYS A 50 1.784 7.199 8.846 1.00 0.00 N ATOM 733 H LYS A 50 0.364 3.514 5.566 1.00 0.00 H ATOM 734 HA LYS A 50 -0.336 6.140 4.560 1.00 0.00 H ATOM 735 HB2 LYS A 50 -0.267 6.765 6.983 1.00 0.00 H ATOM 736 HB3 LYS A 50 -1.380 5.479 6.545 1.00 0.00 H ATOM 737 HG2 LYS A 50 -0.254 3.840 7.577 1.00 0.00 H ATOM 738 HG3 LYS A 50 1.349 4.565 7.437 1.00 0.00 H ATOM 739 HD2 LYS A 50 -0.711 5.912 9.219 1.00 0.00 H ATOM 740 HD3 LYS A 50 0.025 4.412 9.762 1.00 0.00 H ATOM 741 HE2 LYS A 50 1.288 6.273 10.670 1.00 0.00 H ATOM 742 HE3 LYS A 50 2.287 5.316 9.571 1.00 0.00 H ATOM 743 HZ1 LYS A 50 1.030 7.868 8.848 1.00 0.00 H ATOM 744 HZ2 LYS A 50 2.621 7.627 9.215 1.00 0.00 H ATOM 745 HZ3 LYS A 50 1.978 6.939 7.884 1.00 0.00 H ATOM 746 N THR A 51 2.279 6.524 4.019 1.00 0.00 N ATOM 747 CA THR A 51 3.414 7.407 3.757 1.00 0.00 C ATOM 748 C THR A 51 3.453 7.739 2.260 1.00 0.00 C ATOM 749 O THR A 51 3.184 8.882 1.880 1.00 0.00 O ATOM 750 CB THR A 51 4.729 6.793 4.277 1.00 0.00 C ATOM 751 OG1 THR A 51 4.796 6.885 5.685 1.00 0.00 O ATOM 752 CG2 THR A 51 5.983 7.494 3.745 1.00 0.00 C ATOM 753 H THR A 51 1.851 6.060 3.227 1.00 0.00 H ATOM 754 HA THR A 51 3.255 8.349 4.286 1.00 0.00 H ATOM 755 HB THR A 51 4.768 5.749 3.983 1.00 0.00 H ATOM 756 HG1 THR A 51 4.252 6.189 6.083 1.00 0.00 H ATOM 757 HG21 THR A 51 5.934 8.562 3.957 1.00 0.00 H ATOM 758 HG22 THR A 51 6.860 7.075 4.239 1.00 0.00 H ATOM 759 HG23 THR A 51 6.097 7.338 2.672 1.00 0.00 H ATOM 760 N CYS A 52 3.774 6.755 1.409 1.00 0.00 N ATOM 761 CA CYS A 52 3.953 6.960 -0.028 1.00 0.00 C ATOM 762 C CYS A 52 2.599 7.218 -0.704 1.00 0.00 C ATOM 763 O CYS A 52 2.014 6.352 -1.342 1.00 0.00 O ATOM 764 CB CYS A 52 4.660 5.780 -0.638 1.00 0.00 C ATOM 765 SG CYS A 52 4.842 6.066 -2.431 1.00 0.00 S ATOM 766 H CYS A 52 3.955 5.825 1.762 1.00 0.00 H ATOM 767 HA CYS A 52 4.589 7.833 -0.182 1.00 0.00 H ATOM 768 HB2 CYS A 52 5.639 5.622 -0.184 1.00 0.00 H ATOM 769 HB3 CYS A 52 4.036 4.913 -0.441 1.00 0.00 H ATOM 770 N HIS A 53 2.086 8.431 -0.535 1.00 0.00 N ATOM 771 CA HIS A 53 0.841 8.910 -1.122 1.00 0.00 C ATOM 772 C HIS A 53 0.862 10.436 -1.136 1.00 0.00 C ATOM 773 O HIS A 53 0.465 11.056 -2.123 1.00 0.00 O ATOM 774 CB HIS A 53 -0.374 8.425 -0.319 1.00 0.00 C ATOM 775 CG HIS A 53 -0.684 6.952 -0.427 1.00 0.00 C ATOM 776 ND1 HIS A 53 -0.376 5.989 0.506 1.00 0.00 N ATOM 777 CD2 HIS A 53 -1.044 6.304 -1.577 1.00 0.00 C ATOM 778 CE1 HIS A 53 -0.510 4.798 -0.092 1.00 0.00 C ATOM 779 NE2 HIS A 53 -0.909 4.923 -1.368 1.00 0.00 N ATOM 780 H HIS A 53 2.615 9.038 0.080 1.00 0.00 H ATOM 781 HA HIS A 53 0.760 8.559 -2.153 1.00 0.00 H ATOM 782 HB2 HIS A 53 -0.208 8.675 0.727 1.00 0.00 H ATOM 783 HB3 HIS A 53 -1.245 8.965 -0.691 1.00 0.00 H ATOM 784 HD1 HIS A 53 0.059 6.105 1.414 1.00 0.00 H ATOM 785 HD2 HIS A 53 -1.251 6.804 -2.510 1.00 0.00 H ATOM 786 HE1 HIS A 53 -0.218 3.882 0.388 1.00 0.00 H ATOM 787 N LYS A 54 1.325 11.045 -0.036 1.00 0.00 N ATOM 788 CA LYS A 54 1.403 12.491 0.134 1.00 0.00 C ATOM 789 C LYS A 54 2.559 13.074 -0.691 1.00 0.00 C ATOM 790 O LYS A 54 3.474 13.687 -0.145 1.00 0.00 O ATOM 791 CB LYS A 54 1.536 12.832 1.627 1.00 0.00 C ATOM 792 CG LYS A 54 0.378 12.242 2.445 1.00 0.00 C ATOM 793 CD LYS A 54 0.385 12.725 3.901 1.00 0.00 C ATOM 794 CE LYS A 54 -0.224 14.131 4.025 1.00 0.00 C ATOM 795 NZ LYS A 54 -0.215 14.621 5.419 1.00 0.00 N ATOM 796 H LYS A 54 1.665 10.472 0.724 1.00 0.00 H ATOM 797 HA LYS A 54 0.476 12.939 -0.230 1.00 0.00 H ATOM 798 HB2 LYS A 54 2.482 12.441 2.008 1.00 0.00 H ATOM 799 HB3 LYS A 54 1.545 13.918 1.723 1.00 0.00 H ATOM 800 HG2 LYS A 54 -0.567 12.509 1.973 1.00 0.00 H ATOM 801 HG3 LYS A 54 0.471 11.154 2.450 1.00 0.00 H ATOM 802 HD2 LYS A 54 -0.213 12.020 4.486 1.00 0.00 H ATOM 803 HD3 LYS A 54 1.412 12.703 4.274 1.00 0.00 H ATOM 804 HE2 LYS A 54 0.333 14.835 3.406 1.00 0.00 H ATOM 805 HE3 LYS A 54 -1.256 14.104 3.669 1.00 0.00 H ATOM 806 HZ1 LYS A 54 -0.728 13.988 6.017 1.00 0.00 H ATOM 807 HZ2 LYS A 54 0.735 14.700 5.753 1.00 0.00 H ATOM 808 HZ3 LYS A 54 -0.651 15.532 5.461 1.00 0.00 H ATOM 809 N SER A 55 2.479 12.888 -2.007 1.00 0.00 N ATOM 810 CA SER A 55 3.460 13.307 -2.992 1.00 0.00 C ATOM 811 C SER A 55 2.715 13.941 -4.164 1.00 0.00 C ATOM 812 O SER A 55 3.027 15.057 -4.567 1.00 0.00 O ATOM 813 CB SER A 55 4.292 12.099 -3.445 1.00 0.00 C ATOM 814 OG SER A 55 4.763 11.377 -2.322 1.00 0.00 O ATOM 815 H SER A 55 1.667 12.388 -2.338 1.00 0.00 H ATOM 816 HA SER A 55 4.132 14.051 -2.560 1.00 0.00 H ATOM 817 HB2 SER A 55 3.688 11.430 -4.059 1.00 0.00 H ATOM 818 HB3 SER A 55 5.136 12.455 -4.040 1.00 0.00 H ATOM 819 HG SER A 55 5.364 10.686 -2.615 1.00 0.00 H ATOM 820 N ASN A 56 1.720 13.219 -4.698 1.00 0.00 N ATOM 821 CA ASN A 56 0.848 13.691 -5.763 1.00 0.00 C ATOM 822 C ASN A 56 -0.570 13.869 -5.219 1.00 0.00 C ATOM 823 O ASN A 56 -1.073 14.987 -5.141 1.00 0.00 O ATOM 824 CB ASN A 56 0.909 12.686 -6.917 1.00 0.00 C ATOM 825 CG ASN A 56 0.227 13.194 -8.183 1.00 0.00 C ATOM 826 OD1 ASN A 56 -0.659 14.041 -8.149 1.00 0.00 O ATOM 827 ND2 ASN A 56 0.677 12.685 -9.324 1.00 0.00 N ATOM 828 H ASN A 56 1.533 12.295 -4.344 1.00 0.00 H ATOM 829 HA ASN A 56 1.191 14.656 -6.141 1.00 0.00 H ATOM 830 HB2 ASN A 56 1.960 12.512 -7.150 1.00 0.00 H ATOM 831 HB3 ASN A 56 0.463 11.733 -6.632 1.00 0.00 H ATOM 832 HD21 ASN A 56 1.413 11.999 -9.293 1.00 0.00 H ATOM 833 HD22 ASN A 56 0.265 12.992 -10.192 1.00 0.00 H ATOM 834 N ASN A 57 -1.218 12.766 -4.828 1.00 0.00 N ATOM 835 CA ASN A 57 -2.640 12.721 -4.519 1.00 0.00 C ATOM 836 C ASN A 57 -2.964 11.346 -3.932 1.00 0.00 C ATOM 837 O ASN A 57 -2.177 10.416 -4.096 1.00 0.00 O ATOM 838 CB ASN A 57 -3.455 12.927 -5.809 1.00 0.00 C ATOM 839 CG ASN A 57 -3.330 11.715 -6.732 1.00 0.00 C ATOM 840 OD1 ASN A 57 -2.253 11.430 -7.249 1.00 0.00 O ATOM 841 ND2 ASN A 57 -4.415 10.968 -6.904 1.00 0.00 N ATOM 842 H ASN A 57 -0.767 11.860 -4.866 1.00 0.00 H ATOM 843 HA ASN A 57 -2.878 13.505 -3.798 1.00 0.00 H ATOM 844 HB2 ASN A 57 -4.503 13.075 -5.542 1.00 0.00 H ATOM 845 HB3 ASN A 57 -3.119 13.817 -6.342 1.00 0.00 H ATOM 846 HD21 ASN A 57 -5.302 11.204 -6.495 1.00 0.00 H ATOM 847 HD22 ASN A 57 -4.315 10.103 -7.446 1.00 0.00 H ATOM 848 N GLY A 58 -4.138 11.210 -3.301 1.00 0.00 N ATOM 849 CA GLY A 58 -4.723 9.915 -2.967 1.00 0.00 C ATOM 850 C GLY A 58 -5.442 9.918 -1.612 1.00 0.00 C ATOM 851 O GLY A 58 -5.204 10.796 -0.779 1.00 0.00 O ATOM 852 H GLY A 58 -4.705 12.028 -3.137 1.00 0.00 H ATOM 853 HA2 GLY A 58 -5.434 9.683 -3.761 1.00 0.00 H ATOM 854 HA3 GLY A 58 -3.961 9.135 -2.943 1.00 0.00 H ATOM 855 N PRO A 59 -6.320 8.931 -1.364 1.00 0.00 N ATOM 856 CA PRO A 59 -7.020 8.742 -0.097 1.00 0.00 C ATOM 857 C PRO A 59 -6.053 8.218 0.964 1.00 0.00 C ATOM 858 O PRO A 59 -6.094 7.055 1.357 1.00 0.00 O ATOM 859 CB PRO A 59 -8.147 7.760 -0.426 1.00 0.00 C ATOM 860 CG PRO A 59 -7.544 6.896 -1.534 1.00 0.00 C ATOM 861 CD PRO A 59 -6.698 7.897 -2.317 1.00 0.00 C ATOM 862 HA PRO A 59 -7.448 9.664 0.310 1.00 0.00 H ATOM 863 HB2 PRO A 59 -8.472 7.175 0.432 1.00 0.00 H ATOM 864 HB3 PRO A 59 -8.992 8.317 -0.833 1.00 0.00 H ATOM 865 HG2 PRO A 59 -6.897 6.133 -1.095 1.00 0.00 H ATOM 866 HG3 PRO A 59 -8.307 6.425 -2.156 1.00 0.00 H ATOM 867 HD2 PRO A 59 -5.830 7.398 -2.749 1.00 0.00 H ATOM 868 HD3 PRO A 59 -7.307 8.338 -3.109 1.00 0.00 H ATOM 869 N THR A 60 -5.188 9.109 1.442 1.00 0.00 N ATOM 870 CA THR A 60 -4.192 8.822 2.467 1.00 0.00 C ATOM 871 C THR A 60 -4.421 9.669 3.724 1.00 0.00 C ATOM 872 O THR A 60 -3.603 9.641 4.641 1.00 0.00 O ATOM 873 CB THR A 60 -2.800 9.014 1.847 1.00 0.00 C ATOM 874 OG1 THR A 60 -1.784 8.479 2.671 1.00 0.00 O ATOM 875 CG2 THR A 60 -2.494 10.487 1.550 1.00 0.00 C ATOM 876 H THR A 60 -5.165 10.013 0.980 1.00 0.00 H ATOM 877 HA THR A 60 -4.268 7.780 2.776 1.00 0.00 H ATOM 878 HB THR A 60 -2.792 8.456 0.910 1.00 0.00 H ATOM 879 HG1 THR A 60 -1.962 7.546 2.809 1.00 0.00 H ATOM 880 HG21 THR A 60 -3.249 10.917 0.895 1.00 0.00 H ATOM 881 HG22 THR A 60 -2.455 11.057 2.477 1.00 0.00 H ATOM 882 HG23 THR A 60 -1.532 10.565 1.049 1.00 0.00 H ATOM 883 N LYS A 61 -5.530 10.423 3.788 1.00 0.00 N ATOM 884 CA LYS A 61 -5.801 11.298 4.924 1.00 0.00 C ATOM 885 C LYS A 61 -5.768 10.515 6.240 1.00 0.00 C ATOM 886 O LYS A 61 -5.136 10.947 7.200 1.00 0.00 O ATOM 887 CB LYS A 61 -7.054 12.154 4.700 1.00 0.00 C ATOM 888 CG LYS A 61 -8.328 11.348 4.917 1.00 0.00 C ATOM 889 CD LYS A 61 -9.615 12.134 4.635 1.00 0.00 C ATOM 890 CE LYS A 61 -9.858 12.336 3.132 1.00 0.00 C ATOM 891 NZ LYS A 61 -11.144 13.012 2.862 1.00 0.00 N ATOM 892 H LYS A 61 -6.170 10.417 3.010 1.00 0.00 H ATOM 893 HA LYS A 61 -5.005 12.013 4.982 1.00 0.00 H ATOM 894 HB2 LYS A 61 -7.043 12.980 5.412 1.00 0.00 H ATOM 895 HB3 LYS A 61 -7.021 12.566 3.691 1.00 0.00 H ATOM 896 HG2 LYS A 61 -8.273 10.446 4.311 1.00 0.00 H ATOM 897 HG3 LYS A 61 -8.327 11.076 5.970 1.00 0.00 H ATOM 898 HD2 LYS A 61 -10.445 11.564 5.061 1.00 0.00 H ATOM 899 HD3 LYS A 61 -9.559 13.097 5.151 1.00 0.00 H ATOM 900 HE2 LYS A 61 -9.052 12.936 2.705 1.00 0.00 H ATOM 901 HE3 LYS A 61 -9.864 11.362 2.637 1.00 0.00 H ATOM 902 HZ1 LYS A 61 -11.912 12.467 3.231 1.00 0.00 H ATOM 903 HZ2 LYS A 61 -11.157 13.929 3.288 1.00 0.00 H ATOM 904 HZ3 LYS A 61 -11.274 13.117 1.865 1.00 0.00 H ATOM 905 N CYS A 62 -6.430 9.353 6.219 1.00 0.00 N ATOM 906 CA CYS A 62 -6.423 8.303 7.228 1.00 0.00 C ATOM 907 C CYS A 62 -7.431 7.232 6.808 1.00 0.00 C ATOM 908 O CYS A 62 -7.049 6.157 6.344 1.00 0.00 O ATOM 909 CB CYS A 62 -6.734 8.835 8.611 1.00 0.00 C ATOM 910 SG CYS A 62 -7.087 7.493 9.797 1.00 0.00 S ATOM 911 H CYS A 62 -6.851 9.123 5.335 1.00 0.00 H ATOM 912 HA CYS A 62 -5.422 7.882 7.193 1.00 0.00 H ATOM 913 HB2 CYS A 62 -5.896 9.422 8.980 1.00 0.00 H ATOM 914 HB3 CYS A 62 -7.608 9.482 8.528 1.00 0.00 H ATOM 915 N GLY A 63 -8.723 7.560 6.905 1.00 0.00 N ATOM 916 CA GLY A 63 -9.825 6.680 6.547 1.00 0.00 C ATOM 917 C GLY A 63 -9.991 6.596 5.032 1.00 0.00 C ATOM 918 O GLY A 63 -11.004 7.031 4.491 1.00 0.00 O ATOM 919 H GLY A 63 -8.946 8.459 7.301 1.00 0.00 H ATOM 920 HA2 GLY A 63 -9.651 5.680 6.947 1.00 0.00 H ATOM 921 HA3 GLY A 63 -10.743 7.071 6.985 1.00 0.00 H ATOM 922 N GLY A 64 -8.983 6.046 4.356 1.00 0.00 N ATOM 923 CA GLY A 64 -9.015 5.726 2.939 1.00 0.00 C ATOM 924 C GLY A 64 -9.075 4.213 2.778 1.00 0.00 C ATOM 925 O GLY A 64 -10.010 3.661 2.205 1.00 0.00 O ATOM 926 H GLY A 64 -8.168 5.770 4.896 1.00 0.00 H ATOM 927 HA2 GLY A 64 -9.862 6.189 2.430 1.00 0.00 H ATOM 928 HA3 GLY A 64 -8.094 6.084 2.486 1.00 0.00 H ATOM 929 N CYS A 65 -8.091 3.534 3.364 1.00 0.00 N ATOM 930 CA CYS A 65 -7.843 2.099 3.252 1.00 0.00 C ATOM 931 C CYS A 65 -8.729 1.309 4.218 1.00 0.00 C ATOM 932 O CYS A 65 -8.386 0.208 4.639 1.00 0.00 O ATOM 933 CB CYS A 65 -6.394 1.890 3.602 1.00 0.00 C ATOM 934 SG CYS A 65 -5.350 2.837 2.471 1.00 0.00 S ATOM 935 H CYS A 65 -7.393 4.059 3.865 1.00 0.00 H ATOM 936 HA CYS A 65 -8.029 1.762 2.231 1.00 0.00 H ATOM 937 HB2 CYS A 65 -6.265 2.249 4.622 1.00 0.00 H ATOM 938 HB3 CYS A 65 -6.112 0.841 3.565 1.00 0.00 H ATOM 939 N HIS A 66 -9.841 1.903 4.641 1.00 0.00 N ATOM 940 CA HIS A 66 -10.591 1.430 5.784 1.00 0.00 C ATOM 941 C HIS A 66 -12.033 1.897 5.647 1.00 0.00 C ATOM 942 O HIS A 66 -12.509 2.708 6.440 1.00 0.00 O ATOM 943 CB HIS A 66 -9.933 1.964 7.064 1.00 0.00 C ATOM 944 CG HIS A 66 -8.621 1.302 7.394 1.00 0.00 C ATOM 945 ND1 HIS A 66 -8.438 -0.041 7.625 1.00 0.00 N ATOM 946 CD2 HIS A 66 -7.414 1.923 7.587 1.00 0.00 C ATOM 947 CE1 HIS A 66 -7.158 -0.218 7.973 1.00 0.00 C ATOM 948 NE2 HIS A 66 -6.490 0.946 7.985 1.00 0.00 N ATOM 949 H HIS A 66 -10.122 2.764 4.196 1.00 0.00 H ATOM 950 HA HIS A 66 -10.595 0.337 5.786 1.00 0.00 H ATOM 951 HB2 HIS A 66 -9.787 3.041 6.972 1.00 0.00 H ATOM 952 HB3 HIS A 66 -10.603 1.791 7.902 1.00 0.00 H ATOM 953 HD1 HIS A 66 -9.139 -0.776 7.638 1.00 0.00 H ATOM 954 HD2 HIS A 66 -7.237 2.985 7.515 1.00 0.00 H ATOM 955 HE1 HIS A 66 -6.759 -1.170 8.283 1.00 0.00 H ATOM 956 N ILE A 67 -12.721 1.376 4.631 1.00 0.00 N ATOM 957 CA ILE A 67 -14.137 1.642 4.442 1.00 0.00 C ATOM 958 C ILE A 67 -14.908 0.954 5.573 1.00 0.00 C ATOM 959 O ILE A 67 -15.046 -0.270 5.565 1.00 0.00 O ATOM 960 CB ILE A 67 -14.592 1.154 3.052 1.00 0.00 C ATOM 961 CG1 ILE A 67 -13.787 1.793 1.903 1.00 0.00 C ATOM 962 CG2 ILE A 67 -16.096 1.394 2.856 1.00 0.00 C ATOM 963 CD1 ILE A 67 -13.909 3.318 1.806 1.00 0.00 C ATOM 964 H ILE A 67 -12.252 0.730 4.006 1.00 0.00 H ATOM 965 HA ILE A 67 -14.314 2.716 4.508 1.00 0.00 H ATOM 966 HB ILE A 67 -14.422 0.077 2.994 1.00 0.00 H ATOM 967 HG12 ILE A 67 -12.732 1.538 2.007 1.00 0.00 H ATOM 968 HG13 ILE A 67 -14.135 1.366 0.962 1.00 0.00 H ATOM 969 HG21 ILE A 67 -16.350 2.434 3.057 1.00 0.00 H ATOM 970 HG22 ILE A 67 -16.381 1.145 1.834 1.00 0.00 H ATOM 971 HG23 ILE A 67 -16.672 0.760 3.531 1.00 0.00 H ATOM 972 HD11 ILE A 67 -14.948 3.614 1.664 1.00 0.00 H ATOM 973 HD12 ILE A 67 -13.511 3.796 2.701 1.00 0.00 H ATOM 974 HD13 ILE A 67 -13.332 3.663 0.948 1.00 0.00 H ATOM 975 N LYS A 68 -15.394 1.736 6.538 1.00 0.00 N ATOM 976 CA LYS A 68 -16.302 1.326 7.589 1.00 0.00 C ATOM 977 C LYS A 68 -16.966 2.609 8.080 1.00 0.00 C ATOM 978 O LYS A 68 -16.341 3.671 7.854 1.00 0.00 O ATOM 979 CB LYS A 68 -15.528 0.634 8.724 1.00 0.00 C ATOM 980 CG LYS A 68 -16.439 -0.022 9.771 1.00 0.00 C ATOM 981 CD LYS A 68 -17.061 -1.314 9.224 1.00 0.00 C ATOM 982 CE LYS A 68 -18.153 -1.829 10.169 1.00 0.00 C ATOM 983 NZ LYS A 68 -18.799 -3.047 9.637 1.00 0.00 N ATOM 984 OXT LYS A 68 -18.063 2.501 8.668 1.00 0.00 O ATOM 985 H LYS A 68 -15.243 2.742 6.541 1.00 0.00 H ATOM 986 HA LYS A 68 -17.061 0.680 7.153 1.00 0.00 H ATOM 987 HB2 LYS A 68 -14.873 -0.129 8.310 1.00 0.00 H ATOM 988 HB3 LYS A 68 -14.912 1.387 9.217 1.00 0.00 H ATOM 989 HG2 LYS A 68 -15.841 -0.259 10.651 1.00 0.00 H ATOM 990 HG3 LYS A 68 -17.216 0.686 10.067 1.00 0.00 H ATOM 991 HD2 LYS A 68 -17.506 -1.118 8.248 1.00 0.00 H ATOM 992 HD3 LYS A 68 -16.268 -2.054 9.102 1.00 0.00 H ATOM 993 HE2 LYS A 68 -17.717 -2.041 11.147 1.00 0.00 H ATOM 994 HE3 LYS A 68 -18.912 -1.052 10.287 1.00 0.00 H ATOM 995 HZ1 LYS A 68 -19.211 -2.850 8.735 1.00 0.00 H ATOM 996 HZ2 LYS A 68 -18.118 -3.787 9.534 1.00 0.00 H ATOM 997 HZ3 LYS A 68 -19.527 -3.353 10.267 1.00 0.00 H TER 998 LYS A 68 HETATM 999 FE HEC A 69 4.412 -6.675 -5.043 1.00 0.00 FE HETATM 1000 CHA HEC A 69 3.919 -9.291 -2.790 1.00 0.00 C HETATM 1001 CHB HEC A 69 6.085 -8.786 -7.185 1.00 0.00 C HETATM 1002 CHC HEC A 69 4.618 -4.086 -7.285 1.00 0.00 C HETATM 1003 CHD HEC A 69 3.155 -4.476 -2.642 1.00 0.00 C HETATM 1004 NA HEC A 69 4.894 -8.679 -5.003 1.00 0.00 N HETATM 1005 C1A HEC A 69 4.586 -9.544 -3.989 1.00 0.00 C HETATM 1006 C2A HEC A 69 5.121 -10.833 -4.342 1.00 0.00 C HETATM 1007 C3A HEC A 69 5.741 -10.704 -5.565 1.00 0.00 C HETATM 1008 C4A HEC A 69 5.597 -9.325 -5.984 1.00 0.00 C HETATM 1009 CMA HEC A 69 6.425 -11.825 -6.313 1.00 0.00 C HETATM 1010 CAA HEC A 69 5.017 -12.094 -3.511 1.00 0.00 C HETATM 1011 CBA HEC A 69 3.600 -12.675 -3.462 1.00 0.00 C HETATM 1012 CGA HEC A 69 3.131 -13.073 -4.855 1.00 0.00 C HETATM 1013 O1A HEC A 69 3.580 -14.146 -5.310 1.00 0.00 O HETATM 1014 O2A HEC A 69 2.353 -12.290 -5.442 1.00 0.00 O HETATM 1015 NB HEC A 69 5.210 -6.472 -6.905 1.00 0.00 N HETATM 1016 C1B HEC A 69 5.858 -7.461 -7.590 1.00 0.00 C HETATM 1017 C2B HEC A 69 6.287 -6.893 -8.851 1.00 0.00 C HETATM 1018 C3B HEC A 69 5.818 -5.595 -8.906 1.00 0.00 C HETATM 1019 C4B HEC A 69 5.161 -5.325 -7.648 1.00 0.00 C HETATM 1020 CMB HEC A 69 7.143 -7.583 -9.888 1.00 0.00 C HETATM 1021 CAB HEC A 69 5.948 -4.625 -10.068 1.00 0.00 C HETATM 1022 CBB HEC A 69 5.081 -5.010 -11.270 1.00 0.00 C HETATM 1023 NC HEC A 69 3.989 -4.648 -4.969 1.00 0.00 N HETATM 1024 C1C HEC A 69 4.148 -3.797 -6.013 1.00 0.00 C HETATM 1025 C2C HEC A 69 3.738 -2.486 -5.570 1.00 0.00 C HETATM 1026 C3C HEC A 69 3.456 -2.577 -4.229 1.00 0.00 C HETATM 1027 C4C HEC A 69 3.510 -3.972 -3.884 1.00 0.00 C HETATM 1028 CMC HEC A 69 3.640 -1.234 -6.396 1.00 0.00 C HETATM 1029 CAC HEC A 69 3.291 -1.431 -3.250 1.00 0.00 C HETATM 1030 CBC HEC A 69 1.948 -0.706 -3.340 1.00 0.00 C HETATM 1031 ND HEC A 69 3.576 -6.864 -3.103 1.00 0.00 N HETATM 1032 C1D HEC A 69 3.175 -5.821 -2.334 1.00 0.00 C HETATM 1033 C2D HEC A 69 2.790 -6.337 -1.051 1.00 0.00 C HETATM 1034 C3D HEC A 69 2.991 -7.696 -1.074 1.00 0.00 C HETATM 1035 C4D HEC A 69 3.488 -8.026 -2.394 1.00 0.00 C HETATM 1036 CMD HEC A 69 2.400 -5.497 0.137 1.00 0.00 C HETATM 1037 CAD HEC A 69 3.129 -8.556 0.157 1.00 0.00 C HETATM 1038 CBD HEC A 69 1.875 -8.868 0.976 1.00 0.00 C HETATM 1039 CGD HEC A 69 2.304 -9.420 2.330 1.00 0.00 C HETATM 1040 O1D HEC A 69 3.438 -9.942 2.412 1.00 0.00 O HETATM 1041 O2D HEC A 69 1.515 -9.372 3.295 1.00 0.00 O HETATM 1042 HHA HEC A 69 3.791 -10.116 -2.113 1.00 0.00 H HETATM 1043 HHB HEC A 69 6.634 -9.434 -7.848 1.00 0.00 H HETATM 1044 HHC HEC A 69 4.647 -3.271 -7.982 1.00 0.00 H HETATM 1045 HHD HEC A 69 2.784 -3.803 -1.888 1.00 0.00 H HETATM 1046 HMA1 HEC A 69 7.419 -11.984 -5.893 1.00 0.00 H HETATM 1047 HMA2 HEC A 69 5.841 -12.740 -6.207 1.00 0.00 H HETATM 1048 HMA3 HEC A 69 6.508 -11.608 -7.375 1.00 0.00 H HETATM 1049 HAA1 HEC A 69 5.680 -12.859 -3.914 1.00 0.00 H HETATM 1050 HAA2 HEC A 69 5.344 -11.878 -2.495 1.00 0.00 H HETATM 1051 HBA1 HEC A 69 3.600 -13.562 -2.828 1.00 0.00 H HETATM 1052 HBA2 HEC A 69 2.897 -11.956 -3.041 1.00 0.00 H HETATM 1053 HMB1 HEC A 69 7.010 -7.139 -10.871 1.00 0.00 H HETATM 1054 HMB2 HEC A 69 8.191 -7.469 -9.615 1.00 0.00 H HETATM 1055 HMB3 HEC A 69 6.894 -8.641 -9.961 1.00 0.00 H HETATM 1056 HAB HEC A 69 5.614 -3.638 -9.781 1.00 0.00 H HETATM 1057 HBB1 HEC A 69 5.239 -4.290 -12.071 1.00 0.00 H HETATM 1058 HBB2 HEC A 69 5.331 -6.001 -11.640 1.00 0.00 H HETATM 1059 HBB3 HEC A 69 4.034 -4.999 -10.969 1.00 0.00 H HETATM 1060 HMC1 HEC A 69 4.520 -0.602 -6.234 1.00 0.00 H HETATM 1061 HMC2 HEC A 69 3.505 -1.440 -7.455 1.00 0.00 H HETATM 1062 HMC3 HEC A 69 2.749 -0.723 -6.047 1.00 0.00 H HETATM 1063 HAC HEC A 69 3.376 -1.806 -2.235 1.00 0.00 H HETATM 1064 HBC1 HEC A 69 1.942 0.002 -4.166 1.00 0.00 H HETATM 1065 HBC2 HEC A 69 1.141 -1.429 -3.459 1.00 0.00 H HETATM 1066 HBC3 HEC A 69 1.794 -0.150 -2.422 1.00 0.00 H HETATM 1067 HMD1 HEC A 69 2.383 -6.113 1.026 1.00 0.00 H HETATM 1068 HMD2 HEC A 69 3.135 -4.707 0.292 1.00 0.00 H HETATM 1069 HMD3 HEC A 69 1.416 -5.057 -0.023 1.00 0.00 H HETATM 1070 HAD1 HEC A 69 3.590 -9.507 -0.090 1.00 0.00 H HETATM 1071 HAD2 HEC A 69 3.808 -8.010 0.805 1.00 0.00 H HETATM 1072 HBD1 HEC A 69 1.266 -7.982 1.134 1.00 0.00 H HETATM 1073 HBD2 HEC A 69 1.271 -9.613 0.455 1.00 0.00 H HETATM 1074 FE HEC A 70 -0.942 3.450 -2.698 1.00 0.00 FE HETATM 1075 CHA HEC A 70 -3.094 5.267 -4.735 1.00 0.00 C HETATM 1076 CHB HEC A 70 -3.667 1.802 -1.279 1.00 0.00 C HETATM 1077 CHC HEC A 70 1.201 1.673 -0.628 1.00 0.00 C HETATM 1078 CHD HEC A 70 1.778 5.120 -4.083 1.00 0.00 C HETATM 1079 NA HEC A 70 -2.996 3.514 -2.965 1.00 0.00 N HETATM 1080 C1A HEC A 70 -3.638 4.313 -3.872 1.00 0.00 C HETATM 1081 C2A HEC A 70 -5.049 4.026 -3.780 1.00 0.00 C HETATM 1082 C3A HEC A 70 -5.209 3.028 -2.846 1.00 0.00 C HETATM 1083 C4A HEC A 70 -3.904 2.734 -2.296 1.00 0.00 C HETATM 1084 CMA HEC A 70 -6.512 2.347 -2.504 1.00 0.00 C HETATM 1085 CAA HEC A 70 -6.154 4.704 -4.556 1.00 0.00 C HETATM 1086 CBA HEC A 70 -6.332 4.166 -5.978 1.00 0.00 C HETATM 1087 CGA HEC A 70 -7.411 4.936 -6.734 1.00 0.00 C HETATM 1088 O1A HEC A 70 -8.103 5.746 -6.079 1.00 0.00 O HETATM 1089 O2A HEC A 70 -7.517 4.705 -7.956 1.00 0.00 O HETATM 1090 NB HEC A 70 -1.194 2.033 -1.175 1.00 0.00 N HETATM 1091 C1B HEC A 70 -2.394 1.525 -0.769 1.00 0.00 C HETATM 1092 C2B HEC A 70 -2.127 0.566 0.280 1.00 0.00 C HETATM 1093 C3B HEC A 70 -0.763 0.551 0.498 1.00 0.00 C HETATM 1094 C4B HEC A 70 -0.173 1.455 -0.471 1.00 0.00 C HETATM 1095 CMB HEC A 70 -3.170 -0.306 0.935 1.00 0.00 C HETATM 1096 CAB HEC A 70 0.007 -0.353 1.455 1.00 0.00 C HETATM 1097 CBB HEC A 70 -0.061 -1.829 1.047 1.00 0.00 C HETATM 1098 NC HEC A 70 1.129 3.341 -2.466 1.00 0.00 N HETATM 1099 C1C HEC A 70 1.770 2.541 -1.566 1.00 0.00 C HETATM 1100 C2C HEC A 70 3.195 2.756 -1.720 1.00 0.00 C HETATM 1101 C3C HEC A 70 3.356 3.746 -2.675 1.00 0.00 C HETATM 1102 C4C HEC A 70 2.034 4.105 -3.146 1.00 0.00 C HETATM 1103 CMC HEC A 70 4.289 2.092 -0.902 1.00 0.00 C HETATM 1104 CAC HEC A 70 4.653 4.400 -3.146 1.00 0.00 C HETATM 1105 CBC HEC A 70 5.944 3.597 -2.976 1.00 0.00 C HETATM 1106 ND HEC A 70 -0.701 4.932 -4.160 1.00 0.00 N HETATM 1107 C1D HEC A 70 0.495 5.480 -4.520 1.00 0.00 C HETATM 1108 C2D HEC A 70 0.211 6.540 -5.462 1.00 0.00 C HETATM 1109 C3D HEC A 70 -1.158 6.619 -5.597 1.00 0.00 C HETATM 1110 C4D HEC A 70 -1.728 5.546 -4.816 1.00 0.00 C HETATM 1111 CMD HEC A 70 1.229 7.421 -6.142 1.00 0.00 C HETATM 1112 CAD HEC A 70 -1.940 7.635 -6.403 1.00 0.00 C HETATM 1113 CBD HEC A 70 -2.095 7.177 -7.853 1.00 0.00 C HETATM 1114 CGD HEC A 70 -3.317 7.703 -8.586 1.00 0.00 C HETATM 1115 O1D HEC A 70 -3.495 7.222 -9.726 1.00 0.00 O HETATM 1116 O2D HEC A 70 -4.039 8.543 -8.015 1.00 0.00 O HETATM 1117 HHA HEC A 70 -3.771 5.819 -5.368 1.00 0.00 H HETATM 1118 HHB HEC A 70 -4.513 1.274 -0.866 1.00 0.00 H HETATM 1119 HHC HEC A 70 1.875 1.146 0.018 1.00 0.00 H HETATM 1120 HHD HEC A 70 2.615 5.679 -4.465 1.00 0.00 H HETATM 1121 HMA1 HEC A 70 -6.992 2.862 -1.673 1.00 0.00 H HETATM 1122 HMA2 HEC A 70 -7.173 2.357 -3.372 1.00 0.00 H HETATM 1123 HMA3 HEC A 70 -6.339 1.306 -2.242 1.00 0.00 H HETATM 1124 HAA1 HEC A 70 -7.099 4.585 -4.026 1.00 0.00 H HETATM 1125 HAA2 HEC A 70 -5.956 5.773 -4.616 1.00 0.00 H HETATM 1126 HBA1 HEC A 70 -5.396 4.253 -6.530 1.00 0.00 H HETATM 1127 HBA2 HEC A 70 -6.610 3.111 -5.941 1.00 0.00 H HETATM 1128 HMB1 HEC A 70 -3.484 -1.068 0.223 1.00 0.00 H HETATM 1129 HMB2 HEC A 70 -2.786 -0.791 1.829 1.00 0.00 H HETATM 1130 HMB3 HEC A 70 -4.036 0.293 1.212 1.00 0.00 H HETATM 1131 HAB HEC A 70 1.057 -0.088 1.458 1.00 0.00 H HETATM 1132 HBB1 HEC A 70 0.282 -1.947 0.020 1.00 0.00 H HETATM 1133 HBB2 HEC A 70 0.575 -2.419 1.708 1.00 0.00 H HETATM 1134 HBB3 HEC A 70 -1.081 -2.204 1.126 1.00 0.00 H HETATM 1135 HMC1 HEC A 70 4.715 2.805 -0.197 1.00 0.00 H HETATM 1136 HMC2 HEC A 70 3.932 1.235 -0.342 1.00 0.00 H HETATM 1137 HMC3 HEC A 70 5.082 1.713 -1.533 1.00 0.00 H HETATM 1138 HAC HEC A 70 4.578 4.539 -4.227 1.00 0.00 H HETATM 1139 HBC1 HEC A 70 6.226 3.530 -1.926 1.00 0.00 H HETATM 1140 HBC2 HEC A 70 5.837 2.606 -3.427 1.00 0.00 H HETATM 1141 HBC3 HEC A 70 6.748 4.127 -3.483 1.00 0.00 H HETATM 1142 HMD1 HEC A 70 2.036 6.810 -6.547 1.00 0.00 H HETATM 1143 HMD2 HEC A 70 0.771 7.976 -6.959 1.00 0.00 H HETATM 1144 HMD3 HEC A 70 1.637 8.125 -5.415 1.00 0.00 H HETATM 1145 HAD1 HEC A 70 -2.921 7.778 -5.951 1.00 0.00 H HETATM 1146 HAD2 HEC A 70 -1.451 8.610 -6.379 1.00 0.00 H HETATM 1147 HBD1 HEC A 70 -1.220 7.514 -8.405 1.00 0.00 H HETATM 1148 HBD2 HEC A 70 -2.170 6.090 -7.863 1.00 0.00 H HETATM 1149 FE HEC A 71 -4.684 1.181 8.711 1.00 0.00 FE HETATM 1150 CHA HEC A 71 -4.475 -2.166 9.584 1.00 0.00 C HETATM 1151 CHB HEC A 71 -6.109 1.968 11.726 1.00 0.00 C HETATM 1152 CHC HEC A 71 -4.727 4.503 7.746 1.00 0.00 C HETATM 1153 CHD HEC A 71 -3.628 0.363 5.423 1.00 0.00 C HETATM 1154 NA HEC A 71 -5.176 0.102 10.369 1.00 0.00 N HETATM 1155 C1A HEC A 71 -4.963 -1.242 10.520 1.00 0.00 C HETATM 1156 C2A HEC A 71 -5.381 -1.583 11.859 1.00 0.00 C HETATM 1157 C3A HEC A 71 -5.877 -0.444 12.451 1.00 0.00 C HETATM 1158 C4A HEC A 71 -5.739 0.635 11.498 1.00 0.00 C HETATM 1159 CMA HEC A 71 -6.437 -0.380 13.853 1.00 0.00 C HETATM 1160 CAA HEC A 71 -5.382 -2.953 12.490 1.00 0.00 C HETATM 1161 CBA HEC A 71 -6.678 -3.720 12.215 1.00 0.00 C HETATM 1162 CGA HEC A 71 -7.157 -4.433 13.470 1.00 0.00 C HETATM 1163 O1A HEC A 71 -7.140 -5.681 13.461 1.00 0.00 O HETATM 1164 O2A HEC A 71 -7.560 -3.708 14.405 1.00 0.00 O HETATM 1165 NB HEC A 71 -5.323 2.912 9.564 1.00 0.00 N HETATM 1166 C1B HEC A 71 -5.882 2.998 10.805 1.00 0.00 C HETATM 1167 C2B HEC A 71 -6.175 4.390 11.048 1.00 0.00 C HETATM 1168 C3B HEC A 71 -5.683 5.108 9.977 1.00 0.00 C HETATM 1169 C4B HEC A 71 -5.213 4.152 9.006 1.00 0.00 C HETATM 1170 CMB HEC A 71 -6.905 4.925 12.253 1.00 0.00 C HETATM 1171 CAB HEC A 71 -5.499 6.608 9.868 1.00 0.00 C HETATM 1172 CBB HEC A 71 -4.454 7.162 10.835 1.00 0.00 C HETATM 1173 NC HEC A 71 -4.178 2.263 6.915 1.00 0.00 N HETATM 1174 C1C HEC A 71 -4.305 3.606 6.787 1.00 0.00 C HETATM 1175 C2C HEC A 71 -3.980 3.974 5.428 1.00 0.00 C HETATM 1176 C3C HEC A 71 -3.750 2.806 4.739 1.00 0.00 C HETATM 1177 C4C HEC A 71 -3.813 1.720 5.708 1.00 0.00 C HETATM 1178 CMC HEC A 71 -4.033 5.358 4.813 1.00 0.00 C HETATM 1179 CAC HEC A 71 -3.708 2.684 3.219 1.00 0.00 C HETATM 1180 CBC HEC A 71 -2.851 3.732 2.487 1.00 0.00 C HETATM 1181 ND HEC A 71 -4.118 -0.581 7.696 1.00 0.00 N HETATM 1182 C1D HEC A 71 -3.757 -0.661 6.376 1.00 0.00 C HETATM 1183 C2D HEC A 71 -3.524 -2.055 6.087 1.00 0.00 C HETATM 1184 C3D HEC A 71 -3.783 -2.775 7.232 1.00 0.00 C HETATM 1185 C4D HEC A 71 -4.132 -1.827 8.267 1.00 0.00 C HETATM 1186 CMD HEC A 71 -3.111 -2.619 4.754 1.00 0.00 C HETATM 1187 CAD HEC A 71 -3.750 -4.288 7.341 1.00 0.00 C HETATM 1188 CBD HEC A 71 -4.877 -5.009 6.593 1.00 0.00 C HETATM 1189 CGD HEC A 71 -4.311 -5.927 5.520 1.00 0.00 C HETATM 1190 O1D HEC A 71 -4.605 -5.661 4.338 1.00 0.00 O HETATM 1191 O2D HEC A 71 -3.559 -6.849 5.898 1.00 0.00 O HETATM 1192 HHA HEC A 71 -4.424 -3.201 9.880 1.00 0.00 H HETATM 1193 HHB HEC A 71 -6.537 2.235 12.677 1.00 0.00 H HETATM 1194 HHC HEC A 71 -4.767 5.525 7.441 1.00 0.00 H HETATM 1195 HHD HEC A 71 -3.357 0.078 4.419 1.00 0.00 H HETATM 1196 HMA1 HEC A 71 -6.908 0.575 14.074 1.00 0.00 H HETATM 1197 HMA2 HEC A 71 -7.181 -1.167 13.978 1.00 0.00 H HETATM 1198 HMA3 HEC A 71 -5.633 -0.547 14.570 1.00 0.00 H HETATM 1199 HAA1 HEC A 71 -4.531 -3.548 12.158 1.00 0.00 H HETATM 1200 HAA2 HEC A 71 -5.273 -2.825 13.568 1.00 0.00 H HETATM 1201 HBA1 HEC A 71 -7.467 -3.031 11.911 1.00 0.00 H HETATM 1202 HBA2 HEC A 71 -6.518 -4.442 11.413 1.00 0.00 H HETATM 1203 HMB1 HEC A 71 -7.033 6.005 12.190 1.00 0.00 H HETATM 1204 HMB2 HEC A 71 -7.888 4.452 12.295 1.00 0.00 H HETATM 1205 HMB3 HEC A 71 -6.347 4.689 13.158 1.00 0.00 H HETATM 1206 HAB HEC A 71 -5.034 6.832 8.931 1.00 0.00 H HETATM 1207 HBB1 HEC A 71 -3.502 6.660 10.617 1.00 0.00 H HETATM 1208 HBB2 HEC A 71 -4.335 8.231 10.665 1.00 0.00 H HETATM 1209 HBB3 HEC A 71 -4.748 6.980 11.867 1.00 0.00 H HETATM 1210 HMC1 HEC A 71 -4.307 6.141 5.513 1.00 0.00 H HETATM 1211 HMC2 HEC A 71 -3.053 5.611 4.412 1.00 0.00 H HETATM 1212 HMC3 HEC A 71 -4.772 5.362 4.012 1.00 0.00 H HETATM 1213 HAC HEC A 71 -3.356 1.693 2.958 1.00 0.00 H HETATM 1214 HBC1 HEC A 71 -3.431 4.632 2.284 1.00 0.00 H HETATM 1215 HBC2 HEC A 71 -1.980 4.004 3.075 1.00 0.00 H HETATM 1216 HBC3 HEC A 71 -2.536 3.325 1.527 1.00 0.00 H HETATM 1217 HMD1 HEC A 71 -2.196 -2.143 4.413 1.00 0.00 H HETATM 1218 HMD2 HEC A 71 -2.940 -3.690 4.821 1.00 0.00 H HETATM 1219 HMD3 HEC A 71 -3.906 -2.439 4.035 1.00 0.00 H HETATM 1220 HAD1 HEC A 71 -2.795 -4.629 6.944 1.00 0.00 H HETATM 1221 HAD2 HEC A 71 -3.780 -4.619 8.375 1.00 0.00 H HETATM 1222 HBD1 HEC A 71 -5.433 -5.631 7.293 1.00 0.00 H HETATM 1223 HBD2 HEC A 71 -5.560 -4.291 6.139 1.00 0.00 H