ATOM 1 N ALA A 1 0.825 -10.830 -7.419 1.00 0.00 N ATOM 2 CA ALA A 1 -0.303 -11.142 -8.323 1.00 0.00 C ATOM 3 C ALA A 1 -0.592 -9.908 -9.189 1.00 0.00 C ATOM 4 O ALA A 1 0.368 -9.292 -9.651 1.00 0.00 O ATOM 5 CB ALA A 1 -1.524 -11.631 -7.533 1.00 0.00 C ATOM 6 H1 ALA A 1 0.577 -10.044 -6.828 1.00 0.00 H ATOM 7 H2 ALA A 1 1.027 -11.637 -6.840 1.00 0.00 H ATOM 8 H3 ALA A 1 1.644 -10.595 -7.969 1.00 0.00 H ATOM 9 HA ALA A 1 0.012 -11.947 -8.989 1.00 0.00 H ATOM 10 HB1 ALA A 1 -1.242 -12.470 -6.895 1.00 0.00 H ATOM 11 HB2 ALA A 1 -1.925 -10.830 -6.911 1.00 0.00 H ATOM 12 HB3 ALA A 1 -2.299 -11.975 -8.220 1.00 0.00 H ATOM 13 N ASP A 2 -1.861 -9.513 -9.356 1.00 0.00 N ATOM 14 CA ASP A 2 -2.287 -8.358 -10.156 1.00 0.00 C ATOM 15 C ASP A 2 -3.122 -7.388 -9.308 1.00 0.00 C ATOM 16 O ASP A 2 -2.927 -6.174 -9.346 1.00 0.00 O ATOM 17 CB ASP A 2 -3.103 -8.836 -11.364 1.00 0.00 C ATOM 18 CG ASP A 2 -2.237 -9.487 -12.434 1.00 0.00 C ATOM 19 OD1 ASP A 2 -1.664 -10.555 -12.135 1.00 0.00 O ATOM 20 OD2 ASP A 2 -2.178 -8.904 -13.541 1.00 0.00 O ATOM 21 H ASP A 2 -2.586 -10.110 -8.995 1.00 0.00 H ATOM 22 HA ASP A 2 -1.421 -7.811 -10.530 1.00 0.00 H ATOM 23 HB2 ASP A 2 -3.870 -9.544 -11.052 1.00 0.00 H ATOM 24 HB3 ASP A 2 -3.598 -7.974 -11.813 1.00 0.00 H ATOM 25 N VAL A 3 -4.052 -7.933 -8.531 1.00 0.00 N ATOM 26 CA VAL A 3 -4.903 -7.234 -7.580 1.00 0.00 C ATOM 27 C VAL A 3 -4.971 -8.138 -6.350 1.00 0.00 C ATOM 28 O VAL A 3 -4.887 -9.358 -6.501 1.00 0.00 O ATOM 29 CB VAL A 3 -6.295 -6.992 -8.198 1.00 0.00 C ATOM 30 CG1 VAL A 3 -7.246 -6.312 -7.204 1.00 0.00 C ATOM 31 CG2 VAL A 3 -6.200 -6.116 -9.455 1.00 0.00 C ATOM 32 H VAL A 3 -4.111 -8.934 -8.507 1.00 0.00 H ATOM 33 HA VAL A 3 -4.453 -6.283 -7.299 1.00 0.00 H ATOM 34 HB VAL A 3 -6.730 -7.953 -8.483 1.00 0.00 H ATOM 35 HG11 VAL A 3 -6.819 -5.368 -6.865 1.00 0.00 H ATOM 36 HG12 VAL A 3 -8.202 -6.111 -7.689 1.00 0.00 H ATOM 37 HG13 VAL A 3 -7.435 -6.955 -6.345 1.00 0.00 H ATOM 38 HG21 VAL A 3 -5.710 -5.171 -9.214 1.00 0.00 H ATOM 39 HG22 VAL A 3 -5.639 -6.625 -10.237 1.00 0.00 H ATOM 40 HG23 VAL A 3 -7.200 -5.908 -9.837 1.00 0.00 H ATOM 41 N VAL A 4 -5.072 -7.559 -5.150 1.00 0.00 N ATOM 42 CA VAL A 4 -5.173 -8.292 -3.890 1.00 0.00 C ATOM 43 C VAL A 4 -6.107 -7.485 -2.981 1.00 0.00 C ATOM 44 O VAL A 4 -6.127 -6.265 -3.081 1.00 0.00 O ATOM 45 CB VAL A 4 -3.770 -8.476 -3.272 1.00 0.00 C ATOM 46 CG1 VAL A 4 -3.848 -9.181 -1.912 1.00 0.00 C ATOM 47 CG2 VAL A 4 -2.833 -9.288 -4.178 1.00 0.00 C ATOM 48 H VAL A 4 -5.190 -6.551 -5.088 1.00 0.00 H ATOM 49 HA VAL A 4 -5.623 -9.271 -4.065 1.00 0.00 H ATOM 50 HB VAL A 4 -3.313 -7.498 -3.117 1.00 0.00 H ATOM 51 HG11 VAL A 4 -4.362 -10.136 -2.011 1.00 0.00 H ATOM 52 HG12 VAL A 4 -2.842 -9.357 -1.532 1.00 0.00 H ATOM 53 HG13 VAL A 4 -4.379 -8.555 -1.196 1.00 0.00 H ATOM 54 HG21 VAL A 4 -3.284 -10.251 -4.416 1.00 0.00 H ATOM 55 HG22 VAL A 4 -2.624 -8.745 -5.100 1.00 0.00 H ATOM 56 HG23 VAL A 4 -1.883 -9.458 -3.670 1.00 0.00 H ATOM 57 N THR A 5 -6.878 -8.130 -2.105 1.00 0.00 N ATOM 58 CA THR A 5 -7.862 -7.453 -1.266 1.00 0.00 C ATOM 59 C THR A 5 -7.798 -8.057 0.133 1.00 0.00 C ATOM 60 O THR A 5 -7.582 -9.262 0.258 1.00 0.00 O ATOM 61 CB THR A 5 -9.255 -7.621 -1.896 1.00 0.00 C ATOM 62 OG1 THR A 5 -9.212 -7.197 -3.245 1.00 0.00 O ATOM 63 CG2 THR A 5 -10.331 -6.812 -1.164 1.00 0.00 C ATOM 64 H THR A 5 -6.799 -9.130 -1.988 1.00 0.00 H ATOM 65 HA THR A 5 -7.636 -6.388 -1.192 1.00 0.00 H ATOM 66 HB THR A 5 -9.530 -8.678 -1.872 1.00 0.00 H ATOM 67 HG1 THR A 5 -10.095 -7.244 -3.619 1.00 0.00 H ATOM 68 HG21 THR A 5 -10.072 -5.754 -1.164 1.00 0.00 H ATOM 69 HG22 THR A 5 -11.291 -6.939 -1.666 1.00 0.00 H ATOM 70 HG23 THR A 5 -10.435 -7.156 -0.135 1.00 0.00 H ATOM 71 N TYR A 6 -7.989 -7.234 1.168 1.00 0.00 N ATOM 72 CA TYR A 6 -8.079 -7.667 2.555 1.00 0.00 C ATOM 73 C TYR A 6 -9.178 -6.864 3.248 1.00 0.00 C ATOM 74 O TYR A 6 -9.562 -5.792 2.774 1.00 0.00 O ATOM 75 CB TYR A 6 -6.732 -7.477 3.261 1.00 0.00 C ATOM 76 CG TYR A 6 -5.657 -8.458 2.834 1.00 0.00 C ATOM 77 CD1 TYR A 6 -5.558 -9.714 3.459 1.00 0.00 C ATOM 78 CD2 TYR A 6 -4.733 -8.103 1.833 1.00 0.00 C ATOM 79 CE1 TYR A 6 -4.531 -10.604 3.097 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.672 -8.966 1.516 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.576 -10.220 2.139 1.00 0.00 C ATOM 82 OH TYR A 6 -2.575 -11.074 1.783 1.00 0.00 O ATOM 83 H TYR A 6 -8.184 -6.248 0.998 1.00 0.00 H ATOM 84 HA TYR A 6 -8.360 -8.721 2.599 1.00 0.00 H ATOM 85 HB2 TYR A 6 -6.380 -6.459 3.094 1.00 0.00 H ATOM 86 HB3 TYR A 6 -6.885 -7.588 4.336 1.00 0.00 H ATOM 87 HD1 TYR A 6 -6.268 -9.997 4.221 1.00 0.00 H ATOM 88 HD2 TYR A 6 -4.839 -7.170 1.305 1.00 0.00 H ATOM 89 HE1 TYR A 6 -4.470 -11.569 3.576 1.00 0.00 H ATOM 90 HE2 TYR A 6 -2.921 -8.660 0.805 1.00 0.00 H ATOM 91 HH TYR A 6 -2.561 -11.875 2.308 1.00 0.00 H ATOM 92 N GLU A 7 -9.691 -7.394 4.359 1.00 0.00 N ATOM 93 CA GLU A 7 -10.772 -6.791 5.121 1.00 0.00 C ATOM 94 C GLU A 7 -10.239 -6.165 6.412 1.00 0.00 C ATOM 95 O GLU A 7 -9.141 -6.498 6.849 1.00 0.00 O ATOM 96 CB GLU A 7 -11.864 -7.834 5.383 1.00 0.00 C ATOM 97 CG GLU A 7 -12.325 -8.491 4.072 1.00 0.00 C ATOM 98 CD GLU A 7 -13.709 -9.105 4.224 1.00 0.00 C ATOM 99 OE1 GLU A 7 -14.664 -8.303 4.332 1.00 0.00 O ATOM 100 OE2 GLU A 7 -13.785 -10.352 4.237 1.00 0.00 O ATOM 101 H GLU A 7 -9.296 -8.248 4.722 1.00 0.00 H ATOM 102 HA GLU A 7 -11.210 -5.997 4.525 1.00 0.00 H ATOM 103 HB2 GLU A 7 -11.505 -8.609 6.062 1.00 0.00 H ATOM 104 HB3 GLU A 7 -12.717 -7.337 5.849 1.00 0.00 H ATOM 105 HG2 GLU A 7 -12.378 -7.747 3.277 1.00 0.00 H ATOM 106 HG3 GLU A 7 -11.618 -9.265 3.772 1.00 0.00 H ATOM 107 N ASN A 8 -11.004 -5.250 7.016 1.00 0.00 N ATOM 108 CA ASN A 8 -10.618 -4.562 8.251 1.00 0.00 C ATOM 109 C ASN A 8 -11.874 -4.249 9.062 1.00 0.00 C ATOM 110 O ASN A 8 -12.987 -4.447 8.579 1.00 0.00 O ATOM 111 CB ASN A 8 -9.920 -3.233 7.934 1.00 0.00 C ATOM 112 CG ASN A 8 -8.568 -3.359 7.249 1.00 0.00 C ATOM 113 OD1 ASN A 8 -7.581 -3.731 7.872 1.00 0.00 O ATOM 114 ND2 ASN A 8 -8.490 -2.963 5.983 1.00 0.00 N ATOM 115 H ASN A 8 -11.936 -5.065 6.647 1.00 0.00 H ATOM 116 HA ASN A 8 -9.960 -5.189 8.854 1.00 0.00 H ATOM 117 HB2 ASN A 8 -10.606 -2.655 7.330 1.00 0.00 H ATOM 118 HB3 ASN A 8 -9.738 -2.676 8.846 1.00 0.00 H ATOM 119 HD21 ASN A 8 -9.307 -2.576 5.518 1.00 0.00 H ATOM 120 HD22 ASN A 8 -7.609 -3.066 5.503 1.00 0.00 H ATOM 121 N LYS A 9 -11.702 -3.703 10.270 1.00 0.00 N ATOM 122 CA LYS A 9 -12.784 -3.153 11.076 1.00 0.00 C ATOM 123 C LYS A 9 -12.927 -1.649 10.804 1.00 0.00 C ATOM 124 O LYS A 9 -14.014 -1.094 10.952 1.00 0.00 O ATOM 125 CB LYS A 9 -12.514 -3.454 12.556 1.00 0.00 C ATOM 126 CG LYS A 9 -13.736 -3.154 13.437 1.00 0.00 C ATOM 127 CD LYS A 9 -13.432 -3.347 14.932 1.00 0.00 C ATOM 128 CE LYS A 9 -13.029 -4.777 15.326 1.00 0.00 C ATOM 129 NZ LYS A 9 -14.054 -5.778 14.960 1.00 0.00 N ATOM 130 H LYS A 9 -10.756 -3.491 10.590 1.00 0.00 H ATOM 131 HA LYS A 9 -13.722 -3.639 10.804 1.00 0.00 H ATOM 132 HB2 LYS A 9 -12.264 -4.512 12.641 1.00 0.00 H ATOM 133 HB3 LYS A 9 -11.662 -2.864 12.895 1.00 0.00 H ATOM 134 HG2 LYS A 9 -14.024 -2.111 13.299 1.00 0.00 H ATOM 135 HG3 LYS A 9 -14.581 -3.765 13.120 1.00 0.00 H ATOM 136 HD2 LYS A 9 -12.611 -2.679 15.202 1.00 0.00 H ATOM 137 HD3 LYS A 9 -14.308 -3.041 15.508 1.00 0.00 H ATOM 138 HE2 LYS A 9 -12.079 -5.037 14.854 1.00 0.00 H ATOM 139 HE3 LYS A 9 -12.879 -4.804 16.407 1.00 0.00 H ATOM 140 HZ1 LYS A 9 -14.939 -5.550 15.391 1.00 0.00 H ATOM 141 HZ2 LYS A 9 -14.167 -5.808 13.957 1.00 0.00 H ATOM 142 HZ3 LYS A 9 -13.764 -6.694 15.279 1.00 0.00 H ATOM 143 N LYS A 10 -11.838 -0.959 10.446 1.00 0.00 N ATOM 144 CA LYS A 10 -11.902 0.421 9.982 1.00 0.00 C ATOM 145 C LYS A 10 -12.572 0.506 8.611 1.00 0.00 C ATOM 146 O LYS A 10 -13.559 1.222 8.468 1.00 0.00 O ATOM 147 CB LYS A 10 -10.520 1.096 10.019 1.00 0.00 C ATOM 148 CG LYS A 10 -10.427 2.106 11.172 1.00 0.00 C ATOM 149 CD LYS A 10 -10.450 1.431 12.556 1.00 0.00 C ATOM 150 CE LYS A 10 -11.521 1.984 13.510 1.00 0.00 C ATOM 151 NZ LYS A 10 -12.899 1.643 13.093 1.00 0.00 N ATOM 152 H LYS A 10 -10.935 -1.431 10.493 1.00 0.00 H ATOM 153 HA LYS A 10 -12.564 0.970 10.643 1.00 0.00 H ATOM 154 HB2 LYS A 10 -9.721 0.357 10.101 1.00 0.00 H ATOM 155 HB3 LYS A 10 -10.363 1.653 9.093 1.00 0.00 H ATOM 156 HG2 LYS A 10 -9.481 2.635 11.058 1.00 0.00 H ATOM 157 HG3 LYS A 10 -11.219 2.847 11.070 1.00 0.00 H ATOM 158 HD2 LYS A 10 -10.540 0.346 12.461 1.00 0.00 H ATOM 159 HD3 LYS A 10 -9.485 1.627 13.025 1.00 0.00 H ATOM 160 HE2 LYS A 10 -11.345 1.557 14.500 1.00 0.00 H ATOM 161 HE3 LYS A 10 -11.416 3.069 13.587 1.00 0.00 H ATOM 162 HZ1 LYS A 10 -12.994 0.644 12.962 1.00 0.00 H ATOM 163 HZ2 LYS A 10 -13.556 1.945 13.799 1.00 0.00 H ATOM 164 HZ3 LYS A 10 -13.129 2.102 12.224 1.00 0.00 H ATOM 165 N GLY A 11 -12.041 -0.209 7.620 1.00 0.00 N ATOM 166 CA GLY A 11 -12.617 -0.252 6.286 1.00 0.00 C ATOM 167 C GLY A 11 -11.811 -1.204 5.411 1.00 0.00 C ATOM 168 O GLY A 11 -10.578 -1.192 5.458 1.00 0.00 O ATOM 169 H GLY A 11 -11.208 -0.749 7.792 1.00 0.00 H ATOM 170 HA2 GLY A 11 -13.652 -0.588 6.354 1.00 0.00 H ATOM 171 HA3 GLY A 11 -12.596 0.742 5.840 1.00 0.00 H ATOM 172 N ASN A 12 -12.493 -2.065 4.655 1.00 0.00 N ATOM 173 CA ASN A 12 -11.846 -3.036 3.780 1.00 0.00 C ATOM 174 C ASN A 12 -10.941 -2.323 2.780 1.00 0.00 C ATOM 175 O ASN A 12 -11.190 -1.166 2.442 1.00 0.00 O ATOM 176 CB ASN A 12 -12.894 -3.886 3.051 1.00 0.00 C ATOM 177 CG ASN A 12 -13.552 -4.916 3.965 1.00 0.00 C ATOM 178 OD1 ASN A 12 -13.360 -4.893 5.180 1.00 0.00 O ATOM 179 ND2 ASN A 12 -14.293 -5.843 3.369 1.00 0.00 N ATOM 180 H ASN A 12 -13.501 -2.041 4.678 1.00 0.00 H ATOM 181 HA ASN A 12 -11.211 -3.687 4.384 1.00 0.00 H ATOM 182 HB2 ASN A 12 -13.655 -3.241 2.608 1.00 0.00 H ATOM 183 HB3 ASN A 12 -12.396 -4.432 2.249 1.00 0.00 H ATOM 184 HD21 ASN A 12 -14.413 -5.848 2.371 1.00 0.00 H ATOM 185 HD22 ASN A 12 -14.582 -6.678 3.901 1.00 0.00 H ATOM 186 N VAL A 13 -9.882 -3.011 2.343 1.00 0.00 N ATOM 187 CA VAL A 13 -8.827 -2.439 1.530 1.00 0.00 C ATOM 188 C VAL A 13 -8.583 -3.320 0.302 1.00 0.00 C ATOM 189 O VAL A 13 -8.186 -4.478 0.414 1.00 0.00 O ATOM 190 CB VAL A 13 -7.578 -2.221 2.402 1.00 0.00 C ATOM 191 CG1 VAL A 13 -7.028 -3.503 3.044 1.00 0.00 C ATOM 192 CG2 VAL A 13 -6.465 -1.542 1.605 1.00 0.00 C ATOM 193 H VAL A 13 -9.757 -3.983 2.616 1.00 0.00 H ATOM 194 HA VAL A 13 -9.132 -1.453 1.179 1.00 0.00 H ATOM 195 HB VAL A 13 -7.860 -1.543 3.210 1.00 0.00 H ATOM 196 HG11 VAL A 13 -7.796 -4.013 3.621 1.00 0.00 H ATOM 197 HG12 VAL A 13 -6.657 -4.182 2.282 1.00 0.00 H ATOM 198 HG13 VAL A 13 -6.203 -3.246 3.708 1.00 0.00 H ATOM 199 HG21 VAL A 13 -6.836 -0.619 1.158 1.00 0.00 H ATOM 200 HG22 VAL A 13 -5.653 -1.311 2.292 1.00 0.00 H ATOM 201 HG23 VAL A 13 -6.095 -2.196 0.817 1.00 0.00 H ATOM 202 N THR A 14 -8.817 -2.754 -0.882 1.00 0.00 N ATOM 203 CA THR A 14 -8.329 -3.301 -2.136 1.00 0.00 C ATOM 204 C THR A 14 -6.911 -2.762 -2.315 1.00 0.00 C ATOM 205 O THR A 14 -6.725 -1.554 -2.442 1.00 0.00 O ATOM 206 CB THR A 14 -9.266 -2.883 -3.277 1.00 0.00 C ATOM 207 OG1 THR A 14 -10.577 -3.319 -2.972 1.00 0.00 O ATOM 208 CG2 THR A 14 -8.854 -3.504 -4.615 1.00 0.00 C ATOM 209 H THR A 14 -9.119 -1.794 -0.899 1.00 0.00 H ATOM 210 HA THR A 14 -8.312 -4.390 -2.102 1.00 0.00 H ATOM 211 HB THR A 14 -9.267 -1.796 -3.379 1.00 0.00 H ATOM 212 HG1 THR A 14 -10.799 -3.030 -2.084 1.00 0.00 H ATOM 213 HG21 THR A 14 -8.780 -4.587 -4.521 1.00 0.00 H ATOM 214 HG22 THR A 14 -9.600 -3.261 -5.373 1.00 0.00 H ATOM 215 HG23 THR A 14 -7.893 -3.102 -4.938 1.00 0.00 H ATOM 216 N PHE A 15 -5.912 -3.640 -2.288 1.00 0.00 N ATOM 217 CA PHE A 15 -4.590 -3.317 -2.791 1.00 0.00 C ATOM 218 C PHE A 15 -4.698 -3.436 -4.312 1.00 0.00 C ATOM 219 O PHE A 15 -5.516 -4.212 -4.806 1.00 0.00 O ATOM 220 CB PHE A 15 -3.545 -4.345 -2.321 1.00 0.00 C ATOM 221 CG PHE A 15 -3.155 -4.446 -0.852 1.00 0.00 C ATOM 222 CD1 PHE A 15 -4.116 -4.407 0.181 1.00 0.00 C ATOM 223 CD2 PHE A 15 -1.853 -4.898 -0.556 1.00 0.00 C ATOM 224 CE1 PHE A 15 -3.758 -4.763 1.495 1.00 0.00 C ATOM 225 CE2 PHE A 15 -1.535 -5.362 0.732 1.00 0.00 C ATOM 226 CZ PHE A 15 -2.488 -5.294 1.757 1.00 0.00 C ATOM 227 H PHE A 15 -6.153 -4.626 -2.291 1.00 0.00 H ATOM 228 HA PHE A 15 -4.285 -2.310 -2.500 1.00 0.00 H ATOM 229 HB2 PHE A 15 -3.876 -5.333 -2.633 1.00 0.00 H ATOM 230 HB3 PHE A 15 -2.634 -4.129 -2.883 1.00 0.00 H ATOM 231 HD1 PHE A 15 -5.153 -4.199 -0.021 1.00 0.00 H ATOM 232 HD2 PHE A 15 -1.128 -5.014 -1.348 1.00 0.00 H ATOM 233 HE1 PHE A 15 -4.498 -4.800 2.279 1.00 0.00 H ATOM 234 HE2 PHE A 15 -0.586 -5.839 0.920 1.00 0.00 H ATOM 235 HZ PHE A 15 -2.286 -5.731 2.726 1.00 0.00 H ATOM 236 N ASP A 16 -3.811 -2.780 -5.060 1.00 0.00 N ATOM 237 CA ASP A 16 -3.505 -3.288 -6.383 1.00 0.00 C ATOM 238 C ASP A 16 -2.134 -3.907 -6.258 1.00 0.00 C ATOM 239 O ASP A 16 -1.436 -3.691 -5.265 1.00 0.00 O ATOM 240 CB ASP A 16 -3.438 -2.197 -7.443 1.00 0.00 C ATOM 241 CG ASP A 16 -4.635 -1.267 -7.431 1.00 0.00 C ATOM 242 OD1 ASP A 16 -5.732 -1.739 -7.789 1.00 0.00 O ATOM 243 OD2 ASP A 16 -4.392 -0.088 -7.094 1.00 0.00 O ATOM 244 H ASP A 16 -3.062 -2.254 -4.625 1.00 0.00 H ATOM 245 HA ASP A 16 -4.217 -4.035 -6.733 1.00 0.00 H ATOM 246 HB2 ASP A 16 -2.528 -1.633 -7.285 1.00 0.00 H ATOM 247 HB3 ASP A 16 -3.379 -2.675 -8.418 1.00 0.00 H ATOM 248 N HIS A 17 -1.727 -4.609 -7.303 1.00 0.00 N ATOM 249 CA HIS A 17 -0.351 -4.989 -7.477 1.00 0.00 C ATOM 250 C HIS A 17 0.104 -4.423 -8.818 1.00 0.00 C ATOM 251 O HIS A 17 0.981 -3.563 -8.871 1.00 0.00 O ATOM 252 CB HIS A 17 -0.292 -6.510 -7.344 1.00 0.00 C ATOM 253 CG HIS A 17 1.083 -7.030 -7.084 1.00 0.00 C ATOM 254 ND1 HIS A 17 1.810 -7.801 -7.951 1.00 0.00 N ATOM 255 CD2 HIS A 17 1.874 -6.719 -6.014 1.00 0.00 C ATOM 256 CE1 HIS A 17 3.020 -7.971 -7.409 1.00 0.00 C ATOM 257 NE2 HIS A 17 3.118 -7.306 -6.245 1.00 0.00 N ATOM 258 H HIS A 17 -2.377 -4.840 -8.047 1.00 0.00 H ATOM 259 HA HIS A 17 0.273 -4.513 -6.719 1.00 0.00 H ATOM 260 HB2 HIS A 17 -0.919 -6.817 -6.506 1.00 0.00 H ATOM 261 HB3 HIS A 17 -0.681 -6.973 -8.245 1.00 0.00 H ATOM 262 HD1 HIS A 17 1.498 -8.134 -8.858 1.00 0.00 H ATOM 263 HD2 HIS A 17 1.610 -6.069 -5.193 1.00 0.00 H ATOM 264 HE1 HIS A 17 3.822 -8.497 -7.903 1.00 0.00 H ATOM 265 N LYS A 18 -0.573 -4.834 -9.891 1.00 0.00 N ATOM 266 CA LYS A 18 -0.337 -4.316 -11.226 1.00 0.00 C ATOM 267 C LYS A 18 -0.718 -2.839 -11.286 1.00 0.00 C ATOM 268 O LYS A 18 0.128 -2.000 -11.572 1.00 0.00 O ATOM 269 CB LYS A 18 -1.102 -5.158 -12.253 1.00 0.00 C ATOM 270 CG LYS A 18 -0.831 -4.682 -13.690 1.00 0.00 C ATOM 271 CD LYS A 18 -1.168 -5.780 -14.708 1.00 0.00 C ATOM 272 CE LYS A 18 -2.678 -6.039 -14.804 1.00 0.00 C ATOM 273 NZ LYS A 18 -2.961 -7.327 -15.466 1.00 0.00 N ATOM 274 H LYS A 18 -1.358 -5.459 -9.739 1.00 0.00 H ATOM 275 HA LYS A 18 0.728 -4.411 -11.440 1.00 0.00 H ATOM 276 HB2 LYS A 18 -0.762 -6.190 -12.153 1.00 0.00 H ATOM 277 HB3 LYS A 18 -2.169 -5.116 -12.036 1.00 0.00 H ATOM 278 HG2 LYS A 18 -1.398 -3.771 -13.911 1.00 0.00 H ATOM 279 HG3 LYS A 18 0.231 -4.450 -13.793 1.00 0.00 H ATOM 280 HD2 LYS A 18 -0.794 -5.470 -15.686 1.00 0.00 H ATOM 281 HD3 LYS A 18 -0.647 -6.694 -14.411 1.00 0.00 H ATOM 282 HE2 LYS A 18 -3.111 -6.099 -13.805 1.00 0.00 H ATOM 283 HE3 LYS A 18 -3.156 -5.219 -15.343 1.00 0.00 H ATOM 284 HZ1 LYS A 18 -2.536 -7.377 -16.379 1.00 0.00 H ATOM 285 HZ2 LYS A 18 -2.577 -8.068 -14.877 1.00 0.00 H ATOM 286 HZ3 LYS A 18 -3.954 -7.481 -15.531 1.00 0.00 H ATOM 287 N ALA A 19 -1.978 -2.502 -11.003 1.00 0.00 N ATOM 288 CA ALA A 19 -2.452 -1.131 -11.168 1.00 0.00 C ATOM 289 C ALA A 19 -1.725 -0.137 -10.253 1.00 0.00 C ATOM 290 O ALA A 19 -1.633 1.045 -10.586 1.00 0.00 O ATOM 291 CB ALA A 19 -3.970 -1.067 -11.009 1.00 0.00 C ATOM 292 H ALA A 19 -2.644 -3.222 -10.767 1.00 0.00 H ATOM 293 HA ALA A 19 -2.238 -0.828 -12.191 1.00 0.00 H ATOM 294 HB1 ALA A 19 -4.446 -1.715 -11.745 1.00 0.00 H ATOM 295 HB2 ALA A 19 -4.251 -1.388 -10.013 1.00 0.00 H ATOM 296 HB3 ALA A 19 -4.310 -0.043 -11.163 1.00 0.00 H ATOM 297 N HIS A 20 -1.155 -0.602 -9.131 1.00 0.00 N ATOM 298 CA HIS A 20 -0.194 0.224 -8.407 1.00 0.00 C ATOM 299 C HIS A 20 1.098 0.283 -9.235 1.00 0.00 C ATOM 300 O HIS A 20 1.546 1.374 -9.586 1.00 0.00 O ATOM 301 CB HIS A 20 0.047 -0.253 -6.960 1.00 0.00 C ATOM 302 CG HIS A 20 -0.777 0.439 -5.889 1.00 0.00 C ATOM 303 ND1 HIS A 20 -2.144 0.402 -5.776 1.00 0.00 N ATOM 304 CD2 HIS A 20 -0.313 1.227 -4.855 1.00 0.00 C ATOM 305 CE1 HIS A 20 -2.487 1.109 -4.698 1.00 0.00 C ATOM 306 NE2 HIS A 20 -1.414 1.661 -4.095 1.00 0.00 N ATOM 307 H HIS A 20 -1.249 -1.588 -8.910 1.00 0.00 H ATOM 308 HA HIS A 20 -0.576 1.245 -8.338 1.00 0.00 H ATOM 309 HB2 HIS A 20 -0.075 -1.334 -6.887 1.00 0.00 H ATOM 310 HB3 HIS A 20 1.075 -0.018 -6.719 1.00 0.00 H ATOM 311 HD1 HIS A 20 -2.835 0.036 -6.432 1.00 0.00 H ATOM 312 HD2 HIS A 20 0.716 1.498 -4.682 1.00 0.00 H ATOM 313 HE1 HIS A 20 -3.525 1.238 -4.446 1.00 0.00 H ATOM 314 N ALA A 21 1.697 -0.870 -9.567 1.00 0.00 N ATOM 315 CA ALA A 21 2.919 -0.958 -10.370 1.00 0.00 C ATOM 316 C ALA A 21 2.931 -0.035 -11.594 1.00 0.00 C ATOM 317 O ALA A 21 3.980 0.523 -11.899 1.00 0.00 O ATOM 318 CB ALA A 21 3.221 -2.401 -10.782 1.00 0.00 C ATOM 319 H ALA A 21 1.256 -1.748 -9.306 1.00 0.00 H ATOM 320 HA ALA A 21 3.746 -0.658 -9.732 1.00 0.00 H ATOM 321 HB1 ALA A 21 3.257 -3.046 -9.906 1.00 0.00 H ATOM 322 HB2 ALA A 21 2.473 -2.772 -11.478 1.00 0.00 H ATOM 323 HB3 ALA A 21 4.192 -2.424 -11.278 1.00 0.00 H ATOM 324 N GLU A 22 1.798 0.143 -12.277 1.00 0.00 N ATOM 325 CA GLU A 22 1.671 1.068 -13.402 1.00 0.00 C ATOM 326 C GLU A 22 2.216 2.460 -13.069 1.00 0.00 C ATOM 327 O GLU A 22 2.886 3.078 -13.892 1.00 0.00 O ATOM 328 CB GLU A 22 0.205 1.156 -13.841 1.00 0.00 C ATOM 329 CG GLU A 22 -0.227 -0.189 -14.430 1.00 0.00 C ATOM 330 CD GLU A 22 -1.708 -0.243 -14.785 1.00 0.00 C ATOM 331 OE1 GLU A 22 -2.289 0.843 -14.991 1.00 0.00 O ATOM 332 OE2 GLU A 22 -2.229 -1.380 -14.826 1.00 0.00 O ATOM 333 H GLU A 22 0.991 -0.413 -12.012 1.00 0.00 H ATOM 334 HA GLU A 22 2.258 0.679 -14.234 1.00 0.00 H ATOM 335 HB2 GLU A 22 -0.435 1.417 -12.997 1.00 0.00 H ATOM 336 HB3 GLU A 22 0.095 1.923 -14.610 1.00 0.00 H ATOM 337 HG2 GLU A 22 0.358 -0.387 -15.325 1.00 0.00 H ATOM 338 HG3 GLU A 22 -0.025 -0.968 -13.706 1.00 0.00 H ATOM 339 N LYS A 23 1.928 2.951 -11.862 1.00 0.00 N ATOM 340 CA LYS A 23 2.522 4.174 -11.353 1.00 0.00 C ATOM 341 C LYS A 23 3.891 3.865 -10.729 1.00 0.00 C ATOM 342 O LYS A 23 4.864 4.572 -10.974 1.00 0.00 O ATOM 343 CB LYS A 23 1.565 4.818 -10.340 1.00 0.00 C ATOM 344 CG LYS A 23 0.288 5.394 -10.977 1.00 0.00 C ATOM 345 CD LYS A 23 -0.972 4.611 -10.568 1.00 0.00 C ATOM 346 CE LYS A 23 -2.227 5.441 -10.883 1.00 0.00 C ATOM 347 NZ LYS A 23 -3.472 4.804 -10.402 1.00 0.00 N ATOM 348 H LYS A 23 1.435 2.352 -11.207 1.00 0.00 H ATOM 349 HA LYS A 23 2.684 4.887 -12.164 1.00 0.00 H ATOM 350 HB2 LYS A 23 1.282 4.078 -9.595 1.00 0.00 H ATOM 351 HB3 LYS A 23 2.097 5.629 -9.839 1.00 0.00 H ATOM 352 HG2 LYS A 23 0.194 6.425 -10.631 1.00 0.00 H ATOM 353 HG3 LYS A 23 0.378 5.409 -12.065 1.00 0.00 H ATOM 354 HD2 LYS A 23 -0.993 3.654 -11.095 1.00 0.00 H ATOM 355 HD3 LYS A 23 -0.938 4.418 -9.494 1.00 0.00 H ATOM 356 HE2 LYS A 23 -2.140 6.407 -10.382 1.00 0.00 H ATOM 357 HE3 LYS A 23 -2.303 5.622 -11.957 1.00 0.00 H ATOM 358 HZ1 LYS A 23 -3.315 4.305 -9.541 1.00 0.00 H ATOM 359 HZ2 LYS A 23 -4.139 5.549 -10.186 1.00 0.00 H ATOM 360 HZ3 LYS A 23 -3.860 4.175 -11.090 1.00 0.00 H ATOM 361 N LEU A 24 3.952 2.840 -9.875 1.00 0.00 N ATOM 362 CA LEU A 24 5.059 2.592 -8.970 1.00 0.00 C ATOM 363 C LEU A 24 6.323 1.995 -9.594 1.00 0.00 C ATOM 364 O LEU A 24 7.418 2.494 -9.344 1.00 0.00 O ATOM 365 CB LEU A 24 4.557 1.668 -7.862 1.00 0.00 C ATOM 366 CG LEU A 24 3.865 2.466 -6.754 1.00 0.00 C ATOM 367 CD1 LEU A 24 2.431 2.892 -7.043 1.00 0.00 C ATOM 368 CD2 LEU A 24 3.822 1.619 -5.493 1.00 0.00 C ATOM 369 H LEU A 24 3.096 2.337 -9.668 1.00 0.00 H ATOM 370 HA LEU A 24 5.368 3.547 -8.542 1.00 0.00 H ATOM 371 HB2 LEU A 24 3.867 0.920 -8.237 1.00 0.00 H ATOM 372 HB3 LEU A 24 5.435 1.144 -7.482 1.00 0.00 H ATOM 373 HG LEU A 24 4.436 3.371 -6.613 1.00 0.00 H ATOM 374 HD11 LEU A 24 1.822 2.014 -7.231 1.00 0.00 H ATOM 375 HD12 LEU A 24 2.024 3.413 -6.180 1.00 0.00 H ATOM 376 HD13 LEU A 24 2.416 3.569 -7.887 1.00 0.00 H ATOM 377 HD21 LEU A 24 4.818 1.250 -5.260 1.00 0.00 H ATOM 378 HD22 LEU A 24 3.437 2.193 -4.667 1.00 0.00 H ATOM 379 HD23 LEU A 24 3.130 0.802 -5.637 1.00 0.00 H ATOM 380 N GLY A 25 6.204 0.877 -10.311 1.00 0.00 N ATOM 381 CA GLY A 25 7.348 0.208 -10.915 1.00 0.00 C ATOM 382 C GLY A 25 8.147 -0.683 -9.955 1.00 0.00 C ATOM 383 O GLY A 25 9.371 -0.601 -9.926 1.00 0.00 O ATOM 384 H GLY A 25 5.278 0.609 -10.617 1.00 0.00 H ATOM 385 HA2 GLY A 25 7.001 -0.394 -11.755 1.00 0.00 H ATOM 386 HA3 GLY A 25 8.010 0.984 -11.286 1.00 0.00 H ATOM 387 N CYS A 26 7.455 -1.557 -9.212 1.00 0.00 N ATOM 388 CA CYS A 26 7.995 -2.625 -8.356 1.00 0.00 C ATOM 389 C CYS A 26 8.864 -2.110 -7.201 1.00 0.00 C ATOM 390 O CYS A 26 8.460 -2.193 -6.039 1.00 0.00 O ATOM 391 CB CYS A 26 8.697 -3.747 -9.105 1.00 0.00 C ATOM 392 SG CYS A 26 7.969 -4.270 -10.691 1.00 0.00 S ATOM 393 H CYS A 26 6.455 -1.508 -9.304 1.00 0.00 H ATOM 394 HA CYS A 26 7.133 -3.077 -7.879 1.00 0.00 H ATOM 395 HB2 CYS A 26 9.731 -3.466 -9.303 1.00 0.00 H ATOM 396 HB3 CYS A 26 8.733 -4.615 -8.446 1.00 0.00 H ATOM 397 N ASP A 27 10.043 -1.571 -7.514 1.00 0.00 N ATOM 398 CA ASP A 27 11.080 -1.172 -6.568 1.00 0.00 C ATOM 399 C ASP A 27 10.689 0.059 -5.736 1.00 0.00 C ATOM 400 O ASP A 27 11.482 0.556 -4.940 1.00 0.00 O ATOM 401 CB ASP A 27 12.398 -0.942 -7.322 1.00 0.00 C ATOM 402 CG ASP A 27 12.926 -2.220 -7.955 1.00 0.00 C ATOM 403 OD1 ASP A 27 12.357 -2.617 -8.994 1.00 0.00 O ATOM 404 OD2 ASP A 27 13.881 -2.789 -7.385 1.00 0.00 O ATOM 405 H ASP A 27 10.283 -1.526 -8.503 1.00 0.00 H ATOM 406 HA ASP A 27 11.240 -2.004 -5.887 1.00 0.00 H ATOM 407 HB2 ASP A 27 12.259 -0.189 -8.098 1.00 0.00 H ATOM 408 HB3 ASP A 27 13.151 -0.581 -6.620 1.00 0.00 H ATOM 409 N ALA A 28 9.465 0.566 -5.912 1.00 0.00 N ATOM 410 CA ALA A 28 8.870 1.571 -5.045 1.00 0.00 C ATOM 411 C ALA A 28 8.146 0.928 -3.852 1.00 0.00 C ATOM 412 O ALA A 28 7.789 1.637 -2.913 1.00 0.00 O ATOM 413 CB ALA A 28 7.915 2.428 -5.873 1.00 0.00 C ATOM 414 H ALA A 28 8.889 0.167 -6.633 1.00 0.00 H ATOM 415 HA ALA A 28 9.647 2.230 -4.655 1.00 0.00 H ATOM 416 HB1 ALA A 28 8.437 2.839 -6.738 1.00 0.00 H ATOM 417 HB2 ALA A 28 7.081 1.816 -6.209 1.00 0.00 H ATOM 418 HB3 ALA A 28 7.538 3.250 -5.266 1.00 0.00 H ATOM 419 N CYS A 29 7.902 -0.389 -3.892 1.00 0.00 N ATOM 420 CA CYS A 29 7.369 -1.169 -2.774 1.00 0.00 C ATOM 421 C CYS A 29 8.410 -2.209 -2.357 1.00 0.00 C ATOM 422 O CYS A 29 8.765 -2.311 -1.184 1.00 0.00 O ATOM 423 CB CYS A 29 6.085 -1.865 -3.154 1.00 0.00 C ATOM 424 SG CYS A 29 4.688 -0.717 -3.292 1.00 0.00 S ATOM 425 H CYS A 29 8.214 -0.912 -4.704 1.00 0.00 H ATOM 426 HA CYS A 29 7.169 -0.533 -1.911 1.00 0.00 H ATOM 427 HB2 CYS A 29 6.219 -2.410 -4.089 1.00 0.00 H ATOM 428 HB3 CYS A 29 5.842 -2.578 -2.365 1.00 0.00 H ATOM 429 N HIS A 30 8.873 -3.004 -3.324 1.00 0.00 N ATOM 430 CA HIS A 30 9.961 -3.954 -3.159 1.00 0.00 C ATOM 431 C HIS A 30 11.292 -3.221 -3.340 1.00 0.00 C ATOM 432 O HIS A 30 11.310 -1.995 -3.406 1.00 0.00 O ATOM 433 CB HIS A 30 9.769 -5.039 -4.220 1.00 0.00 C ATOM 434 CG HIS A 30 8.481 -5.791 -4.035 1.00 0.00 C ATOM 435 ND1 HIS A 30 8.253 -6.809 -3.137 1.00 0.00 N ATOM 436 CD2 HIS A 30 7.365 -5.652 -4.808 1.00 0.00 C ATOM 437 CE1 HIS A 30 7.029 -7.302 -3.400 1.00 0.00 C ATOM 438 NE2 HIS A 30 6.450 -6.626 -4.406 1.00 0.00 N ATOM 439 H HIS A 30 8.558 -2.846 -4.274 1.00 0.00 H ATOM 440 HA HIS A 30 9.932 -4.403 -2.164 1.00 0.00 H ATOM 441 HB2 HIS A 30 9.769 -4.571 -5.207 1.00 0.00 H ATOM 442 HB3 HIS A 30 10.582 -5.757 -4.210 1.00 0.00 H ATOM 443 HD1 HIS A 30 8.890 -7.133 -2.423 1.00 0.00 H ATOM 444 HD2 HIS A 30 7.249 -4.955 -5.625 1.00 0.00 H ATOM 445 HE1 HIS A 30 6.593 -8.149 -2.894 1.00 0.00 H ATOM 446 N GLU A 31 12.394 -3.965 -3.470 1.00 0.00 N ATOM 447 CA GLU A 31 13.654 -3.434 -3.966 1.00 0.00 C ATOM 448 C GLU A 31 14.503 -4.602 -4.476 1.00 0.00 C ATOM 449 O GLU A 31 14.652 -5.602 -3.773 1.00 0.00 O ATOM 450 CB GLU A 31 14.383 -2.653 -2.861 1.00 0.00 C ATOM 451 CG GLU A 31 15.368 -1.641 -3.463 1.00 0.00 C ATOM 452 CD GLU A 31 16.228 -0.957 -2.404 1.00 0.00 C ATOM 453 OE1 GLU A 31 15.789 -0.925 -1.234 1.00 0.00 O ATOM 454 OE2 GLU A 31 17.321 -0.488 -2.785 1.00 0.00 O ATOM 455 H GLU A 31 12.350 -4.967 -3.353 1.00 0.00 H ATOM 456 HA GLU A 31 13.431 -2.755 -4.790 1.00 0.00 H ATOM 457 HB2 GLU A 31 13.672 -2.089 -2.256 1.00 0.00 H ATOM 458 HB3 GLU A 31 14.919 -3.341 -2.204 1.00 0.00 H ATOM 459 HG2 GLU A 31 16.029 -2.139 -4.170 1.00 0.00 H ATOM 460 HG3 GLU A 31 14.806 -0.871 -3.991 1.00 0.00 H ATOM 461 N GLY A 32 15.042 -4.503 -5.693 1.00 0.00 N ATOM 462 CA GLY A 32 16.078 -5.380 -6.221 1.00 0.00 C ATOM 463 C GLY A 32 15.549 -6.740 -6.675 1.00 0.00 C ATOM 464 O GLY A 32 15.781 -7.156 -7.809 1.00 0.00 O ATOM 465 H GLY A 32 14.741 -3.724 -6.285 1.00 0.00 H ATOM 466 HA2 GLY A 32 16.528 -4.880 -7.078 1.00 0.00 H ATOM 467 HA3 GLY A 32 16.852 -5.530 -5.466 1.00 0.00 H ATOM 468 N THR A 33 14.879 -7.478 -5.791 1.00 0.00 N ATOM 469 CA THR A 33 14.271 -8.764 -6.103 1.00 0.00 C ATOM 470 C THR A 33 13.072 -8.952 -5.171 1.00 0.00 C ATOM 471 O THR A 33 13.264 -9.042 -3.960 1.00 0.00 O ATOM 472 CB THR A 33 15.299 -9.895 -5.942 1.00 0.00 C ATOM 473 OG1 THR A 33 16.387 -9.700 -6.826 1.00 0.00 O ATOM 474 CG2 THR A 33 14.685 -11.265 -6.252 1.00 0.00 C ATOM 475 H THR A 33 14.740 -7.096 -4.859 1.00 0.00 H ATOM 476 HA THR A 33 13.956 -8.755 -7.144 1.00 0.00 H ATOM 477 HB THR A 33 15.676 -9.902 -4.917 1.00 0.00 H ATOM 478 HG1 THR A 33 16.225 -8.908 -7.356 1.00 0.00 H ATOM 479 HG21 THR A 33 14.264 -11.269 -7.257 1.00 0.00 H ATOM 480 HG22 THR A 33 15.461 -12.030 -6.192 1.00 0.00 H ATOM 481 HG23 THR A 33 13.903 -11.511 -5.532 1.00 0.00 H ATOM 482 N PRO A 34 11.837 -8.991 -5.693 1.00 0.00 N ATOM 483 CA PRO A 34 10.659 -9.164 -4.867 1.00 0.00 C ATOM 484 C PRO A 34 10.551 -10.622 -4.417 1.00 0.00 C ATOM 485 O PRO A 34 10.967 -11.530 -5.133 1.00 0.00 O ATOM 486 CB PRO A 34 9.491 -8.766 -5.765 1.00 0.00 C ATOM 487 CG PRO A 34 9.971 -9.173 -7.156 1.00 0.00 C ATOM 488 CD PRO A 34 11.473 -8.896 -7.098 1.00 0.00 C ATOM 489 HA PRO A 34 10.698 -8.504 -3.999 1.00 0.00 H ATOM 490 HB2 PRO A 34 8.565 -9.256 -5.468 1.00 0.00 H ATOM 491 HB3 PRO A 34 9.369 -7.684 -5.750 1.00 0.00 H ATOM 492 HG2 PRO A 34 9.800 -10.240 -7.307 1.00 0.00 H ATOM 493 HG3 PRO A 34 9.489 -8.593 -7.939 1.00 0.00 H ATOM 494 HD2 PRO A 34 11.996 -9.633 -7.709 1.00 0.00 H ATOM 495 HD3 PRO A 34 11.679 -7.886 -7.459 1.00 0.00 H ATOM 496 N ALA A 35 9.970 -10.839 -3.234 1.00 0.00 N ATOM 497 CA ALA A 35 9.739 -12.169 -2.672 1.00 0.00 C ATOM 498 C ALA A 35 8.331 -12.253 -2.094 1.00 0.00 C ATOM 499 O ALA A 35 7.554 -13.128 -2.458 1.00 0.00 O ATOM 500 CB ALA A 35 10.810 -12.481 -1.623 1.00 0.00 C ATOM 501 H ALA A 35 9.663 -10.034 -2.710 1.00 0.00 H ATOM 502 HA ALA A 35 9.801 -12.923 -3.451 1.00 0.00 H ATOM 503 HB1 ALA A 35 10.798 -11.738 -0.826 1.00 0.00 H ATOM 504 HB2 ALA A 35 10.627 -13.468 -1.198 1.00 0.00 H ATOM 505 HB3 ALA A 35 11.793 -12.477 -2.098 1.00 0.00 H ATOM 506 N LYS A 36 8.039 -11.305 -1.204 1.00 0.00 N ATOM 507 CA LYS A 36 6.799 -10.907 -0.567 1.00 0.00 C ATOM 508 C LYS A 36 7.106 -9.642 0.248 1.00 0.00 C ATOM 509 O LYS A 36 8.242 -9.171 0.206 1.00 0.00 O ATOM 510 CB LYS A 36 6.197 -12.059 0.234 1.00 0.00 C ATOM 511 CG LYS A 36 6.979 -12.474 1.484 1.00 0.00 C ATOM 512 CD LYS A 36 6.274 -12.050 2.779 1.00 0.00 C ATOM 513 CE LYS A 36 4.903 -12.734 2.970 1.00 0.00 C ATOM 514 NZ LYS A 36 3.799 -11.786 3.247 1.00 0.00 N ATOM 515 H LYS A 36 8.795 -10.704 -0.973 1.00 0.00 H ATOM 516 HA LYS A 36 6.083 -10.650 -1.332 1.00 0.00 H ATOM 517 HB2 LYS A 36 5.162 -11.822 0.475 1.00 0.00 H ATOM 518 HB3 LYS A 36 6.206 -12.904 -0.444 1.00 0.00 H ATOM 519 HG2 LYS A 36 7.085 -13.561 1.483 1.00 0.00 H ATOM 520 HG3 LYS A 36 7.982 -12.046 1.443 1.00 0.00 H ATOM 521 HD2 LYS A 36 6.930 -12.333 3.597 1.00 0.00 H ATOM 522 HD3 LYS A 36 6.196 -10.969 2.804 1.00 0.00 H ATOM 523 HE2 LYS A 36 4.636 -13.297 2.073 1.00 0.00 H ATOM 524 HE3 LYS A 36 4.966 -13.454 3.789 1.00 0.00 H ATOM 525 HZ1 LYS A 36 4.030 -10.819 3.036 1.00 0.00 H ATOM 526 HZ2 LYS A 36 3.013 -11.983 2.623 1.00 0.00 H ATOM 527 HZ3 LYS A 36 3.469 -11.833 4.198 1.00 0.00 H ATOM 528 N ILE A 37 6.122 -9.101 0.971 1.00 0.00 N ATOM 529 CA ILE A 37 6.271 -8.002 1.925 1.00 0.00 C ATOM 530 C ILE A 37 5.388 -8.378 3.121 1.00 0.00 C ATOM 531 O ILE A 37 4.462 -9.175 2.951 1.00 0.00 O ATOM 532 CB ILE A 37 5.846 -6.650 1.302 1.00 0.00 C ATOM 533 CG1 ILE A 37 6.520 -6.424 -0.065 1.00 0.00 C ATOM 534 CG2 ILE A 37 6.161 -5.480 2.250 1.00 0.00 C ATOM 535 CD1 ILE A 37 6.255 -5.042 -0.672 1.00 0.00 C ATOM 536 H ILE A 37 5.231 -9.572 1.009 1.00 0.00 H ATOM 537 HA ILE A 37 7.311 -7.940 2.254 1.00 0.00 H ATOM 538 HB ILE A 37 4.768 -6.670 1.143 1.00 0.00 H ATOM 539 HG12 ILE A 37 7.598 -6.560 0.025 1.00 0.00 H ATOM 540 HG13 ILE A 37 6.125 -7.161 -0.763 1.00 0.00 H ATOM 541 HG21 ILE A 37 5.648 -5.595 3.202 1.00 0.00 H ATOM 542 HG22 ILE A 37 7.236 -5.420 2.424 1.00 0.00 H ATOM 543 HG23 ILE A 37 5.815 -4.538 1.828 1.00 0.00 H ATOM 544 HD11 ILE A 37 5.195 -4.799 -0.613 1.00 0.00 H ATOM 545 HD12 ILE A 37 6.835 -4.279 -0.151 1.00 0.00 H ATOM 546 HD13 ILE A 37 6.558 -5.035 -1.719 1.00 0.00 H ATOM 547 N ALA A 38 5.678 -7.872 4.321 1.00 0.00 N ATOM 548 CA ALA A 38 4.816 -8.024 5.487 1.00 0.00 C ATOM 549 C ALA A 38 3.945 -6.773 5.602 1.00 0.00 C ATOM 550 O ALA A 38 4.454 -5.710 5.942 1.00 0.00 O ATOM 551 CB ALA A 38 5.674 -8.213 6.742 1.00 0.00 C ATOM 552 H ALA A 38 6.449 -7.226 4.409 1.00 0.00 H ATOM 553 HA ALA A 38 4.177 -8.904 5.394 1.00 0.00 H ATOM 554 HB1 ALA A 38 6.342 -7.362 6.879 1.00 0.00 H ATOM 555 HB2 ALA A 38 5.027 -8.299 7.616 1.00 0.00 H ATOM 556 HB3 ALA A 38 6.268 -9.123 6.650 1.00 0.00 H ATOM 557 N ILE A 39 2.651 -6.874 5.286 1.00 0.00 N ATOM 558 CA ILE A 39 1.714 -5.765 5.413 1.00 0.00 C ATOM 559 C ILE A 39 0.810 -6.009 6.616 1.00 0.00 C ATOM 560 O ILE A 39 -0.322 -6.463 6.493 1.00 0.00 O ATOM 561 CB ILE A 39 0.959 -5.562 4.094 1.00 0.00 C ATOM 562 CG1 ILE A 39 1.935 -5.201 2.964 1.00 0.00 C ATOM 563 CG2 ILE A 39 -0.117 -4.473 4.202 1.00 0.00 C ATOM 564 CD1 ILE A 39 2.670 -3.872 3.175 1.00 0.00 C ATOM 565 H ILE A 39 2.282 -7.753 4.956 1.00 0.00 H ATOM 566 HA ILE A 39 2.235 -4.833 5.626 1.00 0.00 H ATOM 567 HB ILE A 39 0.466 -6.500 3.835 1.00 0.00 H ATOM 568 HG12 ILE A 39 2.669 -5.995 2.829 1.00 0.00 H ATOM 569 HG13 ILE A 39 1.353 -5.122 2.052 1.00 0.00 H ATOM 570 HG21 ILE A 39 0.274 -3.593 4.706 1.00 0.00 H ATOM 571 HG22 ILE A 39 -0.452 -4.179 3.209 1.00 0.00 H ATOM 572 HG23 ILE A 39 -0.976 -4.845 4.758 1.00 0.00 H ATOM 573 HD11 ILE A 39 1.963 -3.071 3.400 1.00 0.00 H ATOM 574 HD12 ILE A 39 3.392 -3.955 3.986 1.00 0.00 H ATOM 575 HD13 ILE A 39 3.210 -3.618 2.263 1.00 0.00 H ATOM 576 N ASP A 40 1.336 -5.662 7.786 1.00 0.00 N ATOM 577 CA ASP A 40 0.615 -5.560 9.041 1.00 0.00 C ATOM 578 C ASP A 40 1.308 -4.491 9.888 1.00 0.00 C ATOM 579 O ASP A 40 2.198 -3.798 9.384 1.00 0.00 O ATOM 580 CB ASP A 40 0.584 -6.923 9.753 1.00 0.00 C ATOM 581 CG ASP A 40 1.894 -7.242 10.464 1.00 0.00 C ATOM 582 OD1 ASP A 40 2.951 -7.094 9.816 1.00 0.00 O ATOM 583 OD2 ASP A 40 1.805 -7.584 11.662 1.00 0.00 O ATOM 584 H ASP A 40 2.306 -5.384 7.823 1.00 0.00 H ATOM 585 HA ASP A 40 -0.410 -5.243 8.838 1.00 0.00 H ATOM 586 HB2 ASP A 40 -0.217 -6.925 10.492 1.00 0.00 H ATOM 587 HB3 ASP A 40 0.371 -7.713 9.033 1.00 0.00 H ATOM 588 N LYS A 41 0.878 -4.395 11.154 1.00 0.00 N ATOM 589 CA LYS A 41 1.474 -3.675 12.279 1.00 0.00 C ATOM 590 C LYS A 41 2.490 -2.599 11.871 1.00 0.00 C ATOM 591 O LYS A 41 2.183 -1.684 11.105 1.00 0.00 O ATOM 592 CB LYS A 41 2.037 -4.702 13.284 1.00 0.00 C ATOM 593 CG LYS A 41 0.976 -5.613 13.919 1.00 0.00 C ATOM 594 CD LYS A 41 1.700 -6.698 14.741 1.00 0.00 C ATOM 595 CE LYS A 41 1.008 -7.028 16.069 1.00 0.00 C ATOM 596 NZ LYS A 41 -0.344 -7.588 15.876 1.00 0.00 N ATOM 597 H LYS A 41 0.138 -5.040 11.382 1.00 0.00 H ATOM 598 HA LYS A 41 0.703 -3.129 12.808 1.00 0.00 H ATOM 599 HB2 LYS A 41 2.782 -5.316 12.774 1.00 0.00 H ATOM 600 HB3 LYS A 41 2.505 -4.175 14.116 1.00 0.00 H ATOM 601 HG2 LYS A 41 0.327 -4.997 14.541 1.00 0.00 H ATOM 602 HG3 LYS A 41 0.375 -6.099 13.148 1.00 0.00 H ATOM 603 HD2 LYS A 41 1.805 -7.597 14.128 1.00 0.00 H ATOM 604 HD3 LYS A 41 2.711 -6.363 14.976 1.00 0.00 H ATOM 605 HE2 LYS A 41 1.620 -7.759 16.602 1.00 0.00 H ATOM 606 HE3 LYS A 41 0.953 -6.124 16.679 1.00 0.00 H ATOM 607 HZ1 LYS A 41 -0.290 -8.440 15.335 1.00 0.00 H ATOM 608 HZ2 LYS A 41 -0.759 -7.794 16.774 1.00 0.00 H ATOM 609 HZ3 LYS A 41 -0.928 -6.925 15.387 1.00 0.00 H ATOM 610 N LYS A 42 3.708 -2.689 12.404 1.00 0.00 N ATOM 611 CA LYS A 42 4.793 -1.777 12.087 1.00 0.00 C ATOM 612 C LYS A 42 5.417 -2.157 10.742 1.00 0.00 C ATOM 613 O LYS A 42 6.617 -2.404 10.643 1.00 0.00 O ATOM 614 CB LYS A 42 5.844 -1.765 13.207 1.00 0.00 C ATOM 615 CG LYS A 42 5.318 -1.158 14.512 1.00 0.00 C ATOM 616 CD LYS A 42 6.485 -1.028 15.501 1.00 0.00 C ATOM 617 CE LYS A 42 6.045 -0.335 16.799 1.00 0.00 C ATOM 618 NZ LYS A 42 7.169 -0.170 17.746 1.00 0.00 N ATOM 619 H LYS A 42 3.891 -3.484 12.988 1.00 0.00 H ATOM 620 HA LYS A 42 4.380 -0.771 11.991 1.00 0.00 H ATOM 621 HB2 LYS A 42 6.202 -2.781 13.385 1.00 0.00 H ATOM 622 HB3 LYS A 42 6.686 -1.157 12.869 1.00 0.00 H ATOM 623 HG2 LYS A 42 4.899 -0.172 14.300 1.00 0.00 H ATOM 624 HG3 LYS A 42 4.535 -1.795 14.925 1.00 0.00 H ATOM 625 HD2 LYS A 42 6.867 -2.028 15.718 1.00 0.00 H ATOM 626 HD3 LYS A 42 7.279 -0.446 15.027 1.00 0.00 H ATOM 627 HE2 LYS A 42 5.639 0.651 16.558 1.00 0.00 H ATOM 628 HE3 LYS A 42 5.259 -0.926 17.274 1.00 0.00 H ATOM 629 HZ1 LYS A 42 7.900 0.391 17.331 1.00 0.00 H ATOM 630 HZ2 LYS A 42 6.846 0.292 18.586 1.00 0.00 H ATOM 631 HZ3 LYS A 42 7.550 -1.071 18.000 1.00 0.00 H ATOM 632 N SER A 43 4.603 -2.164 9.693 1.00 0.00 N ATOM 633 CA SER A 43 5.055 -2.155 8.317 1.00 0.00 C ATOM 634 C SER A 43 4.022 -1.357 7.532 1.00 0.00 C ATOM 635 O SER A 43 4.281 -0.193 7.217 1.00 0.00 O ATOM 636 CB SER A 43 5.283 -3.581 7.811 1.00 0.00 C ATOM 637 OG SER A 43 6.431 -4.124 8.437 1.00 0.00 O ATOM 638 H SER A 43 3.606 -2.062 9.863 1.00 0.00 H ATOM 639 HA SER A 43 6.006 -1.628 8.232 1.00 0.00 H ATOM 640 HB2 SER A 43 4.420 -4.212 8.027 1.00 0.00 H ATOM 641 HB3 SER A 43 5.453 -3.557 6.732 1.00 0.00 H ATOM 642 HG SER A 43 6.582 -3.666 9.274 1.00 0.00 H ATOM 643 N ALA A 44 2.823 -1.929 7.327 1.00 0.00 N ATOM 644 CA ALA A 44 1.672 -1.283 6.677 1.00 0.00 C ATOM 645 C ALA A 44 1.574 0.181 7.108 1.00 0.00 C ATOM 646 O ALA A 44 1.511 1.129 6.330 1.00 0.00 O ATOM 647 CB ALA A 44 0.391 -2.017 7.096 1.00 0.00 C ATOM 648 H ALA A 44 2.656 -2.824 7.778 1.00 0.00 H ATOM 649 HA ALA A 44 1.739 -1.356 5.594 1.00 0.00 H ATOM 650 HB1 ALA A 44 0.471 -3.076 6.863 1.00 0.00 H ATOM 651 HB2 ALA A 44 0.216 -1.919 8.168 1.00 0.00 H ATOM 652 HB3 ALA A 44 -0.461 -1.597 6.560 1.00 0.00 H ATOM 653 N HIS A 45 1.609 0.327 8.420 1.00 0.00 N ATOM 654 CA HIS A 45 1.340 1.544 9.158 1.00 0.00 C ATOM 655 C HIS A 45 2.623 2.181 9.685 1.00 0.00 C ATOM 656 O HIS A 45 2.577 3.066 10.538 1.00 0.00 O ATOM 657 CB HIS A 45 0.412 1.166 10.305 1.00 0.00 C ATOM 658 CG HIS A 45 -1.051 1.399 10.034 1.00 0.00 C ATOM 659 ND1 HIS A 45 -1.896 1.909 10.982 1.00 0.00 N ATOM 660 CD2 HIS A 45 -1.779 1.173 8.886 1.00 0.00 C ATOM 661 CE1 HIS A 45 -3.106 1.991 10.425 1.00 0.00 C ATOM 662 NE2 HIS A 45 -3.105 1.560 9.151 1.00 0.00 N ATOM 663 H HIS A 45 1.878 -0.513 8.909 1.00 0.00 H ATOM 664 HA HIS A 45 0.852 2.268 8.511 1.00 0.00 H ATOM 665 HB2 HIS A 45 0.611 0.127 10.560 1.00 0.00 H ATOM 666 HB3 HIS A 45 0.653 1.750 11.193 1.00 0.00 H ATOM 667 HD1 HIS A 45 -1.666 2.100 11.947 1.00 0.00 H ATOM 668 HD2 HIS A 45 -1.415 0.744 7.963 1.00 0.00 H ATOM 669 HE1 HIS A 45 -3.962 2.311 10.989 1.00 0.00 H ATOM 670 N LYS A 46 3.763 1.743 9.165 1.00 0.00 N ATOM 671 CA LYS A 46 5.067 2.264 9.551 1.00 0.00 C ATOM 672 C LYS A 46 5.543 3.172 8.439 1.00 0.00 C ATOM 673 O LYS A 46 5.962 4.305 8.690 1.00 0.00 O ATOM 674 CB LYS A 46 6.046 1.106 9.755 1.00 0.00 C ATOM 675 CG LYS A 46 7.475 1.533 10.105 1.00 0.00 C ATOM 676 CD LYS A 46 7.615 2.203 11.482 1.00 0.00 C ATOM 677 CE LYS A 46 8.394 3.525 11.388 1.00 0.00 C ATOM 678 NZ LYS A 46 7.631 4.600 10.717 1.00 0.00 N ATOM 679 H LYS A 46 3.684 1.122 8.360 1.00 0.00 H ATOM 680 HA LYS A 46 4.997 2.837 10.474 1.00 0.00 H ATOM 681 HB2 LYS A 46 5.654 0.467 10.532 1.00 0.00 H ATOM 682 HB3 LYS A 46 6.111 0.528 8.836 1.00 0.00 H ATOM 683 HG2 LYS A 46 8.093 0.634 10.083 1.00 0.00 H ATOM 684 HG3 LYS A 46 7.852 2.179 9.317 1.00 0.00 H ATOM 685 HD2 LYS A 46 6.643 2.355 11.954 1.00 0.00 H ATOM 686 HD3 LYS A 46 8.180 1.519 12.119 1.00 0.00 H ATOM 687 HE2 LYS A 46 8.645 3.855 12.399 1.00 0.00 H ATOM 688 HE3 LYS A 46 9.328 3.351 10.847 1.00 0.00 H ATOM 689 HZ1 LYS A 46 7.319 4.329 9.784 1.00 0.00 H ATOM 690 HZ2 LYS A 46 6.802 4.829 11.244 1.00 0.00 H ATOM 691 HZ3 LYS A 46 8.200 5.428 10.625 1.00 0.00 H ATOM 692 N ASP A 47 5.512 2.619 7.236 1.00 0.00 N ATOM 693 CA ASP A 47 5.969 3.240 6.012 1.00 0.00 C ATOM 694 C ASP A 47 5.164 2.617 4.882 1.00 0.00 C ATOM 695 O ASP A 47 4.313 3.294 4.307 1.00 0.00 O ATOM 696 CB ASP A 47 7.495 3.091 5.844 1.00 0.00 C ATOM 697 CG ASP A 47 8.078 1.826 6.467 1.00 0.00 C ATOM 698 OD1 ASP A 47 7.513 0.744 6.203 1.00 0.00 O ATOM 699 OD2 ASP A 47 9.038 1.981 7.252 1.00 0.00 O ATOM 700 H ASP A 47 5.250 1.636 7.189 1.00 0.00 H ATOM 701 HA ASP A 47 5.730 4.298 6.037 1.00 0.00 H ATOM 702 HB2 ASP A 47 7.757 3.114 4.787 1.00 0.00 H ATOM 703 HB3 ASP A 47 7.974 3.940 6.330 1.00 0.00 H ATOM 704 N ALA A 48 5.406 1.323 4.651 1.00 0.00 N ATOM 705 CA ALA A 48 4.816 0.433 3.660 1.00 0.00 C ATOM 706 C ALA A 48 3.575 0.989 2.970 1.00 0.00 C ATOM 707 O ALA A 48 3.587 1.151 1.750 1.00 0.00 O ATOM 708 CB ALA A 48 4.493 -0.908 4.318 1.00 0.00 C ATOM 709 H ALA A 48 6.152 0.922 5.222 1.00 0.00 H ATOM 710 HA ALA A 48 5.577 0.255 2.899 1.00 0.00 H ATOM 711 HB1 ALA A 48 5.359 -1.289 4.860 1.00 0.00 H ATOM 712 HB2 ALA A 48 3.669 -0.772 5.014 1.00 0.00 H ATOM 713 HB3 ALA A 48 4.198 -1.625 3.555 1.00 0.00 H ATOM 714 N CYS A 49 2.501 1.239 3.732 1.00 0.00 N ATOM 715 CA CYS A 49 1.302 1.848 3.195 1.00 0.00 C ATOM 716 C CYS A 49 1.312 3.372 3.420 1.00 0.00 C ATOM 717 O CYS A 49 1.364 4.118 2.444 1.00 0.00 O ATOM 718 CB CYS A 49 0.036 1.117 3.592 1.00 0.00 C ATOM 719 SG CYS A 49 -0.039 -0.655 3.167 1.00 0.00 S ATOM 720 H CYS A 49 2.547 1.118 4.738 1.00 0.00 H ATOM 721 HA CYS A 49 1.349 1.731 2.131 1.00 0.00 H ATOM 722 HB2 CYS A 49 -0.188 1.249 4.647 1.00 0.00 H ATOM 723 HB3 CYS A 49 -0.775 1.548 3.033 1.00 0.00 H ATOM 724 N LYS A 50 1.244 3.861 4.671 1.00 0.00 N ATOM 725 CA LYS A 50 1.232 5.289 5.009 1.00 0.00 C ATOM 726 C LYS A 50 2.070 6.248 4.137 1.00 0.00 C ATOM 727 O LYS A 50 1.547 7.286 3.722 1.00 0.00 O ATOM 728 CB LYS A 50 1.669 5.487 6.468 1.00 0.00 C ATOM 729 CG LYS A 50 0.573 5.142 7.482 1.00 0.00 C ATOM 730 CD LYS A 50 1.106 5.485 8.884 1.00 0.00 C ATOM 731 CE LYS A 50 0.215 4.989 10.032 1.00 0.00 C ATOM 732 NZ LYS A 50 -1.151 5.543 9.982 1.00 0.00 N ATOM 733 H LYS A 50 1.093 3.210 5.433 1.00 0.00 H ATOM 734 HA LYS A 50 0.198 5.625 4.915 1.00 0.00 H ATOM 735 HB2 LYS A 50 2.564 4.890 6.658 1.00 0.00 H ATOM 736 HB3 LYS A 50 1.925 6.539 6.612 1.00 0.00 H ATOM 737 HG2 LYS A 50 -0.314 5.731 7.252 1.00 0.00 H ATOM 738 HG3 LYS A 50 0.331 4.084 7.392 1.00 0.00 H ATOM 739 HD2 LYS A 50 2.087 5.020 9.001 1.00 0.00 H ATOM 740 HD3 LYS A 50 1.252 6.563 8.964 1.00 0.00 H ATOM 741 HE2 LYS A 50 0.145 3.907 9.995 1.00 0.00 H ATOM 742 HE3 LYS A 50 0.686 5.262 10.979 1.00 0.00 H ATOM 743 HZ1 LYS A 50 -1.115 6.552 10.011 1.00 0.00 H ATOM 744 HZ2 LYS A 50 -1.612 5.238 9.137 1.00 0.00 H ATOM 745 HZ3 LYS A 50 -1.679 5.210 10.777 1.00 0.00 H ATOM 746 N THR A 51 3.385 6.031 4.006 1.00 0.00 N ATOM 747 CA THR A 51 4.284 7.121 3.615 1.00 0.00 C ATOM 748 C THR A 51 4.048 7.559 2.174 1.00 0.00 C ATOM 749 O THR A 51 3.799 8.740 1.928 1.00 0.00 O ATOM 750 CB THR A 51 5.751 6.756 3.870 1.00 0.00 C ATOM 751 OG1 THR A 51 5.979 5.415 3.500 1.00 0.00 O ATOM 752 CG2 THR A 51 6.092 6.958 5.350 1.00 0.00 C ATOM 753 H THR A 51 3.800 5.128 4.231 1.00 0.00 H ATOM 754 HA THR A 51 4.055 7.988 4.237 1.00 0.00 H ATOM 755 HB THR A 51 6.398 7.406 3.278 1.00 0.00 H ATOM 756 HG1 THR A 51 6.909 5.205 3.618 1.00 0.00 H ATOM 757 HG21 THR A 51 5.350 6.471 5.982 1.00 0.00 H ATOM 758 HG22 THR A 51 7.080 6.552 5.567 1.00 0.00 H ATOM 759 HG23 THR A 51 6.093 8.025 5.579 1.00 0.00 H ATOM 760 N CYS A 52 4.086 6.622 1.224 1.00 0.00 N ATOM 761 CA CYS A 52 3.778 6.889 -0.180 1.00 0.00 C ATOM 762 C CYS A 52 2.256 7.011 -0.361 1.00 0.00 C ATOM 763 O CYS A 52 1.625 6.320 -1.153 1.00 0.00 O ATOM 764 CB CYS A 52 4.373 5.796 -1.025 1.00 0.00 C ATOM 765 SG CYS A 52 4.095 6.159 -2.787 1.00 0.00 S ATOM 766 H CYS A 52 4.279 5.670 1.504 1.00 0.00 H ATOM 767 HA CYS A 52 4.239 7.831 -0.481 1.00 0.00 H ATOM 768 HB2 CYS A 52 5.444 5.705 -0.841 1.00 0.00 H ATOM 769 HB3 CYS A 52 3.887 4.867 -0.741 1.00 0.00 H ATOM 770 N HIS A 53 1.646 7.896 0.424 1.00 0.00 N ATOM 771 CA HIS A 53 0.213 8.098 0.482 1.00 0.00 C ATOM 772 C HIS A 53 -0.035 9.449 1.129 1.00 0.00 C ATOM 773 O HIS A 53 -0.617 10.316 0.484 1.00 0.00 O ATOM 774 CB HIS A 53 -0.488 6.945 1.216 1.00 0.00 C ATOM 775 CG HIS A 53 -1.213 6.043 0.259 1.00 0.00 C ATOM 776 ND1 HIS A 53 -2.441 6.312 -0.292 1.00 0.00 N ATOM 777 CD2 HIS A 53 -0.718 4.912 -0.340 1.00 0.00 C ATOM 778 CE1 HIS A 53 -2.671 5.367 -1.214 1.00 0.00 C ATOM 779 NE2 HIS A 53 -1.653 4.487 -1.290 1.00 0.00 N ATOM 780 H HIS A 53 2.228 8.461 1.029 1.00 0.00 H ATOM 781 HA HIS A 53 -0.170 8.154 -0.539 1.00 0.00 H ATOM 782 HB2 HIS A 53 0.229 6.357 1.784 1.00 0.00 H ATOM 783 HB3 HIS A 53 -1.227 7.348 1.911 1.00 0.00 H ATOM 784 HD1 HIS A 53 -3.035 7.111 -0.084 1.00 0.00 H ATOM 785 HD2 HIS A 53 0.247 4.469 -0.145 1.00 0.00 H ATOM 786 HE1 HIS A 53 -3.550 5.361 -1.834 1.00 0.00 H ATOM 787 N LYS A 54 0.462 9.655 2.357 1.00 0.00 N ATOM 788 CA LYS A 54 0.466 10.966 2.998 1.00 0.00 C ATOM 789 C LYS A 54 1.358 11.962 2.241 1.00 0.00 C ATOM 790 O LYS A 54 2.432 12.316 2.723 1.00 0.00 O ATOM 791 CB LYS A 54 0.926 10.841 4.449 1.00 0.00 C ATOM 792 CG LYS A 54 -0.008 9.960 5.286 1.00 0.00 C ATOM 793 CD LYS A 54 -0.040 10.459 6.733 1.00 0.00 C ATOM 794 CE LYS A 54 1.355 10.490 7.386 1.00 0.00 C ATOM 795 NZ LYS A 54 1.357 11.248 8.656 1.00 0.00 N ATOM 796 H LYS A 54 0.906 8.884 2.852 1.00 0.00 H ATOM 797 HA LYS A 54 -0.549 11.352 3.017 1.00 0.00 H ATOM 798 HB2 LYS A 54 1.939 10.438 4.480 1.00 0.00 H ATOM 799 HB3 LYS A 54 0.932 11.852 4.862 1.00 0.00 H ATOM 800 HG2 LYS A 54 -1.022 10.021 4.884 1.00 0.00 H ATOM 801 HG3 LYS A 54 0.320 8.920 5.235 1.00 0.00 H ATOM 802 HD2 LYS A 54 -0.471 11.462 6.708 1.00 0.00 H ATOM 803 HD3 LYS A 54 -0.709 9.806 7.294 1.00 0.00 H ATOM 804 HE2 LYS A 54 1.694 9.468 7.559 1.00 0.00 H ATOM 805 HE3 LYS A 54 2.076 10.977 6.728 1.00 0.00 H ATOM 806 HZ1 LYS A 54 0.712 10.841 9.319 1.00 0.00 H ATOM 807 HZ2 LYS A 54 2.287 11.243 9.054 1.00 0.00 H ATOM 808 HZ3 LYS A 54 1.091 12.209 8.483 1.00 0.00 H ATOM 809 N SER A 55 0.910 12.401 1.065 1.00 0.00 N ATOM 810 CA SER A 55 1.655 13.180 0.079 1.00 0.00 C ATOM 811 C SER A 55 0.887 13.168 -1.246 1.00 0.00 C ATOM 812 O SER A 55 0.817 14.185 -1.933 1.00 0.00 O ATOM 813 CB SER A 55 3.075 12.615 -0.132 1.00 0.00 C ATOM 814 OG SER A 55 3.744 13.284 -1.183 1.00 0.00 O ATOM 815 H SER A 55 -0.025 12.088 0.808 1.00 0.00 H ATOM 816 HA SER A 55 1.730 14.209 0.431 1.00 0.00 H ATOM 817 HB2 SER A 55 3.685 12.739 0.762 1.00 0.00 H ATOM 818 HB3 SER A 55 3.020 11.553 -0.376 1.00 0.00 H ATOM 819 HG SER A 55 3.727 14.232 -1.020 1.00 0.00 H ATOM 820 N ASN A 56 0.339 12.007 -1.623 1.00 0.00 N ATOM 821 CA ASN A 56 -0.282 11.820 -2.922 1.00 0.00 C ATOM 822 C ASN A 56 -1.595 12.593 -3.018 1.00 0.00 C ATOM 823 O ASN A 56 -2.202 12.965 -2.016 1.00 0.00 O ATOM 824 CB ASN A 56 -0.500 10.318 -3.192 1.00 0.00 C ATOM 825 CG ASN A 56 0.402 9.821 -4.313 1.00 0.00 C ATOM 826 OD1 ASN A 56 1.434 9.204 -4.070 1.00 0.00 O ATOM 827 ND2 ASN A 56 0.030 10.092 -5.559 1.00 0.00 N ATOM 828 H ASN A 56 0.306 11.229 -0.978 1.00 0.00 H ATOM 829 HA ASN A 56 0.396 12.226 -3.675 1.00 0.00 H ATOM 830 HB2 ASN A 56 -0.293 9.733 -2.296 1.00 0.00 H ATOM 831 HB3 ASN A 56 -1.535 10.123 -3.475 1.00 0.00 H ATOM 832 HD21 ASN A 56 -0.856 10.552 -5.751 1.00 0.00 H ATOM 833 HD22 ASN A 56 0.634 9.820 -6.318 1.00 0.00 H ATOM 834 N ASN A 57 -2.059 12.793 -4.248 1.00 0.00 N ATOM 835 CA ASN A 57 -3.428 13.173 -4.534 1.00 0.00 C ATOM 836 C ASN A 57 -4.384 12.118 -3.974 1.00 0.00 C ATOM 837 O ASN A 57 -4.009 10.966 -3.772 1.00 0.00 O ATOM 838 CB ASN A 57 -3.608 13.283 -6.056 1.00 0.00 C ATOM 839 CG ASN A 57 -3.342 11.943 -6.747 1.00 0.00 C ATOM 840 OD1 ASN A 57 -2.260 11.378 -6.594 1.00 0.00 O ATOM 841 ND2 ASN A 57 -4.314 11.430 -7.495 1.00 0.00 N ATOM 842 H ASN A 57 -1.546 12.414 -5.029 1.00 0.00 H ATOM 843 HA ASN A 57 -3.629 14.142 -4.074 1.00 0.00 H ATOM 844 HB2 ASN A 57 -4.620 13.623 -6.274 1.00 0.00 H ATOM 845 HB3 ASN A 57 -2.908 14.022 -6.448 1.00 0.00 H ATOM 846 HD21 ASN A 57 -5.191 11.906 -7.623 1.00 0.00 H ATOM 847 HD22 ASN A 57 -4.161 10.528 -7.959 1.00 0.00 H ATOM 848 N GLY A 58 -5.639 12.514 -3.766 1.00 0.00 N ATOM 849 CA GLY A 58 -6.731 11.616 -3.421 1.00 0.00 C ATOM 850 C GLY A 58 -6.566 10.982 -2.032 1.00 0.00 C ATOM 851 O GLY A 58 -6.732 11.684 -1.032 1.00 0.00 O ATOM 852 H GLY A 58 -5.842 13.486 -3.930 1.00 0.00 H ATOM 853 HA2 GLY A 58 -7.648 12.205 -3.407 1.00 0.00 H ATOM 854 HA3 GLY A 58 -6.841 10.867 -4.205 1.00 0.00 H ATOM 855 N PRO A 59 -6.306 9.668 -1.922 1.00 0.00 N ATOM 856 CA PRO A 59 -6.302 8.961 -0.644 1.00 0.00 C ATOM 857 C PRO A 59 -5.066 9.296 0.206 1.00 0.00 C ATOM 858 O PRO A 59 -4.163 8.473 0.356 1.00 0.00 O ATOM 859 CB PRO A 59 -6.388 7.475 -1.009 1.00 0.00 C ATOM 860 CG PRO A 59 -5.715 7.419 -2.378 1.00 0.00 C ATOM 861 CD PRO A 59 -6.184 8.720 -3.020 1.00 0.00 C ATOM 862 HA PRO A 59 -7.192 9.222 -0.069 1.00 0.00 H ATOM 863 HB2 PRO A 59 -5.911 6.818 -0.281 1.00 0.00 H ATOM 864 HB3 PRO A 59 -7.436 7.198 -1.122 1.00 0.00 H ATOM 865 HG2 PRO A 59 -4.632 7.454 -2.260 1.00 0.00 H ATOM 866 HG3 PRO A 59 -6.008 6.541 -2.952 1.00 0.00 H ATOM 867 HD2 PRO A 59 -5.472 9.026 -3.785 1.00 0.00 H ATOM 868 HD3 PRO A 59 -7.166 8.566 -3.472 1.00 0.00 H ATOM 869 N THR A 60 -5.058 10.498 0.794 1.00 0.00 N ATOM 870 CA THR A 60 -3.981 10.999 1.648 1.00 0.00 C ATOM 871 C THR A 60 -4.465 11.463 3.029 1.00 0.00 C ATOM 872 O THR A 60 -3.623 11.766 3.874 1.00 0.00 O ATOM 873 CB THR A 60 -3.210 12.110 0.911 1.00 0.00 C ATOM 874 OG1 THR A 60 -2.123 12.581 1.688 1.00 0.00 O ATOM 875 CG2 THR A 60 -4.074 13.322 0.545 1.00 0.00 C ATOM 876 H THR A 60 -5.783 11.142 0.495 1.00 0.00 H ATOM 877 HA THR A 60 -3.265 10.197 1.836 1.00 0.00 H ATOM 878 HB THR A 60 -2.811 11.676 -0.007 1.00 0.00 H ATOM 879 HG1 THR A 60 -2.417 12.658 2.604 1.00 0.00 H ATOM 880 HG21 THR A 60 -4.558 13.740 1.429 1.00 0.00 H ATOM 881 HG22 THR A 60 -3.437 14.088 0.101 1.00 0.00 H ATOM 882 HG23 THR A 60 -4.827 13.045 -0.189 1.00 0.00 H ATOM 883 N LYS A 61 -5.780 11.577 3.271 1.00 0.00 N ATOM 884 CA LYS A 61 -6.274 12.239 4.481 1.00 0.00 C ATOM 885 C LYS A 61 -6.058 11.396 5.745 1.00 0.00 C ATOM 886 O LYS A 61 -5.488 11.865 6.727 1.00 0.00 O ATOM 887 CB LYS A 61 -7.688 12.807 4.276 1.00 0.00 C ATOM 888 CG LYS A 61 -8.789 11.795 4.560 1.00 0.00 C ATOM 889 CD LYS A 61 -10.163 12.357 4.161 1.00 0.00 C ATOM 890 CE LYS A 61 -11.328 11.448 4.585 1.00 0.00 C ATOM 891 NZ LYS A 61 -11.592 11.496 6.038 1.00 0.00 N ATOM 892 H LYS A 61 -6.432 11.335 2.542 1.00 0.00 H ATOM 893 HA LYS A 61 -5.689 13.126 4.632 1.00 0.00 H ATOM 894 HB2 LYS A 61 -7.822 13.648 4.960 1.00 0.00 H ATOM 895 HB3 LYS A 61 -7.779 13.184 3.256 1.00 0.00 H ATOM 896 HG2 LYS A 61 -8.569 10.896 3.988 1.00 0.00 H ATOM 897 HG3 LYS A 61 -8.735 11.591 5.626 1.00 0.00 H ATOM 898 HD2 LYS A 61 -10.294 13.359 4.577 1.00 0.00 H ATOM 899 HD3 LYS A 61 -10.182 12.450 3.072 1.00 0.00 H ATOM 900 HE2 LYS A 61 -12.231 11.778 4.064 1.00 0.00 H ATOM 901 HE3 LYS A 61 -11.121 10.420 4.281 1.00 0.00 H ATOM 902 HZ1 LYS A 61 -10.781 11.200 6.560 1.00 0.00 H ATOM 903 HZ2 LYS A 61 -11.838 12.436 6.317 1.00 0.00 H ATOM 904 HZ3 LYS A 61 -12.365 10.881 6.262 1.00 0.00 H ATOM 905 N CYS A 62 -6.514 10.146 5.685 1.00 0.00 N ATOM 906 CA CYS A 62 -6.290 9.074 6.650 1.00 0.00 C ATOM 907 C CYS A 62 -6.878 7.797 6.051 1.00 0.00 C ATOM 908 O CYS A 62 -6.110 6.980 5.558 1.00 0.00 O ATOM 909 CB CYS A 62 -6.817 9.370 8.045 1.00 0.00 C ATOM 910 SG CYS A 62 -7.087 7.865 9.061 1.00 0.00 S ATOM 911 H CYS A 62 -6.880 9.881 4.785 1.00 0.00 H ATOM 912 HA CYS A 62 -5.210 8.946 6.723 1.00 0.00 H ATOM 913 HB2 CYS A 62 -6.110 10.019 8.561 1.00 0.00 H ATOM 914 HB3 CYS A 62 -7.772 9.891 7.972 1.00 0.00 H ATOM 915 N GLY A 63 -8.209 7.651 6.076 1.00 0.00 N ATOM 916 CA GLY A 63 -8.910 6.431 5.682 1.00 0.00 C ATOM 917 C GLY A 63 -8.344 5.861 4.384 1.00 0.00 C ATOM 918 O GLY A 63 -7.602 4.884 4.430 1.00 0.00 O ATOM 919 H GLY A 63 -8.734 8.363 6.558 1.00 0.00 H ATOM 920 HA2 GLY A 63 -8.793 5.694 6.478 1.00 0.00 H ATOM 921 HA3 GLY A 63 -9.973 6.641 5.558 1.00 0.00 H ATOM 922 N GLY A 64 -8.663 6.527 3.266 1.00 0.00 N ATOM 923 CA GLY A 64 -8.093 6.409 1.926 1.00 0.00 C ATOM 924 C GLY A 64 -8.132 4.989 1.370 1.00 0.00 C ATOM 925 O GLY A 64 -8.883 4.674 0.453 1.00 0.00 O ATOM 926 H GLY A 64 -9.340 7.253 3.373 1.00 0.00 H ATOM 927 HA2 GLY A 64 -8.653 7.062 1.257 1.00 0.00 H ATOM 928 HA3 GLY A 64 -7.059 6.758 1.953 1.00 0.00 H ATOM 929 N CYS A 65 -7.282 4.160 1.953 1.00 0.00 N ATOM 930 CA CYS A 65 -7.171 2.728 1.740 1.00 0.00 C ATOM 931 C CYS A 65 -8.415 2.066 2.321 1.00 0.00 C ATOM 932 O CYS A 65 -9.047 1.225 1.689 1.00 0.00 O ATOM 933 CB CYS A 65 -5.921 2.239 2.428 1.00 0.00 C ATOM 934 SG CYS A 65 -4.512 3.094 1.689 1.00 0.00 S ATOM 935 H CYS A 65 -6.853 4.547 2.786 1.00 0.00 H ATOM 936 HA CYS A 65 -7.105 2.519 0.675 1.00 0.00 H ATOM 937 HB2 CYS A 65 -5.981 2.472 3.491 1.00 0.00 H ATOM 938 HB3 CYS A 65 -5.800 1.165 2.303 1.00 0.00 H ATOM 939 N HIS A 66 -8.756 2.485 3.539 1.00 0.00 N ATOM 940 CA HIS A 66 -9.945 2.082 4.255 1.00 0.00 C ATOM 941 C HIS A 66 -11.125 2.924 3.787 1.00 0.00 C ATOM 942 O HIS A 66 -11.163 4.131 4.032 1.00 0.00 O ATOM 943 CB HIS A 66 -9.714 2.295 5.753 1.00 0.00 C ATOM 944 CG HIS A 66 -8.491 1.584 6.254 1.00 0.00 C ATOM 945 ND1 HIS A 66 -8.321 0.223 6.307 1.00 0.00 N ATOM 946 CD2 HIS A 66 -7.359 2.172 6.745 1.00 0.00 C ATOM 947 CE1 HIS A 66 -7.123 -0.005 6.866 1.00 0.00 C ATOM 948 NE2 HIS A 66 -6.496 1.151 7.156 1.00 0.00 N ATOM 949 H HIS A 66 -8.173 3.197 3.964 1.00 0.00 H ATOM 950 HA HIS A 66 -10.137 1.024 4.072 1.00 0.00 H ATOM 951 HB2 HIS A 66 -9.605 3.360 5.958 1.00 0.00 H ATOM 952 HB3 HIS A 66 -10.581 1.934 6.304 1.00 0.00 H ATOM 953 HD1 HIS A 66 -8.988 -0.473 5.990 1.00 0.00 H ATOM 954 HD2 HIS A 66 -7.192 3.234 6.829 1.00 0.00 H ATOM 955 HE1 HIS A 66 -6.749 -0.994 7.081 1.00 0.00 H ATOM 956 N ILE A 67 -12.107 2.282 3.156 1.00 0.00 N ATOM 957 CA ILE A 67 -13.395 2.900 2.883 1.00 0.00 C ATOM 958 C ILE A 67 -14.096 3.121 4.228 1.00 0.00 C ATOM 959 O ILE A 67 -14.597 2.161 4.813 1.00 0.00 O ATOM 960 CB ILE A 67 -14.204 1.977 1.951 1.00 0.00 C ATOM 961 CG1 ILE A 67 -13.504 1.818 0.587 1.00 0.00 C ATOM 962 CG2 ILE A 67 -15.630 2.504 1.728 1.00 0.00 C ATOM 963 CD1 ILE A 67 -13.617 0.379 0.078 1.00 0.00 C ATOM 964 H ILE A 67 -11.988 1.302 2.935 1.00 0.00 H ATOM 965 HA ILE A 67 -13.248 3.859 2.382 1.00 0.00 H ATOM 966 HB ILE A 67 -14.277 0.998 2.428 1.00 0.00 H ATOM 967 HG12 ILE A 67 -13.949 2.495 -0.142 1.00 0.00 H ATOM 968 HG13 ILE A 67 -12.443 2.057 0.657 1.00 0.00 H ATOM 969 HG21 ILE A 67 -15.598 3.522 1.339 1.00 0.00 H ATOM 970 HG22 ILE A 67 -16.151 1.866 1.014 1.00 0.00 H ATOM 971 HG23 ILE A 67 -16.194 2.498 2.661 1.00 0.00 H ATOM 972 HD11 ILE A 67 -14.664 0.086 -0.003 1.00 0.00 H ATOM 973 HD12 ILE A 67 -13.145 0.303 -0.902 1.00 0.00 H ATOM 974 HD13 ILE A 67 -13.107 -0.295 0.766 1.00 0.00 H ATOM 975 N LYS A 68 -14.117 4.358 4.735 1.00 0.00 N ATOM 976 CA LYS A 68 -14.813 4.706 5.961 1.00 0.00 C ATOM 977 C LYS A 68 -15.265 6.160 5.890 1.00 0.00 C ATOM 978 O LYS A 68 -14.401 7.024 5.632 1.00 0.00 O ATOM 979 CB LYS A 68 -13.906 4.459 7.178 1.00 0.00 C ATOM 980 CG LYS A 68 -14.670 4.625 8.501 1.00 0.00 C ATOM 981 CD LYS A 68 -14.621 6.059 9.063 1.00 0.00 C ATOM 982 CE LYS A 68 -15.975 6.516 9.632 1.00 0.00 C ATOM 983 NZ LYS A 68 -16.867 7.045 8.579 1.00 0.00 N ATOM 984 OXT LYS A 68 -16.459 6.395 6.183 1.00 0.00 O ATOM 985 H LYS A 68 -13.654 5.119 4.255 1.00 0.00 H ATOM 986 HA LYS A 68 -15.702 4.078 6.046 1.00 0.00 H ATOM 987 HB2 LYS A 68 -13.551 3.430 7.118 1.00 0.00 H ATOM 988 HB3 LYS A 68 -13.036 5.117 7.147 1.00 0.00 H ATOM 989 HG2 LYS A 68 -15.696 4.287 8.352 1.00 0.00 H ATOM 990 HG3 LYS A 68 -14.215 3.954 9.231 1.00 0.00 H ATOM 991 HD2 LYS A 68 -13.880 6.076 9.865 1.00 0.00 H ATOM 992 HD3 LYS A 68 -14.282 6.764 8.302 1.00 0.00 H ATOM 993 HE2 LYS A 68 -16.459 5.683 10.145 1.00 0.00 H ATOM 994 HE3 LYS A 68 -15.805 7.310 10.360 1.00 0.00 H ATOM 995 HZ1 LYS A 68 -16.921 6.413 7.778 1.00 0.00 H ATOM 996 HZ2 LYS A 68 -17.798 7.233 8.916 1.00 0.00 H ATOM 997 HZ3 LYS A 68 -16.479 7.881 8.165 1.00 0.00 H TER 998 LYS A 68 HETATM 999 FE HEC A 69 4.773 -7.007 -5.299 1.00 0.00 FE HETATM 1000 CHA HEC A 69 4.134 -9.730 -3.250 1.00 0.00 C HETATM 1001 CHB HEC A 69 6.586 -8.935 -7.465 1.00 0.00 C HETATM 1002 CHC HEC A 69 4.883 -4.327 -7.429 1.00 0.00 C HETATM 1003 CHD HEC A 69 3.317 -4.954 -2.847 1.00 0.00 C HETATM 1004 NA HEC A 69 5.253 -8.972 -5.357 1.00 0.00 N HETATM 1005 C1A HEC A 69 4.872 -9.897 -4.426 1.00 0.00 C HETATM 1006 C2A HEC A 69 5.398 -11.165 -4.853 1.00 0.00 C HETATM 1007 C3A HEC A 69 6.161 -10.948 -5.980 1.00 0.00 C HETATM 1008 C4A HEC A 69 6.023 -9.551 -6.332 1.00 0.00 C HETATM 1009 CMA HEC A 69 6.970 -12.008 -6.691 1.00 0.00 C HETATM 1010 CAA HEC A 69 5.132 -12.488 -4.183 1.00 0.00 C HETATM 1011 CBA HEC A 69 3.662 -12.948 -4.234 1.00 0.00 C HETATM 1012 CGA HEC A 69 2.947 -12.688 -5.565 1.00 0.00 C HETATM 1013 O1A HEC A 69 1.739 -12.369 -5.520 1.00 0.00 O HETATM 1014 O2A HEC A 69 3.586 -12.788 -6.631 1.00 0.00 O HETATM 1015 NB HEC A 69 5.628 -6.672 -7.114 1.00 0.00 N HETATM 1016 C1B HEC A 69 6.337 -7.599 -7.818 1.00 0.00 C HETATM 1017 C2B HEC A 69 6.763 -6.964 -9.047 1.00 0.00 C HETATM 1018 C3B HEC A 69 6.206 -5.700 -9.076 1.00 0.00 C HETATM 1019 C4B HEC A 69 5.519 -5.510 -7.817 1.00 0.00 C HETATM 1020 CMB HEC A 69 7.656 -7.577 -10.101 1.00 0.00 C HETATM 1021 CAB HEC A 69 6.272 -4.694 -10.212 1.00 0.00 C HETATM 1022 CBB HEC A 69 5.437 -5.096 -11.432 1.00 0.00 C HETATM 1023 NC HEC A 69 4.229 -5.001 -5.151 1.00 0.00 N HETATM 1024 C1C HEC A 69 4.365 -4.106 -6.159 1.00 0.00 C HETATM 1025 C2C HEC A 69 3.875 -2.835 -5.683 1.00 0.00 C HETATM 1026 C3C HEC A 69 3.553 -2.988 -4.353 1.00 0.00 C HETATM 1027 C4C HEC A 69 3.683 -4.391 -4.056 1.00 0.00 C HETATM 1028 CMC HEC A 69 3.757 -1.560 -6.471 1.00 0.00 C HETATM 1029 CAC HEC A 69 3.309 -1.893 -3.328 1.00 0.00 C HETATM 1030 CBC HEC A 69 1.951 -1.195 -3.436 1.00 0.00 C HETATM 1031 ND HEC A 69 3.849 -7.295 -3.399 1.00 0.00 N HETATM 1032 C1D HEC A 69 3.376 -6.307 -2.600 1.00 0.00 C HETATM 1033 C2D HEC A 69 2.893 -6.902 -1.384 1.00 0.00 C HETATM 1034 C3D HEC A 69 3.123 -8.255 -1.477 1.00 0.00 C HETATM 1035 C4D HEC A 69 3.710 -8.494 -2.779 1.00 0.00 C HETATM 1036 CMD HEC A 69 2.258 -6.144 -0.243 1.00 0.00 C HETATM 1037 CAD HEC A 69 3.069 -9.236 -0.330 1.00 0.00 C HETATM 1038 CBD HEC A 69 1.714 -9.870 -0.027 1.00 0.00 C HETATM 1039 CGD HEC A 69 1.899 -10.794 1.168 1.00 0.00 C HETATM 1040 O1D HEC A 69 1.664 -10.346 2.307 1.00 0.00 O HETATM 1041 O2D HEC A 69 2.421 -11.912 0.972 1.00 0.00 O HETATM 1042 HHA HEC A 69 3.944 -10.595 -2.639 1.00 0.00 H HETATM 1043 HHB HEC A 69 7.167 -9.536 -8.143 1.00 0.00 H HETATM 1044 HHC HEC A 69 4.879 -3.496 -8.103 1.00 0.00 H HETATM 1045 HHD HEC A 69 2.882 -4.333 -2.085 1.00 0.00 H HETATM 1046 HMA1 HEC A 69 6.328 -12.862 -6.907 1.00 0.00 H HETATM 1047 HMA2 HEC A 69 7.388 -11.651 -7.627 1.00 0.00 H HETATM 1048 HMA3 HEC A 69 7.786 -12.328 -6.040 1.00 0.00 H HETATM 1049 HAA1 HEC A 69 5.758 -13.254 -4.638 1.00 0.00 H HETATM 1050 HAA2 HEC A 69 5.444 -12.390 -3.140 1.00 0.00 H HETATM 1051 HBA1 HEC A 69 3.626 -14.018 -4.025 1.00 0.00 H HETATM 1052 HBA2 HEC A 69 3.098 -12.446 -3.447 1.00 0.00 H HETATM 1053 HMB1 HEC A 69 7.436 -8.636 -10.232 1.00 0.00 H HETATM 1054 HMB2 HEC A 69 7.528 -7.086 -11.061 1.00 0.00 H HETATM 1055 HMB3 HEC A 69 8.696 -7.450 -9.801 1.00 0.00 H HETATM 1056 HAB HEC A 69 5.870 -3.741 -9.900 1.00 0.00 H HETATM 1057 HBB1 HEC A 69 4.395 -5.209 -11.134 1.00 0.00 H HETATM 1058 HBB2 HEC A 69 5.512 -4.315 -12.189 1.00 0.00 H HETATM 1059 HBB3 HEC A 69 5.788 -6.031 -11.861 1.00 0.00 H HETATM 1060 HMC1 HEC A 69 3.856 -1.709 -7.540 1.00 0.00 H HETATM 1061 HMC2 HEC A 69 2.757 -1.181 -6.298 1.00 0.00 H HETATM 1062 HMC3 HEC A 69 4.509 -0.845 -6.129 1.00 0.00 H HETATM 1063 HAC HEC A 69 3.352 -2.310 -2.327 1.00 0.00 H HETATM 1064 HBC1 HEC A 69 1.845 -0.493 -2.612 1.00 0.00 H HETATM 1065 HBC2 HEC A 69 1.875 -0.647 -4.368 1.00 0.00 H HETATM 1066 HBC3 HEC A 69 1.149 -1.932 -3.388 1.00 0.00 H HETATM 1067 HMD1 HEC A 69 1.947 -6.830 0.543 1.00 0.00 H HETATM 1068 HMD2 HEC A 69 2.964 -5.415 0.162 1.00 0.00 H HETATM 1069 HMD3 HEC A 69 1.387 -5.595 -0.602 1.00 0.00 H HETATM 1070 HAD1 HEC A 69 3.765 -10.051 -0.514 1.00 0.00 H HETATM 1071 HAD2 HEC A 69 3.384 -8.714 0.571 1.00 0.00 H HETATM 1072 HBD1 HEC A 69 0.977 -9.103 0.215 1.00 0.00 H HETATM 1073 HBD2 HEC A 69 1.365 -10.447 -0.884 1.00 0.00 H HETATM 1074 FE HEC A 70 -1.518 3.006 -2.598 1.00 0.00 FE HETATM 1075 CHA HEC A 70 -3.943 4.468 -4.572 1.00 0.00 C HETATM 1076 CHB HEC A 70 -3.911 1.140 -0.934 1.00 0.00 C HETATM 1077 CHC HEC A 70 0.994 1.463 -0.721 1.00 0.00 C HETATM 1078 CHD HEC A 70 0.966 4.914 -4.174 1.00 0.00 C HETATM 1079 NA HEC A 70 -3.579 2.897 -2.666 1.00 0.00 N HETATM 1080 C1A HEC A 70 -4.356 3.583 -3.564 1.00 0.00 C HETATM 1081 C2A HEC A 70 -5.726 3.209 -3.307 1.00 0.00 C HETATM 1082 C3A HEC A 70 -5.722 2.258 -2.313 1.00 0.00 C HETATM 1083 C4A HEC A 70 -4.347 2.062 -1.900 1.00 0.00 C HETATM 1084 CMA HEC A 70 -6.948 1.501 -1.855 1.00 0.00 C HETATM 1085 CAA HEC A 70 -6.949 3.730 -4.021 1.00 0.00 C HETATM 1086 CBA HEC A 70 -7.282 2.968 -5.303 1.00 0.00 C HETATM 1087 CGA HEC A 70 -8.454 3.639 -6.000 1.00 0.00 C HETATM 1088 O1A HEC A 70 -8.184 4.399 -6.954 1.00 0.00 O HETATM 1089 O2A HEC A 70 -9.592 3.416 -5.532 1.00 0.00 O HETATM 1090 NB HEC A 70 -1.464 1.580 -1.089 1.00 0.00 N HETATM 1091 C1B HEC A 70 -2.564 0.957 -0.582 1.00 0.00 C HETATM 1092 C2B HEC A 70 -2.103 0.016 0.414 1.00 0.00 C HETATM 1093 C3B HEC A 70 -0.734 0.139 0.524 1.00 0.00 C HETATM 1094 C4B HEC A 70 -0.332 1.115 -0.467 1.00 0.00 C HETATM 1095 CMB HEC A 70 -2.988 -0.932 1.176 1.00 0.00 C HETATM 1096 CAB HEC A 70 0.206 -0.732 1.357 1.00 0.00 C HETATM 1097 CBB HEC A 70 0.201 -2.188 0.873 1.00 0.00 C HETATM 1098 NC HEC A 70 0.613 3.130 -2.499 1.00 0.00 N HETATM 1099 C1C HEC A 70 1.393 2.386 -1.674 1.00 0.00 C HETATM 1100 C2C HEC A 70 2.777 2.699 -1.948 1.00 0.00 C HETATM 1101 C3C HEC A 70 2.782 3.736 -2.867 1.00 0.00 C HETATM 1102 C4C HEC A 70 1.394 3.975 -3.231 1.00 0.00 C HETATM 1103 CMC HEC A 70 3.961 1.987 -1.316 1.00 0.00 C HETATM 1104 CAC HEC A 70 3.983 4.478 -3.465 1.00 0.00 C HETATM 1105 CBC HEC A 70 5.373 3.832 -3.378 1.00 0.00 C HETATM 1106 ND HEC A 70 -1.495 4.445 -4.089 1.00 0.00 N HETATM 1107 C1D HEC A 70 -0.372 5.065 -4.573 1.00 0.00 C HETATM 1108 C2D HEC A 70 -0.804 5.933 -5.642 1.00 0.00 C HETATM 1109 C3D HEC A 70 -2.152 5.726 -5.827 1.00 0.00 C HETATM 1110 C4D HEC A 70 -2.608 4.853 -4.771 1.00 0.00 C HETATM 1111 CMD HEC A 70 0.077 6.820 -6.486 1.00 0.00 C HETATM 1112 CAD HEC A 70 -2.929 6.102 -7.063 1.00 0.00 C HETATM 1113 CBD HEC A 70 -3.625 7.462 -7.033 1.00 0.00 C HETATM 1114 CGD HEC A 70 -4.135 7.817 -8.426 1.00 0.00 C HETATM 1115 O1D HEC A 70 -4.483 6.870 -9.169 1.00 0.00 O HETATM 1116 O2D HEC A 70 -4.130 9.023 -8.743 1.00 0.00 O HETATM 1117 HHA HEC A 70 -4.698 4.891 -5.219 1.00 0.00 H HETATM 1118 HHB HEC A 70 -4.647 0.542 -0.424 1.00 0.00 H HETATM 1119 HHC HEC A 70 1.767 1.011 -0.133 1.00 0.00 H HETATM 1120 HHD HEC A 70 1.711 5.524 -4.656 1.00 0.00 H HETATM 1121 HMA1 HEC A 70 -7.710 2.201 -1.514 1.00 0.00 H HETATM 1122 HMA2 HEC A 70 -7.347 0.941 -2.701 1.00 0.00 H HETATM 1123 HMA3 HEC A 70 -6.729 0.802 -1.052 1.00 0.00 H HETATM 1124 HAA1 HEC A 70 -7.815 3.673 -3.361 1.00 0.00 H HETATM 1125 HAA2 HEC A 70 -6.813 4.779 -4.279 1.00 0.00 H HETATM 1126 HBA1 HEC A 70 -6.422 2.961 -5.973 1.00 0.00 H HETATM 1127 HBA2 HEC A 70 -7.548 1.937 -5.066 1.00 0.00 H HETATM 1128 HMB1 HEC A 70 -3.424 -1.653 0.486 1.00 0.00 H HETATM 1129 HMB2 HEC A 70 -2.424 -1.465 1.934 1.00 0.00 H HETATM 1130 HMB3 HEC A 70 -3.777 -0.362 1.659 1.00 0.00 H HETATM 1131 HAB HEC A 70 1.232 -0.406 1.245 1.00 0.00 H HETATM 1132 HBB1 HEC A 70 0.345 -2.220 -0.207 1.00 0.00 H HETATM 1133 HBB2 HEC A 70 1.012 -2.741 1.342 1.00 0.00 H HETATM 1134 HBB3 HEC A 70 -0.740 -2.674 1.118 1.00 0.00 H HETATM 1135 HMC1 HEC A 70 4.763 1.828 -2.024 1.00 0.00 H HETATM 1136 HMC2 HEC A 70 4.331 2.560 -0.466 1.00 0.00 H HETATM 1137 HMC3 HEC A 70 3.699 0.985 -0.972 1.00 0.00 H HETATM 1138 HAC HEC A 70 3.792 4.597 -4.529 1.00 0.00 H HETATM 1139 HBC1 HEC A 70 5.712 3.768 -2.347 1.00 0.00 H HETATM 1140 HBC2 HEC A 70 5.399 2.847 -3.847 1.00 0.00 H HETATM 1141 HBC3 HEC A 70 6.073 4.476 -3.908 1.00 0.00 H HETATM 1142 HMD1 HEC A 70 -0.522 7.593 -6.967 1.00 0.00 H HETATM 1143 HMD2 HEC A 70 0.826 7.305 -5.862 1.00 0.00 H HETATM 1144 HMD3 HEC A 70 0.575 6.220 -7.249 1.00 0.00 H HETATM 1145 HAD1 HEC A 70 -2.226 6.111 -7.896 1.00 0.00 H HETATM 1146 HAD2 HEC A 70 -3.674 5.335 -7.270 1.00 0.00 H HETATM 1147 HBD1 HEC A 70 -4.465 7.438 -6.338 1.00 0.00 H HETATM 1148 HBD2 HEC A 70 -2.922 8.231 -6.709 1.00 0.00 H HETATM 1149 FE HEC A 71 -4.803 1.373 8.116 1.00 0.00 FE HETATM 1150 CHA HEC A 71 -4.879 -1.944 9.122 1.00 0.00 C HETATM 1151 CHB HEC A 71 -6.572 2.361 10.905 1.00 0.00 C HETATM 1152 CHC HEC A 71 -4.491 4.674 7.100 1.00 0.00 C HETATM 1153 CHD HEC A 71 -3.418 0.387 5.021 1.00 0.00 C HETATM 1154 NA HEC A 71 -5.595 0.382 9.723 1.00 0.00 N HETATM 1155 C1A HEC A 71 -5.476 -0.968 9.945 1.00 0.00 C HETATM 1156 C2A HEC A 71 -6.108 -1.238 11.218 1.00 0.00 C HETATM 1157 C3A HEC A 71 -6.547 -0.037 11.732 1.00 0.00 C HETATM 1158 C4A HEC A 71 -6.271 0.991 10.752 1.00 0.00 C HETATM 1159 CMA HEC A 71 -7.095 0.161 13.127 1.00 0.00 C HETATM 1160 CAA HEC A 71 -6.235 -2.588 11.898 1.00 0.00 C HETATM 1161 CBA HEC A 71 -7.507 -3.356 11.520 1.00 0.00 C HETATM 1162 CGA HEC A 71 -8.771 -2.688 12.049 1.00 0.00 C HETATM 1163 O1A HEC A 71 -8.904 -2.607 13.288 1.00 0.00 O HETATM 1164 O2A HEC A 71 -9.596 -2.272 11.210 1.00 0.00 O HETATM 1165 NB HEC A 71 -5.418 3.198 8.867 1.00 0.00 N HETATM 1166 C1B HEC A 71 -6.132 3.362 10.018 1.00 0.00 C HETATM 1167 C2B HEC A 71 -6.314 4.787 10.211 1.00 0.00 C HETATM 1168 C3B HEC A 71 -5.684 5.434 9.164 1.00 0.00 C HETATM 1169 C4B HEC A 71 -5.142 4.409 8.304 1.00 0.00 C HETATM 1170 CMB HEC A 71 -7.047 5.435 11.359 1.00 0.00 C HETATM 1171 CAB HEC A 71 -5.527 6.930 8.932 1.00 0.00 C HETATM 1172 CBB HEC A 71 -4.324 7.530 9.659 1.00 0.00 C HETATM 1173 NC HEC A 71 -4.077 2.363 6.372 1.00 0.00 N HETATM 1174 C1C HEC A 71 -4.084 3.709 6.203 1.00 0.00 C HETATM 1175 C2C HEC A 71 -3.614 4.006 4.871 1.00 0.00 C HETATM 1176 C3C HEC A 71 -3.420 2.801 4.240 1.00 0.00 C HETATM 1177 C4C HEC A 71 -3.620 1.757 5.231 1.00 0.00 C HETATM 1178 CMC HEC A 71 -3.462 5.370 4.226 1.00 0.00 C HETATM 1179 CAC HEC A 71 -3.122 2.638 2.759 1.00 0.00 C HETATM 1180 CBC HEC A 71 -1.968 3.518 2.276 1.00 0.00 C HETATM 1181 ND HEC A 71 -4.158 -0.443 7.266 1.00 0.00 N HETATM 1182 C1D HEC A 71 -3.644 -0.590 6.003 1.00 0.00 C HETATM 1183 C2D HEC A 71 -3.408 -2.000 5.804 1.00 0.00 C HETATM 1184 C3D HEC A 71 -3.763 -2.655 6.962 1.00 0.00 C HETATM 1185 C4D HEC A 71 -4.291 -1.665 7.876 1.00 0.00 C HETATM 1186 CMD HEC A 71 -2.946 -2.650 4.522 1.00 0.00 C HETATM 1187 CAD HEC A 71 -3.692 -4.155 7.149 1.00 0.00 C HETATM 1188 CBD HEC A 71 -4.808 -4.904 6.412 1.00 0.00 C HETATM 1189 CGD HEC A 71 -4.302 -6.216 5.831 1.00 0.00 C HETATM 1190 O1D HEC A 71 -3.927 -6.189 4.639 1.00 0.00 O HETATM 1191 O2D HEC A 71 -4.286 -7.205 6.593 1.00 0.00 O HETATM 1192 HHA HEC A 71 -4.933 -2.975 9.433 1.00 0.00 H HETATM 1193 HHB HEC A 71 -7.109 2.673 11.785 1.00 0.00 H HETATM 1194 HHC HEC A 71 -4.366 5.685 6.781 1.00 0.00 H HETATM 1195 HHD HEC A 71 -3.029 0.060 4.072 1.00 0.00 H HETATM 1196 HMA1 HEC A 71 -8.110 -0.226 13.174 1.00 0.00 H HETATM 1197 HMA2 HEC A 71 -6.483 -0.389 13.840 1.00 0.00 H HETATM 1198 HMA3 HEC A 71 -7.084 1.205 13.427 1.00 0.00 H HETATM 1199 HAA1 HEC A 71 -5.366 -3.202 11.656 1.00 0.00 H HETATM 1200 HAA2 HEC A 71 -6.231 -2.463 12.980 1.00 0.00 H HETATM 1201 HBA1 HEC A 71 -7.566 -3.447 10.435 1.00 0.00 H HETATM 1202 HBA2 HEC A 71 -7.454 -4.358 11.946 1.00 0.00 H HETATM 1203 HMB1 HEC A 71 -6.820 4.924 12.293 1.00 0.00 H HETATM 1204 HMB2 HEC A 71 -6.751 6.478 11.468 1.00 0.00 H HETATM 1205 HMB3 HEC A 71 -8.120 5.384 11.168 1.00 0.00 H HETATM 1206 HAB HEC A 71 -5.285 7.067 7.900 1.00 0.00 H HETATM 1207 HBB1 HEC A 71 -3.424 7.021 9.298 1.00 0.00 H HETATM 1208 HBB2 HEC A 71 -4.247 8.591 9.426 1.00 0.00 H HETATM 1209 HBB3 HEC A 71 -4.431 7.395 10.734 1.00 0.00 H HETATM 1210 HMC1 HEC A 71 -2.411 5.562 4.022 1.00 0.00 H HETATM 1211 HMC2 HEC A 71 -4.024 5.393 3.293 1.00 0.00 H HETATM 1212 HMC3 HEC A 71 -3.834 6.187 4.833 1.00 0.00 H HETATM 1213 HAC HEC A 71 -2.898 1.602 2.541 1.00 0.00 H HETATM 1214 HBC1 HEC A 71 -2.352 4.484 1.965 1.00 0.00 H HETATM 1215 HBC2 HEC A 71 -1.249 3.679 3.072 1.00 0.00 H HETATM 1216 HBC3 HEC A 71 -1.487 3.045 1.421 1.00 0.00 H HETATM 1217 HMD1 HEC A 71 -3.588 -2.326 3.704 1.00 0.00 H HETATM 1218 HMD2 HEC A 71 -1.908 -2.388 4.318 1.00 0.00 H HETATM 1219 HMD3 HEC A 71 -3.021 -3.733 4.584 1.00 0.00 H HETATM 1220 HAD1 HEC A 71 -2.731 -4.495 6.757 1.00 0.00 H HETATM 1221 HAD2 HEC A 71 -3.713 -4.438 8.200 1.00 0.00 H HETATM 1222 HBD1 HEC A 71 -5.629 -5.116 7.095 1.00 0.00 H HETATM 1223 HBD2 HEC A 71 -5.192 -4.302 5.590 1.00 0.00 H