ATOM 1 N ALA A 1 -4.377 -11.473 -11.470 1.00 0.00 N ATOM 2 CA ALA A 1 -3.472 -11.139 -10.362 1.00 0.00 C ATOM 3 C ALA A 1 -3.749 -9.675 -10.207 1.00 0.00 C ATOM 4 O ALA A 1 -4.944 -9.378 -10.240 1.00 0.00 O ATOM 5 CB ALA A 1 -3.858 -11.820 -9.049 1.00 0.00 C ATOM 6 H1 ALA A 1 -5.332 -11.266 -11.200 1.00 0.00 H ATOM 7 H2 ALA A 1 -4.130 -10.924 -12.286 1.00 0.00 H ATOM 8 H3 ALA A 1 -4.294 -12.460 -11.689 1.00 0.00 H ATOM 9 HA ALA A 1 -2.436 -11.352 -10.630 1.00 0.00 H ATOM 10 HB1 ALA A 1 -3.848 -12.904 -9.157 1.00 0.00 H ATOM 11 HB2 ALA A 1 -3.146 -11.517 -8.279 1.00 0.00 H ATOM 12 HB3 ALA A 1 -4.846 -11.474 -8.735 1.00 0.00 H ATOM 13 N ASP A 2 -2.744 -8.805 -10.207 1.00 0.00 N ATOM 14 CA ASP A 2 -2.930 -7.437 -10.670 1.00 0.00 C ATOM 15 C ASP A 2 -3.585 -6.545 -9.612 1.00 0.00 C ATOM 16 O ASP A 2 -3.310 -5.346 -9.577 1.00 0.00 O ATOM 17 CB ASP A 2 -3.684 -7.391 -12.018 1.00 0.00 C ATOM 18 CG ASP A 2 -3.156 -8.392 -13.043 1.00 0.00 C ATOM 19 OD1 ASP A 2 -3.619 -9.560 -12.989 1.00 0.00 O ATOM 20 OD2 ASP A 2 -2.272 -7.988 -13.825 1.00 0.00 O ATOM 21 H ASP A 2 -1.797 -9.154 -10.197 1.00 0.00 H ATOM 22 HA ASP A 2 -1.925 -7.060 -10.838 1.00 0.00 H ATOM 23 HB2 ASP A 2 -4.749 -7.567 -11.874 1.00 0.00 H ATOM 24 HB3 ASP A 2 -3.591 -6.390 -12.438 1.00 0.00 H ATOM 25 N VAL A 3 -4.403 -7.124 -8.732 1.00 0.00 N ATOM 26 CA VAL A 3 -5.053 -6.463 -7.614 1.00 0.00 C ATOM 27 C VAL A 3 -5.209 -7.497 -6.497 1.00 0.00 C ATOM 28 O VAL A 3 -5.334 -8.689 -6.780 1.00 0.00 O ATOM 29 CB VAL A 3 -6.388 -5.844 -8.076 1.00 0.00 C ATOM 30 CG1 VAL A 3 -7.384 -6.899 -8.579 1.00 0.00 C ATOM 31 CG2 VAL A 3 -7.047 -5.004 -6.973 1.00 0.00 C ATOM 32 H VAL A 3 -4.583 -8.119 -8.818 1.00 0.00 H ATOM 33 HA VAL A 3 -4.397 -5.675 -7.254 1.00 0.00 H ATOM 34 HB VAL A 3 -6.172 -5.169 -8.905 1.00 0.00 H ATOM 35 HG11 VAL A 3 -6.947 -7.481 -9.390 1.00 0.00 H ATOM 36 HG12 VAL A 3 -7.673 -7.570 -7.771 1.00 0.00 H ATOM 37 HG13 VAL A 3 -8.279 -6.402 -8.955 1.00 0.00 H ATOM 38 HG21 VAL A 3 -6.364 -4.223 -6.641 1.00 0.00 H ATOM 39 HG22 VAL A 3 -7.945 -4.528 -7.366 1.00 0.00 H ATOM 40 HG23 VAL A 3 -7.325 -5.626 -6.123 1.00 0.00 H ATOM 41 N VAL A 4 -5.144 -7.043 -5.244 1.00 0.00 N ATOM 42 CA VAL A 4 -5.281 -7.843 -4.029 1.00 0.00 C ATOM 43 C VAL A 4 -6.146 -7.044 -3.039 1.00 0.00 C ATOM 44 O VAL A 4 -6.314 -5.833 -3.195 1.00 0.00 O ATOM 45 CB VAL A 4 -3.879 -8.184 -3.476 1.00 0.00 C ATOM 46 CG1 VAL A 4 -3.943 -9.067 -2.224 1.00 0.00 C ATOM 47 CG2 VAL A 4 -3.013 -8.902 -4.524 1.00 0.00 C ATOM 48 H VAL A 4 -5.030 -6.041 -5.114 1.00 0.00 H ATOM 49 HA VAL A 4 -5.806 -8.770 -4.265 1.00 0.00 H ATOM 50 HB VAL A 4 -3.371 -7.260 -3.207 1.00 0.00 H ATOM 51 HG11 VAL A 4 -4.528 -9.965 -2.425 1.00 0.00 H ATOM 52 HG12 VAL A 4 -2.936 -9.361 -1.926 1.00 0.00 H ATOM 53 HG13 VAL A 4 -4.386 -8.519 -1.396 1.00 0.00 H ATOM 54 HG21 VAL A 4 -3.526 -9.794 -4.884 1.00 0.00 H ATOM 55 HG22 VAL A 4 -2.801 -8.243 -5.366 1.00 0.00 H ATOM 56 HG23 VAL A 4 -2.060 -9.194 -4.083 1.00 0.00 H ATOM 57 N THR A 5 -6.757 -7.696 -2.044 1.00 0.00 N ATOM 58 CA THR A 5 -7.701 -7.049 -1.138 1.00 0.00 C ATOM 59 C THR A 5 -7.701 -7.776 0.206 1.00 0.00 C ATOM 60 O THR A 5 -7.565 -8.999 0.229 1.00 0.00 O ATOM 61 CB THR A 5 -9.098 -7.050 -1.781 1.00 0.00 C ATOM 62 OG1 THR A 5 -9.025 -6.521 -3.092 1.00 0.00 O ATOM 63 CG2 THR A 5 -10.103 -6.225 -0.975 1.00 0.00 C ATOM 64 H THR A 5 -6.609 -8.686 -1.906 1.00 0.00 H ATOM 65 HA THR A 5 -7.384 -6.021 -0.959 1.00 0.00 H ATOM 66 HB THR A 5 -9.465 -8.076 -1.846 1.00 0.00 H ATOM 67 HG1 THR A 5 -8.280 -5.908 -3.134 1.00 0.00 H ATOM 68 HG21 THR A 5 -9.739 -5.204 -0.860 1.00 0.00 H ATOM 69 HG22 THR A 5 -11.057 -6.200 -1.502 1.00 0.00 H ATOM 70 HG23 THR A 5 -10.266 -6.665 0.009 1.00 0.00 H ATOM 71 N TYR A 6 -7.814 -7.023 1.306 1.00 0.00 N ATOM 72 CA TYR A 6 -7.846 -7.520 2.674 1.00 0.00 C ATOM 73 C TYR A 6 -9.019 -6.874 3.416 1.00 0.00 C ATOM 74 O TYR A 6 -9.189 -5.652 3.391 1.00 0.00 O ATOM 75 CB TYR A 6 -6.531 -7.186 3.399 1.00 0.00 C ATOM 76 CG TYR A 6 -5.387 -8.153 3.161 1.00 0.00 C ATOM 77 CD1 TYR A 6 -4.831 -8.285 1.877 1.00 0.00 C ATOM 78 CD2 TYR A 6 -4.834 -8.878 4.236 1.00 0.00 C ATOM 79 CE1 TYR A 6 -3.784 -9.189 1.655 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.729 -9.722 4.023 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.191 -9.863 2.734 1.00 0.00 C ATOM 82 OH TYR A 6 -2.064 -10.602 2.542 1.00 0.00 O ATOM 83 H TYR A 6 -7.918 -6.018 1.195 1.00 0.00 H ATOM 84 HA TYR A 6 -7.981 -8.604 2.681 1.00 0.00 H ATOM 85 HB2 TYR A 6 -6.203 -6.190 3.107 1.00 0.00 H ATOM 86 HB3 TYR A 6 -6.732 -7.161 4.471 1.00 0.00 H ATOM 87 HD1 TYR A 6 -5.177 -7.674 1.059 1.00 0.00 H ATOM 88 HD2 TYR A 6 -5.226 -8.761 5.236 1.00 0.00 H ATOM 89 HE1 TYR A 6 -3.408 -9.325 0.654 1.00 0.00 H ATOM 90 HE2 TYR A 6 -3.268 -10.232 4.858 1.00 0.00 H ATOM 91 HH TYR A 6 -1.610 -10.315 1.733 1.00 0.00 H ATOM 92 N GLU A 7 -9.790 -7.698 4.125 1.00 0.00 N ATOM 93 CA GLU A 7 -10.744 -7.243 5.121 1.00 0.00 C ATOM 94 C GLU A 7 -9.966 -6.845 6.375 1.00 0.00 C ATOM 95 O GLU A 7 -8.968 -7.489 6.696 1.00 0.00 O ATOM 96 CB GLU A 7 -11.719 -8.384 5.448 1.00 0.00 C ATOM 97 CG GLU A 7 -12.317 -9.047 4.197 1.00 0.00 C ATOM 98 CD GLU A 7 -12.944 -8.037 3.249 1.00 0.00 C ATOM 99 OE1 GLU A 7 -13.616 -7.105 3.753 1.00 0.00 O ATOM 100 OE2 GLU A 7 -12.700 -8.170 2.029 1.00 0.00 O ATOM 101 H GLU A 7 -9.599 -8.687 4.100 1.00 0.00 H ATOM 102 HA GLU A 7 -11.295 -6.382 4.739 1.00 0.00 H ATOM 103 HB2 GLU A 7 -11.201 -9.151 6.027 1.00 0.00 H ATOM 104 HB3 GLU A 7 -12.530 -7.981 6.056 1.00 0.00 H ATOM 105 HG2 GLU A 7 -11.548 -9.600 3.657 1.00 0.00 H ATOM 106 HG3 GLU A 7 -13.089 -9.752 4.498 1.00 0.00 H ATOM 107 N ASN A 8 -10.399 -5.809 7.097 1.00 0.00 N ATOM 108 CA ASN A 8 -9.771 -5.417 8.351 1.00 0.00 C ATOM 109 C ASN A 8 -10.791 -4.716 9.241 1.00 0.00 C ATOM 110 O ASN A 8 -11.817 -4.227 8.777 1.00 0.00 O ATOM 111 CB ASN A 8 -8.564 -4.512 8.087 1.00 0.00 C ATOM 112 CG ASN A 8 -8.972 -3.229 7.378 1.00 0.00 C ATOM 113 OD1 ASN A 8 -9.377 -2.259 8.018 1.00 0.00 O ATOM 114 ND2 ASN A 8 -8.866 -3.200 6.053 1.00 0.00 N ATOM 115 H ASN A 8 -11.186 -5.240 6.783 1.00 0.00 H ATOM 116 HA ASN A 8 -9.423 -6.308 8.878 1.00 0.00 H ATOM 117 HB2 ASN A 8 -8.103 -4.247 9.038 1.00 0.00 H ATOM 118 HB3 ASN A 8 -7.827 -5.050 7.491 1.00 0.00 H ATOM 119 HD21 ASN A 8 -8.608 -4.049 5.569 1.00 0.00 H ATOM 120 HD22 ASN A 8 -9.198 -2.411 5.525 1.00 0.00 H ATOM 121 N LYS A 9 -10.523 -4.631 10.543 1.00 0.00 N ATOM 122 CA LYS A 9 -11.506 -4.099 11.478 1.00 0.00 C ATOM 123 C LYS A 9 -11.520 -2.557 11.488 1.00 0.00 C ATOM 124 O LYS A 9 -11.988 -1.964 12.463 1.00 0.00 O ATOM 125 CB LYS A 9 -11.271 -4.739 12.857 1.00 0.00 C ATOM 126 CG LYS A 9 -12.474 -4.639 13.809 1.00 0.00 C ATOM 127 CD LYS A 9 -12.027 -4.488 15.272 1.00 0.00 C ATOM 128 CE LYS A 9 -11.841 -3.021 15.702 1.00 0.00 C ATOM 129 NZ LYS A 9 -10.834 -2.295 14.899 1.00 0.00 N ATOM 130 H LYS A 9 -9.651 -4.994 10.903 1.00 0.00 H ATOM 131 HA LYS A 9 -12.495 -4.428 11.156 1.00 0.00 H ATOM 132 HB2 LYS A 9 -11.063 -5.801 12.718 1.00 0.00 H ATOM 133 HB3 LYS A 9 -10.387 -4.306 13.304 1.00 0.00 H ATOM 134 HG2 LYS A 9 -13.150 -3.826 13.540 1.00 0.00 H ATOM 135 HG3 LYS A 9 -13.040 -5.569 13.709 1.00 0.00 H ATOM 136 HD2 LYS A 9 -12.808 -4.914 15.906 1.00 0.00 H ATOM 137 HD3 LYS A 9 -11.114 -5.061 15.445 1.00 0.00 H ATOM 138 HE2 LYS A 9 -12.795 -2.500 15.619 1.00 0.00 H ATOM 139 HE3 LYS A 9 -11.529 -3.005 16.747 1.00 0.00 H ATOM 140 HZ1 LYS A 9 -9.923 -2.753 14.906 1.00 0.00 H ATOM 141 HZ2 LYS A 9 -11.107 -2.232 13.920 1.00 0.00 H ATOM 142 HZ3 LYS A 9 -10.703 -1.354 15.232 1.00 0.00 H ATOM 143 N LYS A 10 -11.041 -1.900 10.423 1.00 0.00 N ATOM 144 CA LYS A 10 -11.261 -0.490 10.144 1.00 0.00 C ATOM 145 C LYS A 10 -11.811 -0.356 8.710 1.00 0.00 C ATOM 146 O LYS A 10 -11.856 0.753 8.180 1.00 0.00 O ATOM 147 CB LYS A 10 -9.947 0.281 10.403 1.00 0.00 C ATOM 148 CG LYS A 10 -10.084 1.755 10.827 1.00 0.00 C ATOM 149 CD LYS A 10 -10.097 2.751 9.658 1.00 0.00 C ATOM 150 CE LYS A 10 -11.505 3.293 9.375 1.00 0.00 C ATOM 151 NZ LYS A 10 -11.808 3.366 7.933 1.00 0.00 N ATOM 152 H LYS A 10 -10.567 -2.401 9.684 1.00 0.00 H ATOM 153 HA LYS A 10 -12.027 -0.107 10.818 1.00 0.00 H ATOM 154 HB2 LYS A 10 -9.458 -0.193 11.254 1.00 0.00 H ATOM 155 HB3 LYS A 10 -9.266 0.184 9.558 1.00 0.00 H ATOM 156 HG2 LYS A 10 -10.933 1.889 11.500 1.00 0.00 H ATOM 157 HG3 LYS A 10 -9.196 1.983 11.412 1.00 0.00 H ATOM 158 HD2 LYS A 10 -9.454 3.596 9.908 1.00 0.00 H ATOM 159 HD3 LYS A 10 -9.666 2.266 8.785 1.00 0.00 H ATOM 160 HE2 LYS A 10 -12.241 2.618 9.819 1.00 0.00 H ATOM 161 HE3 LYS A 10 -11.619 4.279 9.829 1.00 0.00 H ATOM 162 HZ1 LYS A 10 -11.124 3.862 7.380 1.00 0.00 H ATOM 163 HZ2 LYS A 10 -11.891 2.411 7.593 1.00 0.00 H ATOM 164 HZ3 LYS A 10 -12.710 3.817 7.801 1.00 0.00 H ATOM 165 N GLY A 11 -12.268 -1.448 8.079 1.00 0.00 N ATOM 166 CA GLY A 11 -12.925 -1.407 6.781 1.00 0.00 C ATOM 167 C GLY A 11 -12.355 -2.446 5.823 1.00 0.00 C ATOM 168 O GLY A 11 -11.789 -3.457 6.230 1.00 0.00 O ATOM 169 H GLY A 11 -12.157 -2.377 8.478 1.00 0.00 H ATOM 170 HA2 GLY A 11 -13.991 -1.595 6.912 1.00 0.00 H ATOM 171 HA3 GLY A 11 -12.792 -0.430 6.322 1.00 0.00 H ATOM 172 N ASN A 12 -12.483 -2.177 4.526 1.00 0.00 N ATOM 173 CA ASN A 12 -11.853 -2.970 3.482 1.00 0.00 C ATOM 174 C ASN A 12 -10.628 -2.202 2.998 1.00 0.00 C ATOM 175 O ASN A 12 -10.720 -0.979 2.883 1.00 0.00 O ATOM 176 CB ASN A 12 -12.857 -3.171 2.346 1.00 0.00 C ATOM 177 CG ASN A 12 -12.409 -4.305 1.441 1.00 0.00 C ATOM 178 OD1 ASN A 12 -11.729 -4.076 0.447 1.00 0.00 O ATOM 179 ND2 ASN A 12 -12.782 -5.524 1.802 1.00 0.00 N ATOM 180 H ASN A 12 -12.946 -1.322 4.251 1.00 0.00 H ATOM 181 HA ASN A 12 -11.552 -3.948 3.864 1.00 0.00 H ATOM 182 HB2 ASN A 12 -13.837 -3.417 2.757 1.00 0.00 H ATOM 183 HB3 ASN A 12 -12.947 -2.257 1.757 1.00 0.00 H ATOM 184 HD21 ASN A 12 -13.287 -5.735 2.671 1.00 0.00 H ATOM 185 HD22 ASN A 12 -12.509 -6.379 1.320 1.00 0.00 H ATOM 186 N VAL A 13 -9.493 -2.872 2.756 1.00 0.00 N ATOM 187 CA VAL A 13 -8.311 -2.248 2.168 1.00 0.00 C ATOM 188 C VAL A 13 -7.917 -3.011 0.902 1.00 0.00 C ATOM 189 O VAL A 13 -7.792 -4.234 0.923 1.00 0.00 O ATOM 190 CB VAL A 13 -7.172 -2.109 3.200 1.00 0.00 C ATOM 191 CG1 VAL A 13 -6.560 -3.440 3.654 1.00 0.00 C ATOM 192 CG2 VAL A 13 -6.036 -1.248 2.637 1.00 0.00 C ATOM 193 H VAL A 13 -9.468 -3.885 2.867 1.00 0.00 H ATOM 194 HA VAL A 13 -8.567 -1.234 1.859 1.00 0.00 H ATOM 195 HB VAL A 13 -7.570 -1.596 4.076 1.00 0.00 H ATOM 196 HG11 VAL A 13 -7.333 -4.121 3.994 1.00 0.00 H ATOM 197 HG12 VAL A 13 -6.014 -3.904 2.833 1.00 0.00 H ATOM 198 HG13 VAL A 13 -5.868 -3.264 4.477 1.00 0.00 H ATOM 199 HG21 VAL A 13 -6.413 -0.280 2.315 1.00 0.00 H ATOM 200 HG22 VAL A 13 -5.281 -1.090 3.407 1.00 0.00 H ATOM 201 HG23 VAL A 13 -5.585 -1.758 1.787 1.00 0.00 H ATOM 202 N THR A 14 -7.746 -2.286 -0.205 1.00 0.00 N ATOM 203 CA THR A 14 -7.338 -2.816 -1.500 1.00 0.00 C ATOM 204 C THR A 14 -5.867 -2.470 -1.729 1.00 0.00 C ATOM 205 O THR A 14 -5.435 -1.371 -1.379 1.00 0.00 O ATOM 206 CB THR A 14 -8.249 -2.223 -2.587 1.00 0.00 C ATOM 207 OG1 THR A 14 -9.584 -2.587 -2.301 1.00 0.00 O ATOM 208 CG2 THR A 14 -7.913 -2.738 -3.990 1.00 0.00 C ATOM 209 H THR A 14 -7.817 -1.283 -0.135 1.00 0.00 H ATOM 210 HA THR A 14 -7.460 -3.896 -1.521 1.00 0.00 H ATOM 211 HB THR A 14 -8.166 -1.134 -2.587 1.00 0.00 H ATOM 212 HG1 THR A 14 -9.790 -2.351 -1.392 1.00 0.00 H ATOM 213 HG21 THR A 14 -7.966 -3.826 -4.016 1.00 0.00 H ATOM 214 HG22 THR A 14 -8.636 -2.334 -4.700 1.00 0.00 H ATOM 215 HG23 THR A 14 -6.918 -2.414 -4.296 1.00 0.00 H ATOM 216 N PHE A 15 -5.105 -3.399 -2.312 1.00 0.00 N ATOM 217 CA PHE A 15 -3.785 -3.141 -2.873 1.00 0.00 C ATOM 218 C PHE A 15 -3.967 -3.313 -4.376 1.00 0.00 C ATOM 219 O PHE A 15 -4.457 -4.369 -4.773 1.00 0.00 O ATOM 220 CB PHE A 15 -2.750 -4.184 -2.395 1.00 0.00 C ATOM 221 CG PHE A 15 -2.725 -4.564 -0.923 1.00 0.00 C ATOM 222 CD1 PHE A 15 -3.135 -3.647 0.055 1.00 0.00 C ATOM 223 CD2 PHE A 15 -2.267 -5.836 -0.524 1.00 0.00 C ATOM 224 CE1 PHE A 15 -3.196 -4.022 1.408 1.00 0.00 C ATOM 225 CE2 PHE A 15 -2.261 -6.191 0.836 1.00 0.00 C ATOM 226 CZ PHE A 15 -2.759 -5.299 1.800 1.00 0.00 C ATOM 227 H PHE A 15 -5.542 -4.271 -2.600 1.00 0.00 H ATOM 228 HA PHE A 15 -3.435 -2.134 -2.644 1.00 0.00 H ATOM 229 HB2 PHE A 15 -2.924 -5.104 -2.950 1.00 0.00 H ATOM 230 HB3 PHE A 15 -1.758 -3.827 -2.676 1.00 0.00 H ATOM 231 HD1 PHE A 15 -3.448 -2.671 -0.260 1.00 0.00 H ATOM 232 HD2 PHE A 15 -1.916 -6.554 -1.252 1.00 0.00 H ATOM 233 HE1 PHE A 15 -3.587 -3.338 2.144 1.00 0.00 H ATOM 234 HE2 PHE A 15 -1.888 -7.160 1.138 1.00 0.00 H ATOM 235 HZ PHE A 15 -2.814 -5.602 2.835 1.00 0.00 H ATOM 236 N ASP A 16 -3.548 -2.368 -5.221 1.00 0.00 N ATOM 237 CA ASP A 16 -3.334 -2.790 -6.597 1.00 0.00 C ATOM 238 C ASP A 16 -1.949 -3.397 -6.614 1.00 0.00 C ATOM 239 O ASP A 16 -1.129 -3.120 -5.738 1.00 0.00 O ATOM 240 CB ASP A 16 -3.404 -1.686 -7.645 1.00 0.00 C ATOM 241 CG ASP A 16 -4.584 -0.752 -7.474 1.00 0.00 C ATOM 242 OD1 ASP A 16 -5.727 -1.247 -7.548 1.00 0.00 O ATOM 243 OD2 ASP A 16 -4.288 0.448 -7.296 1.00 0.00 O ATOM 244 H ASP A 16 -2.997 -1.587 -4.892 1.00 0.00 H ATOM 245 HA ASP A 16 -4.081 -3.517 -6.910 1.00 0.00 H ATOM 246 HB2 ASP A 16 -2.472 -1.137 -7.645 1.00 0.00 H ATOM 247 HB3 ASP A 16 -3.502 -2.167 -8.618 1.00 0.00 H ATOM 248 N HIS A 17 -1.687 -4.183 -7.645 1.00 0.00 N ATOM 249 CA HIS A 17 -0.365 -4.683 -7.926 1.00 0.00 C ATOM 250 C HIS A 17 0.043 -4.131 -9.284 1.00 0.00 C ATOM 251 O HIS A 17 1.020 -3.391 -9.382 1.00 0.00 O ATOM 252 CB HIS A 17 -0.400 -6.219 -7.812 1.00 0.00 C ATOM 253 CG HIS A 17 0.857 -6.877 -7.295 1.00 0.00 C ATOM 254 ND1 HIS A 17 1.231 -8.182 -7.523 1.00 0.00 N ATOM 255 CD2 HIS A 17 1.795 -6.324 -6.465 1.00 0.00 C ATOM 256 CE1 HIS A 17 2.399 -8.385 -6.892 1.00 0.00 C ATOM 257 NE2 HIS A 17 2.798 -7.274 -6.247 1.00 0.00 N ATOM 258 H HIS A 17 -2.430 -4.394 -8.300 1.00 0.00 H ATOM 259 HA HIS A 17 0.329 -4.235 -7.222 1.00 0.00 H ATOM 260 HB2 HIS A 17 -1.189 -6.491 -7.109 1.00 0.00 H ATOM 261 HB3 HIS A 17 -0.659 -6.651 -8.777 1.00 0.00 H ATOM 262 HD1 HIS A 17 0.737 -8.865 -8.077 1.00 0.00 H ATOM 263 HD2 HIS A 17 1.775 -5.323 -6.068 1.00 0.00 H ATOM 264 HE1 HIS A 17 2.949 -9.314 -6.952 1.00 0.00 H ATOM 265 N LYS A 18 -0.757 -4.407 -10.315 1.00 0.00 N ATOM 266 CA LYS A 18 -0.459 -3.931 -11.660 1.00 0.00 C ATOM 267 C LYS A 18 -0.674 -2.420 -11.717 1.00 0.00 C ATOM 268 O LYS A 18 0.246 -1.682 -12.054 1.00 0.00 O ATOM 269 CB LYS A 18 -1.284 -4.706 -12.697 1.00 0.00 C ATOM 270 CG LYS A 18 -0.710 -4.703 -14.122 1.00 0.00 C ATOM 271 CD LYS A 18 -1.016 -3.431 -14.925 1.00 0.00 C ATOM 272 CE LYS A 18 -0.516 -3.615 -16.369 1.00 0.00 C ATOM 273 NZ LYS A 18 -0.951 -2.521 -17.259 1.00 0.00 N ATOM 274 H LYS A 18 -1.636 -4.882 -10.121 1.00 0.00 H ATOM 275 HA LYS A 18 0.593 -4.140 -11.856 1.00 0.00 H ATOM 276 HB2 LYS A 18 -1.257 -5.752 -12.403 1.00 0.00 H ATOM 277 HB3 LYS A 18 -2.323 -4.375 -12.699 1.00 0.00 H ATOM 278 HG2 LYS A 18 0.365 -4.880 -14.083 1.00 0.00 H ATOM 279 HG3 LYS A 18 -1.169 -5.554 -14.634 1.00 0.00 H ATOM 280 HD2 LYS A 18 -2.095 -3.264 -14.919 1.00 0.00 H ATOM 281 HD3 LYS A 18 -0.520 -2.571 -14.475 1.00 0.00 H ATOM 282 HE2 LYS A 18 0.575 -3.658 -16.363 1.00 0.00 H ATOM 283 HE3 LYS A 18 -0.899 -4.555 -16.771 1.00 0.00 H ATOM 284 HZ1 LYS A 18 -0.639 -1.612 -16.916 1.00 0.00 H ATOM 285 HZ2 LYS A 18 -0.585 -2.632 -18.191 1.00 0.00 H ATOM 286 HZ3 LYS A 18 -1.956 -2.452 -17.300 1.00 0.00 H ATOM 287 N ALA A 19 -1.879 -1.956 -11.366 1.00 0.00 N ATOM 288 CA ALA A 19 -2.227 -0.542 -11.469 1.00 0.00 C ATOM 289 C ALA A 19 -1.298 0.336 -10.623 1.00 0.00 C ATOM 290 O ALA A 19 -0.935 1.429 -11.052 1.00 0.00 O ATOM 291 CB ALA A 19 -3.699 -0.313 -11.125 1.00 0.00 C ATOM 292 H ALA A 19 -2.590 -2.610 -11.073 1.00 0.00 H ATOM 293 HA ALA A 19 -2.109 -0.244 -12.511 1.00 0.00 H ATOM 294 HB1 ALA A 19 -4.331 -0.971 -11.723 1.00 0.00 H ATOM 295 HB2 ALA A 19 -3.881 -0.497 -10.071 1.00 0.00 H ATOM 296 HB3 ALA A 19 -3.962 0.723 -11.344 1.00 0.00 H ATOM 297 N HIS A 20 -0.864 -0.139 -9.446 1.00 0.00 N ATOM 298 CA HIS A 20 0.156 0.589 -8.699 1.00 0.00 C ATOM 299 C HIS A 20 1.467 0.514 -9.507 1.00 0.00 C ATOM 300 O HIS A 20 2.065 1.547 -9.822 1.00 0.00 O ATOM 301 CB HIS A 20 0.287 0.057 -7.252 1.00 0.00 C ATOM 302 CG HIS A 20 -0.569 0.726 -6.183 1.00 0.00 C ATOM 303 ND1 HIS A 20 -1.943 0.809 -6.152 1.00 0.00 N ATOM 304 CD2 HIS A 20 -0.119 1.355 -5.043 1.00 0.00 C ATOM 305 CE1 HIS A 20 -2.300 1.440 -5.026 1.00 0.00 C ATOM 306 NE2 HIS A 20 -1.227 1.814 -4.308 1.00 0.00 N ATOM 307 H HIS A 20 -1.108 -1.085 -9.169 1.00 0.00 H ATOM 308 HA HIS A 20 -0.109 1.648 -8.636 1.00 0.00 H ATOM 309 HB2 HIS A 20 0.114 -1.020 -7.234 1.00 0.00 H ATOM 310 HB3 HIS A 20 1.311 0.226 -6.947 1.00 0.00 H ATOM 311 HD1 HIS A 20 -2.630 0.564 -6.867 1.00 0.00 H ATOM 312 HD2 HIS A 20 0.915 1.526 -4.790 1.00 0.00 H ATOM 313 HE1 HIS A 20 -3.330 1.682 -4.823 1.00 0.00 H ATOM 314 N ALA A 21 1.913 -0.697 -9.871 1.00 0.00 N ATOM 315 CA ALA A 21 3.150 -0.901 -10.622 1.00 0.00 C ATOM 316 C ALA A 21 3.302 0.013 -11.840 1.00 0.00 C ATOM 317 O ALA A 21 4.422 0.438 -12.106 1.00 0.00 O ATOM 318 CB ALA A 21 3.329 -2.362 -11.032 1.00 0.00 C ATOM 319 H ALA A 21 1.371 -1.526 -9.642 1.00 0.00 H ATOM 320 HA ALA A 21 3.976 -0.674 -9.949 1.00 0.00 H ATOM 321 HB1 ALA A 21 3.360 -2.999 -10.150 1.00 0.00 H ATOM 322 HB2 ALA A 21 2.524 -2.681 -11.691 1.00 0.00 H ATOM 323 HB3 ALA A 21 4.272 -2.456 -11.568 1.00 0.00 H ATOM 324 N GLU A 22 2.225 0.327 -12.570 1.00 0.00 N ATOM 325 CA GLU A 22 2.304 1.237 -13.712 1.00 0.00 C ATOM 326 C GLU A 22 3.059 2.527 -13.386 1.00 0.00 C ATOM 327 O GLU A 22 3.843 3.003 -14.203 1.00 0.00 O ATOM 328 CB GLU A 22 0.913 1.580 -14.255 1.00 0.00 C ATOM 329 CG GLU A 22 0.169 0.317 -14.677 1.00 0.00 C ATOM 330 CD GLU A 22 -0.973 0.623 -15.630 1.00 0.00 C ATOM 331 OE1 GLU A 22 -1.813 1.473 -15.278 1.00 0.00 O ATOM 332 OE2 GLU A 22 -0.993 -0.037 -16.693 1.00 0.00 O ATOM 333 H GLU A 22 1.338 -0.122 -12.352 1.00 0.00 H ATOM 334 HA GLU A 22 2.859 0.729 -14.503 1.00 0.00 H ATOM 335 HB2 GLU A 22 0.321 2.118 -13.511 1.00 0.00 H ATOM 336 HB3 GLU A 22 1.034 2.224 -15.129 1.00 0.00 H ATOM 337 HG2 GLU A 22 0.865 -0.375 -15.149 1.00 0.00 H ATOM 338 HG3 GLU A 22 -0.247 -0.138 -13.788 1.00 0.00 H ATOM 339 N LYS A 23 2.819 3.100 -12.203 1.00 0.00 N ATOM 340 CA LYS A 23 3.539 4.266 -11.746 1.00 0.00 C ATOM 341 C LYS A 23 4.775 3.816 -10.964 1.00 0.00 C ATOM 342 O LYS A 23 5.859 4.363 -11.146 1.00 0.00 O ATOM 343 CB LYS A 23 2.566 5.144 -10.945 1.00 0.00 C ATOM 344 CG LYS A 23 3.312 6.141 -10.057 1.00 0.00 C ATOM 345 CD LYS A 23 2.512 7.417 -9.764 1.00 0.00 C ATOM 346 CE LYS A 23 2.499 8.360 -10.980 1.00 0.00 C ATOM 347 NZ LYS A 23 1.858 9.653 -10.668 1.00 0.00 N ATOM 348 H LYS A 23 2.220 2.643 -11.523 1.00 0.00 H ATOM 349 HA LYS A 23 3.886 4.863 -12.592 1.00 0.00 H ATOM 350 HB2 LYS A 23 1.923 5.660 -11.657 1.00 0.00 H ATOM 351 HB3 LYS A 23 1.931 4.525 -10.308 1.00 0.00 H ATOM 352 HG2 LYS A 23 3.514 5.605 -9.128 1.00 0.00 H ATOM 353 HG3 LYS A 23 4.263 6.409 -10.517 1.00 0.00 H ATOM 354 HD2 LYS A 23 1.491 7.146 -9.487 1.00 0.00 H ATOM 355 HD3 LYS A 23 2.987 7.921 -8.919 1.00 0.00 H ATOM 356 HE2 LYS A 23 3.522 8.547 -11.313 1.00 0.00 H ATOM 357 HE3 LYS A 23 1.950 7.894 -11.800 1.00 0.00 H ATOM 358 HZ1 LYS A 23 0.942 9.498 -10.251 1.00 0.00 H ATOM 359 HZ2 LYS A 23 2.415 10.172 -10.004 1.00 0.00 H ATOM 360 HZ3 LYS A 23 1.747 10.205 -11.507 1.00 0.00 H ATOM 361 N LEU A 24 4.601 2.866 -10.045 1.00 0.00 N ATOM 362 CA LEU A 24 5.611 2.522 -9.066 1.00 0.00 C ATOM 363 C LEU A 24 6.835 1.801 -9.628 1.00 0.00 C ATOM 364 O LEU A 24 7.955 2.117 -9.240 1.00 0.00 O ATOM 365 CB LEU A 24 4.961 1.658 -7.994 1.00 0.00 C ATOM 366 CG LEU A 24 4.245 2.534 -6.960 1.00 0.00 C ATOM 367 CD1 LEU A 24 2.851 3.016 -7.358 1.00 0.00 C ATOM 368 CD2 LEU A 24 4.077 1.727 -5.682 1.00 0.00 C ATOM 369 H LEU A 24 3.675 2.484 -9.890 1.00 0.00 H ATOM 370 HA LEU A 24 5.990 3.444 -8.620 1.00 0.00 H ATOM 371 HB2 LEU A 24 4.252 0.951 -8.414 1.00 0.00 H ATOM 372 HB3 LEU A 24 5.779 1.083 -7.557 1.00 0.00 H ATOM 373 HG LEU A 24 4.852 3.413 -6.789 1.00 0.00 H ATOM 374 HD11 LEU A 24 2.864 3.555 -8.298 1.00 0.00 H ATOM 375 HD12 LEU A 24 2.183 2.164 -7.428 1.00 0.00 H ATOM 376 HD13 LEU A 24 2.468 3.681 -6.590 1.00 0.00 H ATOM 377 HD21 LEU A 24 5.038 1.332 -5.357 1.00 0.00 H ATOM 378 HD22 LEU A 24 3.649 2.337 -4.907 1.00 0.00 H ATOM 379 HD23 LEU A 24 3.371 0.928 -5.854 1.00 0.00 H ATOM 380 N GLY A 25 6.629 0.787 -10.466 1.00 0.00 N ATOM 381 CA GLY A 25 7.736 0.061 -11.063 1.00 0.00 C ATOM 382 C GLY A 25 8.392 -0.958 -10.128 1.00 0.00 C ATOM 383 O GLY A 25 9.613 -1.081 -10.125 1.00 0.00 O ATOM 384 H GLY A 25 5.700 0.643 -10.842 1.00 0.00 H ATOM 385 HA2 GLY A 25 7.399 -0.439 -11.971 1.00 0.00 H ATOM 386 HA3 GLY A 25 8.482 0.808 -11.314 1.00 0.00 H ATOM 387 N CYS A 26 7.579 -1.697 -9.364 1.00 0.00 N ATOM 388 CA CYS A 26 7.975 -2.805 -8.486 1.00 0.00 C ATOM 389 C CYS A 26 8.850 -2.341 -7.316 1.00 0.00 C ATOM 390 O CYS A 26 8.404 -2.335 -6.164 1.00 0.00 O ATOM 391 CB CYS A 26 8.598 -3.984 -9.216 1.00 0.00 C ATOM 392 SG CYS A 26 7.834 -4.478 -10.793 1.00 0.00 S ATOM 393 H CYS A 26 6.596 -1.492 -9.434 1.00 0.00 H ATOM 394 HA CYS A 26 7.061 -3.171 -8.035 1.00 0.00 H ATOM 395 HB2 CYS A 26 9.642 -3.763 -9.441 1.00 0.00 H ATOM 396 HB3 CYS A 26 8.585 -4.842 -8.545 1.00 0.00 H ATOM 397 N ASP A 27 10.083 -1.918 -7.603 1.00 0.00 N ATOM 398 CA ASP A 27 11.123 -1.612 -6.626 1.00 0.00 C ATOM 399 C ASP A 27 10.873 -0.299 -5.863 1.00 0.00 C ATOM 400 O ASP A 27 11.765 0.215 -5.195 1.00 0.00 O ATOM 401 CB ASP A 27 12.493 -1.618 -7.320 1.00 0.00 C ATOM 402 CG ASP A 27 12.864 -2.999 -7.841 1.00 0.00 C ATOM 403 OD1 ASP A 27 12.492 -3.291 -8.996 1.00 0.00 O ATOM 404 OD2 ASP A 27 13.508 -3.747 -7.072 1.00 0.00 O ATOM 405 H ASP A 27 10.349 -1.909 -8.586 1.00 0.00 H ATOM 406 HA ASP A 27 11.132 -2.422 -5.899 1.00 0.00 H ATOM 407 HB2 ASP A 27 12.495 -0.905 -8.145 1.00 0.00 H ATOM 408 HB3 ASP A 27 13.260 -1.319 -6.604 1.00 0.00 H ATOM 409 N ALA A 28 9.657 0.254 -5.949 1.00 0.00 N ATOM 410 CA ALA A 28 9.181 1.316 -5.073 1.00 0.00 C ATOM 411 C ALA A 28 8.447 0.732 -3.859 1.00 0.00 C ATOM 412 O ALA A 28 8.271 1.433 -2.865 1.00 0.00 O ATOM 413 CB ALA A 28 8.265 2.252 -5.860 1.00 0.00 C ATOM 414 H ALA A 28 8.984 -0.184 -6.554 1.00 0.00 H ATOM 415 HA ALA A 28 10.021 1.908 -4.709 1.00 0.00 H ATOM 416 HB1 ALA A 28 8.799 2.653 -6.723 1.00 0.00 H ATOM 417 HB2 ALA A 28 7.389 1.704 -6.195 1.00 0.00 H ATOM 418 HB3 ALA A 28 7.950 3.078 -5.223 1.00 0.00 H ATOM 419 N CYS A 29 7.998 -0.528 -3.946 1.00 0.00 N ATOM 420 CA CYS A 29 7.443 -1.279 -2.822 1.00 0.00 C ATOM 421 C CYS A 29 8.437 -2.372 -2.429 1.00 0.00 C ATOM 422 O CYS A 29 8.769 -2.531 -1.257 1.00 0.00 O ATOM 423 CB CYS A 29 6.121 -1.904 -3.189 1.00 0.00 C ATOM 424 SG CYS A 29 4.797 -0.675 -3.362 1.00 0.00 S ATOM 425 H CYS A 29 8.173 -1.047 -4.798 1.00 0.00 H ATOM 426 HA CYS A 29 7.285 -0.637 -1.955 1.00 0.00 H ATOM 427 HB2 CYS A 29 6.229 -2.474 -4.113 1.00 0.00 H ATOM 428 HB3 CYS A 29 5.834 -2.587 -2.388 1.00 0.00 H ATOM 429 N HIS A 30 8.890 -3.144 -3.420 1.00 0.00 N ATOM 430 CA HIS A 30 9.910 -4.165 -3.260 1.00 0.00 C ATOM 431 C HIS A 30 11.298 -3.529 -3.354 1.00 0.00 C ATOM 432 O HIS A 30 11.410 -2.308 -3.445 1.00 0.00 O ATOM 433 CB HIS A 30 9.676 -5.207 -4.356 1.00 0.00 C ATOM 434 CG HIS A 30 8.349 -5.901 -4.199 1.00 0.00 C ATOM 435 ND1 HIS A 30 8.024 -6.808 -3.217 1.00 0.00 N ATOM 436 CD2 HIS A 30 7.264 -5.765 -5.020 1.00 0.00 C ATOM 437 CE1 HIS A 30 6.773 -7.229 -3.465 1.00 0.00 C ATOM 438 NE2 HIS A 30 6.267 -6.626 -4.550 1.00 0.00 N ATOM 439 H HIS A 30 8.587 -2.953 -4.369 1.00 0.00 H ATOM 440 HA HIS A 30 9.814 -4.645 -2.283 1.00 0.00 H ATOM 441 HB2 HIS A 30 9.716 -4.717 -5.331 1.00 0.00 H ATOM 442 HB3 HIS A 30 10.458 -5.960 -4.341 1.00 0.00 H ATOM 443 HD1 HIS A 30 8.607 -7.092 -2.442 1.00 0.00 H ATOM 444 HD2 HIS A 30 7.210 -5.130 -5.893 1.00 0.00 H ATOM 445 HE1 HIS A 30 6.253 -7.970 -2.881 1.00 0.00 H ATOM 446 N GLU A 31 12.351 -4.354 -3.357 1.00 0.00 N ATOM 447 CA GLU A 31 13.706 -3.925 -3.670 1.00 0.00 C ATOM 448 C GLU A 31 14.523 -5.152 -4.086 1.00 0.00 C ATOM 449 O GLU A 31 14.773 -6.032 -3.265 1.00 0.00 O ATOM 450 CB GLU A 31 14.338 -3.211 -2.464 1.00 0.00 C ATOM 451 CG GLU A 31 15.670 -2.544 -2.836 1.00 0.00 C ATOM 452 CD GLU A 31 16.308 -1.862 -1.632 1.00 0.00 C ATOM 453 OE1 GLU A 31 16.663 -2.600 -0.688 1.00 0.00 O ATOM 454 OE2 GLU A 31 16.430 -0.618 -1.675 1.00 0.00 O ATOM 455 H GLU A 31 12.211 -5.345 -3.234 1.00 0.00 H ATOM 456 HA GLU A 31 13.663 -3.218 -4.501 1.00 0.00 H ATOM 457 HB2 GLU A 31 13.670 -2.429 -2.102 1.00 0.00 H ATOM 458 HB3 GLU A 31 14.510 -3.925 -1.656 1.00 0.00 H ATOM 459 HG2 GLU A 31 16.374 -3.288 -3.208 1.00 0.00 H ATOM 460 HG3 GLU A 31 15.497 -1.800 -3.614 1.00 0.00 H ATOM 461 N GLY A 32 14.931 -5.222 -5.355 1.00 0.00 N ATOM 462 CA GLY A 32 15.974 -6.115 -5.836 1.00 0.00 C ATOM 463 C GLY A 32 15.695 -7.588 -5.543 1.00 0.00 C ATOM 464 O GLY A 32 16.542 -8.262 -4.961 1.00 0.00 O ATOM 465 H GLY A 32 14.550 -4.536 -6.012 1.00 0.00 H ATOM 466 HA2 GLY A 32 16.069 -5.986 -6.914 1.00 0.00 H ATOM 467 HA3 GLY A 32 16.918 -5.831 -5.371 1.00 0.00 H ATOM 468 N THR A 33 14.538 -8.075 -6.012 1.00 0.00 N ATOM 469 CA THR A 33 13.975 -9.427 -5.927 1.00 0.00 C ATOM 470 C THR A 33 12.687 -9.353 -5.101 1.00 0.00 C ATOM 471 O THR A 33 12.752 -9.376 -3.872 1.00 0.00 O ATOM 472 CB THR A 33 14.935 -10.491 -5.365 1.00 0.00 C ATOM 473 OG1 THR A 33 16.102 -10.572 -6.157 1.00 0.00 O ATOM 474 CG2 THR A 33 14.302 -11.888 -5.371 1.00 0.00 C ATOM 475 H THR A 33 13.943 -7.385 -6.440 1.00 0.00 H ATOM 476 HA THR A 33 13.759 -9.735 -6.948 1.00 0.00 H ATOM 477 HB THR A 33 15.194 -10.229 -4.340 1.00 0.00 H ATOM 478 HG1 THR A 33 16.654 -9.818 -5.913 1.00 0.00 H ATOM 479 HG21 THR A 33 14.007 -12.160 -6.385 1.00 0.00 H ATOM 480 HG22 THR A 33 15.033 -12.613 -5.013 1.00 0.00 H ATOM 481 HG23 THR A 33 13.430 -11.925 -4.719 1.00 0.00 H ATOM 482 N PRO A 34 11.510 -9.245 -5.735 1.00 0.00 N ATOM 483 CA PRO A 34 10.259 -9.140 -5.009 1.00 0.00 C ATOM 484 C PRO A 34 9.873 -10.496 -4.414 1.00 0.00 C ATOM 485 O PRO A 34 10.253 -11.548 -4.927 1.00 0.00 O ATOM 486 CB PRO A 34 9.244 -8.647 -6.037 1.00 0.00 C ATOM 487 CG PRO A 34 9.756 -9.246 -7.344 1.00 0.00 C ATOM 488 CD PRO A 34 11.275 -9.223 -7.171 1.00 0.00 C ATOM 489 HA PRO A 34 10.349 -8.406 -4.207 1.00 0.00 H ATOM 490 HB2 PRO A 34 8.228 -8.950 -5.791 1.00 0.00 H ATOM 491 HB3 PRO A 34 9.306 -7.563 -6.118 1.00 0.00 H ATOM 492 HG2 PRO A 34 9.410 -10.277 -7.434 1.00 0.00 H ATOM 493 HG3 PRO A 34 9.440 -8.656 -8.204 1.00 0.00 H ATOM 494 HD2 PRO A 34 11.700 -10.096 -7.669 1.00 0.00 H ATOM 495 HD3 PRO A 34 11.685 -8.305 -7.594 1.00 0.00 H ATOM 496 N ALA A 35 9.107 -10.460 -3.323 1.00 0.00 N ATOM 497 CA ALA A 35 8.635 -11.612 -2.574 1.00 0.00 C ATOM 498 C ALA A 35 7.510 -11.103 -1.675 1.00 0.00 C ATOM 499 O ALA A 35 7.187 -9.915 -1.723 1.00 0.00 O ATOM 500 CB ALA A 35 9.784 -12.214 -1.755 1.00 0.00 C ATOM 501 H ALA A 35 8.758 -9.573 -2.987 1.00 0.00 H ATOM 502 HA ALA A 35 8.238 -12.360 -3.261 1.00 0.00 H ATOM 503 HB1 ALA A 35 10.174 -11.471 -1.059 1.00 0.00 H ATOM 504 HB2 ALA A 35 9.431 -13.079 -1.193 1.00 0.00 H ATOM 505 HB3 ALA A 35 10.586 -12.536 -2.419 1.00 0.00 H ATOM 506 N LYS A 36 6.897 -11.973 -0.867 1.00 0.00 N ATOM 507 CA LYS A 36 5.780 -11.556 -0.034 1.00 0.00 C ATOM 508 C LYS A 36 6.227 -10.531 1.020 1.00 0.00 C ATOM 509 O LYS A 36 6.974 -10.869 1.935 1.00 0.00 O ATOM 510 CB LYS A 36 5.012 -12.767 0.530 1.00 0.00 C ATOM 511 CG LYS A 36 5.774 -13.586 1.584 1.00 0.00 C ATOM 512 CD LYS A 36 5.327 -13.265 3.024 1.00 0.00 C ATOM 513 CE LYS A 36 3.943 -13.817 3.412 1.00 0.00 C ATOM 514 NZ LYS A 36 3.908 -15.293 3.468 1.00 0.00 N ATOM 515 H LYS A 36 7.205 -12.933 -0.839 1.00 0.00 H ATOM 516 HA LYS A 36 5.082 -11.070 -0.704 1.00 0.00 H ATOM 517 HB2 LYS A 36 4.070 -12.406 0.942 1.00 0.00 H ATOM 518 HB3 LYS A 36 4.774 -13.423 -0.308 1.00 0.00 H ATOM 519 HG2 LYS A 36 5.649 -14.647 1.371 1.00 0.00 H ATOM 520 HG3 LYS A 36 6.839 -13.365 1.490 1.00 0.00 H ATOM 521 HD2 LYS A 36 6.082 -13.647 3.714 1.00 0.00 H ATOM 522 HD3 LYS A 36 5.297 -12.183 3.158 1.00 0.00 H ATOM 523 HE2 LYS A 36 3.689 -13.429 4.400 1.00 0.00 H ATOM 524 HE3 LYS A 36 3.183 -13.463 2.712 1.00 0.00 H ATOM 525 HZ1 LYS A 36 4.594 -15.634 4.128 1.00 0.00 H ATOM 526 HZ2 LYS A 36 2.992 -15.597 3.766 1.00 0.00 H ATOM 527 HZ3 LYS A 36 4.098 -15.684 2.556 1.00 0.00 H ATOM 528 N ILE A 37 5.786 -9.276 0.892 1.00 0.00 N ATOM 529 CA ILE A 37 6.042 -8.260 1.903 1.00 0.00 C ATOM 530 C ILE A 37 5.228 -8.609 3.150 1.00 0.00 C ATOM 531 O ILE A 37 4.062 -8.992 3.059 1.00 0.00 O ATOM 532 CB ILE A 37 5.700 -6.853 1.374 1.00 0.00 C ATOM 533 CG1 ILE A 37 6.531 -6.544 0.112 1.00 0.00 C ATOM 534 CG2 ILE A 37 5.948 -5.787 2.454 1.00 0.00 C ATOM 535 CD1 ILE A 37 6.234 -5.170 -0.498 1.00 0.00 C ATOM 536 H ILE A 37 5.222 -9.026 0.096 1.00 0.00 H ATOM 537 HA ILE A 37 7.106 -8.280 2.148 1.00 0.00 H ATOM 538 HB ILE A 37 4.641 -6.837 1.127 1.00 0.00 H ATOM 539 HG12 ILE A 37 7.595 -6.601 0.350 1.00 0.00 H ATOM 540 HG13 ILE A 37 6.308 -7.290 -0.646 1.00 0.00 H ATOM 541 HG21 ILE A 37 5.352 -5.987 3.343 1.00 0.00 H ATOM 542 HG22 ILE A 37 7.003 -5.766 2.727 1.00 0.00 H ATOM 543 HG23 ILE A 37 5.652 -4.803 2.092 1.00 0.00 H ATOM 544 HD11 ILE A 37 5.161 -5.048 -0.641 1.00 0.00 H ATOM 545 HD12 ILE A 37 6.613 -4.372 0.140 1.00 0.00 H ATOM 546 HD13 ILE A 37 6.729 -5.086 -1.466 1.00 0.00 H ATOM 547 N ALA A 38 5.840 -8.467 4.326 1.00 0.00 N ATOM 548 CA ALA A 38 5.186 -8.717 5.602 1.00 0.00 C ATOM 549 C ALA A 38 4.305 -7.522 5.976 1.00 0.00 C ATOM 550 O ALA A 38 4.603 -6.796 6.925 1.00 0.00 O ATOM 551 CB ALA A 38 6.246 -9.014 6.668 1.00 0.00 C ATOM 552 H ALA A 38 6.777 -8.097 4.326 1.00 0.00 H ATOM 553 HA ALA A 38 4.549 -9.599 5.522 1.00 0.00 H ATOM 554 HB1 ALA A 38 6.825 -9.890 6.377 1.00 0.00 H ATOM 555 HB2 ALA A 38 6.916 -8.162 6.783 1.00 0.00 H ATOM 556 HB3 ALA A 38 5.756 -9.215 7.622 1.00 0.00 H ATOM 557 N ILE A 39 3.225 -7.307 5.223 1.00 0.00 N ATOM 558 CA ILE A 39 2.241 -6.290 5.571 1.00 0.00 C ATOM 559 C ILE A 39 1.619 -6.633 6.928 1.00 0.00 C ATOM 560 O ILE A 39 1.296 -7.788 7.198 1.00 0.00 O ATOM 561 CB ILE A 39 1.186 -6.139 4.461 1.00 0.00 C ATOM 562 CG1 ILE A 39 1.811 -5.674 3.133 1.00 0.00 C ATOM 563 CG2 ILE A 39 0.062 -5.176 4.875 1.00 0.00 C ATOM 564 CD1 ILE A 39 2.544 -4.328 3.194 1.00 0.00 C ATOM 565 H ILE A 39 3.047 -7.927 4.438 1.00 0.00 H ATOM 566 HA ILE A 39 2.766 -5.343 5.685 1.00 0.00 H ATOM 567 HB ILE A 39 0.728 -7.114 4.284 1.00 0.00 H ATOM 568 HG12 ILE A 39 2.511 -6.434 2.782 1.00 0.00 H ATOM 569 HG13 ILE A 39 1.007 -5.589 2.400 1.00 0.00 H ATOM 570 HG21 ILE A 39 0.479 -4.235 5.230 1.00 0.00 H ATOM 571 HG22 ILE A 39 -0.590 -4.980 4.024 1.00 0.00 H ATOM 572 HG23 ILE A 39 -0.540 -5.620 5.668 1.00 0.00 H ATOM 573 HD11 ILE A 39 1.888 -3.546 3.576 1.00 0.00 H ATOM 574 HD12 ILE A 39 3.431 -4.394 3.822 1.00 0.00 H ATOM 575 HD13 ILE A 39 2.864 -4.051 2.190 1.00 0.00 H ATOM 576 N ASP A 40 1.486 -5.612 7.778 1.00 0.00 N ATOM 577 CA ASP A 40 1.018 -5.682 9.151 1.00 0.00 C ATOM 578 C ASP A 40 0.772 -4.236 9.579 1.00 0.00 C ATOM 579 O ASP A 40 1.347 -3.320 8.983 1.00 0.00 O ATOM 580 CB ASP A 40 2.103 -6.339 10.023 1.00 0.00 C ATOM 581 CG ASP A 40 1.781 -6.363 11.510 1.00 0.00 C ATOM 582 OD1 ASP A 40 0.588 -6.249 11.859 1.00 0.00 O ATOM 583 OD2 ASP A 40 2.755 -6.428 12.291 1.00 0.00 O ATOM 584 H ASP A 40 1.748 -4.686 7.471 1.00 0.00 H ATOM 585 HA ASP A 40 0.089 -6.252 9.202 1.00 0.00 H ATOM 586 HB2 ASP A 40 2.240 -7.373 9.701 1.00 0.00 H ATOM 587 HB3 ASP A 40 3.046 -5.809 9.883 1.00 0.00 H ATOM 588 N LYS A 41 0.013 -4.021 10.654 1.00 0.00 N ATOM 589 CA LYS A 41 -0.188 -2.720 11.285 1.00 0.00 C ATOM 590 C LYS A 41 1.065 -2.246 12.046 1.00 0.00 C ATOM 591 O LYS A 41 1.029 -1.255 12.772 1.00 0.00 O ATOM 592 CB LYS A 41 -1.425 -2.797 12.194 1.00 0.00 C ATOM 593 CG LYS A 41 -1.998 -1.412 12.541 1.00 0.00 C ATOM 594 CD LYS A 41 -2.521 -1.343 13.980 1.00 0.00 C ATOM 595 CE LYS A 41 -1.345 -1.216 14.964 1.00 0.00 C ATOM 596 NZ LYS A 41 -1.792 -1.160 16.371 1.00 0.00 N ATOM 597 H LYS A 41 -0.223 -4.863 11.185 1.00 0.00 H ATOM 598 HA LYS A 41 -0.366 -2.005 10.487 1.00 0.00 H ATOM 599 HB2 LYS A 41 -2.210 -3.360 11.685 1.00 0.00 H ATOM 600 HB3 LYS A 41 -1.153 -3.352 13.090 1.00 0.00 H ATOM 601 HG2 LYS A 41 -1.251 -0.633 12.404 1.00 0.00 H ATOM 602 HG3 LYS A 41 -2.806 -1.193 11.846 1.00 0.00 H ATOM 603 HD2 LYS A 41 -3.167 -0.465 14.061 1.00 0.00 H ATOM 604 HD3 LYS A 41 -3.116 -2.236 14.184 1.00 0.00 H ATOM 605 HE2 LYS A 41 -0.669 -2.065 14.852 1.00 0.00 H ATOM 606 HE3 LYS A 41 -0.782 -0.308 14.734 1.00 0.00 H ATOM 607 HZ1 LYS A 41 -2.397 -0.364 16.518 1.00 0.00 H ATOM 608 HZ2 LYS A 41 -2.287 -2.006 16.613 1.00 0.00 H ATOM 609 HZ3 LYS A 41 -0.986 -1.071 16.976 1.00 0.00 H ATOM 610 N LYS A 42 2.184 -2.941 11.861 1.00 0.00 N ATOM 611 CA LYS A 42 3.521 -2.541 12.261 1.00 0.00 C ATOM 612 C LYS A 42 4.250 -1.884 11.077 1.00 0.00 C ATOM 613 O LYS A 42 5.198 -1.132 11.288 1.00 0.00 O ATOM 614 CB LYS A 42 4.237 -3.807 12.747 1.00 0.00 C ATOM 615 CG LYS A 42 5.578 -3.557 13.441 1.00 0.00 C ATOM 616 CD LYS A 42 6.283 -4.869 13.827 1.00 0.00 C ATOM 617 CE LYS A 42 5.464 -5.772 14.769 1.00 0.00 C ATOM 618 NZ LYS A 42 4.589 -6.728 14.052 1.00 0.00 N ATOM 619 H LYS A 42 2.098 -3.806 11.356 1.00 0.00 H ATOM 620 HA LYS A 42 3.470 -1.828 13.086 1.00 0.00 H ATOM 621 HB2 LYS A 42 3.572 -4.280 13.468 1.00 0.00 H ATOM 622 HB3 LYS A 42 4.392 -4.474 11.898 1.00 0.00 H ATOM 623 HG2 LYS A 42 6.237 -3.002 12.770 1.00 0.00 H ATOM 624 HG3 LYS A 42 5.413 -2.949 14.333 1.00 0.00 H ATOM 625 HD2 LYS A 42 6.569 -5.414 12.924 1.00 0.00 H ATOM 626 HD3 LYS A 42 7.203 -4.591 14.345 1.00 0.00 H ATOM 627 HE2 LYS A 42 6.160 -6.357 15.374 1.00 0.00 H ATOM 628 HE3 LYS A 42 4.867 -5.156 15.445 1.00 0.00 H ATOM 629 HZ1 LYS A 42 3.923 -6.270 13.428 1.00 0.00 H ATOM 630 HZ2 LYS A 42 5.119 -7.360 13.474 1.00 0.00 H ATOM 631 HZ3 LYS A 42 4.035 -7.270 14.698 1.00 0.00 H ATOM 632 N SER A 43 3.831 -2.189 9.840 1.00 0.00 N ATOM 633 CA SER A 43 4.530 -1.809 8.617 1.00 0.00 C ATOM 634 C SER A 43 3.664 -0.853 7.788 1.00 0.00 C ATOM 635 O SER A 43 4.077 0.276 7.501 1.00 0.00 O ATOM 636 CB SER A 43 4.904 -3.085 7.845 1.00 0.00 C ATOM 637 OG SER A 43 5.778 -2.784 6.778 1.00 0.00 O ATOM 638 H SER A 43 2.995 -2.752 9.733 1.00 0.00 H ATOM 639 HA SER A 43 5.458 -1.291 8.860 1.00 0.00 H ATOM 640 HB2 SER A 43 5.407 -3.788 8.513 1.00 0.00 H ATOM 641 HB3 SER A 43 4.013 -3.572 7.449 1.00 0.00 H ATOM 642 HG SER A 43 6.627 -2.502 7.128 1.00 0.00 H ATOM 643 N ALA A 44 2.443 -1.288 7.435 1.00 0.00 N ATOM 644 CA ALA A 44 1.416 -0.506 6.728 1.00 0.00 C ATOM 645 C ALA A 44 1.316 0.897 7.315 1.00 0.00 C ATOM 646 O ALA A 44 1.230 1.918 6.632 1.00 0.00 O ATOM 647 CB ALA A 44 0.080 -1.228 6.885 1.00 0.00 C ATOM 648 H ALA A 44 2.156 -2.199 7.774 1.00 0.00 H ATOM 649 HA ALA A 44 1.592 -0.436 5.659 1.00 0.00 H ATOM 650 HB1 ALA A 44 0.149 -2.225 6.454 1.00 0.00 H ATOM 651 HB2 ALA A 44 -0.198 -1.317 7.935 1.00 0.00 H ATOM 652 HB3 ALA A 44 -0.683 -0.659 6.357 1.00 0.00 H ATOM 653 N HIS A 45 1.358 0.885 8.637 1.00 0.00 N ATOM 654 CA HIS A 45 1.114 2.003 9.524 1.00 0.00 C ATOM 655 C HIS A 45 2.362 2.823 9.808 1.00 0.00 C ATOM 656 O HIS A 45 2.287 3.780 10.575 1.00 0.00 O ATOM 657 CB HIS A 45 0.517 1.458 10.815 1.00 0.00 C ATOM 658 CG HIS A 45 -0.978 1.448 10.755 1.00 0.00 C ATOM 659 ND1 HIS A 45 -1.785 2.058 11.677 1.00 0.00 N ATOM 660 CD2 HIS A 45 -1.753 1.069 9.688 1.00 0.00 C ATOM 661 CE1 HIS A 45 -3.030 2.029 11.188 1.00 0.00 C ATOM 662 NE2 HIS A 45 -3.064 1.445 9.976 1.00 0.00 N ATOM 663 H HIS A 45 1.623 -0.012 9.010 1.00 0.00 H ATOM 664 HA HIS A 45 0.385 2.666 9.064 1.00 0.00 H ATOM 665 HB2 HIS A 45 0.899 0.459 11.003 1.00 0.00 H ATOM 666 HB3 HIS A 45 0.803 2.088 11.660 1.00 0.00 H ATOM 667 HD1 HIS A 45 -1.490 2.486 12.544 1.00 0.00 H ATOM 668 HD2 HIS A 45 -1.415 0.622 8.767 1.00 0.00 H ATOM 669 HE1 HIS A 45 -3.869 2.441 11.720 1.00 0.00 H ATOM 670 N LYS A 46 3.489 2.458 9.200 1.00 0.00 N ATOM 671 CA LYS A 46 4.734 3.176 9.361 1.00 0.00 C ATOM 672 C LYS A 46 5.054 3.761 7.996 1.00 0.00 C ATOM 673 O LYS A 46 4.659 4.891 7.717 1.00 0.00 O ATOM 674 CB LYS A 46 5.801 2.236 9.943 1.00 0.00 C ATOM 675 CG LYS A 46 7.124 2.976 10.162 1.00 0.00 C ATOM 676 CD LYS A 46 8.117 2.096 10.928 1.00 0.00 C ATOM 677 CE LYS A 46 9.423 2.875 11.136 1.00 0.00 C ATOM 678 NZ LYS A 46 10.436 2.083 11.861 1.00 0.00 N ATOM 679 H LYS A 46 3.455 1.742 8.479 1.00 0.00 H ATOM 680 HA LYS A 46 4.621 4.012 10.053 1.00 0.00 H ATOM 681 HB2 LYS A 46 5.436 1.882 10.908 1.00 0.00 H ATOM 682 HB3 LYS A 46 5.956 1.364 9.308 1.00 0.00 H ATOM 683 HG2 LYS A 46 7.553 3.245 9.195 1.00 0.00 H ATOM 684 HG3 LYS A 46 6.936 3.893 10.721 1.00 0.00 H ATOM 685 HD2 LYS A 46 7.676 1.824 11.890 1.00 0.00 H ATOM 686 HD3 LYS A 46 8.297 1.189 10.349 1.00 0.00 H ATOM 687 HE2 LYS A 46 9.825 3.165 10.161 1.00 0.00 H ATOM 688 HE3 LYS A 46 9.212 3.786 11.701 1.00 0.00 H ATOM 689 HZ1 LYS A 46 10.088 1.822 12.773 1.00 0.00 H ATOM 690 HZ2 LYS A 46 10.665 1.248 11.340 1.00 0.00 H ATOM 691 HZ3 LYS A 46 11.276 2.634 11.978 1.00 0.00 H ATOM 692 N ASP A 47 5.696 2.965 7.140 1.00 0.00 N ATOM 693 CA ASP A 47 6.161 3.417 5.839 1.00 0.00 C ATOM 694 C ASP A 47 5.855 2.410 4.729 1.00 0.00 C ATOM 695 O ASP A 47 6.349 2.562 3.615 1.00 0.00 O ATOM 696 CB ASP A 47 7.650 3.791 5.921 1.00 0.00 C ATOM 697 CG ASP A 47 7.848 5.142 6.601 1.00 0.00 C ATOM 698 OD1 ASP A 47 7.559 6.163 5.935 1.00 0.00 O ATOM 699 OD2 ASP A 47 8.275 5.118 7.777 1.00 0.00 O ATOM 700 H ASP A 47 5.926 2.026 7.428 1.00 0.00 H ATOM 701 HA ASP A 47 5.605 4.306 5.557 1.00 0.00 H ATOM 702 HB2 ASP A 47 8.203 3.020 6.457 1.00 0.00 H ATOM 703 HB3 ASP A 47 8.075 3.876 4.921 1.00 0.00 H ATOM 704 N ALA A 48 5.012 1.405 4.991 1.00 0.00 N ATOM 705 CA ALA A 48 4.538 0.534 3.925 1.00 0.00 C ATOM 706 C ALA A 48 3.330 1.146 3.216 1.00 0.00 C ATOM 707 O ALA A 48 3.330 1.188 1.986 1.00 0.00 O ATOM 708 CB ALA A 48 4.240 -0.860 4.462 1.00 0.00 C ATOM 709 H ALA A 48 4.643 1.271 5.927 1.00 0.00 H ATOM 710 HA ALA A 48 5.323 0.400 3.179 1.00 0.00 H ATOM 711 HB1 ALA A 48 3.559 -0.782 5.295 1.00 0.00 H ATOM 712 HB2 ALA A 48 3.788 -1.474 3.684 1.00 0.00 H ATOM 713 HB3 ALA A 48 5.163 -1.324 4.804 1.00 0.00 H ATOM 714 N CYS A 49 2.304 1.599 3.960 1.00 0.00 N ATOM 715 CA CYS A 49 1.106 2.184 3.362 1.00 0.00 C ATOM 716 C CYS A 49 1.044 3.702 3.609 1.00 0.00 C ATOM 717 O CYS A 49 1.175 4.460 2.650 1.00 0.00 O ATOM 718 CB CYS A 49 -0.175 1.442 3.692 1.00 0.00 C ATOM 719 SG CYS A 49 -0.227 -0.335 3.262 1.00 0.00 S ATOM 720 H CYS A 49 2.353 1.586 4.970 1.00 0.00 H ATOM 721 HA CYS A 49 1.195 2.090 2.289 1.00 0.00 H ATOM 722 HB2 CYS A 49 -0.404 1.546 4.751 1.00 0.00 H ATOM 723 HB3 CYS A 49 -0.977 1.904 3.126 1.00 0.00 H ATOM 724 N LYS A 50 0.859 4.199 4.846 1.00 0.00 N ATOM 725 CA LYS A 50 0.781 5.646 5.091 1.00 0.00 C ATOM 726 C LYS A 50 2.095 6.435 4.897 1.00 0.00 C ATOM 727 O LYS A 50 2.530 7.113 5.825 1.00 0.00 O ATOM 728 CB LYS A 50 0.219 5.898 6.499 1.00 0.00 C ATOM 729 CG LYS A 50 1.105 5.306 7.612 1.00 0.00 C ATOM 730 CD LYS A 50 1.657 6.310 8.642 1.00 0.00 C ATOM 731 CE LYS A 50 0.647 6.711 9.723 1.00 0.00 C ATOM 732 NZ LYS A 50 -0.461 7.510 9.171 1.00 0.00 N ATOM 733 H LYS A 50 0.648 3.585 5.632 1.00 0.00 H ATOM 734 HA LYS A 50 0.063 6.064 4.385 1.00 0.00 H ATOM 735 HB2 LYS A 50 0.111 6.975 6.612 1.00 0.00 H ATOM 736 HB3 LYS A 50 -0.765 5.437 6.559 1.00 0.00 H ATOM 737 HG2 LYS A 50 0.532 4.544 8.127 1.00 0.00 H ATOM 738 HG3 LYS A 50 1.971 4.812 7.162 1.00 0.00 H ATOM 739 HD2 LYS A 50 2.500 5.828 9.144 1.00 0.00 H ATOM 740 HD3 LYS A 50 2.066 7.194 8.154 1.00 0.00 H ATOM 741 HE2 LYS A 50 0.259 5.813 10.210 1.00 0.00 H ATOM 742 HE3 LYS A 50 1.170 7.305 10.476 1.00 0.00 H ATOM 743 HZ1 LYS A 50 -0.093 8.336 8.721 1.00 0.00 H ATOM 744 HZ2 LYS A 50 -0.962 6.959 8.489 1.00 0.00 H ATOM 745 HZ3 LYS A 50 -1.092 7.788 9.911 1.00 0.00 H ATOM 746 N THR A 51 2.699 6.451 3.708 1.00 0.00 N ATOM 747 CA THR A 51 3.840 7.333 3.441 1.00 0.00 C ATOM 748 C THR A 51 3.825 7.782 1.976 1.00 0.00 C ATOM 749 O THR A 51 3.437 8.915 1.681 1.00 0.00 O ATOM 750 CB THR A 51 5.149 6.709 3.984 1.00 0.00 C ATOM 751 OG1 THR A 51 6.145 7.674 4.244 1.00 0.00 O ATOM 752 CG2 THR A 51 5.777 5.606 3.126 1.00 0.00 C ATOM 753 H THR A 51 2.283 5.906 2.959 1.00 0.00 H ATOM 754 HA THR A 51 3.689 8.252 4.010 1.00 0.00 H ATOM 755 HB THR A 51 4.913 6.288 4.961 1.00 0.00 H ATOM 756 HG1 THR A 51 6.778 7.254 4.861 1.00 0.00 H ATOM 757 HG21 THR A 51 5.047 4.825 2.911 1.00 0.00 H ATOM 758 HG22 THR A 51 6.193 6.013 2.206 1.00 0.00 H ATOM 759 HG23 THR A 51 6.612 5.170 3.667 1.00 0.00 H ATOM 760 N CYS A 52 4.149 6.883 1.044 1.00 0.00 N ATOM 761 CA CYS A 52 3.922 7.099 -0.372 1.00 0.00 C ATOM 762 C CYS A 52 2.408 7.155 -0.558 1.00 0.00 C ATOM 763 O CYS A 52 1.729 6.271 -0.049 1.00 0.00 O ATOM 764 CB CYS A 52 4.503 5.947 -1.148 1.00 0.00 C ATOM 765 SG CYS A 52 4.134 6.169 -2.908 1.00 0.00 S ATOM 766 H CYS A 52 4.364 5.942 1.327 1.00 0.00 H ATOM 767 HA CYS A 52 4.396 8.029 -0.688 1.00 0.00 H ATOM 768 HB2 CYS A 52 5.581 5.883 -1.000 1.00 0.00 H ATOM 769 HB3 CYS A 52 4.039 5.029 -0.790 1.00 0.00 H ATOM 770 N HIS A 53 1.904 8.210 -1.214 1.00 0.00 N ATOM 771 CA HIS A 53 0.498 8.535 -1.481 1.00 0.00 C ATOM 772 C HIS A 53 0.377 10.052 -1.583 1.00 0.00 C ATOM 773 O HIS A 53 -0.064 10.576 -2.612 1.00 0.00 O ATOM 774 CB HIS A 53 -0.481 8.011 -0.404 1.00 0.00 C ATOM 775 CG HIS A 53 -1.009 6.610 -0.627 1.00 0.00 C ATOM 776 ND1 HIS A 53 -2.038 5.997 0.054 1.00 0.00 N ATOM 777 CD2 HIS A 53 -0.581 5.731 -1.580 1.00 0.00 C ATOM 778 CE1 HIS A 53 -2.246 4.799 -0.522 1.00 0.00 C ATOM 779 NE2 HIS A 53 -1.372 4.586 -1.518 1.00 0.00 N ATOM 780 H HIS A 53 2.585 8.872 -1.552 1.00 0.00 H ATOM 781 HA HIS A 53 0.220 8.143 -2.459 1.00 0.00 H ATOM 782 HB2 HIS A 53 -0.035 8.084 0.589 1.00 0.00 H ATOM 783 HB3 HIS A 53 -1.352 8.664 -0.423 1.00 0.00 H ATOM 784 HD1 HIS A 53 -2.574 6.385 0.814 1.00 0.00 H ATOM 785 HD2 HIS A 53 0.220 5.910 -2.273 1.00 0.00 H ATOM 786 HE1 HIS A 53 -3.046 4.129 -0.256 1.00 0.00 H ATOM 787 N LYS A 54 0.792 10.731 -0.504 1.00 0.00 N ATOM 788 CA LYS A 54 0.716 12.176 -0.316 1.00 0.00 C ATOM 789 C LYS A 54 1.628 12.886 -1.319 1.00 0.00 C ATOM 790 O LYS A 54 2.705 13.360 -0.967 1.00 0.00 O ATOM 791 CB LYS A 54 1.113 12.533 1.123 1.00 0.00 C ATOM 792 CG LYS A 54 0.128 11.990 2.166 1.00 0.00 C ATOM 793 CD LYS A 54 0.648 12.117 3.607 1.00 0.00 C ATOM 794 CE LYS A 54 0.981 13.557 4.035 1.00 0.00 C ATOM 795 NZ LYS A 54 2.331 13.988 3.607 1.00 0.00 N ATOM 796 H LYS A 54 1.208 10.187 0.241 1.00 0.00 H ATOM 797 HA LYS A 54 -0.309 12.511 -0.479 1.00 0.00 H ATOM 798 HB2 LYS A 54 2.113 12.139 1.323 1.00 0.00 H ATOM 799 HB3 LYS A 54 1.123 13.621 1.189 1.00 0.00 H ATOM 800 HG2 LYS A 54 -0.820 12.524 2.070 1.00 0.00 H ATOM 801 HG3 LYS A 54 -0.064 10.933 1.977 1.00 0.00 H ATOM 802 HD2 LYS A 54 -0.151 11.755 4.258 1.00 0.00 H ATOM 803 HD3 LYS A 54 1.509 11.459 3.751 1.00 0.00 H ATOM 804 HE2 LYS A 54 0.223 14.237 3.642 1.00 0.00 H ATOM 805 HE3 LYS A 54 0.943 13.607 5.125 1.00 0.00 H ATOM 806 HZ1 LYS A 54 2.420 13.946 2.602 1.00 0.00 H ATOM 807 HZ2 LYS A 54 2.497 14.940 3.905 1.00 0.00 H ATOM 808 HZ3 LYS A 54 3.036 13.391 4.018 1.00 0.00 H ATOM 809 N SER A 55 1.193 12.911 -2.575 1.00 0.00 N ATOM 810 CA SER A 55 1.972 13.288 -3.743 1.00 0.00 C ATOM 811 C SER A 55 1.060 13.161 -4.962 1.00 0.00 C ATOM 812 O SER A 55 0.899 14.105 -5.730 1.00 0.00 O ATOM 813 CB SER A 55 3.205 12.373 -3.862 1.00 0.00 C ATOM 814 OG SER A 55 3.882 12.582 -5.085 1.00 0.00 O ATOM 815 H SER A 55 0.297 12.461 -2.734 1.00 0.00 H ATOM 816 HA SER A 55 2.300 14.325 -3.649 1.00 0.00 H ATOM 817 HB2 SER A 55 3.897 12.583 -3.045 1.00 0.00 H ATOM 818 HB3 SER A 55 2.899 11.327 -3.805 1.00 0.00 H ATOM 819 HG SER A 55 4.717 12.106 -5.072 1.00 0.00 H ATOM 820 N ASN A 56 0.433 11.989 -5.111 1.00 0.00 N ATOM 821 CA ASN A 56 -0.473 11.697 -6.216 1.00 0.00 C ATOM 822 C ASN A 56 -1.921 11.845 -5.757 1.00 0.00 C ATOM 823 O ASN A 56 -2.784 12.190 -6.558 1.00 0.00 O ATOM 824 CB ASN A 56 -0.194 10.277 -6.720 1.00 0.00 C ATOM 825 CG ASN A 56 -0.848 9.917 -8.060 1.00 0.00 C ATOM 826 OD1 ASN A 56 -0.160 9.417 -8.951 1.00 0.00 O ATOM 827 ND2 ASN A 56 -2.154 10.097 -8.210 1.00 0.00 N ATOM 828 H ASN A 56 0.543 11.287 -4.387 1.00 0.00 H ATOM 829 HA ASN A 56 -0.297 12.384 -7.046 1.00 0.00 H ATOM 830 HB2 ASN A 56 0.884 10.164 -6.842 1.00 0.00 H ATOM 831 HB3 ASN A 56 -0.520 9.564 -5.961 1.00 0.00 H ATOM 832 HD21 ASN A 56 -2.705 10.627 -7.545 1.00 0.00 H ATOM 833 HD22 ASN A 56 -2.691 9.600 -8.928 1.00 0.00 H ATOM 834 N ASN A 57 -2.213 11.529 -4.493 1.00 0.00 N ATOM 835 CA ASN A 57 -3.568 11.547 -3.957 1.00 0.00 C ATOM 836 C ASN A 57 -3.476 12.111 -2.537 1.00 0.00 C ATOM 837 O ASN A 57 -2.374 12.228 -2.000 1.00 0.00 O ATOM 838 CB ASN A 57 -4.134 10.118 -4.049 1.00 0.00 C ATOM 839 CG ASN A 57 -5.648 10.021 -3.859 1.00 0.00 C ATOM 840 OD1 ASN A 57 -6.204 10.599 -2.931 1.00 0.00 O ATOM 841 ND2 ASN A 57 -6.336 9.281 -4.723 1.00 0.00 N ATOM 842 H ASN A 57 -1.477 11.296 -3.832 1.00 0.00 H ATOM 843 HA ASN A 57 -4.200 12.216 -4.546 1.00 0.00 H ATOM 844 HB2 ASN A 57 -3.908 9.743 -5.047 1.00 0.00 H ATOM 845 HB3 ASN A 57 -3.638 9.476 -3.320 1.00 0.00 H ATOM 846 HD21 ASN A 57 -5.887 8.868 -5.551 1.00 0.00 H ATOM 847 HD22 ASN A 57 -7.331 9.179 -4.598 1.00 0.00 H ATOM 848 N GLY A 58 -4.606 12.485 -1.931 1.00 0.00 N ATOM 849 CA GLY A 58 -4.666 13.090 -0.609 1.00 0.00 C ATOM 850 C GLY A 58 -5.492 12.249 0.367 1.00 0.00 C ATOM 851 O GLY A 58 -6.540 12.712 0.812 1.00 0.00 O ATOM 852 H GLY A 58 -5.485 12.252 -2.380 1.00 0.00 H ATOM 853 HA2 GLY A 58 -3.674 13.248 -0.183 1.00 0.00 H ATOM 854 HA3 GLY A 58 -5.138 14.067 -0.712 1.00 0.00 H ATOM 855 N PRO A 59 -5.027 11.043 0.737 1.00 0.00 N ATOM 856 CA PRO A 59 -5.588 10.275 1.835 1.00 0.00 C ATOM 857 C PRO A 59 -5.162 10.940 3.143 1.00 0.00 C ATOM 858 O PRO A 59 -5.699 11.982 3.512 1.00 0.00 O ATOM 859 CB PRO A 59 -5.063 8.851 1.620 1.00 0.00 C ATOM 860 CG PRO A 59 -3.704 9.062 0.958 1.00 0.00 C ATOM 861 CD PRO A 59 -3.899 10.342 0.145 1.00 0.00 C ATOM 862 HA PRO A 59 -6.674 10.238 1.840 1.00 0.00 H ATOM 863 HB2 PRO A 59 -5.022 8.241 2.522 1.00 0.00 H ATOM 864 HB3 PRO A 59 -5.707 8.362 0.886 1.00 0.00 H ATOM 865 HG2 PRO A 59 -2.917 9.205 1.698 1.00 0.00 H ATOM 866 HG3 PRO A 59 -3.467 8.225 0.305 1.00 0.00 H ATOM 867 HD2 PRO A 59 -2.986 10.939 0.163 1.00 0.00 H ATOM 868 HD3 PRO A 59 -4.153 10.059 -0.876 1.00 0.00 H ATOM 869 N THR A 60 -4.200 10.359 3.860 1.00 0.00 N ATOM 870 CA THR A 60 -3.783 10.762 5.202 1.00 0.00 C ATOM 871 C THR A 60 -4.874 10.378 6.208 1.00 0.00 C ATOM 872 O THR A 60 -4.629 9.605 7.134 1.00 0.00 O ATOM 873 CB THR A 60 -3.403 12.257 5.260 1.00 0.00 C ATOM 874 OG1 THR A 60 -2.649 12.606 4.117 1.00 0.00 O ATOM 875 CG2 THR A 60 -2.570 12.584 6.501 1.00 0.00 C ATOM 876 H THR A 60 -3.831 9.497 3.496 1.00 0.00 H ATOM 877 HA THR A 60 -2.887 10.184 5.435 1.00 0.00 H ATOM 878 HB THR A 60 -4.299 12.880 5.289 1.00 0.00 H ATOM 879 HG1 THR A 60 -3.251 12.600 3.366 1.00 0.00 H ATOM 880 HG21 THR A 60 -1.645 12.007 6.497 1.00 0.00 H ATOM 881 HG22 THR A 60 -2.324 13.648 6.499 1.00 0.00 H ATOM 882 HG23 THR A 60 -3.135 12.356 7.405 1.00 0.00 H ATOM 883 N LYS A 61 -6.090 10.888 5.991 1.00 0.00 N ATOM 884 CA LYS A 61 -7.302 10.426 6.637 1.00 0.00 C ATOM 885 C LYS A 61 -7.566 8.979 6.250 1.00 0.00 C ATOM 886 O LYS A 61 -7.187 8.510 5.176 1.00 0.00 O ATOM 887 CB LYS A 61 -8.505 11.263 6.204 1.00 0.00 C ATOM 888 CG LYS A 61 -8.298 12.760 6.413 1.00 0.00 C ATOM 889 CD LYS A 61 -8.330 13.176 7.891 1.00 0.00 C ATOM 890 CE LYS A 61 -8.053 14.678 8.080 1.00 0.00 C ATOM 891 NZ LYS A 61 -9.037 15.537 7.388 1.00 0.00 N ATOM 892 H LYS A 61 -6.202 11.477 5.175 1.00 0.00 H ATOM 893 HA LYS A 61 -7.173 10.500 7.716 1.00 0.00 H ATOM 894 HB2 LYS A 61 -8.672 11.091 5.139 1.00 0.00 H ATOM 895 HB3 LYS A 61 -9.393 10.937 6.746 1.00 0.00 H ATOM 896 HG2 LYS A 61 -7.352 13.036 5.954 1.00 0.00 H ATOM 897 HG3 LYS A 61 -9.112 13.226 5.868 1.00 0.00 H ATOM 898 HD2 LYS A 61 -9.296 12.912 8.328 1.00 0.00 H ATOM 899 HD3 LYS A 61 -7.556 12.631 8.435 1.00 0.00 H ATOM 900 HE2 LYS A 61 -8.076 14.903 9.149 1.00 0.00 H ATOM 901 HE3 LYS A 61 -7.051 14.906 7.708 1.00 0.00 H ATOM 902 HZ1 LYS A 61 -9.972 15.336 7.714 1.00 0.00 H ATOM 903 HZ2 LYS A 61 -8.832 16.510 7.575 1.00 0.00 H ATOM 904 HZ3 LYS A 61 -8.994 15.388 6.390 1.00 0.00 H ATOM 905 N CYS A 62 -8.242 8.279 7.151 1.00 0.00 N ATOM 906 CA CYS A 62 -8.202 6.836 7.181 1.00 0.00 C ATOM 907 C CYS A 62 -9.036 6.227 6.054 1.00 0.00 C ATOM 908 O CYS A 62 -8.631 5.253 5.414 1.00 0.00 O ATOM 909 CB CYS A 62 -8.629 6.375 8.556 1.00 0.00 C ATOM 910 SG CYS A 62 -7.730 7.217 9.917 1.00 0.00 S ATOM 911 H CYS A 62 -8.530 8.743 8.000 1.00 0.00 H ATOM 912 HA CYS A 62 -7.167 6.593 6.969 1.00 0.00 H ATOM 913 HB2 CYS A 62 -9.690 6.601 8.666 1.00 0.00 H ATOM 914 HB3 CYS A 62 -8.488 5.298 8.621 1.00 0.00 H ATOM 915 N GLY A 63 -10.186 6.853 5.785 1.00 0.00 N ATOM 916 CA GLY A 63 -11.040 6.569 4.640 1.00 0.00 C ATOM 917 C GLY A 63 -10.250 6.455 3.333 1.00 0.00 C ATOM 918 O GLY A 63 -10.638 5.698 2.449 1.00 0.00 O ATOM 919 H GLY A 63 -10.433 7.636 6.372 1.00 0.00 H ATOM 920 HA2 GLY A 63 -11.595 5.651 4.815 1.00 0.00 H ATOM 921 HA3 GLY A 63 -11.756 7.385 4.532 1.00 0.00 H ATOM 922 N GLY A 64 -9.142 7.201 3.225 1.00 0.00 N ATOM 923 CA GLY A 64 -8.260 7.221 2.072 1.00 0.00 C ATOM 924 C GLY A 64 -7.939 5.834 1.509 1.00 0.00 C ATOM 925 O GLY A 64 -7.896 5.674 0.292 1.00 0.00 O ATOM 926 H GLY A 64 -8.855 7.769 4.012 1.00 0.00 H ATOM 927 HA2 GLY A 64 -8.705 7.838 1.289 1.00 0.00 H ATOM 928 HA3 GLY A 64 -7.331 7.682 2.397 1.00 0.00 H ATOM 929 N CYS A 65 -7.680 4.856 2.386 1.00 0.00 N ATOM 930 CA CYS A 65 -7.404 3.472 1.985 1.00 0.00 C ATOM 931 C CYS A 65 -8.260 2.438 2.732 1.00 0.00 C ATOM 932 O CYS A 65 -8.415 1.328 2.228 1.00 0.00 O ATOM 933 CB CYS A 65 -5.925 3.169 2.080 1.00 0.00 C ATOM 934 SG CYS A 65 -5.448 3.021 3.816 1.00 0.00 S ATOM 935 H CYS A 65 -7.691 5.091 3.369 1.00 0.00 H ATOM 936 HA CYS A 65 -7.672 3.354 0.936 1.00 0.00 H ATOM 937 HB2 CYS A 65 -5.707 2.225 1.580 1.00 0.00 H ATOM 938 HB3 CYS A 65 -5.368 3.967 1.591 1.00 0.00 H ATOM 939 N HIS A 66 -8.828 2.764 3.902 1.00 0.00 N ATOM 940 CA HIS A 66 -9.677 1.849 4.655 1.00 0.00 C ATOM 941 C HIS A 66 -11.149 2.232 4.497 1.00 0.00 C ATOM 942 O HIS A 66 -11.593 3.186 5.142 1.00 0.00 O ATOM 943 CB HIS A 66 -9.328 1.933 6.138 1.00 0.00 C ATOM 944 CG HIS A 66 -8.079 1.222 6.570 1.00 0.00 C ATOM 945 ND1 HIS A 66 -8.041 -0.090 6.981 1.00 0.00 N ATOM 946 CD2 HIS A 66 -6.963 1.841 7.064 1.00 0.00 C ATOM 947 CE1 HIS A 66 -6.926 -0.256 7.702 1.00 0.00 C ATOM 948 NE2 HIS A 66 -6.239 0.892 7.792 1.00 0.00 N ATOM 949 H HIS A 66 -8.716 3.695 4.287 1.00 0.00 H ATOM 950 HA HIS A 66 -9.535 0.814 4.338 1.00 0.00 H ATOM 951 HB2 HIS A 66 -9.283 2.974 6.453 1.00 0.00 H ATOM 952 HB3 HIS A 66 -10.135 1.441 6.670 1.00 0.00 H ATOM 953 HD1 HIS A 66 -8.794 -0.768 6.949 1.00 0.00 H ATOM 954 HD2 HIS A 66 -6.764 2.901 7.019 1.00 0.00 H ATOM 955 HE1 HIS A 66 -6.679 -1.174 8.213 1.00 0.00 H ATOM 956 N ILE A 67 -11.924 1.462 3.728 1.00 0.00 N ATOM 957 CA ILE A 67 -13.344 1.727 3.505 1.00 0.00 C ATOM 958 C ILE A 67 -14.153 1.523 4.797 1.00 0.00 C ATOM 959 O ILE A 67 -14.738 0.463 5.006 1.00 0.00 O ATOM 960 CB ILE A 67 -13.886 0.870 2.341 1.00 0.00 C ATOM 961 CG1 ILE A 67 -13.069 1.022 1.042 1.00 0.00 C ATOM 962 CG2 ILE A 67 -15.367 1.182 2.057 1.00 0.00 C ATOM 963 CD1 ILE A 67 -13.071 2.437 0.454 1.00 0.00 C ATOM 964 H ILE A 67 -11.498 0.666 3.259 1.00 0.00 H ATOM 965 HA ILE A 67 -13.453 2.773 3.220 1.00 0.00 H ATOM 966 HB ILE A 67 -13.825 -0.180 2.629 1.00 0.00 H ATOM 967 HG12 ILE A 67 -12.035 0.721 1.215 1.00 0.00 H ATOM 968 HG13 ILE A 67 -13.483 0.344 0.295 1.00 0.00 H ATOM 969 HG21 ILE A 67 -15.518 2.255 1.939 1.00 0.00 H ATOM 970 HG22 ILE A 67 -15.686 0.673 1.148 1.00 0.00 H ATOM 971 HG23 ILE A 67 -16.001 0.833 2.871 1.00 0.00 H ATOM 972 HD11 ILE A 67 -14.086 2.757 0.221 1.00 0.00 H ATOM 973 HD12 ILE A 67 -12.613 3.144 1.146 1.00 0.00 H ATOM 974 HD13 ILE A 67 -12.490 2.434 -0.468 1.00 0.00 H ATOM 975 N LYS A 68 -14.197 2.557 5.642 1.00 0.00 N ATOM 976 CA LYS A 68 -15.207 2.775 6.669 1.00 0.00 C ATOM 977 C LYS A 68 -15.090 4.231 7.096 1.00 0.00 C ATOM 978 O LYS A 68 -14.175 4.534 7.899 1.00 0.00 O ATOM 979 CB LYS A 68 -15.036 1.822 7.871 1.00 0.00 C ATOM 980 CG LYS A 68 -16.165 1.857 8.922 1.00 0.00 C ATOM 981 CD LYS A 68 -16.140 3.015 9.946 1.00 0.00 C ATOM 982 CE LYS A 68 -17.003 4.239 9.571 1.00 0.00 C ATOM 983 NZ LYS A 68 -16.204 5.449 9.280 1.00 0.00 N ATOM 984 OXT LYS A 68 -15.987 5.035 6.765 1.00 0.00 O ATOM 985 H LYS A 68 -13.587 3.337 5.422 1.00 0.00 H ATOM 986 HA LYS A 68 -16.192 2.613 6.228 1.00 0.00 H ATOM 987 HB2 LYS A 68 -15.012 0.803 7.486 1.00 0.00 H ATOM 988 HB3 LYS A 68 -14.089 2.003 8.371 1.00 0.00 H ATOM 989 HG2 LYS A 68 -17.137 1.781 8.430 1.00 0.00 H ATOM 990 HG3 LYS A 68 -16.037 0.940 9.502 1.00 0.00 H ATOM 991 HD2 LYS A 68 -16.564 2.615 10.870 1.00 0.00 H ATOM 992 HD3 LYS A 68 -15.108 3.292 10.167 1.00 0.00 H ATOM 993 HE2 LYS A 68 -17.596 4.007 8.683 1.00 0.00 H ATOM 994 HE3 LYS A 68 -17.698 4.465 10.382 1.00 0.00 H ATOM 995 HZ1 LYS A 68 -15.225 5.196 9.142 1.00 0.00 H ATOM 996 HZ2 LYS A 68 -16.438 5.734 8.325 1.00 0.00 H ATOM 997 HZ3 LYS A 68 -16.315 6.200 9.942 1.00 0.00 H TER 998 LYS A 68 HETATM 999 FE HEC A 69 4.539 -6.987 -5.378 1.00 0.00 FE HETATM 1000 CHA HEC A 69 3.939 -9.655 -3.224 1.00 0.00 C HETATM 1001 CHB HEC A 69 6.121 -9.058 -7.610 1.00 0.00 C HETATM 1002 CHC HEC A 69 4.800 -4.332 -7.527 1.00 0.00 C HETATM 1003 CHD HEC A 69 3.183 -4.842 -2.945 1.00 0.00 C HETATM 1004 NA HEC A 69 4.997 -8.984 -5.390 1.00 0.00 N HETATM 1005 C1A HEC A 69 4.650 -9.876 -4.412 1.00 0.00 C HETATM 1006 C2A HEC A 69 5.139 -11.168 -4.826 1.00 0.00 C HETATM 1007 C3A HEC A 69 5.788 -11.007 -6.030 1.00 0.00 C HETATM 1008 C4A HEC A 69 5.661 -9.616 -6.407 1.00 0.00 C HETATM 1009 CMA HEC A 69 6.453 -12.119 -6.809 1.00 0.00 C HETATM 1010 CAA HEC A 69 4.858 -12.483 -4.136 1.00 0.00 C HETATM 1011 CBA HEC A 69 3.386 -12.897 -4.234 1.00 0.00 C HETATM 1012 CGA HEC A 69 2.945 -12.956 -5.692 1.00 0.00 C HETATM 1013 O1A HEC A 69 2.277 -11.992 -6.128 1.00 0.00 O HETATM 1014 O2A HEC A 69 3.316 -13.952 -6.348 1.00 0.00 O HETATM 1015 NB HEC A 69 5.333 -6.735 -7.233 1.00 0.00 N HETATM 1016 C1B HEC A 69 5.931 -7.716 -7.962 1.00 0.00 C HETATM 1017 C2B HEC A 69 6.336 -7.133 -9.221 1.00 0.00 C HETATM 1018 C3B HEC A 69 5.944 -5.808 -9.212 1.00 0.00 C HETATM 1019 C4B HEC A 69 5.309 -5.566 -7.935 1.00 0.00 C HETATM 1020 CMB HEC A 69 7.010 -7.874 -10.352 1.00 0.00 C HETATM 1021 CAB HEC A 69 6.108 -4.795 -10.334 1.00 0.00 C HETATM 1022 CBB HEC A 69 5.276 -5.140 -11.570 1.00 0.00 C HETATM 1023 NC HEC A 69 4.131 -4.947 -5.236 1.00 0.00 N HETATM 1024 C1C HEC A 69 4.324 -4.067 -6.249 1.00 0.00 C HETATM 1025 C2C HEC A 69 3.926 -2.762 -5.779 1.00 0.00 C HETATM 1026 C3C HEC A 69 3.571 -2.893 -4.454 1.00 0.00 C HETATM 1027 C4C HEC A 69 3.608 -4.302 -4.150 1.00 0.00 C HETATM 1028 CMC HEC A 69 3.905 -1.485 -6.575 1.00 0.00 C HETATM 1029 CAC HEC A 69 3.359 -1.781 -3.440 1.00 0.00 C HETATM 1030 CBC HEC A 69 2.052 -1.005 -3.608 1.00 0.00 C HETATM 1031 ND HEC A 69 3.670 -7.211 -3.439 1.00 0.00 N HETATM 1032 C1D HEC A 69 3.202 -6.194 -2.669 1.00 0.00 C HETATM 1033 C2D HEC A 69 2.685 -6.753 -1.448 1.00 0.00 C HETATM 1034 C3D HEC A 69 2.892 -8.115 -1.511 1.00 0.00 C HETATM 1035 C4D HEC A 69 3.523 -8.394 -2.786 1.00 0.00 C HETATM 1036 CMD HEC A 69 2.020 -5.956 -0.343 1.00 0.00 C HETATM 1037 CAD HEC A 69 2.571 -9.126 -0.430 1.00 0.00 C HETATM 1038 CBD HEC A 69 1.156 -9.712 -0.516 1.00 0.00 C HETATM 1039 CGD HEC A 69 0.171 -9.171 0.512 1.00 0.00 C HETATM 1040 O1D HEC A 69 -1.016 -9.518 0.355 1.00 0.00 O HETATM 1041 O2D HEC A 69 0.593 -8.473 1.459 1.00 0.00 O HETATM 1042 HHA HEC A 69 3.743 -10.505 -2.597 1.00 0.00 H HETATM 1043 HHB HEC A 69 6.613 -9.696 -8.325 1.00 0.00 H HETATM 1044 HHC HEC A 69 4.838 -3.510 -8.211 1.00 0.00 H HETATM 1045 HHD HEC A 69 2.754 -4.195 -2.202 1.00 0.00 H HETATM 1046 HMA1 HEC A 69 7.269 -12.535 -6.216 1.00 0.00 H HETATM 1047 HMA2 HEC A 69 5.719 -12.900 -7.010 1.00 0.00 H HETATM 1048 HMA3 HEC A 69 6.858 -11.778 -7.758 1.00 0.00 H HETATM 1049 HAA1 HEC A 69 5.454 -13.268 -4.601 1.00 0.00 H HETATM 1050 HAA2 HEC A 69 5.146 -12.417 -3.090 1.00 0.00 H HETATM 1051 HBA1 HEC A 69 3.260 -13.883 -3.789 1.00 0.00 H HETATM 1052 HBA2 HEC A 69 2.750 -12.195 -3.694 1.00 0.00 H HETATM 1053 HMB1 HEC A 69 6.287 -8.530 -10.836 1.00 0.00 H HETATM 1054 HMB2 HEC A 69 7.416 -7.189 -11.091 1.00 0.00 H HETATM 1055 HMB3 HEC A 69 7.836 -8.469 -9.966 1.00 0.00 H HETATM 1056 HAB HEC A 69 5.762 -3.818 -10.026 1.00 0.00 H HETATM 1057 HBB1 HEC A 69 5.571 -6.104 -11.979 1.00 0.00 H HETATM 1058 HBB2 HEC A 69 4.222 -5.167 -11.292 1.00 0.00 H HETATM 1059 HBB3 HEC A 69 5.431 -4.373 -12.330 1.00 0.00 H HETATM 1060 HMC1 HEC A 69 4.084 -1.634 -7.635 1.00 0.00 H HETATM 1061 HMC2 HEC A 69 2.907 -1.070 -6.476 1.00 0.00 H HETATM 1062 HMC3 HEC A 69 4.656 -0.797 -6.176 1.00 0.00 H HETATM 1063 HAC HEC A 69 3.340 -2.194 -2.438 1.00 0.00 H HETATM 1064 HBC1 HEC A 69 1.205 -1.692 -3.588 1.00 0.00 H HETATM 1065 HBC2 HEC A 69 1.953 -0.286 -2.797 1.00 0.00 H HETATM 1066 HBC3 HEC A 69 2.055 -0.471 -4.551 1.00 0.00 H HETATM 1067 HMD1 HEC A 69 1.813 -6.599 0.504 1.00 0.00 H HETATM 1068 HMD2 HEC A 69 2.658 -5.134 -0.010 1.00 0.00 H HETATM 1069 HMD3 HEC A 69 1.078 -5.525 -0.689 1.00 0.00 H HETATM 1070 HAD1 HEC A 69 3.235 -9.974 -0.544 1.00 0.00 H HETATM 1071 HAD2 HEC A 69 2.774 -8.710 0.557 1.00 0.00 H HETATM 1072 HBD1 HEC A 69 0.747 -9.548 -1.514 1.00 0.00 H HETATM 1073 HBD2 HEC A 69 1.212 -10.786 -0.345 1.00 0.00 H HETATM 1074 FE HEC A 70 -1.320 3.102 -2.785 1.00 0.00 FE HETATM 1075 CHA HEC A 70 -3.703 4.868 -4.548 1.00 0.00 C HETATM 1076 CHB HEC A 70 -3.826 1.436 -1.035 1.00 0.00 C HETATM 1077 CHC HEC A 70 1.074 1.601 -0.718 1.00 0.00 C HETATM 1078 CHD HEC A 70 1.226 4.765 -4.458 1.00 0.00 C HETATM 1079 NA HEC A 70 -3.402 3.142 -2.792 1.00 0.00 N HETATM 1080 C1A HEC A 70 -4.159 3.949 -3.596 1.00 0.00 C HETATM 1081 C2A HEC A 70 -5.549 3.669 -3.303 1.00 0.00 C HETATM 1082 C3A HEC A 70 -5.573 2.705 -2.319 1.00 0.00 C HETATM 1083 C4A HEC A 70 -4.205 2.367 -2.005 1.00 0.00 C HETATM 1084 CMA HEC A 70 -6.815 2.121 -1.691 1.00 0.00 C HETATM 1085 CAA HEC A 70 -6.774 4.286 -3.945 1.00 0.00 C HETATM 1086 CBA HEC A 70 -7.643 3.283 -4.721 1.00 0.00 C HETATM 1087 CGA HEC A 70 -9.011 3.104 -4.072 1.00 0.00 C HETATM 1088 O1A HEC A 70 -9.284 1.977 -3.608 1.00 0.00 O HETATM 1089 O2A HEC A 70 -9.750 4.111 -4.035 1.00 0.00 O HETATM 1090 NB HEC A 70 -1.361 1.736 -1.193 1.00 0.00 N HETATM 1091 C1B HEC A 70 -2.497 1.201 -0.665 1.00 0.00 C HETATM 1092 C2B HEC A 70 -2.110 0.346 0.432 1.00 0.00 C HETATM 1093 C3B HEC A 70 -0.735 0.395 0.552 1.00 0.00 C HETATM 1094 C4B HEC A 70 -0.267 1.287 -0.492 1.00 0.00 C HETATM 1095 CMB HEC A 70 -3.082 -0.379 1.323 1.00 0.00 C HETATM 1096 CAB HEC A 70 0.144 -0.452 1.473 1.00 0.00 C HETATM 1097 CBB HEC A 70 0.183 -1.930 1.041 1.00 0.00 C HETATM 1098 NC HEC A 70 0.785 3.144 -2.636 1.00 0.00 N HETATM 1099 C1C HEC A 70 1.523 2.455 -1.723 1.00 0.00 C HETATM 1100 C2C HEC A 70 2.919 2.740 -1.969 1.00 0.00 C HETATM 1101 C3C HEC A 70 2.967 3.695 -2.972 1.00 0.00 C HETATM 1102 C4C HEC A 70 1.605 3.895 -3.425 1.00 0.00 C HETATM 1103 CMC HEC A 70 4.076 2.081 -1.239 1.00 0.00 C HETATM 1104 CAC HEC A 70 4.170 4.456 -3.522 1.00 0.00 C HETATM 1105 CBC HEC A 70 5.563 3.829 -3.361 1.00 0.00 C HETATM 1106 ND HEC A 70 -1.250 4.508 -4.273 1.00 0.00 N HETATM 1107 C1D HEC A 70 -0.104 5.025 -4.810 1.00 0.00 C HETATM 1108 C2D HEC A 70 -0.504 5.954 -5.837 1.00 0.00 C HETATM 1109 C3D HEC A 70 -1.875 6.055 -5.787 1.00 0.00 C HETATM 1110 C4D HEC A 70 -2.350 5.080 -4.840 1.00 0.00 C HETATM 1111 CMD HEC A 70 0.413 6.675 -6.792 1.00 0.00 C HETATM 1112 CAD HEC A 70 -2.713 7.159 -6.371 1.00 0.00 C HETATM 1113 CBD HEC A 70 -3.567 6.789 -7.581 1.00 0.00 C HETATM 1114 CGD HEC A 70 -4.441 7.984 -7.928 1.00 0.00 C HETATM 1115 O1D HEC A 70 -5.271 8.334 -7.060 1.00 0.00 O HETATM 1116 O2D HEC A 70 -4.208 8.565 -9.011 1.00 0.00 O HETATM 1117 HHA HEC A 70 -4.428 5.434 -5.109 1.00 0.00 H HETATM 1118 HHB HEC A 70 -4.604 0.916 -0.503 1.00 0.00 H HETATM 1119 HHC HEC A 70 1.816 1.177 -0.069 1.00 0.00 H HETATM 1120 HHD HEC A 70 1.994 5.320 -4.971 1.00 0.00 H HETATM 1121 HMA1 HEC A 70 -7.613 2.863 -1.679 1.00 0.00 H HETATM 1122 HMA2 HEC A 70 -7.142 1.263 -2.278 1.00 0.00 H HETATM 1123 HMA3 HEC A 70 -6.638 1.807 -0.666 1.00 0.00 H HETATM 1124 HAA1 HEC A 70 -7.373 4.749 -3.159 1.00 0.00 H HETATM 1125 HAA2 HEC A 70 -6.504 5.083 -4.633 1.00 0.00 H HETATM 1126 HBA1 HEC A 70 -7.806 3.654 -5.733 1.00 0.00 H HETATM 1127 HBA2 HEC A 70 -7.144 2.316 -4.794 1.00 0.00 H HETATM 1128 HMB1 HEC A 70 -2.583 -1.102 1.961 1.00 0.00 H HETATM 1129 HMB2 HEC A 70 -3.621 0.337 1.929 1.00 0.00 H HETATM 1130 HMB3 HEC A 70 -3.820 -0.876 0.707 1.00 0.00 H HETATM 1131 HAB HEC A 70 1.170 -0.113 1.419 1.00 0.00 H HETATM 1132 HBB1 HEC A 70 0.446 -2.019 -0.014 1.00 0.00 H HETATM 1133 HBB2 HEC A 70 0.930 -2.477 1.616 1.00 0.00 H HETATM 1134 HBB3 HEC A 70 -0.784 -2.403 1.200 1.00 0.00 H HETATM 1135 HMC1 HEC A 70 4.397 2.706 -0.406 1.00 0.00 H HETATM 1136 HMC2 HEC A 70 3.796 1.102 -0.852 1.00 0.00 H HETATM 1137 HMC3 HEC A 70 4.913 1.888 -1.899 1.00 0.00 H HETATM 1138 HAC HEC A 70 4.039 4.531 -4.600 1.00 0.00 H HETATM 1139 HBC1 HEC A 70 5.870 3.819 -2.317 1.00 0.00 H HETATM 1140 HBC2 HEC A 70 5.588 2.817 -3.776 1.00 0.00 H HETATM 1141 HBC3 HEC A 70 6.279 4.437 -3.911 1.00 0.00 H HETATM 1142 HMD1 HEC A 70 0.895 7.508 -6.283 1.00 0.00 H HETATM 1143 HMD2 HEC A 70 1.170 5.983 -7.160 1.00 0.00 H HETATM 1144 HMD3 HEC A 70 -0.160 7.038 -7.645 1.00 0.00 H HETATM 1145 HAD1 HEC A 70 -3.370 7.523 -5.582 1.00 0.00 H HETATM 1146 HAD2 HEC A 70 -2.071 7.983 -6.653 1.00 0.00 H HETATM 1147 HBD1 HEC A 70 -2.926 6.539 -8.428 1.00 0.00 H HETATM 1148 HBD2 HEC A 70 -4.207 5.933 -7.364 1.00 0.00 H HETATM 1149 FE HEC A 71 -4.664 1.177 8.893 1.00 0.00 FE HETATM 1150 CHA HEC A 71 -4.523 -2.156 9.810 1.00 0.00 C HETATM 1151 CHB HEC A 71 -6.544 1.927 11.665 1.00 0.00 C HETATM 1152 CHC HEC A 71 -4.503 4.514 8.051 1.00 0.00 C HETATM 1153 CHD HEC A 71 -3.219 0.396 5.804 1.00 0.00 C HETATM 1154 NA HEC A 71 -5.396 0.083 10.462 1.00 0.00 N HETATM 1155 C1A HEC A 71 -5.180 -1.255 10.665 1.00 0.00 C HETATM 1156 C2A HEC A 71 -5.787 -1.595 11.936 1.00 0.00 C HETATM 1157 C3A HEC A 71 -6.287 -0.427 12.473 1.00 0.00 C HETATM 1158 C4A HEC A 71 -6.108 0.612 11.492 1.00 0.00 C HETATM 1159 CMA HEC A 71 -6.821 -0.213 13.871 1.00 0.00 C HETATM 1160 CAA HEC A 71 -5.889 -2.972 12.561 1.00 0.00 C HETATM 1161 CBA HEC A 71 -7.288 -3.586 12.464 1.00 0.00 C HETATM 1162 CGA HEC A 71 -8.282 -2.897 13.386 1.00 0.00 C HETATM 1163 O1A HEC A 71 -9.062 -2.062 12.891 1.00 0.00 O HETATM 1164 O2A HEC A 71 -8.306 -3.220 14.593 1.00 0.00 O HETATM 1165 NB HEC A 71 -5.463 2.888 9.654 1.00 0.00 N HETATM 1166 C1B HEC A 71 -6.227 2.961 10.782 1.00 0.00 C HETATM 1167 C2B HEC A 71 -6.581 4.348 10.976 1.00 0.00 C HETATM 1168 C3B HEC A 71 -6.009 5.060 9.941 1.00 0.00 C HETATM 1169 C4B HEC A 71 -5.259 4.130 9.147 1.00 0.00 C HETATM 1170 CMB HEC A 71 -7.387 4.901 12.126 1.00 0.00 C HETATM 1171 CAB HEC A 71 -6.062 6.545 9.669 1.00 0.00 C HETATM 1172 CBB HEC A 71 -4.895 7.282 10.328 1.00 0.00 C HETATM 1173 NC HEC A 71 -3.856 2.272 7.293 1.00 0.00 N HETATM 1174 C1C HEC A 71 -3.916 3.621 7.192 1.00 0.00 C HETATM 1175 C2C HEC A 71 -3.338 4.008 5.938 1.00 0.00 C HETATM 1176 C3C HEC A 71 -3.230 2.853 5.203 1.00 0.00 C HETATM 1177 C4C HEC A 71 -3.369 1.748 6.131 1.00 0.00 C HETATM 1178 CMC HEC A 71 -3.233 5.417 5.399 1.00 0.00 C HETATM 1179 CAC HEC A 71 -3.643 2.763 3.758 1.00 0.00 C HETATM 1180 CBC HEC A 71 -2.961 3.743 2.799 1.00 0.00 C HETATM 1181 ND HEC A 71 -3.920 -0.561 7.998 1.00 0.00 N HETATM 1182 C1D HEC A 71 -3.425 -0.641 6.723 1.00 0.00 C HETATM 1183 C2D HEC A 71 -3.178 -2.039 6.451 1.00 0.00 C HETATM 1184 C3D HEC A 71 -3.441 -2.734 7.609 1.00 0.00 C HETATM 1185 C4D HEC A 71 -3.985 -1.798 8.564 1.00 0.00 C HETATM 1186 CMD HEC A 71 -2.761 -2.634 5.126 1.00 0.00 C HETATM 1187 CAD HEC A 71 -3.369 -4.233 7.786 1.00 0.00 C HETATM 1188 CBD HEC A 71 -4.720 -4.916 7.540 1.00 0.00 C HETATM 1189 CGD HEC A 71 -5.135 -5.758 8.738 1.00 0.00 C HETATM 1190 O1D HEC A 71 -5.766 -5.177 9.648 1.00 0.00 O HETATM 1191 O2D HEC A 71 -4.782 -6.955 8.736 1.00 0.00 O HETATM 1192 HHA HEC A 71 -4.476 -3.195 10.089 1.00 0.00 H HETATM 1193 HHB HEC A 71 -7.107 2.155 12.555 1.00 0.00 H HETATM 1194 HHC HEC A 71 -4.455 5.550 7.778 1.00 0.00 H HETATM 1195 HHD HEC A 71 -2.846 0.146 4.822 1.00 0.00 H HETATM 1196 HMA1 HEC A 71 -7.890 -0.010 13.824 1.00 0.00 H HETATM 1197 HMA2 HEC A 71 -6.650 -1.085 14.497 1.00 0.00 H HETATM 1198 HMA3 HEC A 71 -6.315 0.636 14.329 1.00 0.00 H HETATM 1199 HAA1 HEC A 71 -5.201 -3.663 12.076 1.00 0.00 H HETATM 1200 HAA2 HEC A 71 -5.608 -2.926 13.612 1.00 0.00 H HETATM 1201 HBA1 HEC A 71 -7.638 -3.523 11.433 1.00 0.00 H HETATM 1202 HBA2 HEC A 71 -7.234 -4.640 12.745 1.00 0.00 H HETATM 1203 HMB1 HEC A 71 -7.207 4.332 13.037 1.00 0.00 H HETATM 1204 HMB2 HEC A 71 -7.109 5.936 12.322 1.00 0.00 H HETATM 1205 HMB3 HEC A 71 -8.446 4.847 11.875 1.00 0.00 H HETATM 1206 HAB HEC A 71 -5.911 6.744 8.620 1.00 0.00 H HETATM 1207 HBB1 HEC A 71 -4.939 7.172 11.410 1.00 0.00 H HETATM 1208 HBB2 HEC A 71 -3.957 6.849 9.949 1.00 0.00 H HETATM 1209 HBB3 HEC A 71 -4.929 8.336 10.054 1.00 0.00 H HETATM 1210 HMC1 HEC A 71 -3.048 6.137 6.193 1.00 0.00 H HETATM 1211 HMC2 HEC A 71 -2.403 5.485 4.699 1.00 0.00 H HETATM 1212 HMC3 HEC A 71 -4.162 5.678 4.890 1.00 0.00 H HETATM 1213 HAC HEC A 71 -3.447 1.763 3.407 1.00 0.00 H HETATM 1214 HBC1 HEC A 71 -3.012 3.311 1.802 1.00 0.00 H HETATM 1215 HBC2 HEC A 71 -3.479 4.701 2.796 1.00 0.00 H HETATM 1216 HBC3 HEC A 71 -1.914 3.892 3.059 1.00 0.00 H HETATM 1217 HMD1 HEC A 71 -3.048 -3.683 5.074 1.00 0.00 H HETATM 1218 HMD2 HEC A 71 -3.261 -2.112 4.313 1.00 0.00 H HETATM 1219 HMD3 HEC A 71 -1.683 -2.551 4.996 1.00 0.00 H HETATM 1220 HAD1 HEC A 71 -2.627 -4.658 7.111 1.00 0.00 H HETATM 1221 HAD2 HEC A 71 -3.027 -4.456 8.798 1.00 0.00 H HETATM 1222 HBD1 HEC A 71 -5.496 -4.170 7.357 1.00 0.00 H HETATM 1223 HBD2 HEC A 71 -4.652 -5.557 6.660 1.00 0.00 H