REMARK 3DNA v2.1 (c) 2012 Dr. Xiang-Jun Lu (http://x3dna.org) REMARK Mutated PDB File from 3DNA 'mutate_bases' REMARK Mutation#1 A:...1@:[@@@] to [5CM] ATOM 1 O5' 5CM A 1 20.536 35.014 23.372 1.00 10.97 O ATOM 2 C5' 5CM A 1 19.834 33.837 23.766 1.00 10.24 C ATOM 3 C4' 5CM A 1 20.745 32.632 23.743 1.00 10.35 C ATOM 4 O4' 5CM A 1 20.077 31.512 24.349 1.00 10.04 O ATOM 5 C3' 5CM A 1 21.181 32.151 22.364 1.00 10.74 C ATOM 6 O3' 5CM A 1 22.522 31.672 22.474 1.00 11.81 O ATOM 7 C2' 5CM A 1 20.250 30.983 22.081 1.00 9.44 C ATOM 8 C1' 5CM A 1 20.037 30.405 23.469 1.00 8.63 C ATOM 9 N1 5CM A 1 18.774 29.703 23.728 1.00 1.00 N ATOM 10 C2 5CM A 1 18.801 28.501 24.438 1.00 1.00 C ATOM 11 O2 5CM A 1 19.897 28.024 24.768 1.00 1.00 O ATOM 12 N3 5CM A 1 17.635 27.887 24.745 1.00 1.00 N ATOM 13 C4 5CM A 1 16.476 28.433 24.370 1.00 1.00 C ATOM 14 N4 5CM A 1 15.350 27.792 24.694 1.00 1.00 N ATOM 15 C5 5CM A 1 16.420 29.657 23.645 1.00 1.00 C ATOM 16 C5A 5CM A 1 15.098 30.356 23.171 1.00 1.00 C ATOM 17 C6 5CM A 1 17.581 30.253 23.348 1.00 1.00 C ATOM 18 P DG A 2 23.337 31.278 21.156 1.00 13.26 P ATOM 19 OP1 DG A 2 24.761 31.571 21.391 1.00 13.17 O ATOM 20 OP2 DG A 2 22.651 31.834 19.956 1.00 12.34 O ATOM 21 O5' DG A 2 23.180 29.714 21.092 1.00 12.20 O ATOM 22 C5' DG A 2 23.830 28.894 22.040 1.00 10.87 C ATOM 23 C4' DG A 2 23.663 27.461 21.627 1.00 10.59 C ATOM 24 O4' DG A 2 22.328 27.016 21.920 1.00 10.81 O ATOM 25 C3' DG A 2 23.866 27.232 20.130 1.00 11.75 C ATOM 26 O3' DG A 2 24.412 25.926 20.055 1.00 16.36 O ATOM 27 C2' DG A 2 22.447 27.195 19.590 1.00 10.31 C ATOM 28 C1' DG A 2 21.722 26.527 20.744 1.00 8.31 C ATOM 29 N9 DG A 2 20.293 26.737 20.884 1.00 6.86 N ATOM 30 C8 DG A 2 19.536 27.799 20.464 1.00 7.02 C ATOM 31 N7 DG A 2 18.276 27.683 20.786 1.00 7.92 N ATOM 32 C5 DG A 2 18.201 26.464 21.447 1.00 5.72 C ATOM 33 C6 DG A 2 17.091 25.790 22.018 1.00 5.63 C ATOM 34 O6 DG A 2 15.916 26.151 22.052 1.00 7.25 O ATOM 35 N1 DG A 2 17.464 24.566 22.588 1.00 4.99 N ATOM 36 C2 DG A 2 18.749 24.064 22.600 1.00 4.83 C ATOM 37 N2 DG A 2 18.930 22.867 23.187 1.00 6.47 N ATOM 38 N3 DG A 2 19.786 24.688 22.072 1.00 6.26 N ATOM 39 C4 DG A 2 19.440 25.872 21.516 1.00 6.25 C ATOM 40 P DC A 3 25.388 25.500 18.860 1.00 15.45 P ATOM 41 OP1 DC A 3 26.783 25.808 19.232 1.00 18.05 O ATOM 42 OP2 DC A 3 24.827 26.022 17.578 1.00 18.52 O ATOM 43 O5' DC A 3 25.215 23.915 18.859 1.00 16.43 O ATOM 44 C5' DC A 3 25.112 23.171 20.093 1.00 14.01 C ATOM 45 C4' DC A 3 23.925 22.238 20.036 1.00 11.58 C ATOM 46 O4' DC A 3 22.721 23.004 20.043 1.00 10.18 O ATOM 47 C3' DC A 3 23.825 21.353 18.794 1.00 13.01 C ATOM 48 O3' DC A 3 24.468 20.110 19.126 1.00 15.21 O ATOM 49 C2' DC A 3 22.324 21.157 18.609 1.00 12.60 C ATOM 50 C1' DC A 3 21.682 22.203 19.512 1.00 10.51 C ATOM 51 N1 DC A 3 20.674 23.119 18.988 1.00 8.64 N ATOM 52 C2 DC A 3 19.340 22.896 19.319 1.00 7.60 C ATOM 53 O2 DC A 3 19.041 21.875 19.970 1.00 8.60 O ATOM 54 N3 DC A 3 18.408 23.794 18.929 1.00 6.88 N ATOM 55 C4 DC A 3 18.758 24.869 18.228 1.00 6.70 C ATOM 56 N4 DC A 3 17.792 25.737 17.891 1.00 8.31 N ATOM 57 C5 DC A 3 20.113 25.107 17.842 1.00 9.46 C ATOM 58 C6 DC A 3 21.030 24.206 18.236 1.00 9.69 C ATOM 59 P DG A 4 24.871 19.058 17.972 1.00 17.35 P ATOM 60 OP1 DG A 4 25.843 18.117 18.628 1.00 20.51 O ATOM 61 OP2 DG A 4 25.249 19.766 16.753 1.00 17.91 O ATOM 62 O5' DG A 4 23.511 18.294 17.681 1.00 16.58 O ATOM 63 C5' DG A 4 22.921 17.490 18.695 1.00 15.38 C ATOM 64 C4' DG A 4 21.588 16.998 18.210 1.00 14.42 C ATOM 65 O4' DG A 4 20.659 18.097 18.117 1.00 14.87 O ATOM 66 C3' DG A 4 21.632 16.362 16.824 1.00 15.89 C ATOM 67 O3' DG A 4 20.678 15.319 16.883 1.00 19.23 O ATOM 68 C2' DG A 4 21.104 17.456 15.921 1.00 14.78 C ATOM 69 C1' DG A 4 20.090 18.125 16.827 1.00 13.90 C ATOM 70 N9 DG A 4 19.757 19.506 16.488 1.00 12.65 N ATOM 71 C8 DG A 4 20.562 20.452 15.892 1.00 10.25 C ATOM 72 N7 DG A 4 19.949 21.585 15.677 1.00 11.04 N ATOM 73 C5 DG A 4 18.660 21.378 16.171 1.00 9.42 C ATOM 74 C6 DG A 4 17.528 22.248 16.212 1.00 6.06 C ATOM 75 O6 DG A 4 17.430 23.415 15.808 1.00 9.32 O ATOM 76 N1 DG A 4 16.428 21.622 16.800 1.00 8.01 N ATOM 77 C2 DG A 4 16.415 20.343 17.280 1.00 7.53 C ATOM 78 N2 DG A 4 15.257 19.917 17.806 1.00 11.59 N ATOM 79 N3 DG A 4 17.456 19.526 17.250 1.00 9.30 N ATOM 80 C4 DG A 4 18.534 20.105 16.684 1.00 10.01 C ATOM 81 P DA A 5 20.603 14.194 15.744 1.00 19.40 P ATOM 82 OP1 DA A 5 21.230 12.959 16.281 1.00 22.23 O ATOM 83 OP2 DA A 5 21.017 14.732 14.419 1.00 20.38 O ATOM 84 O5' DA A 5 19.039 13.951 15.692 1.00 18.19 O ATOM 85 C5' DA A 5 18.304 13.773 16.911 1.00 15.73 C ATOM 86 C4' DA A 5 16.855 14.135 16.705 1.00 14.82 C ATOM 87 O4' DA A 5 16.695 15.558 16.470 1.00 14.21 O ATOM 88 C3' DA A 5 16.163 13.420 15.547 1.00 13.81 C ATOM 89 O3' DA A 5 14.904 12.934 16.032 1.00 12.63 O ATOM 90 C2' DA A 5 16.031 14.502 14.481 1.00 12.63 C ATOM 91 C1' DA A 5 15.929 15.797 15.300 1.00 12.23 C ATOM 92 N9 DA A 5 16.461 17.015 14.676 1.00 10.21 N ATOM 93 C8 DA A 5 17.734 17.239 14.207 1.00 8.60 C ATOM 94 N7 DA A 5 17.918 18.439 13.718 1.00 9.25 N ATOM 95 C5 DA A 5 16.683 19.056 13.875 1.00 7.96 C ATOM 96 C6 DA A 5 16.223 20.352 13.555 1.00 7.79 C ATOM 97 N6 DA A 5 16.984 21.297 12.994 1.00 8.00 N ATOM 98 N1 DA A 5 14.933 20.644 13.839 1.00 8.78 N ATOM 99 C2 DA A 5 14.171 19.699 14.406 1.00 8.80 C ATOM 100 N3 DA A 5 14.489 18.449 14.756 1.00 9.25 N ATOM 101 C4 DA A 5 15.775 18.188 14.459 1.00 8.46 C ATOM 102 P DA A 6 13.954 12.080 15.071 1.00 12.41 P ATOM 103 OP1 DA A 6 13.092 11.246 15.953 1.00 12.12 O ATOM 104 OP2 DA A 6 14.769 11.453 14.020 1.00 13.04 O ATOM 105 O5' DA A 6 13.056 13.202 14.406 1.00 10.42 O ATOM 106 C5' DA A 6 12.184 13.965 15.222 1.00 8.93 C ATOM 107 C4' DA A 6 11.308 14.846 14.376 1.00 7.26 C ATOM 108 O4' DA A 6 12.033 15.991 13.896 1.00 8.21 O ATOM 109 C3' DA A 6 10.654 14.188 13.168 1.00 7.65 C ATOM 110 O3' DA A 6 9.262 14.480 13.256 1.00 8.46 O ATOM 111 C2' DA A 6 11.373 14.820 11.974 1.00 6.69 C ATOM 112 C1' DA A 6 11.810 16.185 12.511 1.00 7.12 C ATOM 113 N9 DA A 6 13.051 16.742 11.953 1.00 9.06 N ATOM 114 C8 DA A 6 14.253 16.097 11.802 1.00 7.73 C ATOM 115 N7 DA A 6 15.197 16.853 11.305 1.00 8.04 N ATOM 116 C5 DA A 6 14.585 18.084 11.106 1.00 6.10 C ATOM 117 C6 DA A 6 15.066 19.322 10.605 1.00 5.87 C ATOM 118 N6 DA A 6 16.329 19.520 10.209 1.00 5.88 N ATOM 119 N1 DA A 6 14.198 20.357 10.535 1.00 5.73 N ATOM 120 C2 DA A 6 12.938 20.162 10.946 1.00 5.41 C ATOM 121 N3 DA A 6 12.370 19.048 11.444 1.00 9.07 N ATOM 122 C4 DA A 6 13.259 18.034 11.497 1.00 6.34 C ATOM 123 P DT A 7 8.258 14.006 12.104 1.00 8.61 P ATOM 124 OP1 DT A 7 6.947 13.813 12.710 1.00 9.62 O ATOM 125 OP2 DT A 7 8.856 12.940 11.281 1.00 9.62 O ATOM 126 O5' DT A 7 8.163 15.293 11.202 1.00 8.95 O ATOM 127 C5' DT A 7 7.907 16.566 11.799 1.00 7.95 C ATOM 128 C4' DT A 7 8.037 17.644 10.754 1.00 9.61 C ATOM 129 O4' DT A 7 9.413 17.875 10.402 1.00 9.78 O ATOM 130 C3' DT A 7 7.286 17.382 9.446 1.00 10.94 C ATOM 131 O3' DT A 7 6.228 18.341 9.347 1.00 11.97 O ATOM 132 C2' DT A 7 8.356 17.467 8.358 1.00 9.86 C ATOM 133 C1' DT A 7 9.471 18.252 9.036 1.00 8.76 C ATOM 134 N1 DT A 7 10.850 18.009 8.588 1.00 7.75 N ATOM 135 C2 DT A 7 11.576 19.096 8.122 1.00 7.10 C ATOM 136 O2 DT A 7 11.113 20.233 8.017 1.00 8.86 O ATOM 137 N3 DT A 7 12.874 18.803 7.780 1.00 7.27 N ATOM 138 C4 DT A 7 13.507 17.588 7.844 1.00 6.07 C ATOM 139 O4 DT A 7 14.687 17.499 7.508 1.00 7.68 O ATOM 140 C5 DT A 7 12.689 16.491 8.322 1.00 6.88 C ATOM 141 C7 DT A 7 13.292 15.128 8.424 1.00 7.98 C ATOM 142 C6 DT A 7 11.414 16.754 8.659 1.00 7.78 C ATOM 143 P DT A 8 5.196 18.285 8.120 1.00 13.16 P ATOM 144 OP1 DT A 8 3.928 18.831 8.653 1.00 14.21 O ATOM 145 OP2 DT A 8 5.211 16.970 7.475 1.00 12.40 O ATOM 146 O5' DT A 8 5.818 19.323 7.094 1.00 12.21 O ATOM 147 C5' DT A 8 6.104 20.657 7.510 1.00 10.87 C ATOM 148 C4' DT A 8 6.937 21.347 6.466 1.00 9.09 C ATOM 149 O4' DT A 8 8.271 20.815 6.382 1.00 8.32 O ATOM 150 C3' DT A 8 6.372 21.324 5.049 1.00 9.83 C ATOM 151 O3' DT A 8 6.060 22.664 4.718 1.00 11.88 O ATOM 152 C2' DT A 8 7.476 20.700 4.203 1.00 8.59 C ATOM 153 C1' DT A 8 8.709 20.942 5.040 1.00 7.33 C ATOM 154 N1 DT A 8 9.786 19.985 4.858 1.00 7.74 N ATOM 155 C2 DT A 8 11.028 20.464 4.498 1.00 6.25 C ATOM 156 O2 DT A 8 11.253 21.654 4.285 1.00 7.74 O ATOM 157 N3 DT A 8 12.003 19.496 4.402 1.00 6.29 N ATOM 158 C4 DT A 8 11.852 18.139 4.631 1.00 5.16 C ATOM 159 O4 DT A 8 12.819 17.406 4.547 1.00 6.98 O ATOM 160 C5 DT A 8 10.502 17.708 4.979 1.00 5.39 C ATOM 161 C7 DT A 8 10.230 16.254 5.214 1.00 6.78 C ATOM 162 C6 DT A 8 9.556 18.638 5.074 1.00 5.19 C ATOM 163 P DC A 9 5.633 23.056 3.231 1.00 13.02 P ATOM 164 OP1 DC A 9 4.777 24.264 3.372 1.00 14.31 O ATOM 165 OP2 DC A 9 5.136 21.862 2.474 1.00 12.50 O ATOM 166 O5' DC A 9 7.010 23.523 2.599 1.00 11.87 O ATOM 167 C5' DC A 9 7.795 24.522 3.246 1.00 10.75 C ATOM 168 C4' DC A 9 8.959 24.903 2.367 1.00 9.59 C ATOM 169 O4' DC A 9 9.908 23.818 2.295 1.00 9.23 O ATOM 170 C3' DC A 9 8.616 25.264 0.922 1.00 8.81 C ATOM 171 O3' DC A 9 9.415 26.393 0.613 1.00 10.51 O ATOM 172 C2' DC A 9 9.062 24.042 0.116 1.00 8.23 C ATOM 173 C1' DC A 9 10.221 23.504 0.941 1.00 7.64 C ATOM 174 N1 DC A 9 10.496 22.063 0.918 1.00 6.32 N ATOM 175 C2 DC A 9 11.807 21.621 0.655 1.00 6.09 C ATOM 176 O2 DC A 9 12.681 22.438 0.347 1.00 6.51 O ATOM 177 N3 DC A 9 12.084 20.311 0.747 1.00 5.66 N ATOM 178 C4 DC A 9 11.121 19.442 1.060 1.00 4.61 C ATOM 179 N4 DC A 9 11.460 18.160 1.153 1.00 4.93 N ATOM 180 C5 DC A 9 9.772 19.854 1.293 1.00 4.29 C ATOM 181 C6 DC A 9 9.509 21.162 1.213 1.00 5.60 C ATOM 182 P DG A 10 8.967 27.410 -0.543 1.00 10.96 P ATOM 183 OP1 DG A 10 9.539 28.712 -0.121 1.00 12.01 O ATOM 184 OP2 DG A 10 7.537 27.286 -0.852 1.00 10.20 O ATOM 185 O5' DG A 10 9.789 26.881 -1.789 1.00 9.93 O ATOM 186 C5' DG A 10 11.213 26.858 -1.731 1.00 8.74 C ATOM 187 C4' DG A 10 11.749 25.962 -2.815 1.00 8.46 C ATOM 188 O4' DG A 10 11.646 24.576 -2.415 1.00 8.92 O ATOM 189 C3' DG A 10 10.983 26.088 -4.139 1.00 10.13 C ATOM 190 O3' DG A 10 11.919 25.972 -5.215 1.00 12.41 O ATOM 191 C2' DG A 10 10.136 24.826 -4.176 1.00 8.44 C ATOM 192 C1' DG A 10 11.122 23.882 -3.532 1.00 8.25 C ATOM 193 N9 DG A 10 10.650 22.581 -3.105 1.00 7.68 N ATOM 194 C8 DG A 10 9.376 22.181 -2.794 1.00 6.45 C ATOM 195 N7 DG A 10 9.304 20.915 -2.486 1.00 6.73 N ATOM 196 C5 DG A 10 10.614 20.467 -2.594 1.00 6.87 C ATOM 197 C6 DG A 10 11.169 19.186 -2.384 1.00 6.37 C ATOM 198 O6 DG A 10 10.595 18.146 -2.033 1.00 6.70 O ATOM 199 N1 DG A 10 12.547 19.181 -2.617 1.00 5.91 N ATOM 200 C2 DG A 10 13.287 20.270 -2.997 1.00 5.67 C ATOM 201 N2 DG A 10 14.610 20.066 -3.194 1.00 5.88 N ATOM 202 N3 DG A 10 12.777 21.470 -3.181 1.00 5.74 N ATOM 203 C4 DG A 10 11.448 21.491 -2.969 1.00 6.52 C ATOM 204 P DC A 11 12.458 27.280 -5.963 1.00 12.66 P ATOM 205 OP1 DC A 11 12.480 28.409 -5.000 1.00 14.25 O ATOM 206 OP2 DC A 11 11.647 27.383 -7.200 1.00 14.85 O ATOM 207 O5' DC A 11 13.948 26.855 -6.327 1.00 11.12 O ATOM 208 C5' DC A 11 14.960 26.774 -5.311 1.00 11.12 C ATOM 209 C4' DC A 11 15.910 25.631 -5.600 1.00 10.88 C ATOM 210 O4' DC A 11 15.282 24.346 -5.384 1.00 10.00 O ATOM 211 C3' DC A 11 16.519 25.558 -7.001 1.00 10.63 C ATOM 212 O3' DC A 11 17.857 25.082 -6.787 1.00 14.71 O ATOM 213 C2' DC A 11 15.691 24.475 -7.681 1.00 10.22 C ATOM 214 C1' DC A 11 15.425 23.519 -6.536 1.00 8.09 C ATOM 215 N1 DC A 11 14.230 22.675 -6.585 1.00 8.28 N ATOM 216 C2 DC A 11 14.371 21.300 -6.377 1.00 7.02 C ATOM 217 O2 DC A 11 15.509 20.815 -6.267 1.00 6.07 O ATOM 218 N3 DC A 11 13.262 20.537 -6.296 1.00 5.85 N ATOM 219 C4 DC A 11 12.050 21.085 -6.421 1.00 6.09 C ATOM 220 N4 DC A 11 10.985 20.286 -6.287 1.00 6.43 N ATOM 221 C5 DC A 11 11.877 22.475 -6.680 1.00 7.70 C ATOM 222 C6 DC A 11 12.987 23.225 -6.763 1.00 7.22 C ATOM 223 P DG A 12 18.981 25.204 -7.937 1.00 18.40 P ATOM 224 OP1 DG A 12 20.100 25.982 -7.344 1.00 17.61 O ATOM 225 OP2 DG A 12 18.351 25.655 -9.207 1.00 19.16 O ATOM 226 O5' DG A 12 19.535 23.719 -8.107 1.00 16.51 O ATOM 227 C5' DG A 12 18.670 22.624 -8.342 1.00 14.94 C ATOM 228 C4' DG A 12 19.343 21.650 -9.272 1.00 11.73 C ATOM 229 O4' DG A 12 18.456 20.535 -9.424 1.00 13.54 O ATOM 230 C3' DG A 12 19.585 22.202 -10.677 1.00 10.67 C ATOM 231 O3' DG A 12 20.769 21.656 -11.256 1.00 11.20 O ATOM 232 C2' DG A 12 18.346 21.775 -11.441 1.00 9.83 C ATOM 233 C1' DG A 12 17.792 20.587 -10.665 1.00 11.23 C ATOM 234 N9 DG A 12 16.369 20.677 -10.371 1.00 9.01 N ATOM 235 C8 DG A 12 15.562 21.794 -10.380 1.00 9.03 C ATOM 236 N7 DG A 12 14.325 21.522 -10.064 1.00 8.15 N ATOM 237 C5 DG A 12 14.318 20.152 -9.840 1.00 7.27 C ATOM 238 C6 DG A 12 13.255 19.273 -9.485 1.00 7.02 C ATOM 239 O6 DG A 12 12.054 19.541 -9.299 1.00 9.57 O ATOM 240 N1 DG A 12 13.702 17.954 -9.357 1.00 7.75 N ATOM 241 C2 DG A 12 14.998 17.531 -9.553 1.00 7.31 C ATOM 242 N2 DG A 12 15.232 16.222 -9.394 1.00 6.97 N ATOM 243 N3 DG A 12 15.991 18.340 -9.887 1.00 7.60 N ATOM 244 C4 DG A 12 15.578 19.623 -10.017 1.00 8.49 C ATOM 245 O5' DC B 13 7.852 11.318 -8.962 1.00 24.01 O ATOM 246 C5' DC B 13 8.663 10.453 -9.760 1.00 17.43 C ATOM 247 C4' DC B 13 10.124 10.500 -9.371 1.00 16.15 C ATOM 248 O4' DC B 13 10.667 11.825 -9.564 1.00 13.85 O ATOM 249 C3' DC B 13 10.437 10.130 -7.925 1.00 15.72 C ATOM 250 O3' DC B 13 11.600 9.312 -7.938 1.00 16.08 O ATOM 251 C2' DC B 13 10.712 11.467 -7.249 1.00 14.23 C ATOM 252 C1' DC B 13 11.265 12.323 -8.375 1.00 12.84 C ATOM 253 N1 DC B 13 10.916 13.750 -8.299 1.00 11.99 N ATOM 254 C2 DC B 13 11.914 14.726 -8.562 1.00 12.14 C ATOM 255 O2 DC B 13 13.081 14.362 -8.808 1.00 10.37 O ATOM 256 N3 DC B 13 11.569 16.036 -8.541 1.00 9.42 N ATOM 257 C4 DC B 13 10.308 16.395 -8.276 1.00 9.81 C ATOM 258 N4 DC B 13 10.020 17.697 -8.277 1.00 9.52 N ATOM 259 C5 DC B 13 9.288 15.432 -7.998 1.00 9.57 C ATOM 260 C6 DC B 13 9.632 14.137 -8.014 1.00 12.09 C ATOM 261 P DG B 14 12.053 8.530 -6.610 1.00 16.35 P ATOM 262 OP1 DG B 14 12.539 7.185 -7.042 1.00 16.78 O ATOM 263 OP2 DG B 14 11.009 8.640 -5.563 1.00 16.46 O ATOM 264 O5' DG B 14 13.291 9.394 -6.120 1.00 12.62 O ATOM 265 C5' DG B 14 14.408 9.581 -6.976 1.00 10.96 C ATOM 266 C4' DG B 14 15.279 10.678 -6.433 1.00 8.89 C ATOM 267 O4' DG B 14 14.675 11.972 -6.596 1.00 11.49 O ATOM 268 C3' DG B 14 15.622 10.535 -4.958 1.00 10.20 C ATOM 269 O3' DG B 14 17.026 10.331 -4.877 1.00 10.35 O ATOM 270 C2' DG B 14 15.088 11.811 -4.309 1.00 8.73 C ATOM 271 C1' DG B 14 14.985 12.780 -5.476 1.00 9.69 C ATOM 272 N9 DG B 14 13.910 13.758 -5.331 1.00 9.00 N ATOM 273 C8 DG B 14 12.619 13.498 -4.942 1.00 9.20 C ATOM 274 N7 DG B 14 11.872 14.566 -4.900 1.00 9.55 N ATOM 275 C5 DG B 14 12.719 15.599 -5.289 1.00 7.14 C ATOM 276 C6 DG B 14 12.464 16.981 -5.424 1.00 6.60 C ATOM 277 O6 DG B 14 11.396 17.585 -5.243 1.00 7.47 O ATOM 278 N1 DG B 14 13.603 17.679 -5.816 1.00 5.37 N ATOM 279 C2 DG B 14 14.831 17.116 -6.061 1.00 4.29 C ATOM 280 N2 DG B 14 15.805 17.968 -6.419 1.00 5.23 N ATOM 281 N3 DG B 14 15.078 15.810 -5.952 1.00 5.68 N ATOM 282 C4 DG B 14 13.983 15.121 -5.558 1.00 6.34 C ATOM 283 P DC B 15 17.740 10.184 -3.461 1.00 10.32 P ATOM 284 OP1 DC B 15 18.945 9.344 -3.662 1.00 11.85 O ATOM 285 OP2 DC B 15 16.733 9.806 -2.445 1.00 11.85 O ATOM 286 O5' DC B 15 18.221 11.665 -3.148 1.00 8.61 O ATOM 287 C5' DC B 15 19.064 12.358 -4.048 1.00 7.64 C ATOM 288 C4' DC B 15 18.977 13.840 -3.790 1.00 7.94 C ATOM 289 O4' DC B 15 17.626 14.297 -3.972 1.00 8.70 O ATOM 290 C3' DC B 15 19.317 14.264 -2.371 1.00 8.43 C ATOM 291 O3' DC B 15 20.738 14.345 -2.263 1.00 10.15 O ATOM 292 C2' DC B 15 18.628 15.623 -2.261 1.00 9.03 C ATOM 293 C1' DC B 15 17.454 15.513 -3.235 1.00 8.23 C ATOM 294 N1 DC B 15 16.092 15.513 -2.673 1.00 7.06 N ATOM 295 C2 DC B 15 15.359 16.690 -2.735 1.00 4.00 C ATOM 296 O2 DC B 15 15.900 17.704 -3.201 1.00 7.32 O ATOM 297 N3 DC B 15 14.087 16.704 -2.286 1.00 4.74 N ATOM 298 C4 DC B 15 13.548 15.600 -1.770 1.00 6.08 C ATOM 299 N4 DC B 15 12.297 15.671 -1.334 1.00 8.29 N ATOM 300 C5 DC B 15 14.276 14.376 -1.676 1.00 7.53 C ATOM 301 C6 DC B 15 15.540 14.379 -2.131 1.00 6.28 C ATOM 302 P DG B 16 21.424 14.639 -0.847 1.00 10.63 P ATOM 303 OP1 DG B 16 22.828 14.175 -0.955 1.00 12.67 O ATOM 304 OP2 DG B 16 20.542 14.103 0.234 1.00 10.97 O ATOM 305 O5' DG B 16 21.402 16.219 -0.718 1.00 9.05 O ATOM 306 C5' DG B 16 22.084 17.056 -1.638 1.00 8.80 C ATOM 307 C4' DG B 16 21.783 18.499 -1.315 1.00 9.18 C ATOM 308 O4' DG B 16 20.342 18.696 -1.335 1.00 9.51 O ATOM 309 C3' DG B 16 22.258 18.944 0.076 1.00 10.43 C ATOM 310 O3' DG B 16 22.766 20.275 -0.076 1.00 11.03 O ATOM 311 C2' DG B 16 21.008 18.850 0.940 1.00 8.76 C ATOM 312 C1' DG B 16 19.885 19.133 -0.048 1.00 8.80 C ATOM 313 N9 DG B 16 18.643 18.429 0.279 1.00 6.87 N ATOM 314 C8 DG B 16 18.497 17.151 0.767 1.00 5.08 C ATOM 315 N7 DG B 16 17.251 16.831 0.999 1.00 4.80 N ATOM 316 C5 DG B 16 16.532 17.963 0.638 1.00 5.11 C ATOM 317 C6 DG B 16 15.130 18.228 0.674 1.00 4.20 C ATOM 318 O6 DG B 16 14.214 17.487 1.035 1.00 6.60 O ATOM 319 N1 DG B 16 14.839 19.513 0.226 1.00 4.74 N ATOM 320 C2 DG B 16 15.768 20.425 -0.213 1.00 5.83 C ATOM 321 N2 DG B 16 15.295 21.619 -0.606 1.00 7.11 N ATOM 322 N3 DG B 16 17.067 20.190 -0.263 1.00 6.72 N ATOM 323 C4 DG B 16 17.377 18.951 0.180 1.00 7.15 C ATOM 324 P DA B 17 22.722 21.352 1.129 1.00 11.55 P ATOM 325 OP1 DA B 17 23.815 22.298 0.753 1.00 11.87 O ATOM 326 OP2 DA B 17 22.725 20.721 2.460 1.00 12.79 O ATOM 327 O5' DA B 17 21.321 22.073 0.942 1.00 9.64 O ATOM 328 C5' DA B 17 20.969 22.717 -0.290 1.00 9.77 C ATOM 329 C4' DA B 17 19.850 23.702 -0.041 1.00 9.69 C ATOM 330 O4' DA B 17 18.678 22.977 0.387 1.00 9.06 O ATOM 331 C3' DA B 17 20.127 24.729 1.060 1.00 9.94 C ATOM 332 O3' DA B 17 19.481 25.938 0.649 1.00 11.50 O ATOM 333 C2' DA B 17 19.459 24.121 2.289 1.00 8.92 C ATOM 334 C1' DA B 17 18.284 23.347 1.713 1.00 8.62 C ATOM 335 N9 DA B 17 17.934 22.099 2.396 1.00 8.04 N ATOM 336 C8 DA B 17 18.791 21.090 2.750 1.00 6.85 C ATOM 337 N7 DA B 17 18.191 20.040 3.257 1.00 7.38 N ATOM 338 C5 DA B 17 16.846 20.394 3.260 1.00 6.78 C ATOM 339 C6 DA B 17 15.689 19.705 3.665 1.00 5.17 C ATOM 340 N6 DA B 17 15.711 18.462 4.143 1.00 3.99 N ATOM 341 N1 DA B 17 14.502 20.346 3.548 1.00 5.61 N ATOM 342 C2 DA B 17 14.485 21.580 3.041 1.00 4.71 C ATOM 343 N3 DA B 17 15.501 22.320 2.607 1.00 6.35 N ATOM 344 C4 DA B 17 16.672 21.664 2.751 1.00 7.28 C ATOM 345 P DA B 18 19.585 27.272 1.543 1.00 12.50 P ATOM 346 OP1 DA B 18 19.399 28.404 0.597 1.00 13.81 O ATOM 347 OP2 DA B 18 20.774 27.219 2.424 1.00 12.76 O ATOM 348 O5' DA B 18 18.306 27.192 2.490 1.00 10.94 O ATOM 349 C5' DA B 18 17.005 27.186 1.942 1.00 10.80 C ATOM 350 C4' DA B 18 15.992 26.999 3.040 1.00 10.73 C ATOM 351 O4' DA B 18 15.893 25.631 3.479 1.00 10.03 O ATOM 352 C3' DA B 18 16.214 27.852 4.287 1.00 12.14 C ATOM 353 O3' DA B 18 15.136 28.782 4.360 1.00 14.86 O ATOM 354 C2' DA B 18 16.277 26.844 5.435 1.00 11.64 C ATOM 355 C1' DA B 18 15.603 25.596 4.871 1.00 9.42 C ATOM 356 N9 DA B 18 16.096 24.315 5.390 1.00 6.87 N ATOM 357 C8 DA B 18 17.391 23.890 5.486 1.00 6.19 C ATOM 358 N7 DA B 18 17.520 22.672 5.962 1.00 7.59 N ATOM 359 C5 DA B 18 16.219 22.273 6.212 1.00 5.25 C ATOM 360 C6 DA B 18 15.678 21.080 6.722 1.00 6.12 C ATOM 361 N6 DA B 18 16.408 20.015 7.073 1.00 6.75 N ATOM 362 N1 DA B 18 14.335 21.010 6.850 1.00 5.45 N ATOM 363 C2 DA B 18 13.603 22.053 6.476 1.00 3.61 C ATOM 364 N3 DA B 18 13.991 23.226 5.973 1.00 6.67 N ATOM 365 C4 DA B 18 15.330 23.273 5.867 1.00 6.21 C ATOM 366 P DT B 19 14.865 29.619 5.710 1.00 15.30 P ATOM 367 OP1 DT B 19 14.172 30.844 5.281 1.00 15.85 O ATOM 368 OP2 DT B 19 16.107 29.695 6.515 1.00 15.39 O ATOM 369 O5' DT B 19 13.846 28.701 6.510 1.00 13.58 O ATOM 370 C5' DT B 19 12.684 28.174 5.864 1.00 12.30 C ATOM 371 C4' DT B 19 11.909 27.311 6.826 1.00 11.80 C ATOM 372 O4' DT B 19 12.626 26.090 7.129 1.00 11.14 O ATOM 373 C3' DT B 19 11.584 27.960 8.173 1.00 10.83 C ATOM 374 O3' DT B 19 10.189 27.833 8.395 1.00 14.36 O ATOM 375 C2' DT B 19 12.409 27.166 9.184 1.00 9.15 C ATOM 376 C1' DT B 19 12.544 25.808 8.521 1.00 8.05 C ATOM 377 N1 DT B 19 13.716 24.979 8.867 1.00 8.37 N ATOM 378 C2 DT B 19 13.496 23.688 9.310 1.00 5.51 C ATOM 379 O2 DT B 19 12.381 23.202 9.467 1.00 8.94 O ATOM 380 N3 DT B 19 14.631 22.971 9.551 1.00 6.53 N ATOM 381 C4 DT B 19 15.943 23.388 9.393 1.00 5.96 C ATOM 382 O4 DT B 19 16.852 22.613 9.632 1.00 7.83 O ATOM 383 C5 DT B 19 16.107 24.759 8.938 1.00 7.42 C ATOM 384 C7 DT B 19 17.488 25.309 8.745 1.00 6.92 C ATOM 385 C6 DT B 19 14.995 25.475 8.711 1.00 7.58 C ATOM 386 P DT B 20 9.501 28.568 9.648 1.00 16.22 P ATOM 387 OP1 DT B 20 8.217 29.106 9.155 1.00 18.66 O ATOM 388 OP2 DT B 20 10.464 29.479 10.294 1.00 18.15 O ATOM 389 O5' DT B 20 9.217 27.334 10.599 1.00 15.60 O ATOM 390 C5' DT B 20 8.666 26.140 10.056 1.00 14.04 C ATOM 391 C4' DT B 20 8.671 25.050 11.094 1.00 13.51 C ATOM 392 O4' DT B 20 9.970 24.445 11.239 1.00 14.14 O ATOM 393 C3' DT B 20 8.228 25.450 12.498 1.00 14.20 C ATOM 394 O3' DT B 20 7.349 24.412 12.922 1.00 17.99 O ATOM 395 C2' DT B 20 9.522 25.427 13.309 1.00 12.83 C ATOM 396 C1' DT B 20 10.285 24.306 12.618 1.00 12.31 C ATOM 397 N1 DT B 20 11.753 24.267 12.716 1.00 9.62 N ATOM 398 C2 DT B 20 12.350 23.061 13.068 1.00 8.13 C ATOM 399 O2 DT B 20 11.716 22.055 13.367 1.00 7.91 O ATOM 400 N3 DT B 20 13.735 23.086 13.046 1.00 6.98 N ATOM 401 C4 DT B 20 14.546 24.169 12.720 1.00 6.80 C ATOM 402 O4 DT B 20 15.765 24.036 12.699 1.00 9.42 O ATOM 403 C5 DT B 20 13.852 25.402 12.412 1.00 7.42 C ATOM 404 C7 DT B 20 14.653 26.626 12.099 1.00 8.52 C ATOM 405 C6 DT B 20 12.509 25.389 12.425 1.00 8.54 C ATOM 406 P DC B 21 6.372 24.633 14.185 1.00 18.73 P ATOM 407 OP1 DC B 21 5.058 24.006 13.851 1.00 19.36 O ATOM 408 OP2 DC B 21 6.449 26.055 14.615 1.00 18.95 O ATOM 409 O5' DC B 21 7.051 23.746 15.313 1.00 16.94 O ATOM 410 C5' DC B 21 7.250 22.356 15.105 1.00 13.33 C ATOM 411 C4' DC B 21 8.318 21.866 16.046 1.00 12.33 C ATOM 412 O4' DC B 21 9.594 22.420 15.720 1.00 9.71 O ATOM 413 C3' DC B 21 8.060 22.260 17.496 1.00 12.43 C ATOM 414 O3' DC B 21 7.406 21.136 18.085 1.00 14.13 O ATOM 415 C2' DC B 21 9.449 22.565 18.057 1.00 11.08 C ATOM 416 C1' DC B 21 10.377 22.256 16.884 1.00 10.35 C ATOM 417 N1 DC B 21 11.582 23.058 16.698 1.00 8.64 N ATOM 418 C2 DC B 21 12.813 22.427 16.813 1.00 7.60 C ATOM 419 O2 DC B 21 12.840 21.242 17.163 1.00 10.95 O ATOM 420 N3 DC B 21 13.945 23.122 16.543 1.00 8.32 N ATOM 421 C4 DC B 21 13.868 24.403 16.197 1.00 7.65 C ATOM 422 N4 DC B 21 14.999 25.046 15.934 1.00 9.44 N ATOM 423 C5 DC B 21 12.621 25.087 16.108 1.00 10.04 C ATOM 424 C6 DC B 21 11.513 24.384 16.372 1.00 8.27 C ATOM 425 P DG B 22 6.749 21.241 19.556 1.00 16.02 P ATOM 426 OP1 DG B 22 5.888 20.030 19.702 1.00 17.95 O ATOM 427 OP2 DG B 22 6.183 22.583 19.800 1.00 14.32 O ATOM 428 O5' DG B 22 8.000 21.043 20.519 1.00 14.86 O ATOM 429 C5' DG B 22 8.688 19.794 20.587 1.00 13.26 C ATOM 430 C4' DG B 22 9.868 19.921 21.521 1.00 12.52 C ATOM 431 O4' DG B 22 10.942 20.674 20.904 1.00 11.35 O ATOM 432 C3' DG B 22 9.557 20.639 22.837 1.00 11.11 C ATOM 433 O3' DG B 22 10.325 19.982 23.833 1.00 12.05 O ATOM 434 C2' DG B 22 10.156 22.023 22.641 1.00 11.09 C ATOM 435 C1' DG B 22 11.372 21.653 21.822 1.00 10.76 C ATOM 436 N9 DG B 22 12.028 22.718 21.090 1.00 8.55 N ATOM 437 C8 DG B 22 11.473 23.887 20.647 1.00 9.06 C ATOM 438 N7 DG B 22 12.335 24.660 20.036 1.00 8.24 N ATOM 439 C5 DG B 22 13.532 23.949 20.080 1.00 7.21 C ATOM 440 C6 DG B 22 14.820 24.272 19.577 1.00 6.89 C ATOM 441 O6 DG B 22 15.181 25.292 18.956 1.00 9.83 O ATOM 442 N1 DG B 22 15.739 23.266 19.847 1.00 7.06 N ATOM 443 C2 DG B 22 15.466 22.103 20.504 1.00 5.72 C ATOM 444 N2 DG B 22 16.493 21.262 20.671 1.00 7.39 N ATOM 445 N3 DG B 22 14.272 21.783 20.967 1.00 8.10 N ATOM 446 C4 DG B 22 13.358 22.748 20.723 1.00 8.78 C REMARK Mutation#2 B:..23@:[@@@] to [5CM] ATOM 447 P 5CM B 23 9.791 19.880 25.340 1.00 11.05 P ATOM 448 OP1 5CM B 23 8.717 18.881 25.357 1.00 11.33 O ATOM 449 OP2 5CM B 23 9.567 21.231 25.879 1.00 10.81 O ATOM 450 O5' 5CM B 23 11.051 19.250 26.080 1.00 10.81 O ATOM 451 C5' 5CM B 23 11.599 17.986 25.636 1.00 9.82 C ATOM 452 C4' 5CM B 23 13.097 18.083 25.435 1.00 9.12 C ATOM 453 O4' 5CM B 23 13.422 18.939 24.318 1.00 9.65 O ATOM 454 C3' 5CM B 23 13.894 18.658 26.603 1.00 8.49 C ATOM 455 O3' 5CM B 23 14.180 17.651 27.557 1.00 9.73 O ATOM 456 C2' 5CM B 23 15.164 19.135 25.939 1.00 9.23 C ATOM 457 C1' 5CM B 23 14.664 19.604 24.585 1.00 10.01 C ATOM 458 N1 5CM B 23 14.435 21.043 24.480 1.00 1.00 N ATOM 459 C2 5CM B 23 15.492 21.843 24.043 1.00 1.00 C ATOM 460 O2 5CM B 23 16.601 21.321 23.852 1.00 1.00 O ATOM 461 N3 5CM B 23 15.282 23.165 23.840 1.00 1.00 N ATOM 462 C4 5CM B 23 14.074 23.688 24.059 1.00 1.00 C ATOM 463 N4 5CM B 23 13.912 24.997 23.846 1.00 1.00 N ATOM 464 C5 5CM B 23 12.978 22.895 24.505 1.00 1.00 C ATOM 465 C5A 5CM B 23 11.534 23.439 24.783 1.00 1.00 C ATOM 466 C6 5CM B 23 13.201 21.589 24.701 1.00 1.00 C ATOM 467 P DG B 24 14.596 18.068 29.054 1.00 10.01 P ATOM 468 OP1 DG B 24 14.522 16.834 29.888 1.00 12.01 O ATOM 469 OP2 DG B 24 13.826 19.264 29.465 1.00 9.98 O ATOM 470 O5' DG B 24 16.125 18.519 28.949 1.00 8.74 O ATOM 471 C5' DG B 24 17.163 17.611 28.533 1.00 7.36 C ATOM 472 C4' DG B 24 18.439 18.382 28.292 1.00 8.17 C ATOM 473 O4' DG B 24 18.241 19.301 27.198 1.00 6.85 O ATOM 474 C3' DG B 24 18.848 19.257 29.475 1.00 7.53 C ATOM 475 O3' DG B 24 19.638 18.521 30.383 1.00 8.62 O ATOM 476 C2' DG B 24 19.617 20.384 28.823 1.00 8.46 C ATOM 477 C1' DG B 24 18.894 20.541 27.486 1.00 8.34 C ATOM 478 N9 DG B 24 17.884 21.596 27.425 1.00 6.55 N ATOM 479 C8 DG B 24 16.572 21.517 27.831 1.00 6.41 C ATOM 480 N7 DG B 24 15.899 22.608 27.591 1.00 6.28 N ATOM 481 C5 DG B 24 16.823 23.458 27.005 1.00 5.86 C ATOM 482 C6 DG B 24 16.669 24.770 26.519 1.00 6.31 C ATOM 483 O6 DG B 24 15.658 25.450 26.512 1.00 8.43 O ATOM 484 N1 DG B 24 17.856 25.277 26.000 1.00 6.47 N ATOM 485 C2 DG B 24 19.051 24.598 25.963 1.00 5.45 C ATOM 486 N2 DG B 24 20.112 25.260 25.449 1.00 6.23 N ATOM 487 N3 DG B 24 19.205 23.361 26.407 1.00 5.01 N ATOM 488 C4 DG B 24 18.055 22.857 26.911 1.00 5.80 C HETATM 489 MG MG A 25 14.497 29.488 19.686 1.00 9.95 MG HETATM 490 N1 SPM B 26 3.257 20.375 -2.961 1.00 23.13 N HETATM 491 C2 SPM B 26 4.594 20.448 -3.721 1.00 20.24 C HETATM 492 C3 SPM B 26 5.244 19.074 -3.822 1.00 19.51 C HETATM 493 C4 SPM B 26 6.466 19.082 -4.743 1.00 20.97 C HETATM 494 N5 SPM B 26 7.659 18.411 -4.078 1.00 21.48 N HETATM 495 C6 SPM B 26 8.387 17.460 -5.015 1.00 19.53 C HETATM 496 C7 SPM B 26 9.107 16.360 -4.239 1.00 16.81 C HETATM 497 O HOH A 28 8.593 11.593 15.992 1.00 12.85 O HETATM 498 O HOH A 29 8.345 21.807 -6.350 1.00 12.77 O HETATM 499 O HOH A 31 6.819 11.371 14.010 1.00 11.62 O HETATM 500 O HOH A 32 11.457 24.471 4.904 1.00 9.00 O HETATM 501 O HOH A 33 14.648 23.514 -2.942 1.00 9.02 O HETATM 502 O HOH A 35 14.097 24.526 1.308 1.00 5.89 O HETATM 503 O HOH A 36 15.227 25.325 -1.037 1.00 12.99 O HETATM 504 O HOH A 39 20.718 30.364 18.754 1.00 11.34 O HETATM 505 O HOH A 40 4.630 15.194 12.157 1.00 14.56 O HETATM 506 O HOH A 41 6.933 17.387 3.209 1.00 14.32 O HETATM 507 O HOH A 42 6.628 20.354 -1.318 1.00 22.59 O HETATM 508 O HOH A 47 17.016 17.408 19.049 1.00 13.54 O HETATM 509 O HOH A 49 9.393 16.229 1.608 1.00 10.03 O HETATM 510 O HOH A 51 12.520 11.369 9.872 1.00 12.45 O HETATM 511 O HOH A 52 9.747 13.720 8.795 1.00 11.93 O HETATM 512 O HOH A 53 6.851 14.989 15.351 1.00 16.73 O HETATM 513 O HOH A 54 12.653 28.515 23.264 1.00 13.53 O HETATM 514 O HOH A 55 12.456 26.168 2.922 1.00 9.13 O HETATM 515 O HOH A 57 8.264 13.914 6.437 1.00 14.77 O HETATM 516 O HOH A 58 22.693 23.554 -10.395 1.00 14.67 O HETATM 517 O HOH A 59 9.412 24.294 6.779 1.00 12.72 O HETATM 518 O HOH A 60 9.769 22.456 8.822 1.00 9.97 O HETATM 519 O HOH A 62 11.774 28.535 2.024 1.00 16.84 O HETATM 520 O HOH A 64 14.583 12.750 11.362 1.00 16.38 O HETATM 521 O HOH A 65 15.257 27.898 -1.615 1.00 18.38 O HETATM 522 O HOH A 66 19.171 24.892 -12.997 1.00 19.63 O HETATM 523 O HOH A 67 9.732 18.233 14.769 1.00 15.15 O HETATM 524 O HOH A 68 21.233 28.918 16.307 1.00 22.40 O HETATM 525 O HOH A 69 8.408 9.756 20.214 1.00 28.82 O HETATM 526 O HOH A 71 18.647 18.153 9.888 1.00 23.19 O HETATM 527 O HOH A 72 20.133 19.277 12.143 1.00 22.26 O HETATM 528 O HOH A 76 22.599 34.371 18.962 1.00 21.26 O HETATM 529 O HOH A 78 16.794 24.836 -11.397 1.00 20.12 O HETATM 530 O HOH A 80 19.989 21.947 12.311 1.00 26.66 O HETATM 531 O HOH A 84 12.595 23.689 -10.279 1.00 22.43 O HETATM 532 O HOH A 86 5.869 19.277 14.003 1.00 25.50 O HETATM 533 O HOH A 87 13.316 8.620 17.008 1.00 28.02 O HETATM 534 O HOH A 91 8.496 9.149 17.741 1.00 25.20 O HETATM 535 O HOH A 92 16.575 15.568 7.277 1.00 19.81 O HETATM 536 O HOH A 95 14.323 29.489 0.641 1.00 22.34 O HETATM 537 O HOH A 96 13.935 29.718 -3.253 1.00 17.35 O HETATM 538 O HOH A 97 8.213 16.541 -1.233 1.00 24.57 O HETATM 539 O HOH A 98 6.191 19.684 1.122 1.00 28.04 O HETATM 540 O HOH A 99 11.476 11.717 7.474 1.00 32.07 O HETATM 541 O HOH A 100 6.561 23.519 -4.652 1.00 26.19 O HETATM 542 O HOH A 101 19.004 25.383 14.563 1.00 28.41 O HETATM 543 O HOH A 102 18.645 27.650 15.981 1.00 21.81 O HETATM 544 O HOH A 104 6.855 16.274 5.612 1.00 30.29 O HETATM 545 O HOH A 106 8.806 13.842 17.555 1.00 24.51 O HETATM 546 O HOH A 110 21.359 23.984 14.493 1.00 30.22 O HETATM 547 O HOH A 111 4.195 14.329 16.370 1.00 30.47 O HETATM 548 O HOH A 113 8.661 28.758 4.341 1.00 35.97 O HETATM 549 O HOH A 115 7.283 17.567 15.799 1.00 24.26 O HETATM 550 O HOH A 118 12.254 17.776 16.502 1.00 24.08 O HETATM 551 O HOH A 119 17.776 15.828 10.746 1.00 32.85 O HETATM 552 O HOH A 120 8.429 30.856 1.322 1.00 31.03 O HETATM 553 O HOH A 122 12.273 12.158 18.803 1.00 29.59 O HETATM 554 O HOH A 123 13.236 12.557 5.646 1.00 24.36 O HETATM 555 O HOH A 124 13.686 14.800 4.585 1.00 18.40 O HETATM 556 O HOH A 125 6.696 25.463 -2.640 1.00 36.14 O HETATM 557 O HOH A 126 5.368 31.381 1.803 1.00 37.48 O HETATM 558 O HOH A 127 10.262 13.833 2.421 1.00 40.94 O HETATM 559 O HOH A 130 9.820 30.028 -4.350 1.00 26.76 O HETATM 560 O HOH A 131 16.056 31.325 1.498 0.50 23.56 O HETATM 561 O HOH A 135 4.422 17.703 13.038 1.00 31.97 O HETATM 562 O HOH A 137 6.988 25.904 6.628 1.00 24.37 O HETATM 563 O HOH A 142 22.639 24.891 -8.000 1.00 36.07 O HETATM 564 O HOH A 150 4.974 26.179 5.408 1.00 33.35 O HETATM 565 O HOH A 155 20.524 31.121 14.542 1.00 40.94 O HETATM 566 O HOH A 158 10.333 25.040 -8.596 1.00 32.62 O HETATM 567 O HOH A 159 21.736 12.179 12.653 1.00 46.40 O HETATM 568 O HOH A 160 17.064 9.939 13.762 1.00 35.73 O HETATM 569 O HOH A 161 18.720 11.287 12.064 1.00 38.29 O HETATM 570 O HOH A 162 9.887 12.424 4.298 1.00 33.61 O HETATM 571 O HOH A 166 23.963 13.530 19.114 1.00 28.89 O HETATM 572 O HOH A 168 13.592 27.784 -9.330 1.00 30.64 O HETATM 573 O HOH A 170 25.650 15.031 17.968 0.50 30.72 O HETATM 574 O HOH A 172 14.610 15.781 18.932 0.50 21.01 O HETATM 575 O HOH A 173 9.911 30.877 -1.816 0.50 24.90 O HETATM 576 O HOH A 174 6.101 29.493 -1.774 0.50 19.10 O HETATM 577 O HOH A 175 17.494 29.181 -6.799 0.50 27.27 O HETATM 578 O HOH A 182 16.746 7.136 13.812 0.50 23.69 O HETATM 579 O HOH A 183 6.158 28.568 3.200 0.50 24.12 O HETATM 580 O HOH A 185 23.708 20.929 14.886 0.50 25.17 O HETATM 581 O HOH A 186 24.998 35.466 18.258 0.50 33.67 O HETATM 582 O HOH A 188 14.400 28.129 21.209 1.00 8.63 O HETATM 583 O HOH A 189 14.535 31.065 20.990 1.00 9.51 O HETATM 584 O HOH A 191 16.555 29.590 19.782 1.00 8.91 O HETATM 585 O HOH B 27 14.601 27.898 15.650 1.00 11.40 O HETATM 586 O HOH B 30 13.439 21.823 28.480 1.00 11.26 O HETATM 587 O HOH B 34 11.154 27.140 19.246 1.00 11.11 O HETATM 588 O HOH B 37 11.092 13.266 -0.252 1.00 16.95 O HETATM 589 O HOH B 38 9.896 20.046 12.691 1.00 10.19 O HETATM 590 O HOH B 43 7.090 18.134 -8.445 1.00 14.43 O HETATM 591 O HOH B 44 17.909 25.521 12.333 1.00 14.63 O HETATM 592 O HOH B 45 13.654 19.155 20.912 1.00 13.20 O HETATM 593 O HOH B 46 15.860 28.634 9.194 1.00 16.65 O HETATM 594 O HOH B 48 8.182 21.145 10.976 1.00 16.83 O HETATM 595 O HOH B 50 19.383 8.704 -6.257 1.00 15.73 O HETATM 596 O HOH B 56 20.136 15.758 30.219 1.00 12.92 O HETATM 597 O HOH B 61 7.986 24.724 20.727 1.00 21.53 O HETATM 598 O HOH B 63 25.626 21.146 -1.300 1.00 28.65 O HETATM 599 O HOH B 70 12.607 14.835 28.561 1.00 29.11 O HETATM 600 O HOH B 73 8.480 24.845 23.380 1.00 21.57 O HETATM 601 O HOH B 74 19.544 18.208 4.560 1.00 19.29 O HETATM 602 O HOH B 75 10.725 9.446 -12.934 1.00 22.94 O HETATM 603 O HOH B 77 20.119 21.736 6.614 1.00 21.40 O HETATM 604 O HOH B 79 10.795 10.720 -3.681 1.00 26.79 O HETATM 605 O HOH B 81 12.135 10.759 -1.779 1.00 32.24 O HETATM 606 O HOH B 82 18.755 28.923 6.416 1.00 22.72 O HETATM 607 O HOH B 83 11.052 22.795 27.525 1.00 13.14 O HETATM 608 O HOH B 85 14.188 29.952 10.945 1.00 27.78 O HETATM 609 O HOH B 88 7.953 23.240 25.432 1.00 18.07 O HETATM 610 O HOH B 89 6.191 19.408 24.722 1.00 21.52 O HETATM 611 O HOH B 90 11.167 25.744 24.229 1.00 20.46 O HETATM 612 O HOH B 93 17.813 28.071 10.861 1.00 28.46 O HETATM 613 O HOH B 94 22.127 22.451 4.728 1.00 24.80 O HETATM 614 O HOH B 103 15.917 14.631 30.405 1.00 25.29 O HETATM 615 O HOH B 105 13.877 4.300 -10.093 1.00 33.13 O HETATM 616 O HOH B 107 14.905 28.034 27.909 1.00 34.96 O HETATM 617 O HOH B 108 8.415 16.922 27.087 1.00 24.22 O HETATM 618 O HOH B 109 10.060 12.580 -12.046 1.00 26.25 O HETATM 619 O HOH B 112 17.698 16.275 4.668 1.00 25.85 O HETATM 620 O HOH B 114 19.238 19.299 7.412 1.00 25.26 O HETATM 621 O HOH B 116 12.127 6.510 -9.747 1.00 25.07 O HETATM 622 O HOH B 117 15.917 30.398 27.013 1.00 26.49 O HETATM 623 O HOH B 121 19.991 26.231 5.557 1.00 24.99 O HETATM 624 O HOH B 128 16.691 14.598 2.664 1.00 33.01 O HETATM 625 O HOH B 129 19.552 22.501 9.274 1.00 23.89 O HETATM 626 O HOH B 132 13.563 25.902 27.907 1.00 23.54 O HETATM 627 O HOH B 133 12.039 31.697 6.894 1.00 24.53 O HETATM 628 O HOH B 134 5.656 21.645 11.238 1.00 33.81 O HETATM 629 O HOH B 136 19.710 7.113 -2.230 1.00 39.86 O HETATM 630 O HOH B 138 8.577 16.884 23.272 1.00 31.42 O HETATM 631 O HOH B 139 7.729 6.544 -7.752 1.00 38.70 O HETATM 632 O HOH B 140 5.401 23.903 9.261 1.00 30.51 O HETATM 633 O HOH B 141 6.422 17.626 18.719 1.00 32.13 O HETATM 634 O HOH B 143 12.467 34.583 6.854 1.00 34.25 O HETATM 635 O HOH B 144 4.949 18.951 22.187 1.00 29.57 O HETATM 636 O HOH B 145 4.350 18.412 -0.407 1.00 50.75 O HETATM 637 O HOH B 146 9.363 6.391 -10.013 1.00 35.45 O HETATM 638 O HOH B 147 25.051 14.771 -2.501 1.00 55.59 O HETATM 639 O HOH B 148 8.423 6.925 -5.604 1.00 37.30 O HETATM 640 O HOH B 149 8.471 26.685 16.582 1.00 26.72 O HETATM 641 O HOH B 151 2.196 19.129 22.169 1.00 27.87 O HETATM 642 O HOH B 152 9.161 23.520 29.216 1.00 29.15 O HETATM 643 O HOH B 153 14.045 14.937 2.002 1.00 16.21 O HETATM 644 O HOH B 154 6.862 12.892 -6.303 1.00 35.02 O HETATM 645 O HOH B 156 2.963 20.750 20.209 1.00 34.60 O HETATM 646 O HOH B 157 4.145 24.348 17.851 1.00 31.41 O HETATM 647 O HOH B 163 5.610 16.441 -0.967 1.00 39.04 O HETATM 648 O HOH B 164 11.129 26.145 26.802 1.00 41.39 O HETATM 649 O HOH B 165 11.757 28.727 12.530 1.00 25.23 O HETATM 650 O HOH B 167 11.702 18.930 18.568 1.00 42.87 O HETATM 651 O HOH B 169 4.223 11.130 -10.012 0.50 21.84 O HETATM 652 O HOH B 171 4.824 23.165 21.865 0.50 18.67 O HETATM 653 O HOH B 176 21.305 10.062 -0.681 0.50 27.40 O HETATM 654 O HOH B 177 17.940 8.223 1.175 0.50 28.92 O HETATM 655 O HOH B 178 10.449 3.967 -3.477 0.50 20.68 O HETATM 656 O HOH B 179 26.090 23.097 2.312 0.50 35.13 O HETATM 657 O HOH B 180 11.943 22.877 30.958 0.50 21.47 O HETATM 658 O HOH B 181 18.190 14.161 29.049 0.50 20.97 O HETATM 659 O HOH B 184 9.708 31.333 5.446 0.50 18.82 O HETATM 660 O HOH B 187 14.411 27.852 18.413 1.00 8.72 O HETATM 661 O HOH B 190 14.479 30.698 18.002 1.00 9.27 O HETATM 662 O HOH B 192 12.391 29.595 19.638 1.00 10.18 O END