USER MOD reduce.3.24.130724 H: found=0, std=0, add=280, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 280 hydrogens (74 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DC O5' : rot 180:sc= 0 USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 8 DT C7 :methyl -30:sc= -0.112 (180deg=-0.465) USER MOD Single : A 12 DG O3' : rot 180:sc= 0 USER MOD Single : B 13 DC O5' : rot 180:sc= 0 USER MOD Single : B 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 20 DT C7 :methyl -30:sc= -0.12 (180deg=-0.506) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 1.391 -8.115 -1.118 1.00 0.00 O ATOM 2 C5' DC A 1 2.464 -8.061 -2.060 1.00 0.00 C ATOM 3 C4' DC A 1 3.342 -6.799 -1.933 1.00 0.00 C ATOM 4 O4' DC A 1 2.573 -5.636 -2.243 1.00 0.00 O ATOM 5 C3' DC A 1 3.938 -6.610 -0.524 1.00 0.00 C ATOM 6 O3' DC A 1 5.285 -6.154 -0.637 1.00 0.00 O ATOM 7 C2' DC A 1 3.016 -5.530 0.058 1.00 0.00 C ATOM 8 C1' DC A 1 2.746 -4.696 -1.197 1.00 0.00 C ATOM 9 N1 DC A 1 1.570 -3.780 -1.109 1.00 0.00 N ATOM 10 C2 DC A 1 1.762 -2.407 -1.324 1.00 0.00 C ATOM 11 O2 DC A 1 2.865 -1.929 -1.597 1.00 0.00 O ATOM 12 N3 DC A 1 0.724 -1.538 -1.258 1.00 0.00 N ATOM 13 C4 DC A 1 -0.467 -2.009 -0.958 1.00 0.00 C ATOM 14 N4 DC A 1 -1.433 -1.135 -0.946 1.00 0.00 N ATOM 15 C5 DC A 1 -0.734 -3.386 -0.726 1.00 0.00 C ATOM 16 C6 DC A 1 0.311 -4.250 -0.815 1.00 0.00 C ATOM 0 H5' DC A 1 2.052 -8.106 -3.068 1.00 0.00 H new ATOM 0 H5'' DC A 1 3.092 -8.943 -1.933 1.00 0.00 H new ATOM 0 H4' DC A 1 4.165 -6.935 -2.635 1.00 0.00 H new ATOM 0 H3' DC A 1 3.981 -7.510 0.089 1.00 0.00 H new ATOM 0 H2' DC A 1 2.104 -5.948 0.483 1.00 0.00 H new ATOM 0 H2'' DC A 1 3.499 -4.951 0.845 1.00 0.00 H new ATOM 0 HO5' DC A 1 0.876 -8.937 -1.256 1.00 0.00 H new ATOM 0 H1' DC A 1 3.583 -4.017 -1.357 1.00 0.00 H new ATOM 0 H41 DC A 1 -2.384 -1.429 -0.722 1.00 0.00 H new ATOM 0 H42 DC A 1 -1.239 -0.157 -1.161 1.00 0.00 H new ATOM 0 H5 DC A 1 -1.729 -3.732 -0.488 1.00 0.00 H new ATOM 0 H6 DC A 1 0.153 -5.306 -0.655 1.00 0.00 H new ATOM 29 P DG A 2 6.272 -5.993 0.633 1.00 0.00 P ATOM 30 OP1 DG A 2 7.540 -6.694 0.313 1.00 0.00 O ATOM 31 OP2 DG A 2 5.547 -6.365 1.873 1.00 0.00 O ATOM 32 O5' DG A 2 6.551 -4.402 0.681 1.00 0.00 O ATOM 33 C5' DG A 2 7.397 -3.762 -0.273 1.00 0.00 C ATOM 34 C4' DG A 2 7.857 -2.350 0.140 1.00 0.00 C ATOM 35 O4' DG A 2 6.776 -1.424 0.094 1.00 0.00 O ATOM 36 C3' DG A 2 8.470 -2.293 1.550 1.00 0.00 C ATOM 37 O3' DG A 2 9.576 -1.391 1.538 1.00 0.00 O ATOM 38 C2' DG A 2 7.273 -1.827 2.381 1.00 0.00 C ATOM 39 C1' DG A 2 6.516 -0.929 1.400 1.00 0.00 C ATOM 40 N9 DG A 2 5.051 -0.901 1.610 1.00 0.00 N ATOM 41 C8 DG A 2 4.202 -1.955 1.840 1.00 0.00 C ATOM 42 N7 DG A 2 2.937 -1.630 1.896 1.00 0.00 N ATOM 43 C5 DG A 2 2.953 -0.237 1.720 1.00 0.00 C ATOM 44 C6 DG A 2 1.891 0.736 1.683 1.00 0.00 C ATOM 45 O6 DG A 2 0.674 0.567 1.743 1.00 0.00 O ATOM 46 N1 DG A 2 2.336 2.035 1.556 1.00 0.00 N ATOM 47 C2 DG A 2 3.639 2.378 1.430 1.00 0.00 C ATOM 48 N2 DG A 2 3.912 3.650 1.327 1.00 0.00 N ATOM 49 N3 DG A 2 4.652 1.516 1.414 1.00 0.00 N ATOM 50 C4 DG A 2 4.247 0.217 1.574 1.00 0.00 C ATOM 0 H5' DG A 2 6.869 -3.697 -1.224 1.00 0.00 H new ATOM 0 H5'' DG A 2 8.276 -4.385 -0.438 1.00 0.00 H new ATOM 0 H4' DG A 2 8.629 -2.082 -0.582 1.00 0.00 H new ATOM 0 H3' DG A 2 8.888 -3.220 1.943 1.00 0.00 H new ATOM 0 H2' DG A 2 6.662 -2.665 2.718 1.00 0.00 H new ATOM 0 H2'' DG A 2 7.585 -1.282 3.272 1.00 0.00 H new ATOM 0 H1' DG A 2 6.864 0.093 1.552 1.00 0.00 H new ATOM 0 H8 DG A 2 4.551 -2.970 1.964 1.00 0.00 H new ATOM 0 H1 DG A 2 1.641 2.782 1.557 1.00 0.00 H new ATOM 0 H21 DG A 2 4.880 3.958 1.230 1.00 0.00 H new ATOM 0 H22 DG A 2 3.158 4.336 1.343 1.00 0.00 H new HETATM 62 N1 5CM A 3 5.122 1.334 4.905 1.00 0.00 N HETATM 63 C2 5CM A 3 3.843 1.915 4.859 1.00 0.00 C HETATM 64 N3 5CM A 3 2.727 1.151 4.950 1.00 0.00 N HETATM 65 C4 5CM A 3 2.873 -0.149 5.146 1.00 0.00 C HETATM 66 C5 5CM A 3 4.157 -0.803 5.262 1.00 0.00 C HETATM 67 C5A 5CM A 3 4.303 -2.305 5.488 1.00 0.00 C HETATM 68 C6 5CM A 3 5.255 -0.018 5.135 1.00 0.00 C HETATM 69 O2 5CM A 3 3.668 3.127 4.732 1.00 0.00 O HETATM 70 N4 5CM A 3 1.741 -0.809 5.178 1.00 0.00 N HETATM 71 C1' 5CM A 3 6.319 2.190 4.648 1.00 0.00 C HETATM 72 C2' 5CM A 3 7.349 2.228 5.778 1.00 0.00 C HETATM 73 C3' 5CM A 3 8.664 2.574 5.063 1.00 0.00 C HETATM 74 C4' 5CM A 3 8.335 2.291 3.587 1.00 0.00 C HETATM 75 O4' 5CM A 3 7.043 1.701 3.539 1.00 0.00 O HETATM 76 O3' 5CM A 3 9.048 3.937 5.220 1.00 0.00 O HETATM 77 C5' 5CM A 3 9.372 1.413 2.872 1.00 0.00 C HETATM 78 O5' 5CM A 3 9.579 0.172 3.538 1.00 0.00 O HETATM 79 P 5CM A 3 10.431 -1.012 2.855 1.00 0.00 P HETATM 80 OP1 5CM A 3 11.729 -0.450 2.404 1.00 0.00 O HETATM 81 OP2 5CM A 3 10.438 -2.177 3.773 1.00 0.00 O HETATM 0 HN42 5CM A 3 1.743 -1.819 5.324 1.00 0.00 H new HETATM 0 HN41 5CM A 3 0.858 -0.313 5.057 1.00 0.00 H new HETATM 0 H5A3 5CM A 3 3.814 -2.582 6.422 1.00 0.00 H new HETATM 0 H5A2 5CM A 3 3.839 -2.844 4.662 1.00 0.00 H new HETATM 0 H5A1 5CM A 3 5.360 -2.564 5.542 1.00 0.00 H new HETATM 0 H5'' 5CM A 3 9.043 1.224 1.850 1.00 0.00 H new HETATM 0 H2'' 5CM A 3 7.093 2.976 6.528 1.00 0.00 H new HETATM 0 H6 5CM A 3 6.249 -0.459 5.215 1.00 0.00 H new HETATM 0 H5' 5CM A 3 10.318 1.951 2.808 1.00 0.00 H new HETATM 0 H4' 5CM A 3 8.358 3.237 3.045 1.00 0.00 H new HETATM 0 H3' 5CM A 3 9.500 2.002 5.464 1.00 0.00 H new HETATM 0 H2' 5CM A 3 7.414 1.269 6.293 1.00 0.00 H new HETATM 0 H1' 5CM A 3 5.892 3.183 4.509 1.00 0.00 H new ATOM 95 P DG A 4 9.733 4.492 6.574 1.00 0.00 P ATOM 96 OP1 DG A 4 10.478 5.729 6.229 1.00 0.00 O ATOM 97 OP2 DG A 4 10.463 3.385 7.239 1.00 0.00 O ATOM 98 O5' DG A 4 8.477 4.891 7.499 1.00 0.00 O ATOM 99 C5' DG A 4 7.711 6.059 7.231 1.00 0.00 C ATOM 100 C4' DG A 4 6.445 6.155 8.094 1.00 0.00 C ATOM 101 O4' DG A 4 5.471 5.194 7.693 1.00 0.00 O ATOM 102 C3' DG A 4 6.707 5.956 9.601 1.00 0.00 C ATOM 103 O3' DG A 4 6.142 7.058 10.298 1.00 0.00 O ATOM 104 C2' DG A 4 5.966 4.645 9.875 1.00 0.00 C ATOM 105 C1' DG A 4 4.823 4.754 8.872 1.00 0.00 C ATOM 106 N9 DG A 4 4.056 3.507 8.641 1.00 0.00 N ATOM 107 C8 DG A 4 4.484 2.201 8.637 1.00 0.00 C ATOM 108 N7 DG A 4 3.546 1.327 8.370 1.00 0.00 N ATOM 109 C5 DG A 4 2.389 2.113 8.244 1.00 0.00 C ATOM 110 C6 DG A 4 1.008 1.766 8.010 1.00 0.00 C ATOM 111 O6 DG A 4 0.498 0.665 7.798 1.00 0.00 O ATOM 112 N1 DG A 4 0.152 2.847 8.063 1.00 0.00 N ATOM 113 C2 DG A 4 0.559 4.120 8.283 1.00 0.00 C ATOM 114 N2 DG A 4 -0.365 5.033 8.391 1.00 0.00 N ATOM 115 N3 DG A 4 1.819 4.497 8.468 1.00 0.00 N ATOM 116 C4 DG A 4 2.694 3.444 8.442 1.00 0.00 C ATOM 0 H5' DG A 4 7.428 6.068 6.178 1.00 0.00 H new ATOM 0 H5'' DG A 4 8.329 6.940 7.403 1.00 0.00 H new ATOM 0 H4' DG A 4 6.080 7.170 7.937 1.00 0.00 H new ATOM 0 H3' DG A 4 7.752 5.908 9.907 1.00 0.00 H new ATOM 0 H2' DG A 4 6.592 3.771 9.696 1.00 0.00 H new ATOM 0 H2'' DG A 4 5.610 4.578 10.903 1.00 0.00 H new ATOM 0 H1' DG A 4 4.051 5.428 9.242 1.00 0.00 H new ATOM 0 H8 DG A 4 5.507 1.919 8.837 1.00 0.00 H new ATOM 0 H1 DG A 4 -0.845 2.678 7.929 1.00 0.00 H new ATOM 0 H21 DG A 4 -0.104 6.005 8.557 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.349 4.775 8.310 1.00 0.00 H new ATOM 128 P DA A 5 6.463 7.388 11.843 1.00 0.00 P ATOM 129 OP1 DA A 5 7.274 8.630 11.897 1.00 0.00 O ATOM 130 OP2 DA A 5 6.957 6.170 12.529 1.00 0.00 O ATOM 131 O5' DA A 5 4.985 7.699 12.397 1.00 0.00 O ATOM 132 C5' DA A 5 4.266 8.846 11.954 1.00 0.00 C ATOM 133 C4' DA A 5 2.805 8.876 12.434 1.00 0.00 C ATOM 134 O4' DA A 5 2.073 7.789 11.870 1.00 0.00 O ATOM 135 C3' DA A 5 2.679 8.803 13.964 1.00 0.00 C ATOM 136 O3' DA A 5 1.646 9.695 14.382 1.00 0.00 O ATOM 137 C2' DA A 5 2.393 7.314 14.173 1.00 0.00 C ATOM 138 C1' DA A 5 1.634 6.921 12.903 1.00 0.00 C ATOM 139 N9 DA A 5 1.850 5.511 12.495 1.00 0.00 N ATOM 140 C8 DA A 5 3.021 4.789 12.477 1.00 0.00 C ATOM 141 N7 DA A 5 2.888 3.541 12.105 1.00 0.00 N ATOM 142 C5 DA A 5 1.508 3.435 11.868 1.00 0.00 C ATOM 143 C6 DA A 5 0.642 2.393 11.454 1.00 0.00 C ATOM 144 N6 DA A 5 1.023 1.162 11.172 1.00 0.00 N ATOM 145 N1 DA A 5 -0.667 2.597 11.312 1.00 0.00 N ATOM 146 C2 DA A 5 -1.144 3.807 11.575 1.00 0.00 C ATOM 147 N3 DA A 5 -0.468 4.877 11.981 1.00 0.00 N ATOM 148 C4 DA A 5 0.869 4.626 12.102 1.00 0.00 C ATOM 0 H5' DA A 5 4.283 8.878 10.865 1.00 0.00 H new ATOM 0 H5'' DA A 5 4.775 9.743 12.307 1.00 0.00 H new ATOM 0 H4' DA A 5 2.396 9.831 12.102 1.00 0.00 H new ATOM 0 H3' DA A 5 3.541 9.116 14.553 1.00 0.00 H new ATOM 0 H2' DA A 5 3.312 6.740 14.286 1.00 0.00 H new ATOM 0 H2'' DA A 5 1.796 7.141 15.068 1.00 0.00 H new ATOM 0 H1' DA A 5 0.566 7.013 13.098 1.00 0.00 H new ATOM 0 H8 DA A 5 3.974 5.218 12.748 1.00 0.00 H new ATOM 0 H61 DA A 5 0.334 0.469 10.880 1.00 0.00 H new ATOM 0 H62 DA A 5 2.007 0.903 11.246 1.00 0.00 H new ATOM 0 H2 DA A 5 -2.208 3.938 11.444 1.00 0.00 H new ATOM 160 P DA A 6 1.048 9.751 15.881 1.00 0.00 P ATOM 161 OP1 DA A 6 0.651 11.154 16.158 1.00 0.00 O ATOM 162 OP2 DA A 6 1.983 9.079 16.815 1.00 0.00 O ATOM 163 O5' DA A 6 -0.286 8.855 15.754 1.00 0.00 O ATOM 164 C5' DA A 6 -1.384 9.289 14.956 1.00 0.00 C ATOM 165 C4' DA A 6 -2.677 8.487 15.179 1.00 0.00 C ATOM 166 O4' DA A 6 -2.534 7.155 14.698 1.00 0.00 O ATOM 167 C3' DA A 6 -3.105 8.426 16.654 1.00 0.00 C ATOM 168 O3' DA A 6 -4.523 8.573 16.727 1.00 0.00 O ATOM 169 C2' DA A 6 -2.573 7.053 17.077 1.00 0.00 C ATOM 170 C1' DA A 6 -2.636 6.240 15.778 1.00 0.00 C ATOM 171 N9 DA A 6 -1.549 5.242 15.638 1.00 0.00 N ATOM 172 C8 DA A 6 -0.208 5.383 15.905 1.00 0.00 C ATOM 173 N7 DA A 6 0.515 4.325 15.636 1.00 0.00 N ATOM 174 C5 DA A 6 -0.443 3.401 15.187 1.00 0.00 C ATOM 175 C6 DA A 6 -0.410 2.055 14.748 1.00 0.00 C ATOM 176 N6 DA A 6 0.680 1.319 14.633 1.00 0.00 N ATOM 177 N1 DA A 6 -1.528 1.409 14.419 1.00 0.00 N ATOM 178 C2 DA A 6 -2.677 2.069 14.488 1.00 0.00 C ATOM 179 N3 DA A 6 -2.866 3.330 14.854 1.00 0.00 N ATOM 180 C4 DA A 6 -1.700 3.949 15.194 1.00 0.00 C ATOM 0 H5' DA A 6 -1.104 9.222 13.905 1.00 0.00 H new ATOM 0 H5'' DA A 6 -1.580 10.340 15.167 1.00 0.00 H new ATOM 0 H4' DA A 6 -3.450 9.017 14.623 1.00 0.00 H new ATOM 0 H3' DA A 6 -2.723 9.208 17.310 1.00 0.00 H new ATOM 0 H2' DA A 6 -1.556 7.117 17.464 1.00 0.00 H new ATOM 0 H2'' DA A 6 -3.185 6.608 17.861 1.00 0.00 H new ATOM 0 H1' DA A 6 -3.574 5.684 15.787 1.00 0.00 H new ATOM 0 H8 DA A 6 0.215 6.293 16.304 1.00 0.00 H new ATOM 0 H61 DA A 6 0.612 0.355 14.308 1.00 0.00 H new ATOM 0 H62 DA A 6 1.590 1.715 14.869 1.00 0.00 H new ATOM 0 H2 DA A 6 -3.562 1.514 14.214 1.00 0.00 H new ATOM 192 P DT A 7 -5.361 8.474 18.104 1.00 0.00 P ATOM 193 OP1 DT A 7 -6.631 9.220 17.915 1.00 0.00 O ATOM 194 OP2 DT A 7 -4.477 8.844 19.237 1.00 0.00 O ATOM 195 O5' DT A 7 -5.706 6.905 18.214 1.00 0.00 O ATOM 196 C5' DT A 7 -6.553 6.272 17.261 1.00 0.00 C ATOM 197 C4' DT A 7 -6.491 4.742 17.350 1.00 0.00 C ATOM 198 O4' DT A 7 -5.169 4.279 17.120 1.00 0.00 O ATOM 199 C3' DT A 7 -6.927 4.184 18.714 1.00 0.00 C ATOM 200 O3' DT A 7 -8.263 3.692 18.641 1.00 0.00 O ATOM 201 C2' DT A 7 -5.902 3.077 18.981 1.00 0.00 C ATOM 202 C1' DT A 7 -5.087 2.991 17.693 1.00 0.00 C ATOM 203 N1 DT A 7 -3.676 2.599 17.947 1.00 0.00 N ATOM 204 C2 DT A 7 -3.285 1.296 17.623 1.00 0.00 C ATOM 205 O2 DT A 7 -4.056 0.422 17.233 1.00 0.00 O ATOM 206 N3 DT A 7 -1.953 1.001 17.768 1.00 0.00 N ATOM 207 C4 DT A 7 -0.982 1.849 18.244 1.00 0.00 C ATOM 208 O4 DT A 7 0.181 1.449 18.260 1.00 0.00 O ATOM 209 C5 DT A 7 -1.476 3.159 18.674 1.00 0.00 C ATOM 210 C7 DT A 7 -0.533 4.177 19.289 1.00 0.00 C ATOM 211 C6 DT A 7 -2.787 3.487 18.515 1.00 0.00 C ATOM 0 H5' DT A 7 -6.266 6.587 16.258 1.00 0.00 H new ATOM 0 H5'' DT A 7 -7.580 6.601 17.417 1.00 0.00 H new ATOM 0 H4' DT A 7 -7.185 4.390 16.587 1.00 0.00 H new ATOM 0 H3' DT A 7 -6.943 4.923 19.515 1.00 0.00 H new ATOM 0 H2' DT A 7 -5.270 3.319 19.835 1.00 0.00 H new ATOM 0 H2'' DT A 7 -6.391 2.129 19.205 1.00 0.00 H new ATOM 0 H1' DT A 7 -5.478 2.221 17.028 1.00 0.00 H new ATOM 0 H3 DT A 7 -1.655 0.064 17.497 1.00 0.00 H new ATOM 0 H71 DT A 7 -0.884 5.183 19.060 1.00 0.00 H new ATOM 0 H72 DT A 7 -0.504 4.040 20.370 1.00 0.00 H new ATOM 0 H73 DT A 7 0.468 4.040 18.879 1.00 0.00 H new ATOM 0 H6 DT A 7 -3.136 4.457 18.838 1.00 0.00 H new ATOM 224 P DT A 8 -9.095 3.223 19.946 1.00 0.00 P ATOM 225 OP1 DT A 8 -10.536 3.240 19.590 1.00 0.00 O ATOM 226 OP2 DT A 8 -8.642 4.020 21.113 1.00 0.00 O ATOM 227 O5' DT A 8 -8.650 1.692 20.181 1.00 0.00 O ATOM 228 C5' DT A 8 -9.033 0.659 19.277 1.00 0.00 C ATOM 229 C4' DT A 8 -8.294 -0.660 19.550 1.00 0.00 C ATOM 230 O4' DT A 8 -6.900 -0.494 19.337 1.00 0.00 O ATOM 231 C3' DT A 8 -8.501 -1.185 20.982 1.00 0.00 C ATOM 232 O3' DT A 8 -9.332 -2.345 20.953 1.00 0.00 O ATOM 233 C2' DT A 8 -7.075 -1.497 21.455 1.00 0.00 C ATOM 234 C1' DT A 8 -6.206 -1.364 20.207 1.00 0.00 C ATOM 235 N1 DT A 8 -4.863 -0.797 20.505 1.00 0.00 N ATOM 236 C2 DT A 8 -3.729 -1.581 20.265 1.00 0.00 C ATOM 237 O2 DT A 8 -3.768 -2.742 19.859 1.00 0.00 O ATOM 238 N3 DT A 8 -2.511 -1.002 20.532 1.00 0.00 N ATOM 239 C4 DT A 8 -2.312 0.252 21.064 1.00 0.00 C ATOM 240 O4 DT A 8 -1.160 0.641 21.236 1.00 0.00 O ATOM 241 C5 DT A 8 -3.540 0.991 21.362 1.00 0.00 C ATOM 242 C7 DT A 8 -3.488 2.363 22.009 1.00 0.00 C ATOM 243 C6 DT A 8 -4.753 0.454 21.076 1.00 0.00 C ATOM 0 H5' DT A 8 -8.832 0.981 18.255 1.00 0.00 H new ATOM 0 H5'' DT A 8 -10.108 0.493 19.353 1.00 0.00 H new ATOM 0 H4' DT A 8 -8.715 -1.389 18.857 1.00 0.00 H new ATOM 0 H3' DT A 8 -9.001 -0.484 21.650 1.00 0.00 H new ATOM 0 H2' DT A 8 -6.757 -0.803 22.233 1.00 0.00 H new ATOM 0 H2'' DT A 8 -7.010 -2.500 21.876 1.00 0.00 H new ATOM 0 H1' DT A 8 -6.035 -2.349 19.772 1.00 0.00 H new ATOM 0 H3 DT A 8 -1.679 -1.551 20.316 1.00 0.00 H new ATOM 0 H71 DT A 8 -2.605 2.432 22.645 1.00 0.00 H new ATOM 0 H72 DT A 8 -3.438 3.129 21.235 1.00 0.00 H new ATOM 0 H73 DT A 8 -4.383 2.515 22.613 1.00 0.00 H new ATOM 0 H6 DT A 8 -5.648 1.016 21.299 1.00 0.00 H new HETATM 256 N1 5CM A 9 -4.216 -3.839 23.313 1.00 0.00 N HETATM 257 C2 5CM A 9 -2.826 -3.672 23.232 1.00 0.00 C HETATM 258 N3 5CM A 9 -2.249 -2.499 23.579 1.00 0.00 N HETATM 259 C4 5CM A 9 -3.023 -1.527 24.025 1.00 0.00 C HETATM 260 C5 5CM A 9 -4.452 -1.660 24.208 1.00 0.00 C HETATM 261 C5A 5CM A 9 -5.326 -0.548 24.778 1.00 0.00 C HETATM 262 C6 5CM A 9 -5.003 -2.846 23.849 1.00 0.00 C HETATM 263 O2 5CM A 9 -2.076 -4.579 22.875 1.00 0.00 O HETATM 264 N4 5CM A 9 -2.366 -0.430 24.305 1.00 0.00 N HETATM 265 C1' 5CM A 9 -4.808 -5.131 22.875 1.00 0.00 C HETATM 266 C2' 5CM A 9 -5.335 -5.955 24.055 1.00 0.00 C HETATM 267 C3' 5CM A 9 -6.833 -6.142 23.825 1.00 0.00 C HETATM 268 C4' 5CM A 9 -6.960 -5.792 22.337 1.00 0.00 C HETATM 269 O4' 5CM A 9 -5.910 -4.887 22.017 1.00 0.00 O HETATM 270 O3' 5CM A 9 -7.213 -7.493 24.086 1.00 0.00 O HETATM 271 C5' 5CM A 9 -8.325 -5.203 21.943 1.00 0.00 C HETATM 272 O5' 5CM A 9 -8.673 -4.064 22.726 1.00 0.00 O HETATM 273 P 5CM A 9 -9.872 -3.076 22.293 1.00 0.00 P HETATM 274 OP1 5CM A 9 -11.044 -3.905 21.910 1.00 0.00 O HETATM 275 OP2 5CM A 9 -10.040 -2.056 23.357 1.00 0.00 O HETATM 0 HN42 5CM A 9 -2.864 0.387 24.658 1.00 0.00 H new HETATM 0 HN41 5CM A 9 -1.356 -0.392 24.170 1.00 0.00 H new HETATM 0 H5A3 5CM A 9 -4.986 -0.297 25.783 1.00 0.00 H new HETATM 0 H5A2 5CM A 9 -5.255 0.333 24.140 1.00 0.00 H new HETATM 0 H5A1 5CM A 9 -6.362 -0.884 24.819 1.00 0.00 H new HETATM 0 H5'' 5CM A 9 -8.307 -4.924 20.889 1.00 0.00 H new HETATM 0 H2'' 5CM A 9 -4.829 -6.919 24.111 1.00 0.00 H new HETATM 0 H6 5CM A 9 -6.071 -3.013 23.985 1.00 0.00 H new HETATM 0 H5' 5CM A 9 -9.094 -5.967 22.057 1.00 0.00 H new HETATM 0 H4' 5CM A 9 -6.882 -6.717 21.765 1.00 0.00 H new HETATM 0 H3' 5CM A 9 -7.473 -5.539 24.469 1.00 0.00 H new HETATM 0 H2' 5CM A 9 -5.149 -5.442 24.999 1.00 0.00 H new HETATM 0 H1' 5CM A 9 -4.015 -5.683 22.371 1.00 0.00 H new HETATM 289 P 8OG A 10 -7.442 -8.051 25.588 1.00 0.00 P HETATM 290 OP1 8OG A 10 -7.868 -9.469 25.475 1.00 0.00 O HETATM 291 OP2 8OG A 10 -8.329 -7.102 26.306 1.00 0.00 O HETATM 292 O5' 8OG A 10 -5.992 -8.018 26.302 1.00 0.00 O HETATM 293 C5' 8OG A 10 -4.938 -8.904 25.932 1.00 0.00 C HETATM 294 C4' 8OG A 10 -3.575 -8.445 26.488 1.00 0.00 C HETATM 295 O4' 8OG A 10 -3.224 -7.140 26.007 1.00 0.00 O HETATM 296 C3' 8OG A 10 -3.556 -8.391 28.030 1.00 0.00 C HETATM 297 O3' 8OG A 10 -2.348 -8.894 28.588 1.00 0.00 O HETATM 298 C2' 8OG A 10 -3.569 -6.892 28.286 1.00 0.00 C HETATM 299 C1' 8OG A 10 -2.712 -6.420 27.115 1.00 0.00 C HETATM 300 N9 8OG A 10 -2.620 -4.941 26.971 1.00 0.00 N HETATM 301 C8 8OG A 10 -3.581 -3.960 27.108 1.00 0.00 C HETATM 302 N7 8OG A 10 -3.139 -2.747 27.095 1.00 0.00 N HETATM 303 C5 8OG A 10 -1.757 -2.893 27.013 1.00 0.00 C HETATM 304 C6 8OG A 10 -0.708 -1.914 27.021 1.00 0.00 C HETATM 305 O6 8OG A 10 -0.803 -0.691 27.067 1.00 0.00 O HETATM 306 N1 8OG A 10 0.551 -2.472 26.971 1.00 0.00 N HETATM 307 C2 8OG A 10 0.781 -3.809 26.910 1.00 0.00 C HETATM 308 N2 8OG A 10 2.030 -4.198 26.858 1.00 0.00 N HETATM 309 N3 8OG A 10 -0.165 -4.747 26.883 1.00 0.00 N HETATM 310 C4 8OG A 10 -1.430 -4.231 26.936 1.00 0.00 C HETATM 311 O8 8OG A 10 -4.786 -4.157 27.241 1.00 0.00 O HETATM 0 H5'' 8OG A 10 -5.161 -9.906 26.300 1.00 0.00 H new HETATM 0 H2'' 8OG A 10 -4.575 -6.473 28.262 1.00 0.00 H new HETATM 0 H7 8OG A 10 -3.678 -1.882 27.135 1.00 0.00 H new HETATM 0 H5' 8OG A 10 -4.883 -8.968 24.845 1.00 0.00 H new HETATM 0 H4' 8OG A 10 -2.856 -9.187 26.140 1.00 0.00 H new HETATM 0 H3' 8OG A 10 -4.368 -8.977 28.460 1.00 0.00 H new HETATM 0 H22 8OG A 10 2.253 -5.192 26.811 1.00 0.00 H new HETATM 0 H21 8OG A 10 2.780 -3.507 26.864 1.00 0.00 H new HETATM 0 H2' 8OG A 10 -3.137 -6.630 29.252 1.00 0.00 H new HETATM 0 H1' 8OG A 10 -1.653 -6.637 27.252 1.00 0.00 H new HETATM 0 H1 8OG A 10 1.356 -1.845 26.980 1.00 0.00 H new ATOM 323 P DC A 11 -2.113 -10.456 28.866 1.00 0.00 P ATOM 324 OP1 DC A 11 -2.060 -11.179 27.571 1.00 0.00 O ATOM 325 OP2 DC A 11 -3.079 -10.894 29.903 1.00 0.00 O ATOM 326 O5' DC A 11 -0.643 -10.430 29.528 1.00 0.00 O ATOM 327 C5' DC A 11 0.542 -10.333 28.739 1.00 0.00 C ATOM 328 C4' DC A 11 1.649 -9.498 29.410 1.00 0.00 C ATOM 329 O4' DC A 11 1.357 -8.105 29.306 1.00 0.00 O ATOM 330 C3' DC A 11 1.864 -9.832 30.899 1.00 0.00 C ATOM 331 O3' DC A 11 3.256 -10.015 31.145 1.00 0.00 O ATOM 332 C2' DC A 11 1.243 -8.605 31.577 1.00 0.00 C ATOM 333 C1' DC A 11 1.574 -7.502 30.568 1.00 0.00 C ATOM 334 N1 DC A 11 0.795 -6.224 30.643 1.00 0.00 N ATOM 335 C2 DC A 11 1.467 -5.020 30.370 1.00 0.00 C ATOM 336 O2 DC A 11 2.681 -4.973 30.163 1.00 0.00 O ATOM 337 N3 DC A 11 0.805 -3.837 30.336 1.00 0.00 N ATOM 338 C4 DC A 11 -0.482 -3.835 30.599 1.00 0.00 C ATOM 339 N4 DC A 11 -1.080 -2.684 30.509 1.00 0.00 N ATOM 340 C5 DC A 11 -1.214 -4.998 30.941 1.00 0.00 C ATOM 341 C6 DC A 11 -0.550 -6.182 30.943 1.00 0.00 C ATOM 0 H5' DC A 11 0.294 -9.889 27.775 1.00 0.00 H new ATOM 0 H5'' DC A 11 0.922 -11.335 28.540 1.00 0.00 H new ATOM 0 H4' DC A 11 2.564 -9.752 28.875 1.00 0.00 H new ATOM 0 H3' DC A 11 1.415 -10.756 31.264 1.00 0.00 H new ATOM 0 H2' DC A 11 0.169 -8.717 31.725 1.00 0.00 H new ATOM 0 H2'' DC A 11 1.681 -8.411 32.556 1.00 0.00 H new ATOM 0 H1' DC A 11 2.590 -7.167 30.777 1.00 0.00 H new ATOM 0 H41 DC A 11 -2.079 -2.612 30.700 1.00 0.00 H new ATOM 0 H42 DC A 11 -0.550 -1.853 30.247 1.00 0.00 H new ATOM 0 H5 DC A 11 -2.263 -4.945 31.191 1.00 0.00 H new ATOM 0 H6 DC A 11 -1.077 -7.094 31.180 1.00 0.00 H new ATOM 353 P DG A 12 3.867 -10.282 32.614 1.00 0.00 P ATOM 354 OP1 DG A 12 5.104 -11.086 32.454 1.00 0.00 O ATOM 355 OP2 DG A 12 2.795 -10.790 33.507 1.00 0.00 O ATOM 356 O5' DG A 12 4.275 -8.801 33.097 1.00 0.00 O ATOM 357 C5' DG A 12 5.384 -8.117 32.521 1.00 0.00 C ATOM 358 C4' DG A 12 5.627 -6.741 33.158 1.00 0.00 C ATOM 359 O4' DG A 12 4.562 -5.856 32.824 1.00 0.00 O ATOM 360 C3' DG A 12 5.720 -6.808 34.697 1.00 0.00 C ATOM 361 O3' DG A 12 6.811 -6.030 35.184 1.00 0.00 O ATOM 362 C2' DG A 12 4.399 -6.176 35.134 1.00 0.00 C ATOM 363 C1' DG A 12 4.179 -5.174 34.003 1.00 0.00 C ATOM 364 N9 DG A 12 2.782 -4.700 33.908 1.00 0.00 N ATOM 365 C8 DG A 12 1.623 -5.420 34.052 1.00 0.00 C ATOM 366 N7 DG A 12 0.531 -4.704 33.973 1.00 0.00 N ATOM 367 C5 DG A 12 1.008 -3.396 33.785 1.00 0.00 C ATOM 368 C6 DG A 12 0.328 -2.131 33.650 1.00 0.00 C ATOM 369 O6 DG A 12 -0.880 -1.883 33.647 1.00 0.00 O ATOM 370 N1 DG A 12 1.185 -1.057 33.518 1.00 0.00 N ATOM 371 C2 DG A 12 2.534 -1.161 33.528 1.00 0.00 C ATOM 372 N2 DG A 12 3.221 -0.057 33.419 1.00 0.00 N ATOM 373 N3 DG A 12 3.208 -2.300 33.642 1.00 0.00 N ATOM 374 C4 DG A 12 2.388 -3.389 33.761 1.00 0.00 C ATOM 0 H5' DG A 12 5.214 -7.993 31.452 1.00 0.00 H new ATOM 0 H5'' DG A 12 6.280 -8.728 32.632 1.00 0.00 H new ATOM 0 H4' DG A 12 6.579 -6.383 32.766 1.00 0.00 H new ATOM 0 H3' DG A 12 5.881 -7.819 35.070 1.00 0.00 H new ATOM 0 H2' DG A 12 3.593 -6.907 35.202 1.00 0.00 H new ATOM 0 H2'' DG A 12 4.474 -5.692 36.108 1.00 0.00 H new ATOM 0 HO3' DG A 12 6.845 -6.090 36.162 1.00 0.00 H new ATOM 0 H1' DG A 12 4.765 -4.271 34.176 1.00 0.00 H new ATOM 0 H8 DG A 12 1.613 -6.487 34.217 1.00 0.00 H new ATOM 0 H1 DG A 12 0.777 -0.129 33.406 1.00 0.00 H new ATOM 0 H21 DG A 12 4.241 -0.088 33.422 1.00 0.00 H new ATOM 0 H22 DG A 12 2.738 0.837 33.331 1.00 0.00 H new TER 387 DG A 12 ATOM 388 O5' DC B 13 -0.908 8.194 32.630 1.00 0.00 O ATOM 389 C5' DC B 13 0.132 8.293 33.604 1.00 0.00 C ATOM 390 C4' DC B 13 1.194 7.181 33.491 1.00 0.00 C ATOM 391 O4' DC B 13 0.609 5.910 33.779 1.00 0.00 O ATOM 392 C3' DC B 13 1.839 7.094 32.092 1.00 0.00 C ATOM 393 O3' DC B 13 3.242 6.879 32.224 1.00 0.00 O ATOM 394 C2' DC B 13 1.153 5.853 31.507 1.00 0.00 C ATOM 395 C1' DC B 13 1.030 5.005 32.775 1.00 0.00 C ATOM 396 N1 DC B 13 0.114 3.830 32.683 1.00 0.00 N ATOM 397 C2 DC B 13 0.621 2.557 32.985 1.00 0.00 C ATOM 398 O2 DC B 13 1.791 2.376 33.331 1.00 0.00 O ATOM 399 N3 DC B 13 -0.168 1.458 32.924 1.00 0.00 N ATOM 400 C4 DC B 13 -1.419 1.606 32.545 1.00 0.00 C ATOM 401 N4 DC B 13 -2.137 0.519 32.543 1.00 0.00 N ATOM 402 C5 DC B 13 -1.998 2.863 32.219 1.00 0.00 C ATOM 403 C6 DC B 13 -1.202 3.961 32.302 1.00 0.00 C ATOM 0 H5' DC B 13 -0.310 8.261 34.600 1.00 0.00 H new ATOM 0 H5'' DC B 13 0.621 9.262 33.503 1.00 0.00 H new ATOM 0 H4' DC B 13 1.970 7.438 34.212 1.00 0.00 H new ATOM 0 H3' DC B 13 1.721 7.988 31.480 1.00 0.00 H new ATOM 0 H2' DC B 13 0.185 6.081 31.061 1.00 0.00 H new ATOM 0 H2'' DC B 13 1.752 5.368 30.736 1.00 0.00 H new ATOM 0 HO5' DC B 13 -1.547 8.926 32.758 1.00 0.00 H new ATOM 0 H1' DC B 13 1.991 4.535 32.984 1.00 0.00 H new ATOM 0 H41 DC B 13 -3.117 0.555 32.261 1.00 0.00 H new ATOM 0 H42 DC B 13 -1.720 -0.368 32.824 1.00 0.00 H new ATOM 0 H5 DC B 13 -3.032 2.942 31.917 1.00 0.00 H new ATOM 0 H6 DC B 13 -1.602 4.937 32.069 1.00 0.00 H new ATOM 416 P DG B 14 4.273 7.081 30.998 1.00 0.00 P ATOM 417 OP1 DG B 14 5.217 8.166 31.367 1.00 0.00 O ATOM 418 OP2 DG B 14 3.515 7.194 29.728 1.00 0.00 O ATOM 419 O5' DG B 14 5.069 5.678 30.965 1.00 0.00 O ATOM 420 C5' DG B 14 6.043 5.341 31.949 1.00 0.00 C ATOM 421 C4' DG B 14 6.860 4.078 31.609 1.00 0.00 C ATOM 422 O4' DG B 14 6.050 2.907 31.679 1.00 0.00 O ATOM 423 C3' DG B 14 7.498 4.121 30.211 1.00 0.00 C ATOM 424 O3' DG B 14 8.786 3.507 30.269 1.00 0.00 O ATOM 425 C2' DG B 14 6.465 3.357 29.381 1.00 0.00 C ATOM 426 C1' DG B 14 5.916 2.339 30.383 1.00 0.00 C ATOM 427 N9 DG B 14 4.496 1.983 30.161 1.00 0.00 N ATOM 428 C8 DG B 14 3.436 2.819 29.914 1.00 0.00 C ATOM 429 N7 DG B 14 2.278 2.217 29.837 1.00 0.00 N ATOM 430 C5 DG B 14 2.604 0.864 30.014 1.00 0.00 C ATOM 431 C6 DG B 14 1.788 -0.324 30.029 1.00 0.00 C ATOM 432 O6 DG B 14 0.566 -0.435 29.943 1.00 0.00 O ATOM 433 N1 DG B 14 2.513 -1.491 30.164 1.00 0.00 N ATOM 434 C2 DG B 14 3.856 -1.531 30.320 1.00 0.00 C ATOM 435 N2 DG B 14 4.407 -2.709 30.428 1.00 0.00 N ATOM 436 N3 DG B 14 4.648 -0.462 30.357 1.00 0.00 N ATOM 437 C4 DG B 14 3.964 0.712 30.186 1.00 0.00 C ATOM 0 H5' DG B 14 5.543 5.192 32.906 1.00 0.00 H new ATOM 0 H5'' DG B 14 6.726 6.181 32.074 1.00 0.00 H new ATOM 0 H4' DG B 14 7.655 4.048 32.354 1.00 0.00 H new ATOM 0 H3' DG B 14 7.692 5.108 29.791 1.00 0.00 H new ATOM 0 H2' DG B 14 5.683 4.015 29.002 1.00 0.00 H new ATOM 0 H2'' DG B 14 6.919 2.871 28.517 1.00 0.00 H new ATOM 0 H1' DG B 14 6.483 1.416 30.263 1.00 0.00 H new ATOM 0 H8 DG B 14 3.549 3.886 29.793 1.00 0.00 H new ATOM 0 H1 DG B 14 2.006 -2.376 30.145 1.00 0.00 H new ATOM 0 H21 DG B 14 5.417 -2.791 30.547 1.00 0.00 H new ATOM 0 H22 DG B 14 3.828 -3.548 30.393 1.00 0.00 H new HETATM 449 N1 5CM B 15 5.123 -0.172 26.859 1.00 0.00 N HETATM 450 C2 5CM B 15 4.007 -1.027 26.892 1.00 0.00 C HETATM 451 N3 5CM B 15 2.749 -0.534 26.783 1.00 0.00 N HETATM 452 C4 5CM B 15 2.600 0.764 26.582 1.00 0.00 C HETATM 453 C5 5CM B 15 3.705 1.691 26.475 1.00 0.00 C HETATM 454 C5A 5CM B 15 3.511 3.186 26.241 1.00 0.00 C HETATM 455 C6 5CM B 15 4.950 1.173 26.617 1.00 0.00 C HETATM 456 O2 5CM B 15 4.110 -2.246 27.023 1.00 0.00 O HETATM 457 N4 5CM B 15 1.349 1.152 26.533 1.00 0.00 N HETATM 458 C1' 5CM B 15 6.478 -0.733 27.142 1.00 0.00 C HETATM 459 C2' 5CM B 15 7.508 -0.548 26.027 1.00 0.00 C HETATM 460 C3' 5CM B 15 8.856 -0.582 26.764 1.00 0.00 C HETATM 461 C4' 5CM B 15 8.448 -0.374 28.233 1.00 0.00 C HETATM 462 O4' 5CM B 15 7.057 -0.085 28.256 1.00 0.00 O HETATM 463 O3' 5CM B 15 9.540 -1.824 26.622 1.00 0.00 O HETATM 464 C5' 5CM B 15 9.253 0.714 28.960 1.00 0.00 C HETATM 465 O5' 5CM B 15 9.199 1.967 28.287 1.00 0.00 O HETATM 466 P 5CM B 15 9.742 3.315 28.981 1.00 0.00 P HETATM 467 OP1 5CM B 15 11.119 3.062 29.475 1.00 0.00 O HETATM 468 OP2 5CM B 15 9.517 4.447 28.047 1.00 0.00 O HETATM 0 HN42 5CM B 15 1.126 2.136 26.382 1.00 0.00 H new HETATM 0 HN41 5CM B 15 0.599 0.470 26.646 1.00 0.00 H new HETATM 0 H5A3 5CM B 15 2.983 3.342 25.300 1.00 0.00 H new HETATM 0 H5A2 5CM B 15 2.928 3.610 27.059 1.00 0.00 H new HETATM 0 H5A1 5CM B 15 4.483 3.676 26.196 1.00 0.00 H new HETATM 0 H5'' 5CM B 15 8.868 0.831 29.973 1.00 0.00 H new HETATM 0 H2'' 5CM B 15 7.439 -1.341 25.283 1.00 0.00 H new HETATM 0 H6 5CM B 15 5.820 1.825 26.539 1.00 0.00 H new HETATM 0 H5' 5CM B 15 10.292 0.396 29.048 1.00 0.00 H new HETATM 0 H4' 5CM B 15 8.672 -1.289 28.781 1.00 0.00 H new HETATM 0 H3' 5CM B 15 9.548 0.164 26.372 1.00 0.00 H new HETATM 0 H2' 5CM B 15 7.363 0.396 25.501 1.00 0.00 H new HETATM 0 H1' 5CM B 15 6.282 -1.795 27.287 1.00 0.00 H new ATOM 482 P DG B 16 10.357 -2.213 25.284 1.00 0.00 P ATOM 483 OP1 DG B 16 11.352 -3.253 25.647 1.00 0.00 O ATOM 484 OP2 DG B 16 10.836 -0.970 24.628 1.00 0.00 O ATOM 485 O5' DG B 16 9.240 -2.880 24.335 1.00 0.00 O ATOM 486 C5' DG B 16 8.752 -4.192 24.588 1.00 0.00 C ATOM 487 C4' DG B 16 7.556 -4.567 23.701 1.00 0.00 C ATOM 488 O4' DG B 16 6.383 -3.854 24.085 1.00 0.00 O ATOM 489 C3' DG B 16 7.793 -4.307 22.199 1.00 0.00 C ATOM 490 O3' DG B 16 7.503 -5.504 21.490 1.00 0.00 O ATOM 491 C2' DG B 16 6.779 -3.197 21.912 1.00 0.00 C ATOM 492 C1' DG B 16 5.673 -3.567 22.895 1.00 0.00 C ATOM 493 N9 DG B 16 4.639 -2.527 23.112 1.00 0.00 N ATOM 494 C8 DG B 16 4.760 -1.158 23.127 1.00 0.00 C ATOM 495 N7 DG B 16 3.644 -0.521 23.375 1.00 0.00 N ATOM 496 C5 DG B 16 2.693 -1.549 23.477 1.00 0.00 C ATOM 497 C6 DG B 16 1.264 -1.525 23.683 1.00 0.00 C ATOM 498 O6 DG B 16 0.515 -0.569 23.886 1.00 0.00 O ATOM 499 N1 DG B 16 0.677 -2.771 23.611 1.00 0.00 N ATOM 500 C2 DG B 16 1.365 -3.918 23.398 1.00 0.00 C ATOM 501 N2 DG B 16 0.674 -5.015 23.269 1.00 0.00 N ATOM 502 N3 DG B 16 2.681 -3.998 23.238 1.00 0.00 N ATOM 503 C4 DG B 16 3.295 -2.775 23.283 1.00 0.00 C ATOM 0 H5' DG B 16 8.459 -4.270 25.635 1.00 0.00 H new ATOM 0 H5'' DG B 16 9.556 -4.910 24.428 1.00 0.00 H new ATOM 0 H4' DG B 16 7.427 -5.639 23.850 1.00 0.00 H new ATOM 0 H3' DG B 16 8.806 -4.023 21.914 1.00 0.00 H new ATOM 0 H2' DG B 16 7.187 -2.204 22.102 1.00 0.00 H new ATOM 0 H2'' DG B 16 6.435 -3.208 20.878 1.00 0.00 H new ATOM 0 H1' DG B 16 5.080 -4.397 22.511 1.00 0.00 H new ATOM 0 H8 DG B 16 5.697 -0.651 22.949 1.00 0.00 H new ATOM 0 H1 DG B 16 -0.335 -2.832 23.725 1.00 0.00 H new ATOM 0 H21 DG B 16 1.151 -5.902 23.107 1.00 0.00 H new ATOM 0 H22 DG B 16 -0.344 -4.987 23.330 1.00 0.00 H new ATOM 515 P DA B 17 7.918 -5.746 19.952 1.00 0.00 P ATOM 516 OP1 DA B 17 8.989 -6.772 19.911 1.00 0.00 O ATOM 517 OP2 DA B 17 8.136 -4.444 19.276 1.00 0.00 O ATOM 518 O5' DA B 17 6.559 -6.379 19.370 1.00 0.00 O ATOM 519 C5' DA B 17 6.109 -7.661 19.799 1.00 0.00 C ATOM 520 C4' DA B 17 4.702 -8.018 19.292 1.00 0.00 C ATOM 521 O4' DA B 17 3.733 -7.128 19.843 1.00 0.00 O ATOM 522 C3' DA B 17 4.591 -7.968 17.760 1.00 0.00 C ATOM 523 O3' DA B 17 3.795 -9.069 17.322 1.00 0.00 O ATOM 524 C2' DA B 17 3.977 -6.582 17.547 1.00 0.00 C ATOM 525 C1' DA B 17 3.126 -6.378 18.803 1.00 0.00 C ATOM 526 N9 DA B 17 3.008 -4.958 19.215 1.00 0.00 N ATOM 527 C8 DA B 17 3.984 -3.989 19.257 1.00 0.00 C ATOM 528 N7 DA B 17 3.563 -2.806 19.626 1.00 0.00 N ATOM 529 C5 DA B 17 2.191 -3.017 19.834 1.00 0.00 C ATOM 530 C6 DA B 17 1.103 -2.201 20.231 1.00 0.00 C ATOM 531 N6 DA B 17 1.188 -0.917 20.521 1.00 0.00 N ATOM 532 N1 DA B 17 -0.129 -2.698 20.346 1.00 0.00 N ATOM 533 C2 DA B 17 -0.313 -3.983 20.073 1.00 0.00 C ATOM 534 N3 DA B 17 0.597 -4.870 19.681 1.00 0.00 N ATOM 535 C4 DA B 17 1.844 -4.321 19.587 1.00 0.00 C ATOM 0 H5' DA B 17 6.113 -7.693 20.889 1.00 0.00 H new ATOM 0 H5'' DA B 17 6.814 -8.418 19.455 1.00 0.00 H new ATOM 0 H4' DA B 17 4.514 -9.042 19.616 1.00 0.00 H new ATOM 0 H3' DA B 17 5.512 -8.074 17.187 1.00 0.00 H new ATOM 0 H2' DA B 17 4.743 -5.813 17.451 1.00 0.00 H new ATOM 0 H2'' DA B 17 3.372 -6.545 16.641 1.00 0.00 H new ATOM 0 H1' DA B 17 2.110 -6.710 18.589 1.00 0.00 H new ATOM 0 H8 DA B 17 5.015 -4.189 19.006 1.00 0.00 H new ATOM 0 H61 DA B 17 0.354 -0.401 20.799 1.00 0.00 H new ATOM 0 H62 DA B 17 2.088 -0.440 20.467 1.00 0.00 H new ATOM 0 H2 DA B 17 -1.322 -4.353 20.182 1.00 0.00 H new ATOM 547 P DA B 18 3.254 -9.254 15.812 1.00 0.00 P ATOM 548 OP1 DA B 18 3.194 -10.709 15.526 1.00 0.00 O ATOM 549 OP2 DA B 18 4.027 -8.379 14.896 1.00 0.00 O ATOM 550 O5' DA B 18 1.747 -8.687 15.913 1.00 0.00 O ATOM 551 C5' DA B 18 0.763 -9.366 16.689 1.00 0.00 C ATOM 552 C4' DA B 18 -0.675 -8.883 16.438 1.00 0.00 C ATOM 553 O4' DA B 18 -0.853 -7.556 16.920 1.00 0.00 O ATOM 554 C3' DA B 18 -1.075 -8.916 14.954 1.00 0.00 C ATOM 555 O3' DA B 18 -2.418 -9.385 14.850 1.00 0.00 O ATOM 556 C2' DA B 18 -0.863 -7.457 14.541 1.00 0.00 C ATOM 557 C1' DA B 18 -1.137 -6.684 15.837 1.00 0.00 C ATOM 558 N9 DA B 18 -0.311 -5.465 16.000 1.00 0.00 N ATOM 559 C8 DA B 18 1.033 -5.295 15.762 1.00 0.00 C ATOM 560 N7 DA B 18 1.490 -4.101 16.047 1.00 0.00 N ATOM 561 C5 DA B 18 0.336 -3.423 16.474 1.00 0.00 C ATOM 562 C6 DA B 18 0.052 -2.106 16.914 1.00 0.00 C ATOM 563 N6 DA B 18 0.943 -1.141 17.053 1.00 0.00 N ATOM 564 N1 DA B 18 -1.191 -1.734 17.219 1.00 0.00 N ATOM 565 C2 DA B 18 -2.157 -2.638 17.125 1.00 0.00 C ATOM 566 N3 DA B 18 -2.045 -3.907 16.755 1.00 0.00 N ATOM 567 C4 DA B 18 -0.762 -4.242 16.440 1.00 0.00 C ATOM 0 H5' DA B 18 0.998 -9.240 17.746 1.00 0.00 H new ATOM 0 H5'' DA B 18 0.819 -10.433 16.475 1.00 0.00 H new ATOM 0 H4' DA B 18 -1.316 -9.579 16.978 1.00 0.00 H new ATOM 0 H3' DA B 18 -0.511 -9.587 14.307 1.00 0.00 H new ATOM 0 H2' DA B 18 0.149 -7.285 14.176 1.00 0.00 H new ATOM 0 H2'' DA B 18 -1.544 -7.161 13.744 1.00 0.00 H new ATOM 0 H1' DA B 18 -2.176 -6.356 15.806 1.00 0.00 H new ATOM 0 H8 DA B 18 1.661 -6.082 15.372 1.00 0.00 H new ATOM 0 H61 DA B 18 0.650 -0.219 17.377 1.00 0.00 H new ATOM 0 H62 DA B 18 1.924 -1.318 16.837 1.00 0.00 H new ATOM 0 H2 DA B 18 -3.151 -2.302 17.379 1.00 0.00 H new ATOM 579 P DT B 19 -3.227 -9.478 13.455 1.00 0.00 P ATOM 580 OP1 DT B 19 -4.293 -10.498 13.618 1.00 0.00 O ATOM 581 OP2 DT B 19 -2.256 -9.631 12.342 1.00 0.00 O ATOM 582 O5' DT B 19 -3.923 -8.031 13.334 1.00 0.00 O ATOM 583 C5' DT B 19 -4.914 -7.615 14.268 1.00 0.00 C ATOM 584 C4' DT B 19 -5.201 -6.110 14.181 1.00 0.00 C ATOM 585 O4' DT B 19 -4.026 -5.359 14.438 1.00 0.00 O ATOM 586 C3' DT B 19 -5.725 -5.659 12.808 1.00 0.00 C ATOM 587 O3' DT B 19 -7.140 -5.490 12.851 1.00 0.00 O ATOM 588 C2' DT B 19 -4.978 -4.344 12.566 1.00 0.00 C ATOM 589 C1' DT B 19 -4.229 -4.082 13.870 1.00 0.00 C ATOM 590 N1 DT B 19 -2.941 -3.376 13.646 1.00 0.00 N ATOM 591 C2 DT B 19 -2.866 -2.020 13.977 1.00 0.00 C ATOM 592 O2 DT B 19 -3.825 -1.348 14.350 1.00 0.00 O ATOM 593 N3 DT B 19 -1.634 -1.426 13.861 1.00 0.00 N ATOM 594 C4 DT B 19 -0.485 -2.026 13.405 1.00 0.00 C ATOM 595 O4 DT B 19 0.556 -1.371 13.415 1.00 0.00 O ATOM 596 C5 DT B 19 -0.656 -3.413 12.965 1.00 0.00 C ATOM 597 C7 DT B 19 0.508 -4.183 12.369 1.00 0.00 C ATOM 598 C6 DT B 19 -1.860 -4.033 13.096 1.00 0.00 C ATOM 0 H5' DT B 19 -4.585 -7.862 15.277 1.00 0.00 H new ATOM 0 H5'' DT B 19 -5.835 -8.169 14.088 1.00 0.00 H new ATOM 0 H4' DT B 19 -5.972 -5.930 14.930 1.00 0.00 H new ATOM 0 H3' DT B 19 -5.553 -6.376 12.005 1.00 0.00 H new ATOM 0 H2' DT B 19 -4.291 -4.427 11.724 1.00 0.00 H new ATOM 0 H2'' DT B 19 -5.668 -3.533 12.335 1.00 0.00 H new ATOM 0 H1' DT B 19 -4.797 -3.425 14.529 1.00 0.00 H new ATOM 0 H3 DT B 19 -1.565 -0.447 14.139 1.00 0.00 H new ATOM 0 H71 DT B 19 0.394 -5.244 12.591 1.00 0.00 H new ATOM 0 H72 DT B 19 0.525 -4.038 11.289 1.00 0.00 H new ATOM 0 H73 DT B 19 1.442 -3.821 12.799 1.00 0.00 H new ATOM 0 H6 DT B 19 -1.971 -5.055 12.764 1.00 0.00 H new ATOM 611 P DT B 20 -8.028 -5.218 11.527 1.00 0.00 P ATOM 612 OP1 DT B 20 -9.433 -5.571 11.848 1.00 0.00 O ATOM 613 OP2 DT B 20 -7.376 -5.879 10.369 1.00 0.00 O ATOM 614 O5' DT B 20 -7.946 -3.623 11.305 1.00 0.00 O ATOM 615 C5' DT B 20 -8.580 -2.714 12.201 1.00 0.00 C ATOM 616 C4' DT B 20 -8.165 -1.257 11.945 1.00 0.00 C ATOM 617 O4' DT B 20 -6.775 -1.095 12.188 1.00 0.00 O ATOM 618 C3' DT B 20 -8.459 -0.786 10.509 1.00 0.00 C ATOM 619 O3' DT B 20 -9.533 0.154 10.522 1.00 0.00 O ATOM 620 C2' DT B 20 -7.133 -0.155 10.063 1.00 0.00 C ATOM 621 C1' DT B 20 -6.281 -0.088 11.329 1.00 0.00 C ATOM 622 N1 DT B 20 -4.840 -0.333 11.059 1.00 0.00 N ATOM 623 C2 DT B 20 -3.918 0.688 11.323 1.00 0.00 C ATOM 624 O2 DT B 20 -4.229 1.808 11.726 1.00 0.00 O ATOM 625 N3 DT B 20 -2.595 0.402 11.083 1.00 0.00 N ATOM 626 C4 DT B 20 -2.105 -0.772 10.558 1.00 0.00 C ATOM 627 O4 DT B 20 -0.891 -0.889 10.413 1.00 0.00 O ATOM 628 C5 DT B 20 -3.126 -1.769 10.234 1.00 0.00 C ATOM 629 C7 DT B 20 -2.749 -3.091 9.590 1.00 0.00 C ATOM 630 C6 DT B 20 -4.435 -1.523 10.492 1.00 0.00 C ATOM 0 H5' DT B 20 -8.331 -2.985 13.227 1.00 0.00 H new ATOM 0 H5'' DT B 20 -9.662 -2.804 12.101 1.00 0.00 H new ATOM 0 H4' DT B 20 -8.759 -0.650 12.628 1.00 0.00 H new ATOM 0 H3' DT B 20 -8.774 -1.580 9.832 1.00 0.00 H new ATOM 0 H2' DT B 20 -6.649 -0.756 9.293 1.00 0.00 H new ATOM 0 H2'' DT B 20 -7.291 0.837 9.640 1.00 0.00 H new ATOM 0 H1' DT B 20 -6.348 0.909 11.764 1.00 0.00 H new ATOM 0 H3 DT B 20 -1.915 1.126 11.315 1.00 0.00 H new ATOM 0 H71 DT B 20 -1.860 -2.955 8.974 1.00 0.00 H new ATOM 0 H72 DT B 20 -2.544 -3.828 10.366 1.00 0.00 H new ATOM 0 H73 DT B 20 -3.572 -3.440 8.967 1.00 0.00 H new ATOM 0 H6 DT B 20 -5.173 -2.273 10.249 1.00 0.00 H new HETATM 643 N1 5CM B 21 -4.858 2.781 8.253 1.00 0.00 N HETATM 644 C2 5CM B 21 -3.469 2.932 8.366 1.00 0.00 C HETATM 645 N3 5CM B 21 -2.635 1.919 8.036 1.00 0.00 N HETATM 646 C4 5CM B 21 -3.160 0.799 7.576 1.00 0.00 C HETATM 647 C5 5CM B 21 -4.578 0.607 7.361 1.00 0.00 C HETATM 648 C5A 5CM B 21 -5.166 -0.672 6.774 1.00 0.00 C HETATM 649 C6 5CM B 21 -5.389 1.638 7.704 1.00 0.00 C HETATM 650 O2 5CM B 21 -2.950 3.984 8.737 1.00 0.00 O HETATM 651 N4 5CM B 21 -2.266 -0.122 7.316 1.00 0.00 N HETATM 652 C1' 5CM B 21 -5.736 3.906 8.677 1.00 0.00 C HETATM 653 C2' 5CM B 21 -6.415 4.590 7.486 1.00 0.00 C HETATM 654 C3' 5CM B 21 -7.920 4.432 7.689 1.00 0.00 C HETATM 655 C4' 5CM B 21 -7.991 4.058 9.175 1.00 0.00 C HETATM 656 O4' 5CM B 21 -6.767 3.416 9.516 1.00 0.00 O HETATM 657 O3' 5CM B 21 -8.591 5.662 7.421 1.00 0.00 O HETATM 658 C5' 5CM B 21 -9.191 3.170 9.545 1.00 0.00 C HETATM 659 O5' 5CM B 21 -9.254 1.983 8.758 1.00 0.00 O HETATM 660 P 5CM B 21 -10.202 0.745 9.172 1.00 0.00 P HETATM 661 OP1 5CM B 21 -11.539 1.283 9.532 1.00 0.00 O HETATM 662 OP2 5CM B 21 -10.113 -0.283 8.106 1.00 0.00 O HETATM 0 HN42 5CM B 21 -2.559 -1.030 6.955 1.00 0.00 H new HETATM 0 HN41 5CM B 21 -1.277 0.068 7.475 1.00 0.00 H new HETATM 0 H5A3 5CM B 21 -4.756 -0.837 5.778 1.00 0.00 H new HETATM 0 H5A2 5CM B 21 -4.913 -1.517 7.415 1.00 0.00 H new HETATM 0 H5A1 5CM B 21 -6.250 -0.578 6.710 1.00 0.00 H new HETATM 0 H5'' 5CM B 21 -9.128 2.900 10.599 1.00 0.00 H new HETATM 0 H2'' 5CM B 21 -6.140 5.643 7.436 1.00 0.00 H new HETATM 0 H6 5CM B 21 -6.464 1.560 7.544 1.00 0.00 H new HETATM 0 H5' 5CM B 21 -10.113 3.737 9.416 1.00 0.00 H new HETATM 0 H4' 5CM B 21 -8.138 4.975 9.746 1.00 0.00 H new HETATM 0 H3' 5CM B 21 -8.395 3.702 7.034 1.00 0.00 H new HETATM 0 H2' 5CM B 21 -6.101 4.134 6.547 1.00 0.00 H new HETATM 0 H1' 5CM B 21 -5.099 4.624 9.192 1.00 0.00 H new HETATM 676 P 8OG B 22 -8.914 6.160 5.915 1.00 0.00 P HETATM 677 OP1 8OG B 22 -9.655 7.443 6.020 1.00 0.00 O HETATM 678 OP2 8OG B 22 -9.549 5.037 5.181 1.00 0.00 O HETATM 679 O5' 8OG B 22 -7.483 6.462 5.227 1.00 0.00 O HETATM 680 C5' 8OG B 22 -6.665 7.564 5.616 1.00 0.00 C HETATM 681 C4' 8OG B 22 -5.225 7.431 5.084 1.00 0.00 C HETATM 682 O4' 8OG B 22 -4.594 6.239 5.573 1.00 0.00 O HETATM 683 C3' 8OG B 22 -5.167 7.385 3.543 1.00 0.00 C HETATM 684 O3' 8OG B 22 -4.095 8.148 3.004 1.00 0.00 O HETATM 685 C2' 8OG B 22 -4.838 5.922 3.290 1.00 0.00 C HETATM 686 C1' 8OG B 22 -3.915 5.655 4.476 1.00 0.00 C HETATM 687 N9 8OG B 22 -3.493 4.235 4.626 1.00 0.00 N HETATM 688 C8 8OG B 22 -4.202 3.061 4.473 1.00 0.00 C HETATM 689 N7 8OG B 22 -3.497 1.980 4.503 1.00 0.00 N HETATM 690 C5 8OG B 22 -2.187 2.436 4.614 1.00 0.00 C HETATM 691 C6 8OG B 22 -0.943 1.721 4.635 1.00 0.00 C HETATM 692 O6 8OG B 22 -0.757 0.507 4.595 1.00 0.00 O HETATM 693 N1 8OG B 22 0.155 2.549 4.707 1.00 0.00 N HETATM 694 C2 8OG B 22 0.075 3.903 4.763 1.00 0.00 C HETATM 695 N2 8OG B 22 1.202 4.566 4.838 1.00 0.00 N HETATM 696 N3 8OG B 22 -1.060 4.603 4.765 1.00 0.00 N HETATM 697 C4 8OG B 22 -2.173 3.814 4.689 1.00 0.00 C HETATM 698 O8 8OG B 22 -5.417 2.980 4.311 1.00 0.00 O HETATM 0 H5'' 8OG B 22 -7.104 8.490 5.245 1.00 0.00 H new HETATM 0 H2'' 8OG B 22 -5.724 5.287 3.299 1.00 0.00 H new HETATM 0 H7 8OG B 22 -3.824 1.015 4.456 1.00 0.00 H new HETATM 0 H5' 8OG B 22 -6.645 7.634 6.704 1.00 0.00 H new HETATM 0 H4' 8OG B 22 -4.702 8.318 5.442 1.00 0.00 H new HETATM 0 H3' 8OG B 22 -6.083 7.774 3.098 1.00 0.00 H new HETATM 0 H22 8OG B 22 1.192 5.585 4.882 1.00 0.00 H new HETATM 0 H21 8OG B 22 2.089 4.063 4.852 1.00 0.00 H new HETATM 0 H2' 8OG B 22 -4.343 5.765 2.332 1.00 0.00 H new HETATM 0 H1' 8OG B 22 -2.930 6.106 4.355 1.00 0.00 H new HETATM 0 H1 8OG B 22 1.081 2.121 4.719 1.00 0.00 H new ATOM 710 P DC B 23 -4.213 9.724 2.723 1.00 0.00 P ATOM 711 OP1 DC B 23 -4.338 10.441 4.016 1.00 0.00 O ATOM 712 OP2 DC B 23 -5.243 9.932 1.676 1.00 0.00 O ATOM 713 O5' DC B 23 -2.769 10.030 2.075 1.00 0.00 O ATOM 714 C5' DC B 23 -1.602 10.211 2.875 1.00 0.00 C ATOM 715 C4' DC B 23 -0.327 9.640 2.225 1.00 0.00 C ATOM 716 O4' DC B 23 -0.303 8.218 2.338 1.00 0.00 O ATOM 717 C3' DC B 23 -0.170 10.004 0.736 1.00 0.00 C ATOM 718 O3' DC B 23 1.147 10.499 0.506 1.00 0.00 O ATOM 719 C2' DC B 23 -0.481 8.664 0.061 1.00 0.00 C ATOM 720 C1' DC B 23 0.071 7.671 1.086 1.00 0.00 C ATOM 721 N1 DC B 23 -0.399 6.250 1.009 1.00 0.00 N ATOM 722 C2 DC B 23 0.521 5.231 1.304 1.00 0.00 C ATOM 723 O2 DC B 23 1.711 5.460 1.530 1.00 0.00 O ATOM 724 N3 DC B 23 0.142 3.929 1.337 1.00 0.00 N ATOM 725 C4 DC B 23 -1.106 3.636 1.050 1.00 0.00 C ATOM 726 N4 DC B 23 -1.431 2.380 1.139 1.00 0.00 N ATOM 727 C5 DC B 23 -2.075 4.603 0.686 1.00 0.00 C ATOM 728 C6 DC B 23 -1.695 5.905 0.687 1.00 0.00 C ATOM 0 H5' DC B 23 -1.755 9.733 3.842 1.00 0.00 H new ATOM 0 H5'' DC B 23 -1.460 11.275 3.064 1.00 0.00 H new ATOM 0 H4' DC B 23 0.501 10.095 2.768 1.00 0.00 H new ATOM 0 H3' DC B 23 -0.814 10.798 0.357 1.00 0.00 H new ATOM 0 H2' DC B 23 -1.549 8.528 -0.108 1.00 0.00 H new ATOM 0 H2'' DC B 23 0.010 8.569 -0.908 1.00 0.00 H new ATOM 0 H1' DC B 23 1.141 7.572 0.901 1.00 0.00 H new ATOM 0 H41 DC B 23 -2.384 2.084 0.930 1.00 0.00 H new ATOM 0 H42 DC B 23 -0.732 1.691 1.418 1.00 0.00 H new ATOM 0 H5 DC B 23 -3.080 4.314 0.417 1.00 0.00 H new ATOM 0 H6 DC B 23 -2.410 6.674 0.435 1.00 0.00 H new ATOM 740 P DG B 24 1.697 10.902 -0.956 1.00 0.00 P ATOM 741 OP1 DG B 24 2.709 11.974 -0.783 1.00 0.00 O ATOM 742 OP2 DG B 24 0.548 11.145 -1.863 1.00 0.00 O ATOM 743 O5' DG B 24 2.446 9.557 -1.429 1.00 0.00 O ATOM 744 C5' DG B 24 3.684 9.159 -0.847 1.00 0.00 C ATOM 745 C4' DG B 24 4.251 7.879 -1.481 1.00 0.00 C ATOM 746 O4' DG B 24 3.435 6.763 -1.136 1.00 0.00 O ATOM 747 C3' DG B 24 4.314 7.957 -3.022 1.00 0.00 C ATOM 748 O3' DG B 24 5.551 7.462 -3.534 1.00 0.00 O ATOM 749 C2' DG B 24 3.188 7.014 -3.445 1.00 0.00 C ATOM 750 C1' DG B 24 3.232 5.996 -2.308 1.00 0.00 C ATOM 751 N9 DG B 24 2.001 5.185 -2.204 1.00 0.00 N ATOM 752 C8 DG B 24 0.697 5.590 -2.344 1.00 0.00 C ATOM 753 N7 DG B 24 -0.178 4.622 -2.262 1.00 0.00 N ATOM 754 C5 DG B 24 0.614 3.477 -2.074 1.00 0.00 C ATOM 755 C6 DG B 24 0.275 2.081 -1.938 1.00 0.00 C ATOM 756 O6 DG B 24 -0.831 1.537 -1.934 1.00 0.00 O ATOM 757 N1 DG B 24 1.375 1.257 -1.808 1.00 0.00 N ATOM 758 C2 DG B 24 2.655 1.698 -1.821 1.00 0.00 C ATOM 759 N2 DG B 24 3.597 0.801 -1.713 1.00 0.00 N ATOM 760 N3 DG B 24 3.020 2.970 -1.938 1.00 0.00 N ATOM 761 C4 DG B 24 1.951 3.818 -2.055 1.00 0.00 C ATOM 0 H5' DG B 24 3.544 8.999 0.222 1.00 0.00 H new ATOM 0 H5'' DG B 24 4.409 9.966 -0.956 1.00 0.00 H new ATOM 0 H4' DG B 24 5.264 7.766 -1.095 1.00 0.00 H new ATOM 0 H3' DG B 24 4.224 8.980 -3.388 1.00 0.00 H new ATOM 0 H2' DG B 24 2.225 7.521 -3.510 1.00 0.00 H new ATOM 0 H2'' DG B 24 3.374 6.557 -4.417 1.00 0.00 H new ATOM 0 HO3' DG B 24 5.550 7.527 -4.512 1.00 0.00 H new ATOM 0 H1' DG B 24 4.025 5.268 -2.478 1.00 0.00 H new ATOM 0 H8 DG B 24 0.418 6.620 -2.508 1.00 0.00 H new ATOM 0 H1 DG B 24 1.214 0.256 -1.695 1.00 0.00 H new ATOM 0 H21 DG B 24 4.576 1.087 -1.718 1.00 0.00 H new ATOM 0 H22 DG B 24 3.354 -0.186 -1.624 1.00 0.00 H new TER 774 DG B 24