USER MOD reduce.3.24.130724 H: found=0, std=0, add=253, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 251 hydrogens (15 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 NoAdj-H: A 6 DG H21 : A 6 DG N2 : A 22 BAP C4' :(H bumps) USER MOD NoAdj-H: A 22 BAPH4'1 : A 22 BAP C4' : A 6 DG N2 :(H bumps) USER MOD Single : A 1 DC O5' : rot 54:sc= -2.65! USER MOD Single : A 4 DT C7 :methyl -30:sc= -0.468 (180deg=-0.578) USER MOD Single : A 8 DT C7 :methyl 150:sc= -0.975 (180deg=-0.975) USER MOD Single : A 11 DC O3' : rot 180:sc=-0.00151 USER MOD Single : A 22 BAP O1' : rot 180:sc= 0 USER MOD Single : A 22 BAP O2' : rot 180:sc= 0 USER MOD Single : A 22 BAP O3' : rot -159:sc= -0.0198 USER MOD Single : B 12 DG O5' : rot 180:sc= 0 USER MOD Single : B 14 DT C7 :methyl -30:sc= -3.3! (180deg=-5.13!) USER MOD Single : B 19 DT C7 :methyl 150:sc= -1.37 (180deg=-1.37) USER MOD Single : B 21 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 3.169 4.414 0.467 1.00 0.00 O ATOM 2 C5' DC A 1 4.435 4.526 1.123 1.00 0.00 C ATOM 3 C4' DC A 1 5.556 4.042 0.197 1.00 0.00 C ATOM 4 O4' DC A 1 5.365 2.650 -0.104 1.00 0.00 O ATOM 5 C3' DC A 1 5.703 4.704 -1.168 1.00 0.00 C ATOM 6 O3' DC A 1 7.011 4.561 -1.727 1.00 0.00 O ATOM 7 C2' DC A 1 4.700 3.891 -1.947 1.00 0.00 C ATOM 8 C1' DC A 1 5.041 2.495 -1.490 1.00 0.00 C ATOM 9 N1 DC A 1 3.884 1.564 -1.565 1.00 0.00 N ATOM 10 C2 DC A 1 3.944 0.400 -2.332 1.00 0.00 C ATOM 11 O2 DC A 1 4.935 0.098 -2.993 1.00 0.00 O ATOM 12 N3 DC A 1 2.854 -0.415 -2.343 1.00 0.00 N ATOM 13 C4 DC A 1 1.753 -0.110 -1.643 1.00 0.00 C ATOM 14 N4 DC A 1 0.710 -0.928 -1.672 1.00 0.00 N ATOM 15 C5 DC A 1 1.678 1.076 -0.859 1.00 0.00 C ATOM 16 C6 DC A 1 2.759 1.873 -0.854 1.00 0.00 C ATOM 0 H5' DC A 1 4.431 3.937 2.040 1.00 0.00 H new ATOM 0 H5'' DC A 1 4.613 5.562 1.411 1.00 0.00 H new ATOM 0 H4' DC A 1 6.444 4.295 0.776 1.00 0.00 H new ATOM 0 H3' DC A 1 5.549 5.783 -1.156 1.00 0.00 H new ATOM 0 H2' DC A 1 3.673 4.164 -1.706 1.00 0.00 H new ATOM 0 H2'' DC A 1 4.818 4.013 -3.024 1.00 0.00 H new ATOM 0 HO5' DC A 1 3.051 3.499 0.138 1.00 0.00 H new ATOM 0 H1' DC A 1 5.832 2.080 -2.115 1.00 0.00 H new ATOM 0 H41 DC A 1 -0.131 -0.701 -1.141 1.00 0.00 H new ATOM 0 H42 DC A 1 0.749 -1.784 -2.225 1.00 0.00 H new ATOM 0 H5 DC A 1 0.792 1.324 -0.294 1.00 0.00 H new ATOM 0 H6 DC A 1 2.738 2.783 -0.272 1.00 0.00 H new ATOM 29 P DC A 2 7.393 5.269 -3.114 1.00 0.00 P ATOM 30 OP1 DC A 2 8.866 5.268 -3.237 1.00 0.00 O ATOM 31 OP2 DC A 2 6.644 6.546 -3.208 1.00 0.00 O ATOM 32 O5' DC A 2 6.785 4.227 -4.172 1.00 0.00 O ATOM 33 C5' DC A 2 7.527 3.039 -4.464 1.00 0.00 C ATOM 34 C4' DC A 2 7.001 2.329 -5.687 1.00 0.00 C ATOM 35 O4' DC A 2 5.700 1.778 -5.467 1.00 0.00 O ATOM 36 C3' DC A 2 6.878 3.148 -6.965 1.00 0.00 C ATOM 37 O3' DC A 2 7.119 2.370 -8.140 1.00 0.00 O ATOM 38 C2' DC A 2 5.398 3.523 -6.946 1.00 0.00 C ATOM 39 C1' DC A 2 4.834 2.159 -6.538 1.00 0.00 C ATOM 40 N1 DC A 2 3.541 2.109 -5.846 1.00 0.00 N ATOM 41 C2 DC A 2 2.814 0.945 -5.934 1.00 0.00 C ATOM 42 O2 DC A 2 3.219 -0.003 -6.606 1.00 0.00 O ATOM 43 N3 DC A 2 1.644 0.863 -5.267 1.00 0.00 N ATOM 44 C4 DC A 2 1.193 1.884 -4.537 1.00 0.00 C ATOM 45 N4 DC A 2 0.042 1.708 -3.898 1.00 0.00 N ATOM 46 C5 DC A 2 1.937 3.104 -4.440 1.00 0.00 C ATOM 47 C6 DC A 2 3.096 3.164 -5.110 1.00 0.00 C ATOM 0 H5' DC A 2 7.485 2.366 -3.608 1.00 0.00 H new ATOM 0 H5'' DC A 2 8.575 3.295 -4.617 1.00 0.00 H new ATOM 0 H4' DC A 2 7.776 1.577 -5.838 1.00 0.00 H new ATOM 0 H3' DC A 2 7.589 3.974 -6.994 1.00 0.00 H new ATOM 0 H2' DC A 2 5.168 4.310 -6.227 1.00 0.00 H new ATOM 0 H2'' DC A 2 5.033 3.861 -7.916 1.00 0.00 H new ATOM 0 H1' DC A 2 4.744 1.588 -7.462 1.00 0.00 H new ATOM 0 H41 DC A 2 -0.344 2.460 -3.327 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.456 0.821 -3.979 1.00 0.00 H new ATOM 0 H5 DC A 2 1.580 3.938 -3.854 1.00 0.00 H new ATOM 0 H6 DC A 2 3.688 4.066 -5.065 1.00 0.00 H new ATOM 59 P DA A 3 7.258 2.979 -9.613 1.00 0.00 P ATOM 60 OP1 DA A 3 8.688 3.060 -9.976 1.00 0.00 O ATOM 61 OP2 DA A 3 6.371 4.158 -9.715 1.00 0.00 O ATOM 62 O5' DA A 3 6.588 1.785 -10.435 1.00 0.00 O ATOM 63 C5' DA A 3 6.783 0.410 -10.078 1.00 0.00 C ATOM 64 C4' DA A 3 5.516 -0.343 -10.394 1.00 0.00 C ATOM 65 O4' DA A 3 4.475 0.214 -9.579 1.00 0.00 O ATOM 66 C3' DA A 3 5.048 -0.228 -11.854 1.00 0.00 C ATOM 67 O3' DA A 3 4.534 -1.437 -12.423 1.00 0.00 O ATOM 68 C2' DA A 3 3.881 0.730 -11.711 1.00 0.00 C ATOM 69 C1' DA A 3 3.313 0.287 -10.381 1.00 0.00 C ATOM 70 N9 DA A 3 2.402 1.236 -9.727 1.00 0.00 N ATOM 71 C8 DA A 3 2.395 2.602 -9.774 1.00 0.00 C ATOM 72 N7 DA A 3 1.421 3.153 -9.091 1.00 0.00 N ATOM 73 C5 DA A 3 0.742 2.057 -8.554 1.00 0.00 C ATOM 74 C6 DA A 3 -0.394 1.923 -7.728 1.00 0.00 C ATOM 75 N6 DA A 3 -1.149 2.914 -7.259 1.00 0.00 N ATOM 76 N1 DA A 3 -0.764 0.688 -7.408 1.00 0.00 N ATOM 77 C2 DA A 3 -0.088 -0.358 -7.853 1.00 0.00 C ATOM 78 N3 DA A 3 0.977 -0.366 -8.627 1.00 0.00 N ATOM 79 C4 DA A 3 1.344 0.890 -8.945 1.00 0.00 C ATOM 0 H5' DA A 3 7.023 0.323 -9.018 1.00 0.00 H new ATOM 0 H5'' DA A 3 7.623 -0.011 -10.631 1.00 0.00 H new ATOM 0 H4' DA A 3 5.723 -1.396 -10.206 1.00 0.00 H new ATOM 0 H3' DA A 3 5.875 0.061 -12.503 1.00 0.00 H new ATOM 0 H2' DA A 3 4.201 1.772 -11.697 1.00 0.00 H new ATOM 0 H2'' DA A 3 3.161 0.628 -12.523 1.00 0.00 H new ATOM 0 H1' DA A 3 2.723 -0.619 -10.517 1.00 0.00 H new ATOM 0 H8 DA A 3 3.126 3.176 -10.324 1.00 0.00 H new ATOM 0 H61 DA A 3 -1.953 2.706 -6.666 1.00 0.00 H new ATOM 0 H62 DA A 3 -0.924 3.881 -7.492 1.00 0.00 H new ATOM 0 H2 DA A 3 -0.455 -1.325 -7.543 1.00 0.00 H new ATOM 91 P DT A 4 4.231 -1.641 -13.991 1.00 0.00 P ATOM 92 OP1 DT A 4 5.413 -2.230 -14.653 1.00 0.00 O ATOM 93 OP2 DT A 4 3.573 -0.438 -14.547 1.00 0.00 O ATOM 94 O5' DT A 4 3.112 -2.778 -14.017 1.00 0.00 O ATOM 95 C5' DT A 4 3.132 -3.951 -13.200 1.00 0.00 C ATOM 96 C4' DT A 4 1.751 -4.161 -12.603 1.00 0.00 C ATOM 97 O4' DT A 4 1.403 -2.968 -11.888 1.00 0.00 O ATOM 98 C3' DT A 4 0.593 -4.394 -13.604 1.00 0.00 C ATOM 99 O3' DT A 4 -0.466 -5.311 -13.273 1.00 0.00 O ATOM 100 C2' DT A 4 -0.120 -3.058 -13.620 1.00 0.00 C ATOM 101 C1' DT A 4 0.022 -2.747 -12.144 1.00 0.00 C ATOM 102 N1 DT A 4 -0.320 -1.356 -11.836 1.00 0.00 N ATOM 103 C2 DT A 4 -1.280 -1.181 -10.875 1.00 0.00 C ATOM 104 O2 DT A 4 -1.844 -2.106 -10.299 1.00 0.00 O ATOM 105 N3 DT A 4 -1.601 0.101 -10.584 1.00 0.00 N ATOM 106 C4 DT A 4 -1.069 1.223 -11.144 1.00 0.00 C ATOM 107 O4 DT A 4 -1.476 2.307 -10.741 1.00 0.00 O ATOM 108 C5 DT A 4 -0.063 0.976 -12.157 1.00 0.00 C ATOM 109 C7 DT A 4 0.610 2.150 -12.873 1.00 0.00 C ATOM 110 C6 DT A 4 0.277 -0.298 -12.470 1.00 0.00 C ATOM 0 H5' DT A 4 3.873 -3.845 -12.407 1.00 0.00 H new ATOM 0 H5'' DT A 4 3.422 -4.818 -13.793 1.00 0.00 H new ATOM 0 H4' DT A 4 1.841 -5.068 -12.005 1.00 0.00 H new ATOM 0 H3' DT A 4 1.066 -4.802 -14.497 1.00 0.00 H new ATOM 0 H2' DT A 4 0.364 -2.322 -14.261 1.00 0.00 H new ATOM 0 H2'' DT A 4 -1.158 -3.130 -13.945 1.00 0.00 H new ATOM 0 H1' DT A 4 -0.647 -3.358 -11.538 1.00 0.00 H new ATOM 0 H3 DT A 4 -2.316 0.242 -9.871 1.00 0.00 H new ATOM 0 H71 DT A 4 -0.083 2.990 -12.926 1.00 0.00 H new ATOM 0 H72 DT A 4 1.501 2.450 -12.322 1.00 0.00 H new ATOM 0 H73 DT A 4 0.892 1.848 -13.882 1.00 0.00 H new ATOM 0 H6 DT A 4 1.026 -0.481 -13.226 1.00 0.00 H new ATOM 123 P DC A 5 -0.412 -6.580 -12.272 1.00 0.00 P ATOM 124 OP1 DC A 5 -0.973 -6.140 -10.977 1.00 0.00 O ATOM 125 OP2 DC A 5 0.941 -7.188 -12.331 1.00 0.00 O ATOM 126 O5' DC A 5 -1.446 -7.602 -13.001 1.00 0.00 O ATOM 127 C5' DC A 5 -2.829 -7.915 -12.691 1.00 0.00 C ATOM 128 C4' DC A 5 -3.924 -7.043 -13.360 1.00 0.00 C ATOM 129 O4' DC A 5 -4.052 -5.711 -12.856 1.00 0.00 O ATOM 130 C3' DC A 5 -3.837 -6.719 -14.848 1.00 0.00 C ATOM 131 O3' DC A 5 -3.938 -7.773 -15.803 1.00 0.00 O ATOM 132 C2' DC A 5 -5.153 -5.933 -14.941 1.00 0.00 C ATOM 133 C1' DC A 5 -5.014 -5.025 -13.683 1.00 0.00 C ATOM 134 N1 DC A 5 -4.532 -3.619 -13.782 1.00 0.00 N ATOM 135 C2 DC A 5 -4.990 -2.703 -12.830 1.00 0.00 C ATOM 136 O2 DC A 5 -5.834 -2.996 -11.983 1.00 0.00 O ATOM 137 N3 DC A 5 -4.500 -1.441 -12.859 1.00 0.00 N ATOM 138 C4 DC A 5 -3.597 -1.076 -13.777 1.00 0.00 C ATOM 139 N4 DC A 5 -3.114 0.163 -13.791 1.00 0.00 N ATOM 140 C5 DC A 5 -3.121 -1.983 -14.758 1.00 0.00 C ATOM 141 C6 DC A 5 -3.615 -3.236 -14.729 1.00 0.00 C ATOM 0 H5' DC A 5 -2.956 -7.846 -11.611 1.00 0.00 H new ATOM 0 H5'' DC A 5 -3.010 -8.954 -12.967 1.00 0.00 H new ATOM 0 H4' DC A 5 -4.730 -7.740 -13.130 1.00 0.00 H new ATOM 0 H3' DC A 5 -2.866 -6.286 -15.090 1.00 0.00 H new ATOM 0 H2' DC A 5 -5.231 -5.358 -15.864 1.00 0.00 H new ATOM 0 H2'' DC A 5 -6.029 -6.580 -14.894 1.00 0.00 H new ATOM 0 H1' DC A 5 -6.041 -4.894 -13.341 1.00 0.00 H new ATOM 0 H41 DC A 5 -2.426 0.434 -14.493 1.00 0.00 H new ATOM 0 H42 DC A 5 -3.432 0.842 -13.099 1.00 0.00 H new ATOM 0 H5 DC A 5 -2.393 -1.682 -15.497 1.00 0.00 H new ATOM 0 H6 DC A 5 -3.283 -3.953 -15.465 1.00 0.00 H new ATOM 153 P DG A 6 -3.703 -7.523 -17.374 1.00 0.00 P ATOM 154 OP1 DG A 6 -3.032 -8.725 -17.911 1.00 0.00 O ATOM 155 OP2 DG A 6 -3.087 -6.191 -17.578 1.00 0.00 O ATOM 156 O5' DG A 6 -5.183 -7.467 -17.945 1.00 0.00 O ATOM 157 C5' DG A 6 -5.610 -8.411 -18.932 1.00 0.00 C ATOM 158 C4' DG A 6 -7.101 -8.616 -18.837 1.00 0.00 C ATOM 159 O4' DG A 6 -7.483 -9.252 -17.606 1.00 0.00 O ATOM 160 C3' DG A 6 -7.914 -7.344 -18.866 1.00 0.00 C ATOM 161 O3' DG A 6 -9.238 -7.573 -19.342 1.00 0.00 O ATOM 162 C2' DG A 6 -7.913 -6.991 -17.370 1.00 0.00 C ATOM 163 C1' DG A 6 -8.282 -8.367 -16.789 1.00 0.00 C ATOM 164 N9 DG A 6 -7.881 -8.657 -15.381 1.00 0.00 N ATOM 165 C8 DG A 6 -7.261 -9.792 -14.907 1.00 0.00 C ATOM 166 N7 DG A 6 -7.015 -9.778 -13.629 1.00 0.00 N ATOM 167 C5 DG A 6 -7.502 -8.546 -13.210 1.00 0.00 C ATOM 168 C6 DG A 6 -7.512 -7.970 -11.909 1.00 0.00 C ATOM 169 O6 DG A 6 -7.095 -8.426 -10.850 1.00 0.00 O ATOM 170 N1 DG A 6 -8.090 -6.726 -11.916 1.00 0.00 N ATOM 171 C2 DG A 6 -8.598 -6.099 -13.017 1.00 0.00 C ATOM 172 N2 DG A 6 -9.127 -4.905 -12.783 1.00 0.00 N ATOM 173 N3 DG A 6 -8.599 -6.623 -14.242 1.00 0.00 N ATOM 174 C4 DG A 6 -8.035 -7.850 -14.268 1.00 0.00 C ATOM 0 H5' DG A 6 -5.094 -9.360 -18.787 1.00 0.00 H new ATOM 0 H5'' DG A 6 -5.346 -8.054 -19.927 1.00 0.00 H new ATOM 0 H4' DG A 6 -7.311 -9.225 -19.717 1.00 0.00 H new ATOM 0 H3' DG A 6 -7.524 -6.569 -19.526 1.00 0.00 H new ATOM 0 H2' DG A 6 -6.943 -6.636 -17.023 1.00 0.00 H new ATOM 0 H2'' DG A 6 -8.642 -6.221 -17.120 1.00 0.00 H new ATOM 0 H1' DG A 6 -9.368 -8.457 -16.790 1.00 0.00 H new ATOM 0 H8 DG A 6 -7.000 -10.625 -15.543 1.00 0.00 H new ATOM 0 H1 DG A 6 -8.145 -6.229 -11.027 1.00 0.00 H new ATOM 0 H22 DG A 6 -9.131 -4.526 -11.836 1.00 0.00 H new ATOM 185 P DC A 7 -9.611 -7.137 -20.847 1.00 0.00 P ATOM 186 OP1 DC A 7 -10.425 -8.218 -21.439 1.00 0.00 O ATOM 187 OP2 DC A 7 -8.392 -6.679 -21.553 1.00 0.00 O ATOM 188 O5' DC A 7 -10.547 -5.862 -20.557 1.00 0.00 O ATOM 189 C5' DC A 7 -10.283 -4.976 -19.465 1.00 0.00 C ATOM 190 C4' DC A 7 -11.509 -4.767 -18.579 1.00 0.00 C ATOM 191 O4' DC A 7 -11.072 -4.205 -17.325 1.00 0.00 O ATOM 192 C3' DC A 7 -12.454 -3.650 -19.171 1.00 0.00 C ATOM 193 O3' DC A 7 -13.759 -3.970 -19.692 1.00 0.00 O ATOM 194 C2' DC A 7 -12.621 -2.568 -18.019 1.00 0.00 C ATOM 195 C1' DC A 7 -11.285 -2.780 -17.295 1.00 0.00 C ATOM 196 N1 DC A 7 -10.124 -1.961 -17.704 1.00 0.00 N ATOM 197 C2 DC A 7 -10.278 -0.578 -17.713 1.00 0.00 C ATOM 198 O2 DC A 7 -11.334 -0.024 -17.400 1.00 0.00 O ATOM 199 N3 DC A 7 -9.226 0.181 -18.083 1.00 0.00 N ATOM 200 C4 DC A 7 -8.062 -0.373 -18.435 1.00 0.00 C ATOM 201 N4 DC A 7 -7.067 0.434 -18.770 1.00 0.00 N ATOM 202 C5 DC A 7 -7.884 -1.792 -18.434 1.00 0.00 C ATOM 203 C6 DC A 7 -8.940 -2.540 -18.059 1.00 0.00 C ATOM 0 H5' DC A 7 -9.950 -4.014 -19.853 1.00 0.00 H new ATOM 0 H5'' DC A 7 -9.467 -5.377 -18.864 1.00 0.00 H new ATOM 0 H4' DC A 7 -12.016 -5.728 -18.493 1.00 0.00 H new ATOM 0 H3' DC A 7 -11.945 -3.342 -20.084 1.00 0.00 H new ATOM 0 H2' DC A 7 -12.734 -1.555 -18.406 1.00 0.00 H new ATOM 0 H2'' DC A 7 -13.482 -2.763 -17.380 1.00 0.00 H new ATOM 0 H1' DC A 7 -11.367 -2.389 -16.281 1.00 0.00 H new ATOM 0 H41 DC A 7 -6.165 0.045 -19.044 1.00 0.00 H new ATOM 0 H42 DC A 7 -7.203 1.445 -18.754 1.00 0.00 H new ATOM 0 H5 DC A 7 -6.946 -2.243 -18.721 1.00 0.00 H new ATOM 0 H6 DC A 7 -8.848 -3.616 -18.039 1.00 0.00 H new ATOM 215 P DT A 8 -14.538 -3.018 -20.744 1.00 0.00 P ATOM 216 OP1 DT A 8 -15.905 -3.547 -20.942 1.00 0.00 O ATOM 217 OP2 DT A 8 -13.671 -2.755 -21.916 1.00 0.00 O ATOM 218 O5' DT A 8 -14.648 -1.686 -19.878 1.00 0.00 O ATOM 219 C5' DT A 8 -15.501 -1.534 -18.733 1.00 0.00 C ATOM 220 C4' DT A 8 -15.637 -0.046 -18.437 1.00 0.00 C ATOM 221 O4' DT A 8 -14.318 0.512 -18.250 1.00 0.00 O ATOM 222 C3' DT A 8 -16.259 0.727 -19.597 1.00 0.00 C ATOM 223 O3' DT A 8 -16.884 1.981 -19.318 1.00 0.00 O ATOM 224 C2' DT A 8 -15.014 0.989 -20.365 1.00 0.00 C ATOM 225 C1' DT A 8 -14.141 1.511 -19.256 1.00 0.00 C ATOM 226 N1 DT A 8 -12.739 1.638 -19.712 1.00 0.00 N ATOM 227 C2 DT A 8 -12.120 2.870 -19.746 1.00 0.00 C ATOM 228 O2 DT A 8 -12.658 3.908 -19.379 1.00 0.00 O ATOM 229 N3 DT A 8 -10.827 2.892 -20.211 1.00 0.00 N ATOM 230 C4 DT A 8 -10.089 1.810 -20.646 1.00 0.00 C ATOM 231 O4 DT A 8 -8.934 1.979 -21.031 1.00 0.00 O ATOM 232 C5 DT A 8 -10.811 0.556 -20.573 1.00 0.00 C ATOM 233 C7 DT A 8 -10.134 -0.735 -21.033 1.00 0.00 C ATOM 234 C6 DT A 8 -12.082 0.513 -20.114 1.00 0.00 C ATOM 0 H5' DT A 8 -15.081 -2.056 -17.873 1.00 0.00 H new ATOM 0 H5'' DT A 8 -16.479 -1.974 -18.926 1.00 0.00 H new ATOM 0 H4' DT A 8 -16.273 0.044 -17.556 1.00 0.00 H new ATOM 0 H3' DT A 8 -17.082 0.169 -20.044 1.00 0.00 H new ATOM 0 H2' DT A 8 -14.610 0.088 -20.827 1.00 0.00 H new ATOM 0 H2'' DT A 8 -15.159 1.718 -21.162 1.00 0.00 H new ATOM 0 H1' DT A 8 -14.394 2.510 -18.901 1.00 0.00 H new ATOM 0 H3 DT A 8 -10.365 3.801 -20.237 1.00 0.00 H new ATOM 0 H71 DT A 8 -10.529 -1.576 -20.463 1.00 0.00 H new ATOM 0 H72 DT A 8 -10.331 -0.891 -22.094 1.00 0.00 H new ATOM 0 H73 DT A 8 -9.059 -0.660 -20.871 1.00 0.00 H new ATOM 0 H6 DT A 8 -12.591 -0.438 -20.064 1.00 0.00 H new ATOM 247 P DA A 9 -17.814 2.706 -20.423 1.00 0.00 P ATOM 248 OP1 DA A 9 -19.187 2.765 -19.885 1.00 0.00 O ATOM 249 OP2 DA A 9 -17.564 2.101 -21.755 1.00 0.00 O ATOM 250 O5' DA A 9 -17.222 4.191 -20.461 1.00 0.00 O ATOM 251 C5' DA A 9 -17.380 5.157 -19.409 1.00 0.00 C ATOM 252 C4' DA A 9 -16.785 6.491 -19.826 1.00 0.00 C ATOM 253 O4' DA A 9 -15.404 6.260 -20.107 1.00 0.00 O ATOM 254 C3' DA A 9 -17.389 7.151 -21.064 1.00 0.00 C ATOM 255 O3' DA A 9 -17.548 8.569 -21.008 1.00 0.00 O ATOM 256 C2' DA A 9 -16.381 6.717 -22.115 1.00 0.00 C ATOM 257 C1' DA A 9 -15.069 6.815 -21.369 1.00 0.00 C ATOM 258 N9 DA A 9 -14.008 5.958 -21.932 1.00 0.00 N ATOM 259 C8 DA A 9 -14.108 4.649 -22.328 1.00 0.00 C ATOM 260 N7 DA A 9 -13.005 4.146 -22.803 1.00 0.00 N ATOM 261 C5 DA A 9 -12.107 5.208 -22.711 1.00 0.00 C ATOM 262 C6 DA A 9 -10.754 5.341 -23.048 1.00 0.00 C ATOM 263 N6 DA A 9 -9.998 4.390 -23.589 1.00 0.00 N ATOM 264 N1 DA A 9 -10.181 6.524 -22.823 1.00 0.00 N ATOM 265 C2 DA A 9 -10.880 7.521 -22.299 1.00 0.00 C ATOM 266 N3 DA A 9 -12.153 7.527 -21.944 1.00 0.00 N ATOM 267 C4 DA A 9 -12.711 6.316 -22.181 1.00 0.00 C ATOM 0 H5' DA A 9 -16.892 4.801 -18.502 1.00 0.00 H new ATOM 0 H5'' DA A 9 -18.437 5.280 -19.174 1.00 0.00 H new ATOM 0 H4' DA A 9 -16.987 7.175 -19.002 1.00 0.00 H new ATOM 0 H3' DA A 9 -18.423 6.851 -21.236 1.00 0.00 H new ATOM 0 H2' DA A 9 -16.573 5.704 -22.467 1.00 0.00 H new ATOM 0 H2'' DA A 9 -16.400 7.368 -22.989 1.00 0.00 H new ATOM 0 H1' DA A 9 -14.690 7.837 -21.383 1.00 0.00 H new ATOM 0 H8 DA A 9 -15.025 4.083 -22.252 1.00 0.00 H new ATOM 0 H61 DA A 9 -9.018 4.577 -23.802 1.00 0.00 H new ATOM 0 H62 DA A 9 -10.398 3.474 -23.791 1.00 0.00 H new ATOM 0 H2 DA A 9 -10.342 8.444 -22.143 1.00 0.00 H new ATOM 279 P DC A 10 -18.076 9.445 -22.252 1.00 0.00 P ATOM 280 OP1 DC A 10 -18.953 10.521 -21.740 1.00 0.00 O ATOM 281 OP2 DC A 10 -18.552 8.554 -23.333 1.00 0.00 O ATOM 282 O5' DC A 10 -16.677 10.055 -22.676 1.00 0.00 O ATOM 283 C5' DC A 10 -15.909 10.850 -21.753 1.00 0.00 C ATOM 284 C4' DC A 10 -14.605 11.217 -22.398 1.00 0.00 C ATOM 285 O4' DC A 10 -13.996 9.985 -22.777 1.00 0.00 O ATOM 286 C3' DC A 10 -14.839 11.977 -23.702 1.00 0.00 C ATOM 287 O3' DC A 10 -14.372 13.326 -23.758 1.00 0.00 O ATOM 288 C2' DC A 10 -14.217 11.095 -24.758 1.00 0.00 C ATOM 289 C1' DC A 10 -13.279 10.275 -23.965 1.00 0.00 C ATOM 290 N1 DC A 10 -13.007 8.986 -24.607 1.00 0.00 N ATOM 291 C2 DC A 10 -11.719 8.718 -24.988 1.00 0.00 C ATOM 292 O2 DC A 10 -10.830 9.539 -24.816 1.00 0.00 O ATOM 293 N3 DC A 10 -11.449 7.530 -25.556 1.00 0.00 N ATOM 294 C4 DC A 10 -12.403 6.628 -25.752 1.00 0.00 C ATOM 295 N4 DC A 10 -12.010 5.502 -26.326 1.00 0.00 N ATOM 296 C5 DC A 10 -13.762 6.885 -25.364 1.00 0.00 C ATOM 297 C6 DC A 10 -14.009 8.082 -24.794 1.00 0.00 C ATOM 0 H5' DC A 10 -15.731 10.293 -20.833 1.00 0.00 H new ATOM 0 H5'' DC A 10 -16.461 11.749 -21.480 1.00 0.00 H new ATOM 0 H4' DC A 10 -14.014 11.824 -21.713 1.00 0.00 H new ATOM 0 H3' DC A 10 -15.908 12.142 -23.840 1.00 0.00 H new ATOM 0 H2' DC A 10 -14.961 10.484 -25.268 1.00 0.00 H new ATOM 0 H2'' DC A 10 -13.703 11.676 -25.523 1.00 0.00 H new ATOM 0 H1' DC A 10 -12.333 10.799 -23.829 1.00 0.00 H new ATOM 0 H41 DC A 10 -12.686 4.760 -26.510 1.00 0.00 H new ATOM 0 H42 DC A 10 -11.031 5.376 -26.585 1.00 0.00 H new ATOM 0 H5 DC A 10 -14.545 6.158 -25.521 1.00 0.00 H new ATOM 0 H6 DC A 10 -15.013 8.327 -24.482 1.00 0.00 H new ATOM 309 P DC A 11 -14.659 14.228 -25.057 1.00 0.00 P ATOM 310 OP1 DC A 11 -14.680 15.640 -24.622 1.00 0.00 O ATOM 311 OP2 DC A 11 -15.829 13.667 -25.772 1.00 0.00 O ATOM 312 O5' DC A 11 -13.361 13.994 -25.967 1.00 0.00 O ATOM 313 C5' DC A 11 -12.052 14.451 -25.596 1.00 0.00 C ATOM 314 C4' DC A 11 -11.034 13.968 -26.611 1.00 0.00 C ATOM 315 O4' DC A 11 -11.013 12.524 -26.623 1.00 0.00 O ATOM 316 C3' DC A 11 -11.323 14.395 -28.065 1.00 0.00 C ATOM 317 O3' DC A 11 -10.203 14.595 -28.944 1.00 0.00 O ATOM 318 C2' DC A 11 -12.055 13.175 -28.545 1.00 0.00 C ATOM 319 C1' DC A 11 -11.101 12.140 -27.992 1.00 0.00 C ATOM 320 N1 DC A 11 -11.617 10.785 -28.193 1.00 0.00 N ATOM 321 C2 DC A 11 -10.752 9.861 -28.742 1.00 0.00 C ATOM 322 O2 DC A 11 -9.594 10.145 -29.036 1.00 0.00 O ATOM 323 N3 DC A 11 -11.215 8.618 -28.958 1.00 0.00 N ATOM 324 C4 DC A 11 -12.469 8.285 -28.652 1.00 0.00 C ATOM 325 N4 DC A 11 -12.854 7.043 -28.898 1.00 0.00 N ATOM 326 C5 DC A 11 -13.378 9.226 -28.081 1.00 0.00 C ATOM 327 C6 DC A 11 -12.904 10.467 -27.870 1.00 0.00 C ATOM 0 H5' DC A 11 -11.795 14.080 -24.604 1.00 0.00 H new ATOM 0 H5'' DC A 11 -12.038 15.540 -25.543 1.00 0.00 H new ATOM 0 H4' DC A 11 -10.093 14.419 -26.297 1.00 0.00 H new ATOM 0 H3' DC A 11 -11.814 15.368 -28.077 1.00 0.00 H new ATOM 0 H2' DC A 11 -13.061 13.091 -28.134 1.00 0.00 H new ATOM 0 H2'' DC A 11 -12.149 13.133 -29.630 1.00 0.00 H new ATOM 0 HO3' DC A 11 -10.526 14.860 -29.830 1.00 0.00 H new ATOM 0 H1' DC A 11 -10.125 12.110 -28.477 1.00 0.00 H new ATOM 0 H41 DC A 11 -13.806 6.751 -28.677 1.00 0.00 H new ATOM 0 H42 DC A 11 -12.199 6.378 -29.308 1.00 0.00 H new ATOM 0 H5 DC A 11 -14.393 8.956 -27.831 1.00 0.00 H new ATOM 0 H6 DC A 11 -13.549 11.219 -27.440 1.00 0.00 H new TER 339 DC A 11 ATOM 340 O5' DG B 12 -4.368 1.373 -32.162 1.00 0.00 O ATOM 341 C5' DG B 12 -3.292 2.072 -32.792 1.00 0.00 C ATOM 342 C4' DG B 12 -3.121 3.470 -32.190 1.00 0.00 C ATOM 343 O4' DG B 12 -4.404 4.128 -32.215 1.00 0.00 O ATOM 344 C3' DG B 12 -2.670 3.536 -30.717 1.00 0.00 C ATOM 345 O3' DG B 12 -1.894 4.670 -30.295 1.00 0.00 O ATOM 346 C2' DG B 12 -4.006 3.667 -30.016 1.00 0.00 C ATOM 347 C1' DG B 12 -4.653 4.684 -30.916 1.00 0.00 C ATOM 348 N9 DG B 12 -6.091 4.691 -30.647 1.00 0.00 N ATOM 349 C8 DG B 12 -6.940 3.635 -30.709 1.00 0.00 C ATOM 350 N7 DG B 12 -8.178 3.933 -30.428 1.00 0.00 N ATOM 351 C5 DG B 12 -8.132 5.298 -30.159 1.00 0.00 C ATOM 352 C6 DG B 12 -9.164 6.202 -29.792 1.00 0.00 C ATOM 353 O6 DG B 12 -10.361 5.977 -29.627 1.00 0.00 O ATOM 354 N1 DG B 12 -8.682 7.487 -29.614 1.00 0.00 N ATOM 355 C2 DG B 12 -7.366 7.858 -29.770 1.00 0.00 C ATOM 356 N2 DG B 12 -7.020 9.112 -29.548 1.00 0.00 N ATOM 357 N3 DG B 12 -6.403 7.018 -30.114 1.00 0.00 N ATOM 358 C4 DG B 12 -6.855 5.763 -30.292 1.00 0.00 C ATOM 0 H5' DG B 12 -3.483 2.153 -33.862 1.00 0.00 H new ATOM 0 H5'' DG B 12 -2.368 1.506 -32.675 1.00 0.00 H new ATOM 0 H4' DG B 12 -2.337 3.928 -32.793 1.00 0.00 H new ATOM 0 H3' DG B 12 -2.021 2.684 -30.514 1.00 0.00 H new ATOM 0 H2' DG B 12 -4.556 2.727 -29.981 1.00 0.00 H new ATOM 0 H2'' DG B 12 -3.908 4.017 -28.988 1.00 0.00 H new ATOM 0 HO5' DG B 12 -4.460 0.484 -32.563 1.00 0.00 H new ATOM 0 H1' DG B 12 -4.288 5.704 -30.797 1.00 0.00 H new ATOM 0 H8 DG B 12 -6.619 2.637 -30.968 1.00 0.00 H new ATOM 0 H1 DG B 12 -9.350 8.211 -29.348 1.00 0.00 H new ATOM 0 H21 DG B 12 -6.048 9.400 -29.660 1.00 0.00 H new ATOM 0 H22 DG B 12 -7.725 9.793 -29.264 1.00 0.00 H new ATOM 371 P DG B 13 -1.011 4.645 -28.942 1.00 0.00 P ATOM 372 OP1 DG B 13 0.421 4.660 -29.314 1.00 0.00 O ATOM 373 OP2 DG B 13 -1.534 3.600 -28.029 1.00 0.00 O ATOM 374 O5' DG B 13 -1.410 6.057 -28.370 1.00 0.00 O ATOM 375 C5' DG B 13 -1.054 7.281 -29.015 1.00 0.00 C ATOM 376 C4' DG B 13 -1.725 8.397 -28.264 1.00 0.00 C ATOM 377 O4' DG B 13 -3.153 8.283 -28.410 1.00 0.00 O ATOM 378 C3' DG B 13 -1.439 8.383 -26.771 1.00 0.00 C ATOM 379 O3' DG B 13 -1.419 9.657 -26.174 1.00 0.00 O ATOM 380 C2' DG B 13 -2.650 7.642 -26.274 1.00 0.00 C ATOM 381 C1' DG B 13 -3.726 8.263 -27.109 1.00 0.00 C ATOM 382 N9 DG B 13 -4.914 7.407 -27.068 1.00 0.00 N ATOM 383 C8 DG B 13 -5.018 6.091 -27.421 1.00 0.00 C ATOM 384 N7 DG B 13 -6.217 5.598 -27.258 1.00 0.00 N ATOM 385 C5 DG B 13 -6.948 6.676 -26.757 1.00 0.00 C ATOM 386 C6 DG B 13 -8.309 6.770 -26.380 1.00 0.00 C ATOM 387 O6 DG B 13 -9.195 5.921 -26.407 1.00 0.00 O ATOM 388 N1 DG B 13 -8.617 8.036 -25.930 1.00 0.00 N ATOM 389 C2 DG B 13 -7.743 9.089 -25.848 1.00 0.00 C ATOM 390 N2 DG B 13 -8.204 10.229 -25.374 1.00 0.00 N ATOM 391 N3 DG B 13 -6.470 9.014 -26.199 1.00 0.00 N ATOM 392 C4 DG B 13 -6.147 7.781 -26.641 1.00 0.00 C ATOM 0 H5' DG B 13 -1.374 7.273 -30.057 1.00 0.00 H new ATOM 0 H5'' DG B 13 0.028 7.414 -29.015 1.00 0.00 H new ATOM 0 H4' DG B 13 -1.328 9.320 -28.687 1.00 0.00 H new ATOM 0 H3' DG B 13 -0.460 7.961 -26.544 1.00 0.00 H new ATOM 0 H2' DG B 13 -2.571 6.567 -26.436 1.00 0.00 H new ATOM 0 H2'' DG B 13 -2.817 7.793 -25.207 1.00 0.00 H new ATOM 0 H1' DG B 13 -4.039 9.253 -26.778 1.00 0.00 H new ATOM 0 H8 DG B 13 -4.188 5.513 -27.799 1.00 0.00 H new ATOM 0 H1 DG B 13 -9.578 8.204 -25.632 1.00 0.00 H new ATOM 0 H21 DG B 13 -7.586 11.037 -25.297 1.00 0.00 H new ATOM 0 H22 DG B 13 -9.179 10.304 -25.084 1.00 0.00 H new ATOM 404 P DT B 14 -1.203 9.762 -24.597 1.00 0.00 P ATOM 405 OP1 DT B 14 -0.125 10.743 -24.366 1.00 0.00 O ATOM 406 OP2 DT B 14 -1.099 8.407 -24.006 1.00 0.00 O ATOM 407 O5' DT B 14 -2.594 10.372 -24.123 1.00 0.00 O ATOM 408 C5' DT B 14 -3.026 11.704 -24.434 1.00 0.00 C ATOM 409 C4' DT B 14 -4.172 12.077 -23.501 1.00 0.00 C ATOM 410 O4' DT B 14 -5.256 11.189 -23.747 1.00 0.00 O ATOM 411 C3' DT B 14 -3.922 12.099 -21.986 1.00 0.00 C ATOM 412 O3' DT B 14 -4.673 13.107 -21.288 1.00 0.00 O ATOM 413 C2' DT B 14 -4.409 10.718 -21.644 1.00 0.00 C ATOM 414 C1' DT B 14 -5.633 10.593 -22.520 1.00 0.00 C ATOM 415 N1 DT B 14 -5.977 9.202 -22.838 1.00 0.00 N ATOM 416 C2 DT B 14 -7.288 8.832 -22.691 1.00 0.00 C ATOM 417 O2 DT B 14 -8.183 9.594 -22.347 1.00 0.00 O ATOM 418 N3 DT B 14 -7.578 7.532 -22.984 1.00 0.00 N ATOM 419 C4 DT B 14 -6.720 6.561 -23.400 1.00 0.00 C ATOM 420 O4 DT B 14 -7.186 5.445 -23.629 1.00 0.00 O ATOM 421 C5 DT B 14 -5.351 7.002 -23.538 1.00 0.00 C ATOM 422 C7 DT B 14 -4.319 5.943 -24.001 1.00 0.00 C ATOM 423 C6 DT B 14 -5.021 8.302 -23.262 1.00 0.00 C ATOM 0 H5' DT B 14 -3.350 11.763 -25.473 1.00 0.00 H new ATOM 0 H5'' DT B 14 -2.200 12.406 -24.317 1.00 0.00 H new ATOM 0 H4' DT B 14 -4.359 13.122 -23.747 1.00 0.00 H new ATOM 0 H3' DT B 14 -2.895 12.335 -21.707 1.00 0.00 H new ATOM 0 H2' DT B 14 -3.665 9.955 -21.871 1.00 0.00 H new ATOM 0 H2'' DT B 14 -4.652 10.621 -20.586 1.00 0.00 H new ATOM 0 H1' DT B 14 -6.485 11.042 -22.010 1.00 0.00 H new ATOM 0 H3 DT B 14 -8.554 7.255 -22.879 1.00 0.00 H new ATOM 0 H71 DT B 14 -4.632 4.956 -23.659 1.00 0.00 H new ATOM 0 H72 DT B 14 -4.257 5.947 -25.089 1.00 0.00 H new ATOM 0 H73 DT B 14 -3.341 6.180 -23.581 1.00 0.00 H new ATOM 0 H6 DT B 14 -3.998 8.628 -23.378 1.00 0.00 H new ATOM 436 P DA B 15 -4.554 13.417 -19.701 1.00 0.00 P ATOM 437 OP1 DA B 15 -4.853 14.855 -19.483 1.00 0.00 O ATOM 438 OP2 DA B 15 -3.299 12.842 -19.170 1.00 0.00 O ATOM 439 O5' DA B 15 -5.765 12.533 -19.122 1.00 0.00 O ATOM 440 C5' DA B 15 -7.072 13.087 -18.918 1.00 0.00 C ATOM 441 C4' DA B 15 -7.957 12.131 -18.131 1.00 0.00 C ATOM 442 O4' DA B 15 -8.060 10.908 -18.860 1.00 0.00 O ATOM 443 C3' DA B 15 -7.438 11.709 -16.745 1.00 0.00 C ATOM 444 O3' DA B 15 -8.266 11.925 -15.596 1.00 0.00 O ATOM 445 C2' DA B 15 -7.164 10.218 -16.886 1.00 0.00 C ATOM 446 C1' DA B 15 -8.151 9.835 -17.936 1.00 0.00 C ATOM 447 N9 DA B 15 -7.735 8.641 -18.674 1.00 0.00 N ATOM 448 C8 DA B 15 -6.499 8.296 -19.144 1.00 0.00 C ATOM 449 N7 DA B 15 -6.470 7.161 -19.794 1.00 0.00 N ATOM 450 C5 DA B 15 -7.799 6.737 -19.734 1.00 0.00 C ATOM 451 C6 DA B 15 -8.471 5.610 -20.224 1.00 0.00 C ATOM 452 N6 DA B 15 -7.885 4.634 -20.914 1.00 0.00 N ATOM 453 N1 DA B 15 -9.784 5.536 -19.968 1.00 0.00 N ATOM 454 C2 DA B 15 -10.406 6.492 -19.286 1.00 0.00 C ATOM 455 N3 DA B 15 -9.882 7.592 -18.784 1.00 0.00 N ATOM 456 C4 DA B 15 -8.562 7.642 -19.051 1.00 0.00 C ATOM 0 H5' DA B 15 -7.533 13.304 -19.882 1.00 0.00 H new ATOM 0 H5'' DA B 15 -6.990 14.034 -18.384 1.00 0.00 H new ATOM 0 H4' DA B 15 -8.886 12.683 -17.991 1.00 0.00 H new ATOM 0 H3' DA B 15 -6.586 12.351 -16.523 1.00 0.00 H new ATOM 0 H2' DA B 15 -6.138 10.016 -17.194 1.00 0.00 H new ATOM 0 H2'' DA B 15 -7.328 9.680 -15.952 1.00 0.00 H new ATOM 0 H1' DA B 15 -9.131 9.643 -17.498 1.00 0.00 H new ATOM 0 H8 DA B 15 -5.622 8.908 -18.992 1.00 0.00 H new ATOM 0 H61 DA B 15 -8.435 3.840 -21.242 1.00 0.00 H new ATOM 0 H62 DA B 15 -6.886 4.680 -21.115 1.00 0.00 H new ATOM 0 H2 DA B 15 -11.464 6.351 -19.124 1.00 0.00 H new ATOM 468 P DG B 16 -9.842 11.630 -15.389 1.00 0.00 P ATOM 469 OP1 DG B 16 -10.343 10.680 -16.402 1.00 0.00 O ATOM 470 OP2 DG B 16 -10.519 12.935 -15.221 1.00 0.00 O ATOM 471 O5' DG B 16 -9.809 10.890 -13.963 1.00 0.00 O ATOM 472 C5' DG B 16 -10.961 10.354 -13.297 1.00 0.00 C ATOM 473 C4' DG B 16 -10.840 8.851 -13.031 1.00 0.00 C ATOM 474 O4' DG B 16 -10.676 8.140 -14.271 1.00 0.00 O ATOM 475 C3' DG B 16 -9.563 8.393 -12.333 1.00 0.00 C ATOM 476 O3' DG B 16 -9.292 8.563 -10.936 1.00 0.00 O ATOM 477 C2' DG B 16 -9.464 6.915 -12.696 1.00 0.00 C ATOM 478 C1' DG B 16 -10.374 6.780 -13.920 1.00 0.00 C ATOM 479 N9 DG B 16 -9.618 6.085 -14.967 1.00 0.00 N ATOM 480 C8 DG B 16 -8.416 6.452 -15.494 1.00 0.00 C ATOM 481 N7 DG B 16 -7.961 5.622 -16.389 1.00 0.00 N ATOM 482 C5 DG B 16 -8.940 4.629 -16.452 1.00 0.00 C ATOM 483 C6 DG B 16 -9.008 3.455 -17.245 1.00 0.00 C ATOM 484 O6 DG B 16 -8.210 3.019 -18.069 1.00 0.00 O ATOM 485 N1 DG B 16 -10.160 2.743 -16.992 1.00 0.00 N ATOM 486 C2 DG B 16 -11.132 3.105 -16.098 1.00 0.00 C ATOM 487 N2 DG B 16 -12.170 2.290 -15.988 1.00 0.00 N ATOM 488 N3 DG B 16 -11.084 4.199 -15.352 1.00 0.00 N ATOM 489 C4 DG B 16 -9.959 4.914 -15.580 1.00 0.00 C ATOM 0 H5' DG B 16 -11.847 10.542 -13.903 1.00 0.00 H new ATOM 0 H5'' DG B 16 -11.105 10.876 -12.351 1.00 0.00 H new ATOM 0 H4' DG B 16 -11.734 8.659 -12.438 1.00 0.00 H new ATOM 0 H3' DG B 16 -8.814 9.100 -12.692 1.00 0.00 H new ATOM 0 H2' DG B 16 -8.438 6.627 -12.926 1.00 0.00 H new ATOM 0 H2'' DG B 16 -9.798 6.278 -11.877 1.00 0.00 H new ATOM 0 H1' DG B 16 -11.289 6.210 -13.758 1.00 0.00 H new ATOM 0 H8 DG B 16 -7.890 7.347 -15.197 1.00 0.00 H new ATOM 0 H1 DG B 16 -10.300 1.877 -17.512 1.00 0.00 H new ATOM 0 H21 DG B 16 -12.924 2.510 -15.337 1.00 0.00 H new ATOM 0 H22 DG B 16 -12.215 1.443 -16.554 1.00 0.00 H new ATOM 501 P DG B 17 -10.314 8.318 -9.726 1.00 0.00 P ATOM 502 OP1 DG B 17 -11.577 9.031 -10.028 1.00 0.00 O ATOM 503 OP2 DG B 17 -9.582 8.627 -8.480 1.00 0.00 O ATOM 504 O5' DG B 17 -10.575 6.749 -9.788 1.00 0.00 O ATOM 505 C5' DG B 17 -11.747 6.131 -10.337 1.00 0.00 C ATOM 506 C4' DG B 17 -11.787 4.680 -9.867 1.00 0.00 C ATOM 507 O4' DG B 17 -10.852 3.855 -10.573 1.00 0.00 O ATOM 508 C3' DG B 17 -11.459 4.471 -8.386 1.00 0.00 C ATOM 509 O3' DG B 17 -12.021 3.305 -7.784 1.00 0.00 O ATOM 510 C2' DG B 17 -9.954 4.283 -8.505 1.00 0.00 C ATOM 511 C1' DG B 17 -9.934 3.293 -9.630 1.00 0.00 C ATOM 512 N9 DG B 17 -8.640 3.243 -10.295 1.00 0.00 N ATOM 513 C8 DG B 17 -7.895 4.278 -10.778 1.00 0.00 C ATOM 514 N7 DG B 17 -6.782 3.912 -11.346 1.00 0.00 N ATOM 515 C5 DG B 17 -6.807 2.524 -11.219 1.00 0.00 C ATOM 516 C6 DG B 17 -5.875 1.555 -11.641 1.00 0.00 C ATOM 517 O6 DG B 17 -4.807 1.725 -12.214 1.00 0.00 O ATOM 518 N1 DG B 17 -6.285 0.278 -11.320 1.00 0.00 N ATOM 519 C2 DG B 17 -7.449 -0.033 -10.669 1.00 0.00 C ATOM 520 N2 DG B 17 -7.691 -1.310 -10.438 1.00 0.00 N ATOM 521 N3 DG B 17 -8.336 0.867 -10.262 1.00 0.00 N ATOM 522 C4 DG B 17 -7.944 2.119 -10.574 1.00 0.00 C ATOM 0 H5' DG B 17 -11.726 6.177 -11.426 1.00 0.00 H new ATOM 0 H5'' DG B 17 -12.643 6.660 -10.013 1.00 0.00 H new ATOM 0 H4' DG B 17 -12.823 4.403 -10.060 1.00 0.00 H new ATOM 0 H3' DG B 17 -11.842 5.277 -7.760 1.00 0.00 H new ATOM 0 H2' DG B 17 -9.431 5.208 -8.748 1.00 0.00 H new ATOM 0 H2'' DG B 17 -9.504 3.893 -7.592 1.00 0.00 H new ATOM 0 H1' DG B 17 -10.164 2.290 -9.271 1.00 0.00 H new ATOM 0 H8 DG B 17 -8.201 5.310 -10.697 1.00 0.00 H new ATOM 0 H1 DG B 17 -5.675 -0.494 -11.588 1.00 0.00 H new ATOM 0 H21 DG B 17 -8.546 -1.588 -9.956 1.00 0.00 H new ATOM 0 H22 DG B 17 -7.023 -2.019 -10.742 1.00 0.00 H new ATOM 534 P DA B 18 -11.800 2.887 -6.248 1.00 0.00 P ATOM 535 OP1 DA B 18 -13.122 2.581 -5.665 1.00 0.00 O ATOM 536 OP2 DA B 18 -10.908 3.859 -5.570 1.00 0.00 O ATOM 537 O5' DA B 18 -11.005 1.516 -6.422 1.00 0.00 O ATOM 538 C5' DA B 18 -11.629 0.332 -6.944 1.00 0.00 C ATOM 539 C4' DA B 18 -10.721 -0.881 -6.781 1.00 0.00 C ATOM 540 O4' DA B 18 -9.523 -0.669 -7.543 1.00 0.00 O ATOM 541 C3' DA B 18 -10.286 -1.256 -5.360 1.00 0.00 C ATOM 542 O3' DA B 18 -10.079 -2.660 -5.140 1.00 0.00 O ATOM 543 C2' DA B 18 -8.963 -0.499 -5.299 1.00 0.00 C ATOM 544 C1' DA B 18 -8.401 -0.785 -6.673 1.00 0.00 C ATOM 545 N9 DA B 18 -7.411 0.226 -7.112 1.00 0.00 N ATOM 546 C8 DA B 18 -7.499 1.593 -6.990 1.00 0.00 C ATOM 547 N7 DA B 18 -6.487 2.242 -7.489 1.00 0.00 N ATOM 548 C5 DA B 18 -5.666 1.232 -7.975 1.00 0.00 C ATOM 549 C6 DA B 18 -4.431 1.269 -8.622 1.00 0.00 C ATOM 550 N6 DA B 18 -3.798 2.404 -8.917 1.00 0.00 N ATOM 551 N1 DA B 18 -3.895 0.096 -8.963 1.00 0.00 N ATOM 552 C2 DA B 18 -4.538 -1.032 -8.688 1.00 0.00 C ATOM 553 N3 DA B 18 -5.703 -1.202 -8.087 1.00 0.00 N ATOM 554 C4 DA B 18 -6.219 0.000 -7.751 1.00 0.00 C ATOM 0 H5' DA B 18 -11.864 0.475 -7.999 1.00 0.00 H new ATOM 0 H5'' DA B 18 -12.573 0.156 -6.428 1.00 0.00 H new ATOM 0 H4' DA B 18 -11.340 -1.710 -7.124 1.00 0.00 H new ATOM 0 H3' DA B 18 -11.034 -1.013 -4.605 1.00 0.00 H new ATOM 0 H2' DA B 18 -9.106 0.568 -5.126 1.00 0.00 H new ATOM 0 H2'' DA B 18 -8.314 -0.866 -4.504 1.00 0.00 H new ATOM 0 H1' DA B 18 -7.902 -1.754 -6.675 1.00 0.00 H new ATOM 0 H8 DA B 18 -8.337 2.086 -6.520 1.00 0.00 H new ATOM 0 H61 DA B 18 -2.896 2.376 -9.392 1.00 0.00 H new ATOM 0 H62 DA B 18 -4.216 3.301 -8.668 1.00 0.00 H new ATOM 0 H2 DA B 18 -4.039 -1.938 -8.999 1.00 0.00 H new ATOM 566 P DT B 19 -9.337 -3.273 -3.858 1.00 0.00 P ATOM 567 OP1 DT B 19 -9.892 -4.616 -3.581 1.00 0.00 O ATOM 568 OP2 DT B 19 -9.274 -2.257 -2.779 1.00 0.00 O ATOM 569 O5' DT B 19 -7.882 -3.449 -4.504 1.00 0.00 O ATOM 570 C5' DT B 19 -7.706 -4.381 -5.590 1.00 0.00 C ATOM 571 C4' DT B 19 -6.259 -4.735 -5.812 1.00 0.00 C ATOM 572 O4' DT B 19 -5.530 -3.560 -6.159 1.00 0.00 O ATOM 573 C3' DT B 19 -5.476 -5.259 -4.558 1.00 0.00 C ATOM 574 O3' DT B 19 -4.385 -6.107 -4.930 1.00 0.00 O ATOM 575 C2' DT B 19 -4.773 -4.030 -3.927 1.00 0.00 C ATOM 576 C1' DT B 19 -4.389 -3.430 -5.306 1.00 0.00 C ATOM 577 N1 DT B 19 -4.178 -1.989 -5.273 1.00 0.00 N ATOM 578 C2 DT B 19 -3.023 -1.517 -5.821 1.00 0.00 C ATOM 579 O2 DT B 19 -2.177 -2.232 -6.340 1.00 0.00 O ATOM 580 N3 DT B 19 -2.857 -0.171 -5.774 1.00 0.00 N ATOM 581 C4 DT B 19 -3.709 0.750 -5.239 1.00 0.00 C ATOM 582 O4 DT B 19 -3.373 1.930 -5.315 1.00 0.00 O ATOM 583 C5 DT B 19 -4.923 0.173 -4.669 1.00 0.00 C ATOM 584 C7 DT B 19 -5.982 1.065 -4.002 1.00 0.00 C ATOM 585 C6 DT B 19 -5.107 -1.165 -4.712 1.00 0.00 C ATOM 0 H5' DT B 19 -8.117 -3.952 -6.504 1.00 0.00 H new ATOM 0 H5'' DT B 19 -8.272 -5.289 -5.382 1.00 0.00 H new ATOM 0 H4' DT B 19 -6.313 -5.516 -6.570 1.00 0.00 H new ATOM 0 H3' DT B 19 -6.182 -5.785 -3.915 1.00 0.00 H new ATOM 0 H2' DT B 19 -5.432 -3.396 -3.334 1.00 0.00 H new ATOM 0 H2'' DT B 19 -3.919 -4.280 -3.297 1.00 0.00 H new ATOM 0 H1' DT B 19 -3.482 -3.945 -5.623 1.00 0.00 H new ATOM 0 H3 DT B 19 -1.998 0.193 -6.185 1.00 0.00 H new ATOM 0 H71 DT B 19 -6.966 0.613 -4.122 1.00 0.00 H new ATOM 0 H72 DT B 19 -5.756 1.166 -2.940 1.00 0.00 H new ATOM 0 H73 DT B 19 -5.975 2.049 -4.470 1.00 0.00 H new ATOM 0 H6 DT B 19 -6.008 -1.589 -4.294 1.00 0.00 H new ATOM 598 P DG B 20 -4.184 -7.518 -4.235 1.00 0.00 P ATOM 599 OP1 DG B 20 -5.265 -8.430 -4.682 1.00 0.00 O ATOM 600 OP2 DG B 20 -3.937 -7.300 -2.793 1.00 0.00 O ATOM 601 O5' DG B 20 -2.808 -7.941 -4.931 1.00 0.00 O ATOM 602 C5' DG B 20 -2.744 -8.387 -6.290 1.00 0.00 C ATOM 603 C4' DG B 20 -1.297 -8.397 -6.790 1.00 0.00 C ATOM 604 O4' DG B 20 -0.755 -7.076 -6.826 1.00 0.00 O ATOM 605 C3' DG B 20 -0.349 -9.203 -5.896 1.00 0.00 C ATOM 606 O3' DG B 20 0.931 -9.597 -6.401 1.00 0.00 O ATOM 607 C2' DG B 20 -0.101 -8.101 -4.861 1.00 0.00 C ATOM 608 C1' DG B 20 0.175 -6.922 -5.763 1.00 0.00 C ATOM 609 N9 DG B 20 -0.141 -5.603 -5.184 1.00 0.00 N ATOM 610 C8 DG B 20 -1.097 -5.285 -4.249 1.00 0.00 C ATOM 611 N7 DG B 20 -1.136 -4.023 -3.950 1.00 0.00 N ATOM 612 C5 DG B 20 -0.141 -3.461 -4.739 1.00 0.00 C ATOM 613 C6 DG B 20 0.279 -2.120 -4.843 1.00 0.00 C ATOM 614 O6 DG B 20 -0.159 -1.128 -4.267 1.00 0.00 O ATOM 615 N1 DG B 20 1.309 -1.973 -5.744 1.00 0.00 N ATOM 616 C2 DG B 20 1.879 -2.982 -6.474 1.00 0.00 C ATOM 617 N2 DG B 20 2.854 -2.674 -7.298 1.00 0.00 N ATOM 618 N3 DG B 20 1.489 -4.247 -6.383 1.00 0.00 N ATOM 619 C4 DG B 20 0.475 -4.420 -5.497 1.00 0.00 C ATOM 0 H5' DG B 20 -3.347 -7.734 -6.921 1.00 0.00 H new ATOM 0 H5'' DG B 20 -3.168 -9.388 -6.370 1.00 0.00 H new ATOM 0 H4' DG B 20 -1.356 -8.850 -7.780 1.00 0.00 H new ATOM 0 H3' DG B 20 -0.784 -10.168 -5.637 1.00 0.00 H new ATOM 0 H2' DG B 20 -0.966 -7.936 -4.218 1.00 0.00 H new ATOM 0 H2'' DG B 20 0.742 -8.329 -4.209 1.00 0.00 H new ATOM 0 H1' DG B 20 1.237 -6.927 -6.007 1.00 0.00 H new ATOM 0 H8 DG B 20 -1.755 -6.017 -3.805 1.00 0.00 H new ATOM 0 H1 DG B 20 1.679 -1.032 -5.880 1.00 0.00 H new ATOM 0 H21 DG B 20 3.299 -3.402 -7.856 1.00 0.00 H new ATOM 0 H22 DG B 20 3.166 -1.706 -7.380 1.00 0.00 H new ATOM 631 P DG B 21 1.695 -10.897 -5.816 1.00 0.00 P ATOM 632 OP1 DG B 21 1.396 -12.053 -6.687 1.00 0.00 O ATOM 633 OP2 DG B 21 1.449 -11.011 -4.356 1.00 0.00 O ATOM 634 O5' DG B 21 3.244 -10.473 -6.012 1.00 0.00 O ATOM 635 C5' DG B 21 3.854 -10.117 -7.269 1.00 0.00 C ATOM 636 C4' DG B 21 4.996 -9.123 -7.031 1.00 0.00 C ATOM 637 O4' DG B 21 4.411 -7.926 -6.539 1.00 0.00 O ATOM 638 C3' DG B 21 6.051 -9.561 -5.998 1.00 0.00 C ATOM 639 O3' DG B 21 7.430 -9.396 -6.349 1.00 0.00 O ATOM 640 C2' DG B 21 5.724 -8.646 -4.812 1.00 0.00 C ATOM 641 C1' DG B 21 5.269 -7.392 -5.541 1.00 0.00 C ATOM 642 N9 DG B 21 4.310 -6.583 -4.767 1.00 0.00 N ATOM 643 C8 DG B 21 3.182 -7.085 -4.182 1.00 0.00 C ATOM 644 N7 DG B 21 2.454 -6.198 -3.571 1.00 0.00 N ATOM 645 C5 DG B 21 3.155 -5.012 -3.764 1.00 0.00 C ATOM 646 C6 DG B 21 2.843 -3.701 -3.317 1.00 0.00 C ATOM 647 O6 DG B 21 1.878 -3.303 -2.673 1.00 0.00 O ATOM 648 N1 DG B 21 3.788 -2.791 -3.708 1.00 0.00 N ATOM 649 C2 DG B 21 4.910 -3.076 -4.438 1.00 0.00 C ATOM 650 N2 DG B 21 5.688 -2.031 -4.705 1.00 0.00 N ATOM 651 N3 DG B 21 5.227 -4.300 -4.872 1.00 0.00 N ATOM 652 C4 DG B 21 4.301 -5.227 -4.494 1.00 0.00 C ATOM 0 H5' DG B 21 3.110 -9.677 -7.933 1.00 0.00 H new ATOM 0 H5'' DG B 21 4.235 -11.010 -7.764 1.00 0.00 H new ATOM 0 H4' DG B 21 5.517 -9.023 -7.983 1.00 0.00 H new ATOM 0 H3' DG B 21 5.981 -10.638 -5.844 1.00 0.00 H new ATOM 0 H2' DG B 21 4.944 -9.059 -4.173 1.00 0.00 H new ATOM 0 H2'' DG B 21 6.592 -8.464 -4.178 1.00 0.00 H new ATOM 0 HO3' DG B 21 7.995 -9.708 -5.612 1.00 0.00 H new ATOM 0 H1' DG B 21 6.140 -6.797 -5.816 1.00 0.00 H new ATOM 0 H8 DG B 21 2.917 -8.131 -4.224 1.00 0.00 H new ATOM 0 H1 DG B 21 3.644 -1.820 -3.432 1.00 0.00 H new ATOM 0 H21 DG B 21 6.544 -2.157 -5.245 1.00 0.00 H new ATOM 0 H22 DG B 21 5.428 -1.103 -4.370 1.00 0.00 H new TER 664 DG B 21 HETATM 665 C1 BAP A 22 -6.416 2.036 -15.458 1.00 0.00 C HETATM 666 C2 BAP A 22 -5.451 1.246 -16.190 1.00 0.00 C HETATM 667 C3 BAP A 22 -5.556 -0.183 -16.203 1.00 0.00 C HETATM 668 C3A BAP A 22 -6.608 -0.827 -15.493 1.00 0.00 C HETATM 669 C4 BAP A 22 -6.719 -2.256 -15.503 1.00 0.00 C HETATM 670 C5 BAP A 22 -7.769 -2.874 -14.821 1.00 0.00 C HETATM 671 C5A BAP A 22 -8.740 -2.111 -14.092 1.00 0.00 C HETATM 672 C6 BAP A 22 -9.800 -2.784 -13.396 1.00 0.00 C HETATM 673 C7 BAP A 22 -10.789 -2.011 -12.658 1.00 0.00 C HETATM 674 C8 BAP A 22 -10.676 -0.560 -12.640 1.00 0.00 C HETATM 675 C8A BAP A 22 -9.605 0.092 -13.337 1.00 0.00 C HETATM 676 C9 BAP A 22 -9.496 1.526 -13.328 1.00 0.00 C HETATM 677 C10 BAP A 22 -8.438 2.165 -14.033 1.00 0.00 C HETATM 678 C1A BAP A 22 -7.476 1.391 -14.752 1.00 0.00 C HETATM 679 C3B BAP A 22 -7.575 -0.038 -14.765 1.00 0.00 C HETATM 680 C5B BAP A 22 -8.641 -0.687 -14.061 1.00 0.00 C HETATM 681 C1' BAP A 22 -12.069 -2.689 -12.149 1.00 0.00 C HETATM 682 O1' BAP A 22 -12.185 -2.170 -10.816 1.00 0.00 O HETATM 683 C2' BAP A 22 -11.948 -4.230 -12.133 1.00 0.00 C HETATM 684 O2' BAP A 22 -13.111 -4.975 -11.699 1.00 0.00 O HETATM 685 C3' BAP A 22 -11.514 -4.657 -13.530 1.00 0.00 C HETATM 686 O3' BAP A 22 -12.334 -4.029 -14.530 1.00 0.00 O HETATM 687 C4' BAP A 22 -10.056 -4.238 -13.742 1.00 0.00 C HETATM 0 H4'2 BAP A 22 -9.782 -4.412 -14.783 1.00 0.00 H new HETATM 0 HO3 BAP A 22 -12.282 -4.541 -15.364 1.00 0.00 H new HETATM 0 HO2 BAP A 22 -12.916 -5.935 -11.732 1.00 0.00 H new HETATM 0 HO1 BAP A 22 -12.985 -2.542 -10.389 1.00 0.00 H new HETATM 0 H9 BAP A 22 -10.225 2.124 -12.781 1.00 0.00 H new HETATM 0 H8 BAP A 22 -11.409 0.034 -12.094 1.00 0.00 H new HETATM 0 H5 BAP A 22 -7.852 -3.961 -14.843 1.00 0.00 H new HETATM 0 H4 BAP A 22 -5.987 -2.858 -16.041 1.00 0.00 H new HETATM 0 H3' BAP A 22 -11.620 -5.738 -13.620 1.00 0.00 H new HETATM 0 H3 BAP A 22 -4.830 -0.777 -16.757 1.00 0.00 H new HETATM 0 H2' BAP A 22 -11.216 -4.478 -11.364 1.00 0.00 H new HETATM 0 H2 BAP A 22 -4.643 1.738 -16.732 1.00 0.00 H new HETATM 0 H10 BAP A 22 -8.361 3.252 -14.024 1.00 0.00 H new HETATM 0 H1' BAP A 22 -12.934 -2.488 -12.781 1.00 0.00 H new HETATM 0 H1 BAP A 22 -6.334 3.123 -15.445 1.00 0.00 H new