USER MOD reduce.3.24.130724 H: found=0, std=0, add=184, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 184 hydrogens (0 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 DA O5' : rot 180:sc= -0.0202 USER MOD Single : A 2 DT C7 :methyl -30:sc= -0.911 (180deg=-1.51!) USER MOD Single : A 5 DT C7 :methyl 150:sc= -0.579 (180deg=-0.579) USER MOD Single : A 8 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 9 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 16 DT C7 :methyl -30:sc= -0.881 (180deg=-2.14) USER MOD Single : A 16 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 7.530 1.182 2.606 1.00 0.00 O ATOM 2 C5' DA A 1 8.836 1.519 2.120 1.00 0.00 C ATOM 3 C4' DA A 1 9.269 2.913 2.549 1.00 0.00 C ATOM 4 O4' DA A 1 8.618 3.924 1.739 1.00 0.00 O ATOM 5 C3' DA A 1 8.885 3.172 4.000 1.00 0.00 C ATOM 6 O3' DA A 1 9.953 3.798 4.721 1.00 0.00 O ATOM 7 C2' DA A 1 7.703 4.078 3.916 1.00 0.00 C ATOM 8 C1' DA A 1 7.810 4.775 2.583 1.00 0.00 C ATOM 9 N9 DA A 1 6.478 5.002 1.991 1.00 0.00 N ATOM 10 C8 DA A 1 5.526 4.107 1.631 1.00 0.00 C ATOM 11 N7 DA A 1 4.443 4.569 1.102 1.00 0.00 N ATOM 12 C5 DA A 1 4.692 5.946 1.105 1.00 0.00 C ATOM 13 C6 DA A 1 3.939 7.045 0.674 1.00 0.00 C ATOM 14 N6 DA A 1 2.732 6.925 0.120 1.00 0.00 N ATOM 15 N1 DA A 1 4.484 8.267 0.827 1.00 0.00 N ATOM 16 C2 DA A 1 5.697 8.402 1.370 1.00 0.00 C ATOM 17 N3 DA A 1 6.494 7.430 1.810 1.00 0.00 N ATOM 18 C4 DA A 1 5.926 6.218 1.645 1.00 0.00 C ATOM 0 H5' DA A 1 8.844 1.457 1.032 1.00 0.00 H new ATOM 0 H5'' DA A 1 9.557 0.788 2.486 1.00 0.00 H new ATOM 0 H4' DA A 1 10.351 2.967 2.426 1.00 0.00 H new ATOM 0 H3' DA A 1 8.668 2.247 4.535 1.00 0.00 H new ATOM 0 H2' DA A 1 6.773 3.514 3.988 1.00 0.00 H new ATOM 0 H2'' DA A 1 7.704 4.798 4.734 1.00 0.00 H new ATOM 0 HO5' DA A 1 7.292 0.280 2.306 1.00 0.00 H new ATOM 0 H1' DA A 1 8.265 5.759 2.694 1.00 0.00 H new ATOM 0 H8 DA A 1 5.668 3.047 1.781 1.00 0.00 H new ATOM 0 H61 DA A 1 2.223 7.757 -0.178 1.00 0.00 H new ATOM 0 H62 DA A 1 2.318 6.001 -0.006 1.00 0.00 H new ATOM 0 H2 DA A 1 6.073 9.410 1.462 1.00 0.00 H new ATOM 31 P DT A 2 9.776 4.184 6.272 1.00 0.00 P ATOM 32 OP1 DT A 2 11.112 4.202 6.919 1.00 0.00 O ATOM 33 OP2 DT A 2 8.697 3.346 6.857 1.00 0.00 O ATOM 34 O5' DT A 2 9.245 5.695 6.131 1.00 0.00 O ATOM 35 C5' DT A 2 9.913 6.616 5.258 1.00 0.00 C ATOM 36 C4' DT A 2 9.363 8.032 5.351 1.00 0.00 C ATOM 37 O4' DT A 2 8.165 8.194 4.545 1.00 0.00 O ATOM 38 C3' DT A 2 8.995 8.397 6.782 1.00 0.00 C ATOM 39 O3' DT A 2 9.570 9.656 7.145 1.00 0.00 O ATOM 40 C2' DT A 2 7.504 8.474 6.794 1.00 0.00 C ATOM 41 C1' DT A 2 7.099 8.731 5.365 1.00 0.00 C ATOM 42 N1 DT A 2 5.795 8.114 5.038 1.00 0.00 N ATOM 43 C2 DT A 2 4.814 8.942 4.538 1.00 0.00 C ATOM 44 O2 DT A 2 4.981 10.154 4.410 1.00 0.00 O ATOM 45 N3 DT A 2 3.628 8.334 4.193 1.00 0.00 N ATOM 46 C4 DT A 2 3.336 6.987 4.301 1.00 0.00 C ATOM 47 O4 DT A 2 2.240 6.552 3.954 1.00 0.00 O ATOM 48 C5 DT A 2 4.420 6.197 4.837 1.00 0.00 C ATOM 49 C7 DT A 2 4.250 4.689 4.987 1.00 0.00 C ATOM 50 C6 DT A 2 5.588 6.770 5.186 1.00 0.00 C ATOM 0 H5' DT A 2 9.822 6.264 4.230 1.00 0.00 H new ATOM 0 H5'' DT A 2 10.976 6.629 5.498 1.00 0.00 H new ATOM 0 H4' DT A 2 10.157 8.684 4.986 1.00 0.00 H new ATOM 0 H3' DT A 2 9.370 7.666 7.499 1.00 0.00 H new ATOM 0 H2' DT A 2 7.067 7.547 7.164 1.00 0.00 H new ATOM 0 H2'' DT A 2 7.158 9.274 7.449 1.00 0.00 H new ATOM 0 H1' DT A 2 6.962 9.797 5.186 1.00 0.00 H new ATOM 0 H3 DT A 2 2.893 8.936 3.822 1.00 0.00 H new ATOM 0 H71 DT A 2 3.200 4.457 5.167 1.00 0.00 H new ATOM 0 H72 DT A 2 4.580 4.193 4.074 1.00 0.00 H new ATOM 0 H73 DT A 2 4.849 4.337 5.827 1.00 0.00 H new ATOM 0 H6 DT A 2 6.378 6.155 5.591 1.00 0.00 H new ATOM 63 P DC A 3 9.272 10.316 8.578 1.00 0.00 P ATOM 64 OP1 DC A 3 10.456 11.104 9.003 1.00 0.00 O ATOM 65 OP2 DC A 3 8.724 9.275 9.485 1.00 0.00 O ATOM 66 O5' DC A 3 8.091 11.326 8.163 1.00 0.00 O ATOM 67 C5' DC A 3 8.211 12.112 6.966 1.00 0.00 C ATOM 68 C4' DC A 3 7.122 13.170 6.831 1.00 0.00 C ATOM 69 O4' DC A 3 5.930 12.628 6.203 1.00 0.00 O ATOM 70 C3' DC A 3 6.716 13.719 8.189 1.00 0.00 C ATOM 71 O3' DC A 3 6.703 15.151 8.184 1.00 0.00 O ATOM 72 C2' DC A 3 5.343 13.176 8.424 1.00 0.00 C ATOM 73 C1' DC A 3 4.786 12.839 7.063 1.00 0.00 C ATOM 74 N1 DC A 3 3.933 11.632 7.114 1.00 0.00 N ATOM 75 C2 DC A 3 2.628 11.739 6.659 1.00 0.00 C ATOM 76 O2 DC A 3 2.188 12.819 6.275 1.00 0.00 O ATOM 77 N3 DC A 3 1.858 10.618 6.659 1.00 0.00 N ATOM 78 C4 DC A 3 2.342 9.445 7.088 1.00 0.00 C ATOM 79 N4 DC A 3 1.565 8.359 7.055 1.00 0.00 N ATOM 80 C5 DC A 3 3.682 9.336 7.562 1.00 0.00 C ATOM 81 C6 DC A 3 4.436 10.448 7.559 1.00 0.00 C ATOM 0 H5' DC A 3 8.176 11.451 6.100 1.00 0.00 H new ATOM 0 H5'' DC A 3 9.186 12.600 6.955 1.00 0.00 H new ATOM 0 H4' DC A 3 7.542 13.964 6.213 1.00 0.00 H new ATOM 0 H3' DC A 3 7.415 13.427 8.972 1.00 0.00 H new ATOM 0 H2' DC A 3 5.378 12.292 9.060 1.00 0.00 H new ATOM 0 H2'' DC A 3 4.716 13.909 8.931 1.00 0.00 H new ATOM 0 H1' DC A 3 4.151 13.643 6.691 1.00 0.00 H new ATOM 0 H41 DC A 3 1.927 7.463 7.380 1.00 0.00 H new ATOM 0 H42 DC A 3 0.609 8.426 6.705 1.00 0.00 H new ATOM 0 H5 DC A 3 4.077 8.393 7.911 1.00 0.00 H new ATOM 0 H6 DC A 3 5.455 10.402 7.914 1.00 0.00 H new ATOM 93 P DC A 4 6.365 15.971 9.522 1.00 0.00 P ATOM 94 OP1 DC A 4 6.984 17.318 9.430 1.00 0.00 O ATOM 95 OP2 DC A 4 6.660 15.116 10.699 1.00 0.00 O ATOM 96 O5' DC A 4 4.774 16.119 9.373 1.00 0.00 O ATOM 97 C5' DC A 4 4.214 16.894 8.305 1.00 0.00 C ATOM 98 C4' DC A 4 2.718 17.114 8.462 1.00 0.00 C ATOM 99 O4' DC A 4 1.975 15.904 8.162 1.00 0.00 O ATOM 100 C3' DC A 4 2.366 17.529 9.887 1.00 0.00 C ATOM 101 O3' DC A 4 1.581 18.723 9.910 1.00 0.00 O ATOM 102 C2' DC A 4 1.602 16.371 10.449 1.00 0.00 C ATOM 103 C1' DC A 4 1.091 15.590 9.261 1.00 0.00 C ATOM 104 N1 DC A 4 1.070 14.132 9.532 1.00 0.00 N ATOM 105 C2 DC A 4 -0.113 13.453 9.290 1.00 0.00 C ATOM 106 O2 DC A 4 -1.103 14.059 8.886 1.00 0.00 O ATOM 107 N3 DC A 4 -0.142 12.112 9.510 1.00 0.00 N ATOM 108 C4 DC A 4 0.943 11.457 9.949 1.00 0.00 C ATOM 109 N4 DC A 4 0.891 10.135 10.137 1.00 0.00 N ATOM 110 C5 DC A 4 2.161 12.151 10.202 1.00 0.00 C ATOM 111 C6 DC A 4 2.183 13.479 9.982 1.00 0.00 C ATOM 0 H5' DC A 4 4.406 16.391 7.357 1.00 0.00 H new ATOM 0 H5'' DC A 4 4.717 17.860 8.260 1.00 0.00 H new ATOM 0 H4' DC A 4 2.448 17.905 7.763 1.00 0.00 H new ATOM 0 H3' DC A 4 3.258 17.755 10.471 1.00 0.00 H new ATOM 0 H2' DC A 4 2.241 15.751 11.078 1.00 0.00 H new ATOM 0 H2'' DC A 4 0.777 16.714 11.074 1.00 0.00 H new ATOM 0 H1' DC A 4 0.061 15.864 9.032 1.00 0.00 H new ATOM 0 H41 DC A 4 1.715 9.635 10.471 1.00 0.00 H new ATOM 0 H42 DC A 4 0.028 9.626 9.947 1.00 0.00 H new ATOM 0 H5 DC A 4 3.037 11.630 10.558 1.00 0.00 H new ATOM 0 H6 DC A 4 3.091 14.035 10.163 1.00 0.00 H new ATOM 123 P DT A 5 1.170 19.384 11.315 1.00 0.00 P ATOM 124 OP1 DT A 5 1.052 20.854 11.143 1.00 0.00 O ATOM 125 OP2 DT A 5 2.061 18.845 12.375 1.00 0.00 O ATOM 126 O5' DT A 5 -0.296 18.759 11.500 1.00 0.00 O ATOM 127 C5' DT A 5 -1.385 19.229 10.697 1.00 0.00 C ATOM 128 C4' DT A 5 -2.662 18.434 10.918 1.00 0.00 C ATOM 129 O4' DT A 5 -2.422 17.007 10.810 1.00 0.00 O ATOM 130 C3' DT A 5 -3.243 18.700 12.301 1.00 0.00 C ATOM 131 O3' DT A 5 -4.624 19.065 12.219 1.00 0.00 O ATOM 132 C2' DT A 5 -3.069 17.411 13.045 1.00 0.00 C ATOM 133 C1' DT A 5 -2.921 16.343 11.992 1.00 0.00 C ATOM 134 N1 DT A 5 -2.006 15.263 12.428 1.00 0.00 N ATOM 135 C2 DT A 5 -2.490 13.968 12.384 1.00 0.00 C ATOM 136 O2 DT A 5 -3.642 13.713 12.039 1.00 0.00 O ATOM 137 N3 DT A 5 -1.605 12.975 12.762 1.00 0.00 N ATOM 138 C4 DT A 5 -0.302 13.155 13.174 1.00 0.00 C ATOM 139 O4 DT A 5 0.395 12.186 13.475 1.00 0.00 O ATOM 140 C5 DT A 5 0.120 14.541 13.195 1.00 0.00 C ATOM 141 C7 DT A 5 1.536 14.895 13.643 1.00 0.00 C ATOM 142 C6 DT A 5 -0.722 15.531 12.830 1.00 0.00 C ATOM 0 H5' DT A 5 -1.105 19.175 9.645 1.00 0.00 H new ATOM 0 H5'' DT A 5 -1.572 20.279 10.923 1.00 0.00 H new ATOM 0 H4' DT A 5 -3.362 18.755 10.146 1.00 0.00 H new ATOM 0 H3' DT A 5 -2.745 19.531 12.800 1.00 0.00 H new ATOM 0 H2' DT A 5 -2.191 17.448 13.690 1.00 0.00 H new ATOM 0 H2'' DT A 5 -3.928 17.211 13.686 1.00 0.00 H new ATOM 0 H1' DT A 5 -3.878 15.857 11.799 1.00 0.00 H new ATOM 0 H3 DT A 5 -1.950 12.016 12.733 1.00 0.00 H new ATOM 0 H71 DT A 5 1.864 15.799 13.130 1.00 0.00 H new ATOM 0 H72 DT A 5 1.545 15.065 14.720 1.00 0.00 H new ATOM 0 H73 DT A 5 2.211 14.074 13.399 1.00 0.00 H new ATOM 0 H6 DT A 5 -0.378 16.554 12.855 1.00 0.00 H new ATOM 155 P DA A 6 -5.274 20.043 13.316 1.00 0.00 P ATOM 156 OP1 DA A 6 -6.197 20.985 12.635 1.00 0.00 O ATOM 157 OP2 DA A 6 -4.196 20.582 14.182 1.00 0.00 O ATOM 158 O5' DA A 6 -6.138 18.984 14.158 1.00 0.00 O ATOM 159 C5' DA A 6 -7.288 18.364 13.570 1.00 0.00 C ATOM 160 C4' DA A 6 -7.785 17.174 14.375 1.00 0.00 C ATOM 161 O4' DA A 6 -6.857 16.062 14.277 1.00 0.00 O ATOM 162 C3' DA A 6 -7.929 17.529 15.853 1.00 0.00 C ATOM 163 O3' DA A 6 -9.212 17.134 16.364 1.00 0.00 O ATOM 164 C2' DA A 6 -6.831 16.770 16.528 1.00 0.00 C ATOM 165 C1' DA A 6 -6.496 15.630 15.603 1.00 0.00 C ATOM 166 N9 DA A 6 -5.073 15.249 15.707 1.00 0.00 N ATOM 167 C8 DA A 6 -3.958 16.015 15.850 1.00 0.00 C ATOM 168 N7 DA A 6 -2.835 15.403 16.034 1.00 0.00 N ATOM 169 C5 DA A 6 -3.239 14.064 16.008 1.00 0.00 C ATOM 170 C6 DA A 6 -2.544 12.858 16.148 1.00 0.00 C ATOM 171 N6 DA A 6 -1.234 12.787 16.384 1.00 0.00 N ATOM 172 N1 DA A 6 -3.258 11.724 16.063 1.00 0.00 N ATOM 173 C2 DA A 6 -4.575 11.767 15.859 1.00 0.00 C ATOM 174 N3 DA A 6 -5.328 12.846 15.719 1.00 0.00 N ATOM 175 C4 DA A 6 -4.595 13.968 15.804 1.00 0.00 C ATOM 0 H5' DA A 6 -7.044 18.038 12.559 1.00 0.00 H new ATOM 0 H5'' DA A 6 -8.088 19.099 13.483 1.00 0.00 H new ATOM 0 H4' DA A 6 -8.755 16.897 13.962 1.00 0.00 H new ATOM 0 H3' DA A 6 -7.860 18.603 16.023 1.00 0.00 H new ATOM 0 H2' DA A 6 -5.962 17.406 16.697 1.00 0.00 H new ATOM 0 H2'' DA A 6 -7.151 16.402 17.503 1.00 0.00 H new ATOM 0 H1' DA A 6 -7.049 14.729 15.869 1.00 0.00 H new ATOM 0 H8 DA A 6 -4.009 17.093 15.811 1.00 0.00 H new ATOM 0 H61 DA A 6 -0.781 11.878 16.477 1.00 0.00 H new ATOM 0 H62 DA A 6 -0.685 13.642 16.472 1.00 0.00 H new ATOM 0 H2 DA A 6 -5.083 10.816 15.802 1.00 0.00 H new ATOM 187 P DG A 7 -9.935 17.994 17.516 1.00 0.00 P ATOM 188 OP1 DG A 7 -11.299 18.363 17.057 1.00 0.00 O ATOM 189 OP2 DG A 7 -9.010 19.064 17.971 1.00 0.00 O ATOM 190 O5' DG A 7 -10.060 16.886 18.677 1.00 0.00 O ATOM 191 C5' DG A 7 -10.357 15.520 18.357 1.00 0.00 C ATOM 192 C4' DG A 7 -9.767 14.535 19.369 1.00 0.00 C ATOM 193 O4' DG A 7 -8.343 14.372 19.144 1.00 0.00 O ATOM 194 C3' DG A 7 -9.943 14.992 20.825 1.00 0.00 C ATOM 195 O3' DG A 7 -10.439 13.927 21.642 1.00 0.00 O ATOM 196 C2' DG A 7 -8.576 15.395 21.270 1.00 0.00 C ATOM 197 C1' DG A 7 -7.614 14.674 20.356 1.00 0.00 C ATOM 198 N9 DG A 7 -6.424 15.499 20.069 1.00 0.00 N ATOM 199 C8 DG A 7 -6.333 16.818 19.761 1.00 0.00 C ATOM 200 N7 DG A 7 -5.154 17.303 19.557 1.00 0.00 N ATOM 201 C5 DG A 7 -4.344 16.180 19.746 1.00 0.00 C ATOM 202 C6 DG A 7 -2.932 16.053 19.660 1.00 0.00 C ATOM 203 O6 DG A 7 -2.103 16.922 19.400 1.00 0.00 O ATOM 204 N1 DG A 7 -2.521 14.752 19.921 1.00 0.00 N ATOM 205 C2 DG A 7 -3.360 13.699 20.227 1.00 0.00 C ATOM 206 N2 DG A 7 -2.775 12.522 20.439 1.00 0.00 N ATOM 207 N3 DG A 7 -4.691 13.811 20.312 1.00 0.00 N ATOM 208 C4 DG A 7 -5.115 15.070 20.061 1.00 0.00 C ATOM 0 H5' DG A 7 -9.969 15.291 17.364 1.00 0.00 H new ATOM 0 H5'' DG A 7 -11.438 15.388 18.315 1.00 0.00 H new ATOM 0 H4' DG A 7 -10.309 13.601 19.221 1.00 0.00 H new ATOM 0 H3' DG A 7 -10.664 15.806 20.908 1.00 0.00 H new ATOM 0 H2' DG A 7 -8.445 16.475 21.201 1.00 0.00 H new ATOM 0 H2'' DG A 7 -8.407 15.119 22.311 1.00 0.00 H new ATOM 0 H1' DG A 7 -7.245 13.763 20.827 1.00 0.00 H new ATOM 0 H8 DG A 7 -7.214 17.439 19.689 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.520 14.559 19.884 1.00 0.00 H new ATOM 0 H21 DG A 7 -3.341 11.705 20.669 1.00 0.00 H new ATOM 0 H22 DG A 7 -1.761 12.437 20.371 1.00 0.00 H new ATOM 220 P DT A 8 -10.673 14.153 23.214 1.00 0.00 P ATOM 221 OP1 DT A 8 -11.890 13.410 23.632 1.00 0.00 O ATOM 222 OP2 DT A 8 -10.568 15.604 23.513 1.00 0.00 O ATOM 223 O5' DT A 8 -9.377 13.404 23.801 1.00 0.00 O ATOM 224 C5' DT A 8 -9.318 11.970 23.807 1.00 0.00 C ATOM 225 C4' DT A 8 -7.891 11.429 23.844 1.00 0.00 C ATOM 226 O4' DT A 8 -6.971 12.322 23.165 1.00 0.00 O ATOM 227 C3' DT A 8 -7.384 11.253 25.273 1.00 0.00 C ATOM 228 O3' DT A 8 -6.841 9.940 25.466 1.00 0.00 O ATOM 229 C2' DT A 8 -6.322 12.295 25.429 1.00 0.00 C ATOM 230 C1' DT A 8 -5.853 12.616 24.031 1.00 0.00 C ATOM 231 N1 DT A 8 -5.437 14.030 23.913 1.00 0.00 N ATOM 232 C2 DT A 8 -4.156 14.276 23.456 1.00 0.00 C ATOM 233 O2 DT A 8 -3.384 13.371 23.151 1.00 0.00 O ATOM 234 N3 DT A 8 -3.792 15.607 23.356 1.00 0.00 N ATOM 235 C4 DT A 8 -4.586 16.695 23.670 1.00 0.00 C ATOM 236 O4 DT A 8 -4.158 17.840 23.546 1.00 0.00 O ATOM 237 C5 DT A 8 -5.908 16.342 24.139 1.00 0.00 C ATOM 238 C7 DT A 8 -6.889 17.446 24.521 1.00 0.00 C ATOM 239 C6 DT A 8 -6.288 15.052 24.244 1.00 0.00 C ATOM 0 H5' DT A 8 -9.822 11.588 22.919 1.00 0.00 H new ATOM 0 H5'' DT A 8 -9.865 11.593 24.671 1.00 0.00 H new ATOM 0 H4' DT A 8 -7.927 10.462 23.342 1.00 0.00 H new ATOM 0 H3' DT A 8 -8.181 11.362 26.008 1.00 0.00 H new ATOM 0 H2' DT A 8 -6.715 13.183 25.923 1.00 0.00 H new ATOM 0 H2'' DT A 8 -5.500 11.927 26.042 1.00 0.00 H new ATOM 0 H1' DT A 8 -4.976 12.027 23.762 1.00 0.00 H new ATOM 0 H3 DT A 8 -2.850 15.804 23.019 1.00 0.00 H new ATOM 0 H71 DT A 8 -7.908 17.108 24.335 1.00 0.00 H new ATOM 0 H72 DT A 8 -6.774 17.685 25.578 1.00 0.00 H new ATOM 0 H73 DT A 8 -6.687 18.335 23.924 1.00 0.00 H new ATOM 0 H6 DT A 8 -7.282 14.820 24.596 1.00 0.00 H new ATOM 252 P DT A 9 -6.493 9.401 26.941 1.00 0.00 P ATOM 253 OP1 DT A 9 -6.336 7.924 26.891 1.00 0.00 O ATOM 254 OP2 DT A 9 -7.453 9.994 27.906 1.00 0.00 O ATOM 255 O5' DT A 9 -5.049 10.071 27.162 1.00 0.00 O ATOM 256 C5' DT A 9 -3.862 9.454 26.644 1.00 0.00 C ATOM 257 C4' DT A 9 -3.156 10.320 25.604 1.00 0.00 C ATOM 258 O4' DT A 9 -3.319 11.733 25.893 1.00 0.00 O ATOM 259 C3' DT A 9 -1.663 10.036 25.581 1.00 0.00 C ATOM 260 O3' DT A 9 -1.198 9.873 24.242 1.00 0.00 O ATOM 261 C2' DT A 9 -1.034 11.231 26.222 1.00 0.00 C ATOM 262 C1' DT A 9 -2.023 12.354 26.049 1.00 0.00 C ATOM 263 N1 DT A 9 -2.000 13.261 27.211 1.00 0.00 N ATOM 264 C2 DT A 9 -1.692 14.589 26.980 1.00 0.00 C ATOM 265 O2 DT A 9 -1.450 15.018 25.855 1.00 0.00 O ATOM 266 N3 DT A 9 -1.670 15.409 28.093 1.00 0.00 N ATOM 267 C4 DT A 9 -1.925 15.020 29.396 1.00 0.00 C ATOM 268 O4 DT A 9 -1.877 15.834 30.315 1.00 0.00 O ATOM 269 C5 DT A 9 -2.236 13.616 29.539 1.00 0.00 C ATOM 270 C7 DT A 9 -2.528 13.051 30.924 1.00 0.00 C ATOM 271 C6 DT A 9 -2.265 12.797 28.469 1.00 0.00 C ATOM 0 H5' DT A 9 -4.121 8.494 26.197 1.00 0.00 H new ATOM 0 H5'' DT A 9 -3.176 9.248 27.466 1.00 0.00 H new ATOM 0 H4' DT A 9 -3.609 10.076 24.643 1.00 0.00 H new ATOM 0 H3' DT A 9 -1.414 9.113 26.104 1.00 0.00 H new ATOM 0 H2' DT A 9 -0.830 11.048 27.277 1.00 0.00 H new ATOM 0 H2'' DT A 9 -0.081 11.472 25.751 1.00 0.00 H new ATOM 0 H1' DT A 9 -1.778 12.965 25.181 1.00 0.00 H new ATOM 0 H3 DT A 9 -1.445 16.392 27.939 1.00 0.00 H new ATOM 0 H71 DT A 9 -3.221 12.214 30.837 1.00 0.00 H new ATOM 0 H72 DT A 9 -1.599 12.708 31.380 1.00 0.00 H new ATOM 0 H73 DT A 9 -2.973 13.827 31.547 1.00 0.00 H new ATOM 0 H6 DT A 9 -2.502 11.753 28.608 1.00 0.00 H new ATOM 284 P DA A 10 -0.285 8.617 23.865 1.00 0.00 P ATOM 285 OP1 DA A 10 0.583 8.292 25.025 1.00 0.00 O ATOM 286 OP2 DA A 10 0.339 8.852 22.538 1.00 0.00 O ATOM 287 O5' DA A 10 -1.414 7.484 23.727 1.00 0.00 O ATOM 288 C5' DA A 10 -1.047 6.113 23.872 1.00 0.00 C ATOM 289 C4' DA A 10 -1.753 5.201 22.874 1.00 0.00 C ATOM 290 O4' DA A 10 -3.003 5.790 22.443 1.00 0.00 O ATOM 291 C3' DA A 10 -0.878 5.025 21.643 1.00 0.00 C ATOM 292 O3' DA A 10 -1.086 3.744 21.036 1.00 0.00 O ATOM 293 C2' DA A 10 -1.354 6.124 20.751 1.00 0.00 C ATOM 294 C1' DA A 10 -2.812 6.321 21.125 1.00 0.00 C ATOM 295 N9 DA A 10 -3.283 7.715 21.078 1.00 0.00 N ATOM 296 C8 DA A 10 -2.593 8.868 21.193 1.00 0.00 C ATOM 297 N7 DA A 10 -3.263 9.966 21.269 1.00 0.00 N ATOM 298 C5 DA A 10 -4.572 9.499 21.218 1.00 0.00 C ATOM 299 C6 DA A 10 -5.808 10.146 21.254 1.00 0.00 C ATOM 300 N6 DA A 10 -5.930 11.470 21.321 1.00 0.00 N ATOM 301 N1 DA A 10 -6.911 9.381 21.184 1.00 0.00 N ATOM 302 C2 DA A 10 -6.806 8.055 21.082 1.00 0.00 C ATOM 303 N3 DA A 10 -5.684 7.341 21.037 1.00 0.00 N ATOM 304 C4 DA A 10 -4.597 8.131 21.110 1.00 0.00 C ATOM 0 H5' DA A 10 -1.281 5.785 24.885 1.00 0.00 H new ATOM 0 H5'' DA A 10 0.031 6.015 23.746 1.00 0.00 H new ATOM 0 H4' DA A 10 -1.941 4.244 23.361 1.00 0.00 H new ATOM 0 H3' DA A 10 0.189 5.069 21.860 1.00 0.00 H new ATOM 0 H2' DA A 10 -0.779 7.037 20.906 1.00 0.00 H new ATOM 0 H2'' DA A 10 -1.248 5.855 19.700 1.00 0.00 H new ATOM 0 H1' DA A 10 -3.406 5.798 20.375 1.00 0.00 H new ATOM 0 H8 DA A 10 -1.513 8.871 21.221 1.00 0.00 H new ATOM 0 H61 DA A 10 -6.856 11.896 21.345 1.00 0.00 H new ATOM 0 H62 DA A 10 -5.097 12.058 21.348 1.00 0.00 H new ATOM 0 H2 DA A 10 -7.732 7.501 21.030 1.00 0.00 H new ATOM 316 P DT A 11 -0.277 3.325 19.713 1.00 0.00 P ATOM 317 OP1 DT A 11 0.234 1.941 19.883 1.00 0.00 O ATOM 318 OP2 DT A 11 0.671 4.412 19.362 1.00 0.00 O ATOM 319 O5' DT A 11 -1.474 3.313 18.643 1.00 0.00 O ATOM 320 C5' DT A 11 -2.755 2.781 19.003 1.00 0.00 C ATOM 321 C4' DT A 11 -3.867 3.245 18.075 1.00 0.00 C ATOM 322 O4' DT A 11 -3.955 4.691 18.043 1.00 0.00 O ATOM 323 C3' DT A 11 -3.634 2.767 16.648 1.00 0.00 C ATOM 324 O3' DT A 11 -4.806 2.136 16.125 1.00 0.00 O ATOM 325 C2' DT A 11 -3.296 4.006 15.876 1.00 0.00 C ATOM 326 C1' DT A 11 -3.871 5.151 16.676 1.00 0.00 C ATOM 327 N1 DT A 11 -3.045 6.375 16.579 1.00 0.00 N ATOM 328 C2 DT A 11 -3.697 7.541 16.231 1.00 0.00 C ATOM 329 O2 DT A 11 -4.896 7.567 15.969 1.00 0.00 O ATOM 330 N3 DT A 11 -2.922 8.681 16.193 1.00 0.00 N ATOM 331 C4 DT A 11 -1.569 8.761 16.470 1.00 0.00 C ATOM 332 O4 DT A 11 -0.984 9.843 16.430 1.00 0.00 O ATOM 333 C5 DT A 11 -0.967 7.496 16.817 1.00 0.00 C ATOM 334 C7 DT A 11 0.524 7.438 17.130 1.00 0.00 C ATOM 335 C6 DT A 11 -1.701 6.365 16.862 1.00 0.00 C ATOM 0 H5' DT A 11 -2.993 3.078 20.024 1.00 0.00 H new ATOM 0 H5'' DT A 11 -2.708 1.692 18.990 1.00 0.00 H new ATOM 0 H4' DT A 11 -4.791 2.820 18.467 1.00 0.00 H new ATOM 0 H3' DT A 11 -2.840 2.023 16.588 1.00 0.00 H new ATOM 0 H2' DT A 11 -2.218 4.113 15.758 1.00 0.00 H new ATOM 0 H2'' DT A 11 -3.725 3.973 14.874 1.00 0.00 H new ATOM 0 H1' DT A 11 -4.850 5.428 16.286 1.00 0.00 H new ATOM 0 H3 DT A 11 -3.392 9.549 15.936 1.00 0.00 H new ATOM 0 H71 DT A 11 0.715 6.636 17.843 1.00 0.00 H new ATOM 0 H72 DT A 11 1.081 7.248 16.213 1.00 0.00 H new ATOM 0 H73 DT A 11 0.843 8.388 17.558 1.00 0.00 H new ATOM 0 H6 DT A 11 -1.222 5.433 17.126 1.00 0.00 H new ATOM 348 P DA A 12 -4.823 1.553 14.630 1.00 0.00 P ATOM 349 OP1 DA A 12 -5.746 0.392 14.579 1.00 0.00 O ATOM 350 OP2 DA A 12 -3.423 1.392 14.160 1.00 0.00 O ATOM 351 O5' DA A 12 -5.495 2.788 13.857 1.00 0.00 O ATOM 352 C5' DA A 12 -6.718 3.365 14.335 1.00 0.00 C ATOM 353 C4' DA A 12 -7.287 4.393 13.370 1.00 0.00 C ATOM 354 O4' DA A 12 -6.619 5.672 13.523 1.00 0.00 O ATOM 355 C3' DA A 12 -7.094 3.946 11.926 1.00 0.00 C ATOM 356 O3' DA A 12 -8.296 4.119 11.167 1.00 0.00 O ATOM 357 C2' DA A 12 -6.003 4.825 11.404 1.00 0.00 C ATOM 358 C1' DA A 12 -6.024 6.060 12.266 1.00 0.00 C ATOM 359 N9 DA A 12 -4.670 6.619 12.461 1.00 0.00 N ATOM 360 C8 DA A 12 -3.502 6.003 12.772 1.00 0.00 C ATOM 361 N7 DA A 12 -2.457 6.750 12.933 1.00 0.00 N ATOM 362 C5 DA A 12 -2.985 8.026 12.699 1.00 0.00 C ATOM 363 C6 DA A 12 -2.421 9.309 12.706 1.00 0.00 C ATOM 364 N6 DA A 12 -1.137 9.553 12.984 1.00 0.00 N ATOM 365 N1 DA A 12 -3.236 10.340 12.429 1.00 0.00 N ATOM 366 C2 DA A 12 -4.522 10.135 12.163 1.00 0.00 C ATOM 367 N3 DA A 12 -5.160 8.971 12.132 1.00 0.00 N ATOM 368 C4 DA A 12 -4.328 7.950 12.410 1.00 0.00 C ATOM 0 H5' DA A 12 -6.541 3.836 15.302 1.00 0.00 H new ATOM 0 H5'' DA A 12 -7.452 2.575 14.495 1.00 0.00 H new ATOM 0 H4' DA A 12 -8.348 4.490 13.599 1.00 0.00 H new ATOM 0 H3' DA A 12 -6.844 2.887 11.854 1.00 0.00 H new ATOM 0 H2' DA A 12 -5.036 4.325 11.461 1.00 0.00 H new ATOM 0 H2'' DA A 12 -6.170 5.076 10.357 1.00 0.00 H new ATOM 0 H1' DA A 12 -6.601 6.851 11.787 1.00 0.00 H new ATOM 0 H8 DA A 12 -3.446 4.930 12.881 1.00 0.00 H new ATOM 0 H61 DA A 12 -0.786 10.511 12.973 1.00 0.00 H new ATOM 0 H62 DA A 12 -0.508 8.782 13.207 1.00 0.00 H new ATOM 0 H2 DA A 12 -5.114 11.013 11.948 1.00 0.00 H new ATOM 380 P DG A 13 -8.341 3.728 9.608 1.00 0.00 P ATOM 381 OP1 DG A 13 -9.652 3.096 9.307 1.00 0.00 O ATOM 382 OP2 DG A 13 -7.092 3.008 9.254 1.00 0.00 O ATOM 383 O5' DG A 13 -8.304 5.192 8.946 1.00 0.00 O ATOM 384 C5' DG A 13 -9.245 6.200 9.349 1.00 0.00 C ATOM 385 C4' DG A 13 -9.031 7.521 8.621 1.00 0.00 C ATOM 386 O4' DG A 13 -7.808 8.165 9.066 1.00 0.00 O ATOM 387 C3' DG A 13 -8.910 7.299 7.120 1.00 0.00 C ATOM 388 O3' DG A 13 -9.701 8.240 6.387 1.00 0.00 O ATOM 389 C2' DG A 13 -7.456 7.482 6.828 1.00 0.00 C ATOM 390 C1' DG A 13 -6.908 8.334 7.947 1.00 0.00 C ATOM 391 N9 DG A 13 -5.538 7.919 8.312 1.00 0.00 N ATOM 392 C8 DG A 13 -5.053 6.680 8.574 1.00 0.00 C ATOM 393 N7 DG A 13 -3.825 6.583 8.957 1.00 0.00 N ATOM 394 C5 DG A 13 -3.419 7.919 8.947 1.00 0.00 C ATOM 395 C6 DG A 13 -2.162 8.488 9.271 1.00 0.00 C ATOM 396 O6 DG A 13 -1.136 7.922 9.649 1.00 0.00 O ATOM 397 N1 DG A 13 -2.177 9.864 9.124 1.00 0.00 N ATOM 398 C2 DG A 13 -3.257 10.613 8.712 1.00 0.00 C ATOM 399 N2 DG A 13 -3.048 11.924 8.590 1.00 0.00 N ATOM 400 N3 DG A 13 -4.450 10.090 8.411 1.00 0.00 N ATOM 401 C4 DG A 13 -4.462 8.745 8.548 1.00 0.00 C ATOM 0 H5' DG A 13 -9.160 6.363 10.423 1.00 0.00 H new ATOM 0 H5'' DG A 13 -10.258 5.844 9.159 1.00 0.00 H new ATOM 0 H4' DG A 13 -9.893 8.150 8.844 1.00 0.00 H new ATOM 0 H3' DG A 13 -9.272 6.315 6.824 1.00 0.00 H new ATOM 0 H2' DG A 13 -6.944 6.521 6.783 1.00 0.00 H new ATOM 0 H2'' DG A 13 -7.310 7.966 5.862 1.00 0.00 H new ATOM 0 H1' DG A 13 -6.845 9.379 7.643 1.00 0.00 H new ATOM 0 H8 DG A 13 -5.674 5.803 8.466 1.00 0.00 H new ATOM 0 H1 DG A 13 -1.315 10.366 9.339 1.00 0.00 H new ATOM 0 H21 DG A 13 -3.807 12.536 8.289 1.00 0.00 H new ATOM 0 H22 DG A 13 -2.129 12.315 8.798 1.00 0.00 H new ATOM 413 P DG A 14 -9.730 8.196 4.781 1.00 0.00 P ATOM 414 OP1 DG A 14 -11.075 8.621 4.314 1.00 0.00 O ATOM 415 OP2 DG A 14 -9.183 6.893 4.322 1.00 0.00 O ATOM 416 O5' DG A 14 -8.670 9.354 4.443 1.00 0.00 O ATOM 417 C5' DG A 14 -9.024 10.732 4.619 1.00 0.00 C ATOM 418 C4' DG A 14 -7.938 11.686 4.137 1.00 0.00 C ATOM 419 O4' DG A 14 -6.703 11.500 4.881 1.00 0.00 O ATOM 420 C3' DG A 14 -7.619 11.463 2.664 1.00 0.00 C ATOM 421 O3' DG A 14 -7.614 12.700 1.946 1.00 0.00 O ATOM 422 C2' DG A 14 -6.262 10.834 2.655 1.00 0.00 C ATOM 423 C1' DG A 14 -5.619 11.221 3.962 1.00 0.00 C ATOM 424 N9 DG A 14 -4.752 10.139 4.464 1.00 0.00 N ATOM 425 C8 DG A 14 -5.009 8.814 4.583 1.00 0.00 C ATOM 426 N7 DG A 14 -4.072 8.062 5.046 1.00 0.00 N ATOM 427 C5 DG A 14 -3.050 8.986 5.265 1.00 0.00 C ATOM 428 C6 DG A 14 -1.742 8.786 5.768 1.00 0.00 C ATOM 429 O6 DG A 14 -1.215 7.736 6.131 1.00 0.00 O ATOM 430 N1 DG A 14 -1.036 9.977 5.829 1.00 0.00 N ATOM 431 C2 DG A 14 -1.518 11.212 5.456 1.00 0.00 C ATOM 432 N2 DG A 14 -0.679 12.240 5.599 1.00 0.00 N ATOM 433 N3 DG A 14 -2.750 11.412 4.980 1.00 0.00 N ATOM 434 C4 DG A 14 -3.459 10.262 4.911 1.00 0.00 C ATOM 0 H5' DG A 14 -9.224 10.919 5.674 1.00 0.00 H new ATOM 0 H5'' DG A 14 -9.948 10.937 4.078 1.00 0.00 H new ATOM 0 H4' DG A 14 -8.325 12.693 4.292 1.00 0.00 H new ATOM 0 H3' DG A 14 -8.365 10.835 2.176 1.00 0.00 H new ATOM 0 H2' DG A 14 -6.334 9.750 2.561 1.00 0.00 H new ATOM 0 H2'' DG A 14 -5.673 11.189 1.810 1.00 0.00 H new ATOM 0 H1' DG A 14 -4.977 12.094 3.844 1.00 0.00 H new ATOM 0 H8 DG A 14 -5.967 8.403 4.299 1.00 0.00 H new ATOM 0 H1 DG A 14 -0.079 9.935 6.180 1.00 0.00 H new ATOM 0 H21 DG A 14 -0.976 13.181 5.340 1.00 0.00 H new ATOM 0 H22 DG A 14 0.260 12.085 5.967 1.00 0.00 H new ATOM 446 P DA A 15 -7.272 12.731 0.378 1.00 0.00 P ATOM 447 OP1 DA A 15 -8.078 13.794 -0.272 1.00 0.00 O ATOM 448 OP2 DA A 15 -7.327 11.346 -0.154 1.00 0.00 O ATOM 449 O5' DA A 15 -5.738 13.206 0.445 1.00 0.00 O ATOM 450 C5' DA A 15 -5.361 14.277 1.320 1.00 0.00 C ATOM 451 C4' DA A 15 -3.881 14.624 1.234 1.00 0.00 C ATOM 452 O4' DA A 15 -3.077 13.696 2.012 1.00 0.00 O ATOM 453 C3' DA A 15 -3.382 14.562 -0.202 1.00 0.00 C ATOM 454 O3' DA A 15 -2.612 15.723 -0.529 1.00 0.00 O ATOM 455 C2' DA A 15 -2.528 13.338 -0.255 1.00 0.00 C ATOM 456 C1' DA A 15 -2.074 13.099 1.159 1.00 0.00 C ATOM 457 N9 DA A 15 -1.908 11.660 1.426 1.00 0.00 N ATOM 458 C8 DA A 15 -2.738 10.623 1.154 1.00 0.00 C ATOM 459 N7 DA A 15 -2.335 9.438 1.473 1.00 0.00 N ATOM 460 C5 DA A 15 -1.081 9.713 2.027 1.00 0.00 C ATOM 461 C6 DA A 15 -0.091 8.900 2.576 1.00 0.00 C ATOM 462 N6 DA A 15 -0.194 7.576 2.656 1.00 0.00 N ATOM 463 N1 DA A 15 1.017 9.500 3.030 1.00 0.00 N ATOM 464 C2 DA A 15 1.155 10.822 2.951 1.00 0.00 C ATOM 465 N3 DA A 15 0.286 11.688 2.450 1.00 0.00 N ATOM 466 C4 DA A 15 -0.819 11.062 2.003 1.00 0.00 C ATOM 0 H5' DA A 15 -5.605 14.003 2.346 1.00 0.00 H new ATOM 0 H5'' DA A 15 -5.950 15.161 1.077 1.00 0.00 H new ATOM 0 H4' DA A 15 -3.780 15.636 1.627 1.00 0.00 H new ATOM 0 H3' DA A 15 -4.204 14.528 -0.917 1.00 0.00 H new ATOM 0 H2' DA A 15 -3.089 12.485 -0.636 1.00 0.00 H new ATOM 0 H2'' DA A 15 -1.677 13.482 -0.921 1.00 0.00 H new ATOM 0 H1' DA A 15 -1.098 13.547 1.346 1.00 0.00 H new ATOM 0 H8 DA A 15 -3.699 10.782 0.688 1.00 0.00 H new ATOM 0 H61 DA A 15 0.562 7.030 3.068 1.00 0.00 H new ATOM 0 H62 DA A 15 -1.029 7.107 2.305 1.00 0.00 H new ATOM 0 H2 DA A 15 2.076 11.233 3.337 1.00 0.00 H new ATOM 478 P DT A 16 -1.939 15.875 -1.979 1.00 0.00 P ATOM 479 OP1 DT A 16 -2.089 17.281 -2.434 1.00 0.00 O ATOM 480 OP2 DT A 16 -2.420 14.775 -2.852 1.00 0.00 O ATOM 481 O5' DT A 16 -0.397 15.607 -1.603 1.00 0.00 O ATOM 482 C5' DT A 16 0.269 16.443 -0.645 1.00 0.00 C ATOM 483 C4' DT A 16 1.705 16.007 -0.369 1.00 0.00 C ATOM 484 O4' DT A 16 1.753 14.683 0.223 1.00 0.00 O ATOM 485 C3' DT A 16 2.529 15.968 -1.650 1.00 0.00 C ATOM 486 O3' DT A 16 3.758 16.690 -1.496 1.00 0.00 O ATOM 487 C2' DT A 16 2.786 14.512 -1.896 1.00 0.00 C ATOM 488 C1' DT A 16 2.626 13.834 -0.558 1.00 0.00 C ATOM 489 N1 DT A 16 2.060 12.476 -0.707 1.00 0.00 N ATOM 490 C2 DT A 16 2.803 11.419 -0.211 1.00 0.00 C ATOM 491 O2 DT A 16 3.891 11.581 0.333 1.00 0.00 O ATOM 492 N3 DT A 16 2.247 10.162 -0.369 1.00 0.00 N ATOM 493 C4 DT A 16 1.036 9.877 -0.974 1.00 0.00 C ATOM 494 O4 DT A 16 0.647 8.715 -1.075 1.00 0.00 O ATOM 495 C5 DT A 16 0.332 11.043 -1.457 1.00 0.00 C ATOM 496 C7 DT A 16 -1.029 10.876 -2.127 1.00 0.00 C ATOM 497 C6 DT A 16 0.853 12.279 -1.315 1.00 0.00 C ATOM 0 H5' DT A 16 -0.293 16.435 0.289 1.00 0.00 H new ATOM 0 H5'' DT A 16 0.271 17.471 -1.007 1.00 0.00 H new ATOM 0 H4' DT A 16 2.119 16.742 0.322 1.00 0.00 H new ATOM 0 H3' DT A 16 2.010 16.439 -2.485 1.00 0.00 H new ATOM 0 H2' DT A 16 2.083 14.109 -2.625 1.00 0.00 H new ATOM 0 H2'' DT A 16 3.787 14.354 -2.297 1.00 0.00 H new ATOM 0 HO3' DT A 16 4.269 16.648 -2.331 1.00 0.00 H new ATOM 0 H1' DT A 16 3.591 13.705 -0.067 1.00 0.00 H new ATOM 0 H3 DT A 16 2.780 9.372 -0.006 1.00 0.00 H new ATOM 0 H71 DT A 16 -1.074 9.906 -2.622 1.00 0.00 H new ATOM 0 H72 DT A 16 -1.815 10.936 -1.374 1.00 0.00 H new ATOM 0 H73 DT A 16 -1.171 11.667 -2.864 1.00 0.00 H new ATOM 0 H6 DT A 16 0.304 13.130 -1.690 1.00 0.00 H new TER 511 DT A 16