USER MOD reduce.3.24.130724 H: found=0, std=0, add=243, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 263 hydrogens (20 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 15 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 15 DT O5' : rot -36:sc= 0.0226 USER MOD Single : A 18 DT C7 :methyl 150:sc= -0.0565 (180deg=-0.0565) USER MOD Single : A 22 DT C7 :methyl -30:sc= 0 (180deg=-0.0493) USER MOD Single : A 22 DT O3' : rot 180:sc= 0 USER MOD Single : B 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 1 DT O5' : rot -27:sc= 0.0168 USER MOD Single : B 4 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 7 DT C7 :methyl -30:sc=-0.00775 (180deg=-1.2) USER MOD Single : B 7 DT O3' : rot 180:sc= 0 USER MOD Single : C 8 DA O5' : rot -30:sc= 0.0103 USER MOD Single : C 14 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT B 1 1.846 11.398 11.008 1.00 0.00 O ATOM 2 C5' DT B 1 1.491 10.033 11.092 1.00 0.00 C ATOM 3 C4' DT B 1 -0.033 9.902 10.995 1.00 0.00 C ATOM 4 O4' DT B 1 -0.451 10.436 9.742 1.00 0.00 O ATOM 5 C3' DT B 1 -0.477 8.440 11.058 1.00 0.00 C ATOM 6 O3' DT B 1 -1.651 8.362 11.844 1.00 0.00 O ATOM 7 C2' DT B 1 -0.718 8.097 9.591 1.00 0.00 C ATOM 8 C1' DT B 1 -1.156 9.444 9.010 1.00 0.00 C ATOM 9 N1 DT B 1 -0.876 9.602 7.561 1.00 0.00 N ATOM 10 C2 DT B 1 -1.922 9.947 6.689 1.00 0.00 C ATOM 11 O2 DT B 1 -3.072 10.170 7.053 1.00 0.00 O ATOM 12 N3 DT B 1 -1.606 10.042 5.349 1.00 0.00 N ATOM 13 C4 DT B 1 -0.342 9.881 4.815 1.00 0.00 C ATOM 14 O4 DT B 1 -0.179 10.021 3.610 1.00 0.00 O ATOM 15 C5 DT B 1 0.698 9.560 5.782 1.00 0.00 C ATOM 16 C7 DT B 1 2.130 9.371 5.340 1.00 0.00 C ATOM 17 C6 DT B 1 0.408 9.437 7.098 1.00 0.00 C ATOM 0 H5' DT B 1 1.845 9.610 12.032 1.00 0.00 H new ATOM 0 H5'' DT B 1 1.968 9.471 10.289 1.00 0.00 H new ATOM 0 H4' DT B 1 -0.477 10.438 11.833 1.00 0.00 H new ATOM 0 H3' DT B 1 0.234 7.751 11.514 1.00 0.00 H new ATOM 0 H2' DT B 1 0.183 7.719 9.108 1.00 0.00 H new ATOM 0 H2'' DT B 1 -1.487 7.333 9.473 1.00 0.00 H new ATOM 0 HO5' DT B 1 1.166 11.882 10.494 1.00 0.00 H new ATOM 0 H1' DT B 1 -2.239 9.528 9.101 1.00 0.00 H new ATOM 0 H3 DT B 1 -2.366 10.248 4.701 1.00 0.00 H new ATOM 0 H71 DT B 1 2.802 9.664 6.147 1.00 0.00 H new ATOM 0 H72 DT B 1 2.299 8.323 5.091 1.00 0.00 H new ATOM 0 H73 DT B 1 2.325 9.989 4.463 1.00 0.00 H new ATOM 0 H6 DT B 1 1.199 9.205 7.796 1.00 0.00 H new ATOM 31 P DC B 2 -2.290 6.948 12.294 1.00 0.00 P ATOM 32 OP1 DC B 2 -3.021 7.110 13.567 1.00 0.00 O ATOM 33 OP2 DC B 2 -1.250 5.899 12.211 1.00 0.00 O ATOM 34 O5' DC B 2 -3.316 6.809 11.063 1.00 0.00 O ATOM 35 C5' DC B 2 -4.407 7.701 10.923 1.00 0.00 C ATOM 36 C4' DC B 2 -5.121 7.496 9.585 1.00 0.00 C ATOM 37 O4' DC B 2 -4.263 7.779 8.489 1.00 0.00 O ATOM 38 C3' DC B 2 -5.664 6.076 9.386 1.00 0.00 C ATOM 39 O3' DC B 2 -7.078 6.148 9.313 1.00 0.00 O ATOM 40 C2' DC B 2 -5.040 5.646 8.058 1.00 0.00 C ATOM 41 C1' DC B 2 -4.704 6.986 7.408 1.00 0.00 C ATOM 42 N1 DC B 2 -3.657 6.888 6.356 1.00 0.00 N ATOM 43 C2 DC B 2 -3.980 7.214 5.034 1.00 0.00 C ATOM 44 O2 DC B 2 -5.116 7.553 4.710 1.00 0.00 O ATOM 45 N3 DC B 2 -3.035 7.135 4.064 1.00 0.00 N ATOM 46 C4 DC B 2 -1.807 6.770 4.378 1.00 0.00 C ATOM 47 N4 DC B 2 -0.943 6.740 3.391 1.00 0.00 N ATOM 48 C5 DC B 2 -1.419 6.429 5.711 1.00 0.00 C ATOM 49 C6 DC B 2 -2.379 6.489 6.669 1.00 0.00 C ATOM 0 H5' DC B 2 -4.051 8.729 10.995 1.00 0.00 H new ATOM 0 H5'' DC B 2 -5.111 7.550 11.741 1.00 0.00 H new ATOM 0 H4' DC B 2 -5.960 8.191 9.617 1.00 0.00 H new ATOM 0 H3' DC B 2 -5.426 5.373 10.184 1.00 0.00 H new ATOM 0 H2' DC B 2 -4.152 5.032 8.206 1.00 0.00 H new ATOM 0 H2'' DC B 2 -5.734 5.063 7.453 1.00 0.00 H new ATOM 0 H1' DC B 2 -5.566 7.399 6.884 1.00 0.00 H new ATOM 0 H41 DC B 2 0.024 6.466 3.567 1.00 0.00 H new ATOM 0 H42 DC B 2 -1.238 6.991 2.447 1.00 0.00 H new ATOM 0 H5 DC B 2 -0.406 6.136 5.946 1.00 0.00 H new ATOM 0 H6 DC B 2 -2.137 6.221 7.687 1.00 0.00 H new ATOM 61 P DC B 3 -8.006 4.829 9.359 1.00 0.00 P ATOM 62 OP1 DC B 3 -9.318 5.165 9.951 1.00 0.00 O ATOM 63 OP2 DC B 3 -7.258 3.688 9.926 1.00 0.00 O ATOM 64 O5' DC B 3 -8.171 4.634 7.770 1.00 0.00 O ATOM 65 C5' DC B 3 -8.960 5.531 7.009 1.00 0.00 C ATOM 66 C4' DC B 3 -9.074 5.083 5.549 1.00 0.00 C ATOM 67 O4' DC B 3 -7.853 5.287 4.848 1.00 0.00 O ATOM 68 C3' DC B 3 -9.464 3.605 5.404 1.00 0.00 C ATOM 69 O3' DC B 3 -10.604 3.542 4.561 1.00 0.00 O ATOM 70 C2' DC B 3 -8.210 2.994 4.778 1.00 0.00 C ATOM 71 C1' DC B 3 -7.654 4.182 3.989 1.00 0.00 C ATOM 72 N1 DC B 3 -6.212 4.075 3.629 1.00 0.00 N ATOM 73 C2 DC B 3 -5.825 4.197 2.286 1.00 0.00 C ATOM 74 O2 DC B 3 -6.638 4.363 1.378 1.00 0.00 O ATOM 75 N3 DC B 3 -4.515 4.104 1.946 1.00 0.00 N ATOM 76 C4 DC B 3 -3.610 3.904 2.887 1.00 0.00 C ATOM 77 N4 DC B 3 -2.376 3.765 2.475 1.00 0.00 N ATOM 78 C5 DC B 3 -3.946 3.769 4.266 1.00 0.00 C ATOM 79 C6 DC B 3 -5.258 3.870 4.598 1.00 0.00 C ATOM 0 H5' DC B 3 -8.521 6.528 7.051 1.00 0.00 H new ATOM 0 H5'' DC B 3 -9.956 5.602 7.447 1.00 0.00 H new ATOM 0 H4' DC B 3 -9.866 5.698 5.122 1.00 0.00 H new ATOM 0 H3' DC B 3 -9.737 3.082 6.321 1.00 0.00 H new ATOM 0 H2' DC B 3 -7.508 2.637 5.531 1.00 0.00 H new ATOM 0 H2'' DC B 3 -8.444 2.147 4.133 1.00 0.00 H new ATOM 0 H1' DC B 3 -8.160 4.254 3.026 1.00 0.00 H new ATOM 0 H41 DC B 3 -1.628 3.608 3.150 1.00 0.00 H new ATOM 0 H42 DC B 3 -2.162 3.814 1.479 1.00 0.00 H new ATOM 0 H5 DC B 3 -3.188 3.594 5.015 1.00 0.00 H new ATOM 0 H6 DC B 3 -5.556 3.789 5.633 1.00 0.00 H new ATOM 91 P DT B 4 -11.465 2.198 4.367 1.00 0.00 P ATOM 92 OP1 DT B 4 -12.819 2.561 3.883 1.00 0.00 O ATOM 93 OP2 DT B 4 -11.406 1.329 5.556 1.00 0.00 O ATOM 94 O5' DT B 4 -10.643 1.585 3.137 1.00 0.00 O ATOM 95 C5' DT B 4 -10.719 2.187 1.857 1.00 0.00 C ATOM 96 C4' DT B 4 -9.671 1.619 0.902 1.00 0.00 C ATOM 97 O4' DT B 4 -8.354 1.908 1.325 1.00 0.00 O ATOM 98 C3' DT B 4 -9.728 0.103 0.728 1.00 0.00 C ATOM 99 O3' DT B 4 -10.573 -0.215 -0.362 1.00 0.00 O ATOM 100 C2' DT B 4 -8.266 -0.272 0.476 1.00 0.00 C ATOM 101 C1' DT B 4 -7.525 1.063 0.561 1.00 0.00 C ATOM 102 N1 DT B 4 -6.171 0.938 1.155 1.00 0.00 N ATOM 103 C2 DT B 4 -5.086 1.042 0.284 1.00 0.00 C ATOM 104 O2 DT B 4 -5.191 1.196 -0.929 1.00 0.00 O ATOM 105 N3 DT B 4 -3.840 0.933 0.851 1.00 0.00 N ATOM 106 C4 DT B 4 -3.557 0.632 2.159 1.00 0.00 C ATOM 107 O4 DT B 4 -2.380 0.458 2.470 1.00 0.00 O ATOM 108 C5 DT B 4 -4.736 0.527 3.019 1.00 0.00 C ATOM 109 C7 DT B 4 -4.573 0.225 4.496 1.00 0.00 C ATOM 110 C6 DT B 4 -5.987 0.680 2.497 1.00 0.00 C ATOM 0 H5' DT B 4 -10.579 3.264 1.952 1.00 0.00 H new ATOM 0 H5'' DT B 4 -11.714 2.031 1.440 1.00 0.00 H new ATOM 0 H4' DT B 4 -9.914 2.104 -0.043 1.00 0.00 H new ATOM 0 H3' DT B 4 -10.139 -0.440 1.580 1.00 0.00 H new ATOM 0 H2' DT B 4 -7.901 -0.980 1.220 1.00 0.00 H new ATOM 0 H2'' DT B 4 -8.136 -0.740 -0.500 1.00 0.00 H new ATOM 0 H1' DT B 4 -7.345 1.465 -0.436 1.00 0.00 H new ATOM 0 H3 DT B 4 -3.042 1.092 0.236 1.00 0.00 H new ATOM 0 H71 DT B 4 -5.389 0.684 5.054 1.00 0.00 H new ATOM 0 H72 DT B 4 -4.590 -0.854 4.651 1.00 0.00 H new ATOM 0 H73 DT B 4 -3.623 0.627 4.847 1.00 0.00 H new ATOM 0 H6 DT B 4 -6.847 0.598 3.145 1.00 0.00 H new ATOM 123 P DC B 5 -11.094 -1.723 -0.616 1.00 0.00 P ATOM 124 OP1 DC B 5 -12.354 -1.668 -1.386 1.00 0.00 O ATOM 125 OP2 DC B 5 -11.093 -2.468 0.662 1.00 0.00 O ATOM 126 O5' DC B 5 -9.878 -2.222 -1.549 1.00 0.00 O ATOM 127 C5' DC B 5 -9.798 -1.844 -2.916 1.00 0.00 C ATOM 128 C4' DC B 5 -8.538 -2.403 -3.592 1.00 0.00 C ATOM 129 O4' DC B 5 -7.365 -1.816 -3.060 1.00 0.00 O ATOM 130 C3' DC B 5 -8.387 -3.921 -3.457 1.00 0.00 C ATOM 131 O3' DC B 5 -8.763 -4.547 -4.670 1.00 0.00 O ATOM 132 C2' DC B 5 -6.901 -4.125 -3.163 1.00 0.00 C ATOM 133 C1' DC B 5 -6.300 -2.720 -3.268 1.00 0.00 C ATOM 134 N1 DC B 5 -5.246 -2.485 -2.250 1.00 0.00 N ATOM 135 C2 DC B 5 -3.912 -2.381 -2.656 1.00 0.00 C ATOM 136 O2 DC B 5 -3.579 -2.459 -3.839 1.00 0.00 O ATOM 137 N3 DC B 5 -2.938 -2.202 -1.732 1.00 0.00 N ATOM 138 C4 DC B 5 -3.263 -2.128 -0.452 1.00 0.00 C ATOM 139 N4 DC B 5 -2.267 -1.918 0.365 1.00 0.00 N ATOM 140 C5 DC B 5 -4.606 -2.235 0.021 1.00 0.00 C ATOM 141 C6 DC B 5 -5.572 -2.416 -0.914 1.00 0.00 C ATOM 0 H5' DC B 5 -9.799 -0.757 -2.993 1.00 0.00 H new ATOM 0 H5'' DC B 5 -10.682 -2.202 -3.444 1.00 0.00 H new ATOM 0 H4' DC B 5 -8.662 -2.155 -4.646 1.00 0.00 H new ATOM 0 H3' DC B 5 -9.016 -4.351 -2.678 1.00 0.00 H new ATOM 0 H2' DC B 5 -6.746 -4.551 -2.172 1.00 0.00 H new ATOM 0 H2'' DC B 5 -6.444 -4.808 -3.879 1.00 0.00 H new ATOM 0 H1' DC B 5 -5.829 -2.592 -4.242 1.00 0.00 H new ATOM 0 H41 DC B 5 -2.436 -1.848 1.368 1.00 0.00 H new ATOM 0 H42 DC B 5 -1.319 -1.823 -0.000 1.00 0.00 H new ATOM 0 H5 DC B 5 -4.842 -2.175 1.073 1.00 0.00 H new ATOM 0 H6 DC B 5 -6.604 -2.507 -0.608 1.00 0.00 H new ATOM 153 P DC B 6 -9.199 -6.100 -4.716 1.00 0.00 P ATOM 154 OP1 DC B 6 -10.066 -6.313 -5.892 1.00 0.00 O ATOM 155 OP2 DC B 6 -9.713 -6.526 -3.397 1.00 0.00 O ATOM 156 O5' DC B 6 -7.751 -6.777 -4.935 1.00 0.00 O ATOM 157 C5' DC B 6 -7.098 -6.761 -6.197 1.00 0.00 C ATOM 158 C4' DC B 6 -6.031 -7.863 -6.281 1.00 0.00 C ATOM 159 O4' DC B 6 -4.927 -7.590 -5.414 1.00 0.00 O ATOM 160 C3' DC B 6 -6.606 -9.238 -5.881 1.00 0.00 C ATOM 161 O3' DC B 6 -6.332 -10.275 -6.807 1.00 0.00 O ATOM 162 C2' DC B 6 -5.845 -9.534 -4.604 1.00 0.00 C ATOM 163 C1' DC B 6 -4.511 -8.834 -4.891 1.00 0.00 C ATOM 164 N1 DC B 6 -3.569 -8.710 -3.737 1.00 0.00 N ATOM 165 C2 DC B 6 -2.193 -8.587 -4.013 1.00 0.00 C ATOM 166 O2 DC B 6 -1.745 -8.448 -5.154 1.00 0.00 O ATOM 167 N3 DC B 6 -1.289 -8.649 -3.005 1.00 0.00 N ATOM 168 C4 DC B 6 -1.714 -8.806 -1.764 1.00 0.00 C ATOM 169 N4 DC B 6 -0.805 -8.863 -0.832 1.00 0.00 N ATOM 170 C5 DC B 6 -3.083 -8.907 -1.414 1.00 0.00 C ATOM 171 C6 DC B 6 -3.985 -8.852 -2.426 1.00 0.00 C ATOM 0 H5' DC B 6 -6.634 -5.788 -6.358 1.00 0.00 H new ATOM 0 H5'' DC B 6 -7.831 -6.899 -6.991 1.00 0.00 H new ATOM 0 H4' DC B 6 -5.698 -7.882 -7.319 1.00 0.00 H new ATOM 0 H3' DC B 6 -7.693 -9.201 -5.810 1.00 0.00 H new ATOM 0 H2' DC B 6 -6.343 -9.128 -3.723 1.00 0.00 H new ATOM 0 H2'' DC B 6 -5.722 -10.604 -4.436 1.00 0.00 H new ATOM 0 H1' DC B 6 -3.894 -9.420 -5.571 1.00 0.00 H new ATOM 0 H41 DC B 6 -1.081 -8.983 0.143 1.00 0.00 H new ATOM 0 H42 DC B 6 0.182 -8.787 -1.077 1.00 0.00 H new ATOM 0 H5 DC B 6 -3.395 -9.023 -0.387 1.00 0.00 H new ATOM 0 H6 DC B 6 -5.040 -8.920 -2.205 1.00 0.00 H new ATOM 183 P DT B 7 -7.121 -10.378 -8.209 1.00 0.00 P ATOM 184 OP1 DT B 7 -8.000 -9.211 -8.408 1.00 0.00 O ATOM 185 OP2 DT B 7 -7.702 -11.728 -8.364 1.00 0.00 O ATOM 186 O5' DT B 7 -5.833 -10.212 -9.152 1.00 0.00 O ATOM 187 C5' DT B 7 -4.950 -11.292 -9.370 1.00 0.00 C ATOM 188 C4' DT B 7 -3.518 -10.801 -9.181 1.00 0.00 C ATOM 189 O4' DT B 7 -3.278 -10.605 -7.793 1.00 0.00 O ATOM 190 C3' DT B 7 -2.500 -11.843 -9.679 1.00 0.00 C ATOM 191 O3' DT B 7 -1.450 -11.230 -10.409 1.00 0.00 O ATOM 192 C2' DT B 7 -1.940 -12.414 -8.381 1.00 0.00 C ATOM 193 C1' DT B 7 -2.036 -11.191 -7.477 1.00 0.00 C ATOM 194 N1 DT B 7 -1.902 -11.521 -6.041 1.00 0.00 N ATOM 195 C2 DT B 7 -0.632 -11.390 -5.479 1.00 0.00 C ATOM 196 O2 DT B 7 0.370 -11.095 -6.123 1.00 0.00 O ATOM 197 N3 DT B 7 -0.534 -11.625 -4.130 1.00 0.00 N ATOM 198 C4 DT B 7 -1.554 -11.997 -3.288 1.00 0.00 C ATOM 199 O4 DT B 7 -1.299 -12.133 -2.093 1.00 0.00 O ATOM 200 C5 DT B 7 -2.844 -12.174 -3.956 1.00 0.00 C ATOM 201 C7 DT B 7 -4.055 -12.621 -3.171 1.00 0.00 C ATOM 202 C6 DT B 7 -2.979 -11.935 -5.289 1.00 0.00 C ATOM 0 H5' DT B 7 -5.083 -11.691 -10.376 1.00 0.00 H new ATOM 0 H5'' DT B 7 -5.166 -12.103 -8.674 1.00 0.00 H new ATOM 0 H4' DT B 7 -3.401 -9.877 -9.748 1.00 0.00 H new ATOM 0 H3' DT B 7 -2.949 -12.582 -10.343 1.00 0.00 H new ATOM 0 H2' DT B 7 -2.529 -13.252 -8.009 1.00 0.00 H new ATOM 0 H2'' DT B 7 -0.915 -12.768 -8.492 1.00 0.00 H new ATOM 0 HO3' DT B 7 -0.818 -11.915 -10.711 1.00 0.00 H new ATOM 0 H1' DT B 7 -1.211 -10.500 -7.651 1.00 0.00 H new ATOM 0 H3 DT B 7 0.389 -11.512 -3.711 1.00 0.00 H new ATOM 0 H71 DT B 7 -3.737 -13.248 -2.338 1.00 0.00 H new ATOM 0 H72 DT B 7 -4.582 -11.748 -2.787 1.00 0.00 H new ATOM 0 H73 DT B 7 -4.720 -13.190 -3.821 1.00 0.00 H new ATOM 0 H6 DT B 7 -3.940 -12.071 -5.762 1.00 0.00 H new TER 216 DT B 7 ATOM 217 O5' DA C 8 8.559 -14.609 -1.435 1.00 0.00 O ATOM 218 C5' DA C 8 9.115 -13.309 -1.482 1.00 0.00 C ATOM 219 C4' DA C 8 8.994 -12.763 -2.911 1.00 0.00 C ATOM 220 O4' DA C 8 7.617 -12.674 -3.249 1.00 0.00 O ATOM 221 C3' DA C 8 9.570 -11.354 -3.052 1.00 0.00 C ATOM 222 O3' DA C 8 10.022 -11.189 -4.387 1.00 0.00 O ATOM 223 C2' DA C 8 8.371 -10.478 -2.695 1.00 0.00 C ATOM 224 C1' DA C 8 7.186 -11.323 -3.174 1.00 0.00 C ATOM 225 N9 DA C 8 5.990 -11.260 -2.300 1.00 0.00 N ATOM 226 C8 DA C 8 5.903 -11.186 -0.929 1.00 0.00 C ATOM 227 N7 DA C 8 4.683 -11.259 -0.473 1.00 0.00 N ATOM 228 C5 DA C 8 3.898 -11.355 -1.617 1.00 0.00 C ATOM 229 C6 DA C 8 2.509 -11.459 -1.857 1.00 0.00 C ATOM 230 N6 DA C 8 1.559 -11.512 -0.927 1.00 0.00 N ATOM 231 N1 DA C 8 2.066 -11.520 -3.117 1.00 0.00 N ATOM 232 C2 DA C 8 2.949 -11.489 -4.111 1.00 0.00 C ATOM 233 N3 DA C 8 4.269 -11.407 -4.029 1.00 0.00 N ATOM 234 C4 DA C 8 4.688 -11.339 -2.737 1.00 0.00 C ATOM 0 H5' DA C 8 10.161 -13.336 -1.177 1.00 0.00 H new ATOM 0 H5'' DA C 8 8.596 -12.653 -0.783 1.00 0.00 H new ATOM 0 H4' DA C 8 9.548 -13.441 -3.560 1.00 0.00 H new ATOM 0 H3' DA C 8 10.430 -11.118 -2.425 1.00 0.00 H new ATOM 0 H2' DA C 8 8.320 -10.278 -1.625 1.00 0.00 H new ATOM 0 H2'' DA C 8 8.410 -9.512 -3.199 1.00 0.00 H new ATOM 0 HO5' DA C 8 7.845 -14.684 -2.102 1.00 0.00 H new ATOM 0 H1' DA C 8 6.879 -10.917 -4.138 1.00 0.00 H new ATOM 0 H8 DA C 8 6.766 -11.077 -0.289 1.00 0.00 H new ATOM 0 H61 DA C 8 0.580 -11.587 -1.202 1.00 0.00 H new ATOM 0 H62 DA C 8 1.810 -11.478 0.061 1.00 0.00 H new ATOM 0 H2 DA C 8 2.539 -11.537 -5.109 1.00 0.00 H new ATOM 247 P DG C 9 10.850 -9.888 -4.852 1.00 0.00 P ATOM 248 OP1 DG C 9 11.746 -10.220 -5.980 1.00 0.00 O ATOM 249 OP2 DG C 9 11.440 -9.230 -3.667 1.00 0.00 O ATOM 250 O5' DG C 9 9.595 -9.032 -5.380 1.00 0.00 O ATOM 251 C5' DG C 9 8.971 -9.328 -6.619 1.00 0.00 C ATOM 252 C4' DG C 9 7.841 -8.336 -6.926 1.00 0.00 C ATOM 253 O4' DG C 9 6.690 -8.647 -6.152 1.00 0.00 O ATOM 254 C3' DG C 9 8.224 -6.874 -6.637 1.00 0.00 C ATOM 255 O3' DG C 9 7.933 -6.068 -7.768 1.00 0.00 O ATOM 256 C2' DG C 9 7.343 -6.535 -5.438 1.00 0.00 C ATOM 257 C1' DG C 9 6.134 -7.432 -5.694 1.00 0.00 C ATOM 258 N9 DG C 9 5.291 -7.671 -4.502 1.00 0.00 N ATOM 259 C8 DG C 9 5.670 -7.779 -3.181 1.00 0.00 C ATOM 260 N7 DG C 9 4.685 -7.992 -2.356 1.00 0.00 N ATOM 261 C5 DG C 9 3.570 -8.012 -3.190 1.00 0.00 C ATOM 262 C6 DG C 9 2.193 -8.205 -2.874 1.00 0.00 C ATOM 263 O6 DG C 9 1.691 -8.402 -1.778 1.00 0.00 O ATOM 264 N1 DG C 9 1.354 -8.163 -3.965 1.00 0.00 N ATOM 265 C2 DG C 9 1.781 -7.949 -5.238 1.00 0.00 C ATOM 266 N2 DG C 9 0.842 -7.937 -6.157 1.00 0.00 N ATOM 267 N3 DG C 9 3.063 -7.755 -5.578 1.00 0.00 N ATOM 268 C4 DG C 9 3.919 -7.808 -4.505 1.00 0.00 C ATOM 0 H5' DG C 9 8.571 -10.342 -6.594 1.00 0.00 H new ATOM 0 H5'' DG C 9 9.712 -9.297 -7.418 1.00 0.00 H new ATOM 0 H4' DG C 9 7.640 -8.433 -7.993 1.00 0.00 H new ATOM 0 H3' DG C 9 9.282 -6.710 -6.433 1.00 0.00 H new ATOM 0 H2' DG C 9 7.832 -6.764 -4.491 1.00 0.00 H new ATOM 0 H2'' DG C 9 7.074 -5.479 -5.411 1.00 0.00 H new ATOM 0 H1' DG C 9 5.459 -6.956 -6.406 1.00 0.00 H new ATOM 0 H8 DG C 9 6.697 -7.694 -2.858 1.00 0.00 H new ATOM 0 H1 DG C 9 0.355 -8.300 -3.809 1.00 0.00 H new ATOM 0 H21 DG C 9 1.087 -7.782 -7.135 1.00 0.00 H new ATOM 0 H22 DG C 9 -0.132 -8.083 -5.893 1.00 0.00 H new ATOM 280 P DG C 10 8.486 -4.564 -7.898 1.00 0.00 P ATOM 281 OP1 DG C 10 8.682 -4.214 -9.321 1.00 0.00 O ATOM 282 OP2 DG C 10 9.723 -4.379 -7.110 1.00 0.00 O ATOM 283 O5' DG C 10 7.263 -3.742 -7.263 1.00 0.00 O ATOM 284 C5' DG C 10 6.046 -3.605 -7.976 1.00 0.00 C ATOM 285 C4' DG C 10 5.085 -2.580 -7.362 1.00 0.00 C ATOM 286 O4' DG C 10 4.325 -3.118 -6.279 1.00 0.00 O ATOM 287 C3' DG C 10 5.774 -1.290 -6.847 1.00 0.00 C ATOM 288 O3' DG C 10 5.174 -0.054 -7.242 1.00 0.00 O ATOM 289 C2' DG C 10 5.513 -1.402 -5.343 1.00 0.00 C ATOM 290 C1' DG C 10 4.123 -2.033 -5.395 1.00 0.00 C ATOM 291 N9 DG C 10 3.488 -2.360 -4.092 1.00 0.00 N ATOM 292 C8 DG C 10 4.034 -2.315 -2.826 1.00 0.00 C ATOM 293 N7 DG C 10 3.148 -2.238 -1.870 1.00 0.00 N ATOM 294 C5 DG C 10 1.927 -2.247 -2.535 1.00 0.00 C ATOM 295 C6 DG C 10 0.591 -2.108 -2.036 1.00 0.00 C ATOM 296 O6 DG C 10 0.206 -1.905 -0.888 1.00 0.00 O ATOM 297 N1 DG C 10 -0.375 -2.207 -3.012 1.00 0.00 N ATOM 298 C2 DG C 10 -0.102 -2.390 -4.329 1.00 0.00 C ATOM 299 N2 DG C 10 -1.139 -2.489 -5.129 1.00 0.00 N ATOM 300 N3 DG C 10 1.130 -2.479 -4.840 1.00 0.00 N ATOM 301 C4 DG C 10 2.117 -2.399 -3.890 1.00 0.00 C ATOM 0 H5' DG C 10 5.550 -4.574 -8.020 1.00 0.00 H new ATOM 0 H5'' DG C 10 6.267 -3.313 -9.003 1.00 0.00 H new ATOM 0 H4' DG C 10 4.433 -2.322 -8.197 1.00 0.00 H new ATOM 0 H3' DG C 10 6.798 -1.250 -7.217 1.00 0.00 H new ATOM 0 H2' DG C 10 6.243 -2.031 -4.833 1.00 0.00 H new ATOM 0 H2'' DG C 10 5.519 -0.435 -4.840 1.00 0.00 H new ATOM 0 H1' DG C 10 3.362 -1.334 -5.743 1.00 0.00 H new ATOM 0 H8 DG C 10 5.098 -2.341 -2.642 1.00 0.00 H new ATOM 0 H1 DG C 10 -1.353 -2.139 -2.729 1.00 0.00 H new ATOM 0 H21 DG C 10 -1.000 -2.627 -6.130 1.00 0.00 H new ATOM 0 H22 DG C 10 -2.084 -2.428 -4.749 1.00 0.00 H new ATOM 313 P DA C 11 4.936 0.407 -8.770 1.00 0.00 P ATOM 314 OP1 DA C 11 5.100 -0.657 -9.778 1.00 0.00 O ATOM 315 OP2 DA C 11 5.408 1.777 -9.081 1.00 0.00 O ATOM 316 O5' DA C 11 3.384 0.741 -8.572 1.00 0.00 O ATOM 317 C5' DA C 11 2.400 -0.263 -8.392 1.00 0.00 C ATOM 318 C4' DA C 11 1.249 0.265 -7.534 1.00 0.00 C ATOM 319 O4' DA C 11 1.520 0.196 -6.153 1.00 0.00 O ATOM 320 C3' DA C 11 0.956 1.747 -7.716 1.00 0.00 C ATOM 321 O3' DA C 11 0.310 1.976 -8.961 1.00 0.00 O ATOM 322 C2' DA C 11 0.189 2.116 -6.445 1.00 0.00 C ATOM 323 C1' DA C 11 0.455 0.902 -5.553 1.00 0.00 C ATOM 324 N9 DA C 11 0.713 1.210 -4.131 1.00 0.00 N ATOM 325 C8 DA C 11 1.878 1.496 -3.460 1.00 0.00 C ATOM 326 N7 DA C 11 1.735 1.572 -2.159 1.00 0.00 N ATOM 327 C5 DA C 11 0.365 1.352 -1.964 1.00 0.00 C ATOM 328 C6 DA C 11 -0.506 1.257 -0.848 1.00 0.00 C ATOM 329 N6 DA C 11 -0.181 1.358 0.432 1.00 0.00 N ATOM 330 N1 DA C 11 -1.804 1.003 -1.036 1.00 0.00 N ATOM 331 C2 DA C 11 -2.255 0.826 -2.271 1.00 0.00 C ATOM 332 N3 DA C 11 -1.565 0.866 -3.397 1.00 0.00 N ATOM 333 C4 DA C 11 -0.254 1.144 -3.168 1.00 0.00 C ATOM 0 H5' DA C 11 2.846 -1.136 -7.916 1.00 0.00 H new ATOM 0 H5'' DA C 11 2.021 -0.587 -9.361 1.00 0.00 H new ATOM 0 H4' DA C 11 0.426 -0.370 -7.862 1.00 0.00 H new ATOM 0 H3' DA C 11 1.826 2.398 -7.801 1.00 0.00 H new ATOM 0 H2' DA C 11 0.558 3.039 -5.999 1.00 0.00 H new ATOM 0 H2'' DA C 11 -0.875 2.257 -6.636 1.00 0.00 H new ATOM 0 H1' DA C 11 -0.452 0.299 -5.498 1.00 0.00 H new ATOM 0 H8 DA C 11 2.824 1.644 -3.959 1.00 0.00 H new ATOM 0 H61 DA C 11 -0.901 1.272 1.149 1.00 0.00 H new ATOM 0 H62 DA C 11 0.789 1.522 0.700 1.00 0.00 H new ATOM 0 H2 DA C 11 -3.312 0.625 -2.367 1.00 0.00 H new ATOM 345 P DG C 12 0.226 3.461 -9.571 1.00 0.00 P ATOM 346 OP1 DG C 12 -0.079 3.161 -10.988 1.00 0.00 O ATOM 347 OP2 DG C 12 1.552 4.059 -9.271 1.00 0.00 O ATOM 348 O5' DG C 12 -1.092 3.933 -8.766 1.00 0.00 O ATOM 349 C5' DG C 12 -2.344 3.287 -9.009 1.00 0.00 C ATOM 350 C4' DG C 12 -3.502 3.719 -8.096 1.00 0.00 C ATOM 351 O4' DG C 12 -3.244 3.370 -6.743 1.00 0.00 O ATOM 352 C3' DG C 12 -3.838 5.213 -8.144 1.00 0.00 C ATOM 353 O3' DG C 12 -5.251 5.323 -8.265 1.00 0.00 O ATOM 354 C2' DG C 12 -3.327 5.699 -6.793 1.00 0.00 C ATOM 355 C1' DG C 12 -3.611 4.472 -5.932 1.00 0.00 C ATOM 356 N9 DG C 12 -2.858 4.447 -4.658 1.00 0.00 N ATOM 357 C8 DG C 12 -1.504 4.560 -4.451 1.00 0.00 C ATOM 358 N7 DG C 12 -1.142 4.480 -3.199 1.00 0.00 N ATOM 359 C5 DG C 12 -2.355 4.342 -2.522 1.00 0.00 C ATOM 360 C6 DG C 12 -2.637 4.256 -1.121 1.00 0.00 C ATOM 361 O6 DG C 12 -1.845 4.246 -0.180 1.00 0.00 O ATOM 362 N1 DG C 12 -3.988 4.210 -0.833 1.00 0.00 N ATOM 363 C2 DG C 12 -4.967 4.194 -1.780 1.00 0.00 C ATOM 364 N2 DG C 12 -6.210 4.245 -1.353 1.00 0.00 N ATOM 365 N3 DG C 12 -4.741 4.240 -3.093 1.00 0.00 N ATOM 366 C4 DG C 12 -3.411 4.324 -3.405 1.00 0.00 C ATOM 0 H5' DG C 12 -2.204 2.211 -8.904 1.00 0.00 H new ATOM 0 H5'' DG C 12 -2.633 3.471 -10.044 1.00 0.00 H new ATOM 0 H4' DG C 12 -4.364 3.179 -8.489 1.00 0.00 H new ATOM 0 H3' DG C 12 -3.405 5.784 -8.965 1.00 0.00 H new ATOM 0 H2' DG C 12 -2.267 5.952 -6.817 1.00 0.00 H new ATOM 0 H2'' DG C 12 -3.858 6.584 -6.442 1.00 0.00 H new ATOM 0 H1' DG C 12 -4.658 4.462 -5.629 1.00 0.00 H new ATOM 0 H8 DG C 12 -0.799 4.703 -5.256 1.00 0.00 H new ATOM 0 H1 DG C 12 -4.269 4.187 0.147 1.00 0.00 H new ATOM 0 H21 DG C 12 -6.980 4.236 -2.022 1.00 0.00 H new ATOM 0 H22 DG C 12 -6.404 4.294 -0.353 1.00 0.00 H new ATOM 378 P DG C 13 -5.987 6.721 -8.595 1.00 0.00 P ATOM 379 OP1 DG C 13 -7.233 6.435 -9.339 1.00 0.00 O ATOM 380 OP2 DG C 13 -5.009 7.638 -9.219 1.00 0.00 O ATOM 381 O5' DG C 13 -6.349 7.157 -7.080 1.00 0.00 O ATOM 382 C5' DG C 13 -7.438 6.557 -6.392 1.00 0.00 C ATOM 383 C4' DG C 13 -7.628 7.093 -4.964 1.00 0.00 C ATOM 384 O4' DG C 13 -6.573 6.691 -4.106 1.00 0.00 O ATOM 385 C3' DG C 13 -7.762 8.619 -4.858 1.00 0.00 C ATOM 386 O3' DG C 13 -9.111 8.946 -4.546 1.00 0.00 O ATOM 387 C2' DG C 13 -6.792 8.973 -3.727 1.00 0.00 C ATOM 388 C1' DG C 13 -6.508 7.633 -3.056 1.00 0.00 C ATOM 389 N9 DG C 13 -5.188 7.601 -2.394 1.00 0.00 N ATOM 390 C8 DG C 13 -3.943 7.639 -2.968 1.00 0.00 C ATOM 391 N7 DG C 13 -2.965 7.581 -2.106 1.00 0.00 N ATOM 392 C5 DG C 13 -3.602 7.518 -0.869 1.00 0.00 C ATOM 393 C6 DG C 13 -3.065 7.430 0.457 1.00 0.00 C ATOM 394 O6 DG C 13 -1.884 7.377 0.810 1.00 0.00 O ATOM 395 N1 DG C 13 -4.046 7.404 1.433 1.00 0.00 N ATOM 396 C2 DG C 13 -5.385 7.431 1.172 1.00 0.00 C ATOM 397 N2 DG C 13 -6.199 7.458 2.202 1.00 0.00 N ATOM 398 N3 DG C 13 -5.914 7.499 -0.050 1.00 0.00 N ATOM 399 C4 DG C 13 -4.968 7.538 -1.035 1.00 0.00 C ATOM 0 H5' DG C 13 -7.282 5.479 -6.350 1.00 0.00 H new ATOM 0 H5'' DG C 13 -8.353 6.724 -6.960 1.00 0.00 H new ATOM 0 H4' DG C 13 -8.576 6.654 -4.654 1.00 0.00 H new ATOM 0 H3' DG C 13 -7.528 9.166 -5.771 1.00 0.00 H new ATOM 0 H2' DG C 13 -5.880 9.429 -4.111 1.00 0.00 H new ATOM 0 H2'' DG C 13 -7.234 9.684 -3.029 1.00 0.00 H new ATOM 0 H1' DG C 13 -7.224 7.428 -2.260 1.00 0.00 H new ATOM 0 H8 DG C 13 -3.787 7.710 -4.034 1.00 0.00 H new ATOM 0 H1 DG C 13 -3.750 7.362 2.408 1.00 0.00 H new ATOM 0 H21 DG C 13 -7.208 7.479 2.054 1.00 0.00 H new ATOM 0 H22 DG C 13 -5.822 7.458 3.150 1.00 0.00 H new ATOM 411 P DA C 14 -9.658 10.471 -4.535 1.00 0.00 P ATOM 412 OP1 DA C 14 -11.104 10.497 -4.840 1.00 0.00 O ATOM 413 OP2 DA C 14 -8.770 11.359 -5.313 1.00 0.00 O ATOM 414 O5' DA C 14 -9.458 10.761 -2.963 1.00 0.00 O ATOM 415 C5' DA C 14 -10.243 10.097 -1.987 1.00 0.00 C ATOM 416 C4' DA C 14 -9.888 10.573 -0.572 1.00 0.00 C ATOM 417 O4' DA C 14 -8.599 10.097 -0.200 1.00 0.00 O ATOM 418 C3' DA C 14 -9.872 12.107 -0.447 1.00 0.00 C ATOM 419 O3' DA C 14 -10.576 12.523 0.711 1.00 0.00 O ATOM 420 C2' DA C 14 -8.389 12.414 -0.285 1.00 0.00 C ATOM 421 C1' DA C 14 -7.914 11.155 0.437 1.00 0.00 C ATOM 422 N9 DA C 14 -6.448 10.967 0.380 1.00 0.00 N ATOM 423 C8 DA C 14 -5.613 10.971 -0.713 1.00 0.00 C ATOM 424 N7 DA C 14 -4.345 10.851 -0.421 1.00 0.00 N ATOM 425 C5 DA C 14 -4.349 10.761 0.980 1.00 0.00 C ATOM 426 C6 DA C 14 -3.351 10.619 1.974 1.00 0.00 C ATOM 427 N6 DA C 14 -2.058 10.563 1.717 1.00 0.00 N ATOM 428 N1 DA C 14 -3.674 10.522 3.273 1.00 0.00 N ATOM 429 C2 DA C 14 -4.962 10.590 3.593 1.00 0.00 C ATOM 430 N3 DA C 14 -6.003 10.757 2.780 1.00 0.00 N ATOM 431 C4 DA C 14 -5.625 10.821 1.472 1.00 0.00 C ATOM 0 H5' DA C 14 -10.087 9.021 -2.061 1.00 0.00 H new ATOM 0 H5'' DA C 14 -11.300 10.280 -2.181 1.00 0.00 H new ATOM 0 H4' DA C 14 -10.662 10.175 0.084 1.00 0.00 H new ATOM 0 H3' DA C 14 -10.341 12.611 -1.292 1.00 0.00 H new ATOM 0 H2' DA C 14 -7.889 12.555 -1.243 1.00 0.00 H new ATOM 0 H2'' DA C 14 -8.215 13.317 0.301 1.00 0.00 H new ATOM 0 HO3' DA C 14 -10.553 13.501 0.774 1.00 0.00 H new ATOM 0 H1' DA C 14 -8.130 11.212 1.504 1.00 0.00 H new ATOM 0 H8 DA C 14 -5.975 11.065 -1.726 1.00 0.00 H new ATOM 0 H61 DA C 14 -1.390 10.460 2.481 1.00 0.00 H new ATOM 0 H62 DA C 14 -1.726 10.623 0.754 1.00 0.00 H new ATOM 0 H2 DA C 14 -5.193 10.498 4.644 1.00 0.00 H new TER 444 DA C 14 ATOM 445 O5' DT A 15 0.136 16.017 -1.823 1.00 0.00 O ATOM 446 C5' DT A 15 0.895 15.405 -2.845 1.00 0.00 C ATOM 447 C4' DT A 15 1.750 14.293 -2.230 1.00 0.00 C ATOM 448 O4' DT A 15 0.925 13.340 -1.573 1.00 0.00 O ATOM 449 C3' DT A 15 2.583 13.565 -3.285 1.00 0.00 C ATOM 450 O3' DT A 15 3.911 14.055 -3.246 1.00 0.00 O ATOM 451 C2' DT A 15 2.496 12.111 -2.835 1.00 0.00 C ATOM 452 C1' DT A 15 1.186 12.028 -2.053 1.00 0.00 C ATOM 453 N1 DT A 15 -0.031 11.546 -2.774 1.00 0.00 N ATOM 454 C2 DT A 15 -1.087 11.125 -1.955 1.00 0.00 C ATOM 455 O2 DT A 15 -1.006 11.043 -0.734 1.00 0.00 O ATOM 456 N3 DT A 15 -2.266 10.782 -2.570 1.00 0.00 N ATOM 457 C4 DT A 15 -2.482 10.752 -3.930 1.00 0.00 C ATOM 458 O4 DT A 15 -3.591 10.433 -4.337 1.00 0.00 O ATOM 459 C5 DT A 15 -1.323 11.131 -4.740 1.00 0.00 C ATOM 460 C7 DT A 15 -1.417 11.103 -6.257 1.00 0.00 C ATOM 461 C6 DT A 15 -0.155 11.513 -4.151 1.00 0.00 C ATOM 0 H5' DT A 15 1.531 16.142 -3.335 1.00 0.00 H new ATOM 0 H5'' DT A 15 0.236 14.994 -3.610 1.00 0.00 H new ATOM 0 H4' DT A 15 2.423 14.770 -1.517 1.00 0.00 H new ATOM 0 H3' DT A 15 2.243 13.698 -4.312 1.00 0.00 H new ATOM 0 H2' DT A 15 2.493 11.432 -3.687 1.00 0.00 H new ATOM 0 H2'' DT A 15 3.348 11.837 -2.212 1.00 0.00 H new ATOM 0 HO5' DT A 15 -0.136 15.341 -1.168 1.00 0.00 H new ATOM 0 H1' DT A 15 1.349 11.267 -1.290 1.00 0.00 H new ATOM 0 H3 DT A 15 -3.049 10.528 -1.968 1.00 0.00 H new ATOM 0 H71 DT A 15 -0.754 11.860 -6.677 1.00 0.00 H new ATOM 0 H72 DT A 15 -1.121 10.119 -6.622 1.00 0.00 H new ATOM 0 H73 DT A 15 -2.443 11.310 -6.562 1.00 0.00 H new ATOM 0 H6 DT A 15 0.686 11.794 -4.768 1.00 0.00 H new ATOM 475 P DG A 16 4.929 13.872 -4.486 1.00 0.00 P ATOM 476 OP1 DG A 16 6.153 14.664 -4.246 1.00 0.00 O ATOM 477 OP2 DG A 16 4.177 14.115 -5.736 1.00 0.00 O ATOM 478 O5' DG A 16 5.244 12.302 -4.329 1.00 0.00 O ATOM 479 C5' DG A 16 5.955 11.784 -3.212 1.00 0.00 C ATOM 480 C4' DG A 16 5.909 10.250 -3.219 1.00 0.00 C ATOM 481 O4' DG A 16 4.570 9.789 -3.318 1.00 0.00 O ATOM 482 C3' DG A 16 6.705 9.653 -4.390 1.00 0.00 C ATOM 483 O3' DG A 16 7.492 8.529 -4.017 1.00 0.00 O ATOM 484 C2' DG A 16 5.593 9.185 -5.315 1.00 0.00 C ATOM 485 C1' DG A 16 4.533 8.771 -4.295 1.00 0.00 C ATOM 486 N9 DG A 16 3.176 8.588 -4.861 1.00 0.00 N ATOM 487 C8 DG A 16 2.803 8.510 -6.182 1.00 0.00 C ATOM 488 N7 DG A 16 1.539 8.266 -6.372 1.00 0.00 N ATOM 489 C5 DG A 16 1.027 8.146 -5.078 1.00 0.00 C ATOM 490 C6 DG A 16 -0.302 7.863 -4.611 1.00 0.00 C ATOM 491 O6 DG A 16 -1.333 7.667 -5.243 1.00 0.00 O ATOM 492 N1 DG A 16 -0.397 7.828 -3.236 1.00 0.00 N ATOM 493 C2 DG A 16 0.639 8.035 -2.386 1.00 0.00 C ATOM 494 N2 DG A 16 0.394 7.973 -1.095 1.00 0.00 N ATOM 495 N3 DG A 16 1.884 8.302 -2.781 1.00 0.00 N ATOM 496 C4 DG A 16 2.022 8.344 -4.145 1.00 0.00 C ATOM 0 H5' DG A 16 5.521 12.164 -2.287 1.00 0.00 H new ATOM 0 H5'' DG A 16 6.990 12.124 -3.241 1.00 0.00 H new ATOM 0 H4' DG A 16 6.358 9.925 -2.280 1.00 0.00 H new ATOM 0 H3' DG A 16 7.409 10.371 -4.811 1.00 0.00 H new ATOM 0 H2' DG A 16 5.244 9.978 -5.976 1.00 0.00 H new ATOM 0 H2'' DG A 16 5.904 8.355 -5.949 1.00 0.00 H new ATOM 0 H1' DG A 16 4.756 7.784 -3.889 1.00 0.00 H new ATOM 0 H8 DG A 16 3.502 8.641 -6.995 1.00 0.00 H new ATOM 0 H1 DG A 16 -1.312 7.632 -2.829 1.00 0.00 H new ATOM 0 H21 DG A 16 1.148 8.123 -0.425 1.00 0.00 H new ATOM 0 H22 DG A 16 -0.550 7.775 -0.764 1.00 0.00 H new ATOM 508 P DG A 17 8.808 8.667 -3.090 1.00 0.00 P ATOM 509 OP1 DG A 17 9.204 10.089 -2.984 1.00 0.00 O ATOM 510 OP2 DG A 17 9.828 7.687 -3.514 1.00 0.00 O ATOM 511 O5' DG A 17 8.125 8.169 -1.716 1.00 0.00 O ATOM 512 C5' DG A 17 8.065 8.993 -0.561 1.00 0.00 C ATOM 513 C4' DG A 17 7.197 8.363 0.538 1.00 0.00 C ATOM 514 O4' DG A 17 5.912 7.978 0.054 1.00 0.00 O ATOM 515 C3' DG A 17 7.860 7.124 1.135 1.00 0.00 C ATOM 516 O3' DG A 17 7.623 7.124 2.531 1.00 0.00 O ATOM 517 C2' DG A 17 7.171 5.983 0.400 1.00 0.00 C ATOM 518 C1' DG A 17 5.787 6.558 0.092 1.00 0.00 C ATOM 519 N9 DG A 17 5.207 6.059 -1.178 1.00 0.00 N ATOM 520 C8 DG A 17 5.788 5.945 -2.418 1.00 0.00 C ATOM 521 N7 DG A 17 4.979 5.513 -3.349 1.00 0.00 N ATOM 522 C5 DG A 17 3.770 5.309 -2.677 1.00 0.00 C ATOM 523 C6 DG A 17 2.484 4.861 -3.142 1.00 0.00 C ATOM 524 O6 DG A 17 2.126 4.546 -4.275 1.00 0.00 O ATOM 525 N1 DG A 17 1.535 4.792 -2.138 1.00 0.00 N ATOM 526 C2 DG A 17 1.794 5.065 -0.826 1.00 0.00 C ATOM 527 N2 DG A 17 0.825 4.934 0.048 1.00 0.00 N ATOM 528 N3 DG A 17 2.968 5.496 -0.361 1.00 0.00 N ATOM 529 C4 DG A 17 3.916 5.610 -1.339 1.00 0.00 C ATOM 0 H5' DG A 17 7.661 9.969 -0.830 1.00 0.00 H new ATOM 0 H5'' DG A 17 9.072 9.159 -0.179 1.00 0.00 H new ATOM 0 H4' DG A 17 7.084 9.134 1.300 1.00 0.00 H new ATOM 0 H3' DG A 17 8.942 7.060 1.020 1.00 0.00 H new ATOM 0 H2' DG A 17 7.705 5.708 -0.509 1.00 0.00 H new ATOM 0 H2'' DG A 17 7.107 5.086 1.016 1.00 0.00 H new ATOM 0 H1' DG A 17 5.099 6.234 0.873 1.00 0.00 H new ATOM 0 H8 DG A 17 6.823 6.191 -2.607 1.00 0.00 H new ATOM 0 H1 DG A 17 0.585 4.521 -2.393 1.00 0.00 H new ATOM 0 H21 DG A 17 0.997 5.133 1.034 1.00 0.00 H new ATOM 0 H22 DG A 17 -0.100 4.633 -0.258 1.00 0.00 H new ATOM 541 P DT A 18 8.361 6.085 3.511 1.00 0.00 P ATOM 542 OP1 DT A 18 8.688 6.772 4.779 1.00 0.00 O ATOM 543 OP2 DT A 18 9.454 5.398 2.789 1.00 0.00 O ATOM 544 O5' DT A 18 7.105 5.095 3.693 1.00 0.00 O ATOM 545 C5' DT A 18 6.059 5.406 4.599 1.00 0.00 C ATOM 546 C4' DT A 18 5.092 4.231 4.775 1.00 0.00 C ATOM 547 O4' DT A 18 4.252 4.059 3.644 1.00 0.00 O ATOM 548 C3' DT A 18 5.814 2.914 5.057 1.00 0.00 C ATOM 549 O3' DT A 18 5.881 2.703 6.453 1.00 0.00 O ATOM 550 C2' DT A 18 4.941 1.878 4.361 1.00 0.00 C ATOM 551 C1' DT A 18 4.130 2.681 3.338 1.00 0.00 C ATOM 552 N1 DT A 18 4.528 2.483 1.920 1.00 0.00 N ATOM 553 C2 DT A 18 3.513 2.234 0.986 1.00 0.00 C ATOM 554 O2 DT A 18 2.329 2.088 1.285 1.00 0.00 O ATOM 555 N3 DT A 18 3.895 2.134 -0.332 1.00 0.00 N ATOM 556 C4 DT A 18 5.188 2.177 -0.804 1.00 0.00 C ATOM 557 O4 DT A 18 5.380 2.045 -2.009 1.00 0.00 O ATOM 558 C5 DT A 18 6.197 2.406 0.228 1.00 0.00 C ATOM 559 C7 DT A 18 7.659 2.486 -0.138 1.00 0.00 C ATOM 560 C6 DT A 18 5.844 2.565 1.530 1.00 0.00 C ATOM 0 H5' DT A 18 5.512 6.276 4.237 1.00 0.00 H new ATOM 0 H5'' DT A 18 6.484 5.676 5.566 1.00 0.00 H new ATOM 0 H4' DT A 18 4.482 4.488 5.641 1.00 0.00 H new ATOM 0 H3' DT A 18 6.843 2.881 4.700 1.00 0.00 H new ATOM 0 H2' DT A 18 5.546 1.112 3.875 1.00 0.00 H new ATOM 0 H2'' DT A 18 4.290 1.367 5.070 1.00 0.00 H new ATOM 0 H1' DT A 18 3.106 2.315 3.420 1.00 0.00 H new ATOM 0 H3 DT A 18 3.153 2.017 -1.022 1.00 0.00 H new ATOM 0 H71 DT A 18 8.173 3.146 0.560 1.00 0.00 H new ATOM 0 H72 DT A 18 8.101 1.491 -0.089 1.00 0.00 H new ATOM 0 H73 DT A 18 7.760 2.878 -1.150 1.00 0.00 H new ATOM 0 H6 DT A 18 6.607 2.758 2.269 1.00 0.00 H new ATOM 573 P DG A 19 6.937 1.668 7.089 1.00 0.00 P ATOM 574 OP1 DG A 19 7.152 1.996 8.514 1.00 0.00 O ATOM 575 OP2 DG A 19 8.122 1.520 6.218 1.00 0.00 O ATOM 576 O5' DG A 19 6.060 0.331 6.943 1.00 0.00 O ATOM 577 C5' DG A 19 5.195 -0.109 7.974 1.00 0.00 C ATOM 578 C4' DG A 19 4.731 -1.545 7.706 1.00 0.00 C ATOM 579 O4' DG A 19 3.796 -1.595 6.628 1.00 0.00 O ATOM 580 C3' DG A 19 5.889 -2.486 7.358 1.00 0.00 C ATOM 581 O3' DG A 19 6.483 -3.139 8.463 1.00 0.00 O ATOM 582 C2' DG A 19 5.177 -3.477 6.449 1.00 0.00 C ATOM 583 C1' DG A 19 4.200 -2.578 5.686 1.00 0.00 C ATOM 584 N9 DG A 19 4.818 -1.939 4.487 1.00 0.00 N ATOM 585 C8 DG A 19 6.135 -1.668 4.179 1.00 0.00 C ATOM 586 N7 DG A 19 6.346 -1.340 2.936 1.00 0.00 N ATOM 587 C5 DG A 19 5.075 -1.371 2.369 1.00 0.00 C ATOM 588 C6 DG A 19 4.640 -1.164 1.018 1.00 0.00 C ATOM 589 O6 DG A 19 5.305 -0.909 0.020 1.00 0.00 O ATOM 590 N1 DG A 19 3.272 -1.297 0.863 1.00 0.00 N ATOM 591 C2 DG A 19 2.413 -1.559 1.892 1.00 0.00 C ATOM 592 N2 DG A 19 1.132 -1.620 1.630 1.00 0.00 N ATOM 593 N3 DG A 19 2.784 -1.784 3.150 1.00 0.00 N ATOM 594 C4 DG A 19 4.133 -1.681 3.325 1.00 0.00 C ATOM 0 H5' DG A 19 4.331 0.553 8.040 1.00 0.00 H new ATOM 0 H5'' DG A 19 5.709 -0.059 8.934 1.00 0.00 H new ATOM 0 H4' DG A 19 4.266 -1.876 8.635 1.00 0.00 H new ATOM 0 H3' DG A 19 6.738 -1.959 6.924 1.00 0.00 H new ATOM 0 H2' DG A 19 5.871 -3.985 5.779 1.00 0.00 H new ATOM 0 H2'' DG A 19 4.659 -4.250 7.017 1.00 0.00 H new ATOM 0 H1' DG A 19 3.364 -3.159 5.296 1.00 0.00 H new ATOM 0 H8 DG A 19 6.928 -1.723 4.910 1.00 0.00 H new ATOM 0 H1 DG A 19 2.882 -1.193 -0.074 1.00 0.00 H new ATOM 0 H21 DG A 19 0.467 -1.814 2.379 1.00 0.00 H new ATOM 0 H22 DG A 19 0.799 -1.473 0.677 1.00 0.00 H new HETATM 606 C1 J32 A 20 -3.616 -5.539 -1.364 1.00 0.00 C HETATM 607 C2 J32 A 20 -3.113 -5.554 -2.668 1.00 0.00 C HETATM 608 C3 J32 A 20 -1.737 -5.474 -2.893 1.00 0.00 C HETATM 609 C4 J32 A 20 0.524 -5.316 -2.031 1.00 0.00 C HETATM 610 C5 J32 A 20 1.403 -5.194 -0.950 1.00 0.00 C HETATM 611 C6 J32 A 20 1.746 -5.014 1.464 1.00 0.00 C HETATM 612 C7 J32 A 20 1.244 -5.037 2.762 1.00 0.00 C HETATM 613 P J32 A 20 8.032 -3.502 8.464 1.00 0.00 P HETATM 614 OP1 J32 A 20 8.050 -4.570 9.524 1.00 0.00 O HETATM 615 OP2 J32 A 20 8.669 -2.181 8.797 1.00 0.00 O HETATM 616 O5' J32 A 20 8.335 -3.991 6.976 1.00 0.00 O HETATM 617 C2' J32 A 20 9.654 -4.457 6.565 1.00 0.00 C HETATM 618 C3' J32 A 20 10.013 -3.790 5.206 1.00 0.00 C HETATM 619 O1 J32 A 20 10.180 -4.773 4.141 1.00 0.00 O HETATM 620 C4' J32 A 20 9.918 -4.386 2.759 1.00 0.00 C HETATM 621 C2A J32 A 20 8.450 -4.528 2.370 1.00 0.00 C HETATM 622 C12 J32 A 20 8.043 -4.484 1.020 1.00 0.00 C HETATM 623 C11 J32 A 20 6.693 -4.632 0.673 1.00 0.00 C HETATM 624 C4A J32 A 20 5.757 -4.775 1.693 1.00 0.00 C HETATM 625 C14 J32 A 20 6.143 -4.816 3.024 1.00 0.00 C HETATM 626 C13 J32 A 20 7.481 -4.716 3.361 1.00 0.00 C HETATM 627 C15 J32 A 20 4.343 -4.860 1.507 1.00 0.00 C HETATM 628 C16 J32 A 20 3.176 -4.929 1.443 1.00 0.00 C HETATM 629 C8 J32 A 20 -0.121 -5.093 2.988 1.00 0.00 C HETATM 630 C8A J32 A 20 -0.993 -5.194 1.896 1.00 0.00 C HETATM 631 C1B J32 A 20 -0.482 -5.226 0.583 1.00 0.00 C HETATM 632 C1A J32 A 20 -1.358 -5.342 -0.501 1.00 0.00 C HETATM 633 C3A J32 A 20 -0.857 -5.377 -1.810 1.00 0.00 C HETATM 634 C5A J32 A 20 0.902 -5.139 0.357 1.00 0.00 C HETATM 635 C1C J32 A 20 -2.740 -5.429 -0.280 1.00 0.00 C HETATM 636 C10 J32 A 20 -3.244 -5.394 1.025 1.00 0.00 C HETATM 637 C9 J32 A 20 -2.372 -5.274 2.111 1.00 0.00 C HETATM 638 C1' J32 A 20 9.629 -6.002 6.506 1.00 0.00 C HETATM 639 O3' J32 A 20 9.396 -6.451 7.730 1.00 0.00 O ATOM 660 P DG A 21 8.880 -7.848 7.971 1.00 0.00 P ATOM 661 OP1 DG A 21 9.070 -8.262 9.377 1.00 0.00 O ATOM 662 OP2 DG A 21 9.540 -8.786 7.039 1.00 0.00 O ATOM 663 O5' DG A 21 7.318 -7.954 7.640 1.00 0.00 O ATOM 664 C5' DG A 21 6.344 -7.255 8.393 1.00 0.00 C ATOM 665 C4' DG A 21 4.942 -7.389 7.783 1.00 0.00 C ATOM 666 O4' DG A 21 4.835 -6.683 6.551 1.00 0.00 O ATOM 667 C3' DG A 21 4.487 -8.832 7.549 1.00 0.00 C ATOM 668 O3' DG A 21 3.773 -9.306 8.679 1.00 0.00 O ATOM 669 C2' DG A 21 3.560 -8.662 6.352 1.00 0.00 C ATOM 670 C1' DG A 21 4.135 -7.467 5.598 1.00 0.00 C ATOM 671 N9 DG A 21 5.063 -7.868 4.511 1.00 0.00 N ATOM 672 C8 DG A 21 6.434 -7.932 4.516 1.00 0.00 C ATOM 673 N7 DG A 21 6.970 -8.099 3.341 1.00 0.00 N ATOM 674 C5 DG A 21 5.872 -8.185 2.483 1.00 0.00 C ATOM 675 C6 DG A 21 5.787 -8.328 1.056 1.00 0.00 C ATOM 676 O6 DG A 21 6.688 -8.415 0.225 1.00 0.00 O ATOM 677 N1 DG A 21 4.481 -8.355 0.593 1.00 0.00 N ATOM 678 C2 DG A 21 3.380 -8.339 1.405 1.00 0.00 C ATOM 679 N2 DG A 21 2.202 -8.512 0.852 1.00 0.00 N ATOM 680 N3 DG A 21 3.425 -8.191 2.730 1.00 0.00 N ATOM 681 C4 DG A 21 4.701 -8.102 3.207 1.00 0.00 C ATOM 0 H5' DG A 21 6.616 -6.201 8.449 1.00 0.00 H new ATOM 0 H5'' DG A 21 6.333 -7.636 9.414 1.00 0.00 H new ATOM 0 H4' DG A 21 4.285 -6.953 8.536 1.00 0.00 H new ATOM 0 H3' DG A 21 5.295 -9.546 7.386 1.00 0.00 H new ATOM 0 H2' DG A 21 3.546 -9.556 5.729 1.00 0.00 H new ATOM 0 H2'' DG A 21 2.533 -8.477 6.667 1.00 0.00 H new ATOM 0 H1' DG A 21 3.322 -6.918 5.123 1.00 0.00 H new ATOM 0 H8 DG A 21 7.020 -7.851 5.420 1.00 0.00 H new ATOM 0 H1 DG A 21 4.331 -8.389 -0.415 1.00 0.00 H new ATOM 0 H21 DG A 21 1.361 -8.505 1.430 1.00 0.00 H new ATOM 0 H22 DG A 21 2.127 -8.653 -0.155 1.00 0.00 H new ATOM 693 P DT A 22 3.654 -10.879 9.018 1.00 0.00 P ATOM 694 OP1 DT A 22 3.017 -11.072 10.337 1.00 0.00 O ATOM 695 OP2 DT A 22 4.957 -11.531 8.772 1.00 0.00 O ATOM 696 O5' DT A 22 2.626 -11.330 7.860 1.00 0.00 O ATOM 697 C5' DT A 22 1.259 -10.963 7.885 1.00 0.00 C ATOM 698 C4' DT A 22 0.503 -11.582 6.701 1.00 0.00 C ATOM 699 O4' DT A 22 1.002 -11.095 5.462 1.00 0.00 O ATOM 700 C3' DT A 22 0.559 -13.117 6.690 1.00 0.00 C ATOM 701 O3' DT A 22 -0.741 -13.683 6.734 1.00 0.00 O ATOM 702 C2' DT A 22 1.250 -13.484 5.381 1.00 0.00 C ATOM 703 C1' DT A 22 1.392 -12.164 4.613 1.00 0.00 C ATOM 704 N1 DT A 22 2.761 -11.935 4.083 1.00 0.00 N ATOM 705 C2 DT A 22 2.918 -11.703 2.709 1.00 0.00 C ATOM 706 O2 DT A 22 1.992 -11.658 1.896 1.00 0.00 O ATOM 707 N3 DT A 22 4.210 -11.552 2.266 1.00 0.00 N ATOM 708 C4 DT A 22 5.355 -11.598 3.028 1.00 0.00 C ATOM 709 O4 DT A 22 6.439 -11.472 2.471 1.00 0.00 O ATOM 710 C5 DT A 22 5.115 -11.811 4.449 1.00 0.00 C ATOM 711 C7 DT A 22 6.264 -11.841 5.427 1.00 0.00 C ATOM 712 C6 DT A 22 3.856 -11.987 4.920 1.00 0.00 C ATOM 0 H5' DT A 22 1.169 -9.877 7.851 1.00 0.00 H new ATOM 0 H5'' DT A 22 0.807 -11.291 8.821 1.00 0.00 H new ATOM 0 H4' DT A 22 -0.537 -11.282 6.828 1.00 0.00 H new ATOM 0 H3' DT A 22 1.090 -13.499 7.562 1.00 0.00 H new ATOM 0 H2' DT A 22 2.223 -13.939 5.564 1.00 0.00 H new ATOM 0 H2'' DT A 22 0.662 -14.207 4.815 1.00 0.00 H new ATOM 0 HO3' DT A 22 -0.673 -14.661 6.724 1.00 0.00 H new ATOM 0 H1' DT A 22 0.741 -12.219 3.741 1.00 0.00 H new ATOM 0 H3 DT A 22 4.333 -11.389 1.267 1.00 0.00 H new ATOM 0 H71 DT A 22 7.158 -12.215 4.927 1.00 0.00 H new ATOM 0 H72 DT A 22 6.451 -10.834 5.800 1.00 0.00 H new ATOM 0 H73 DT A 22 6.014 -12.496 6.262 1.00 0.00 H new ATOM 0 H6 DT A 22 3.707 -12.172 5.974 1.00 0.00 H new TER 726 DT A 22