USER MOD reduce.3.24.130724 H: found=0, std=0, add=271, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 277 hydrogens (6 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DC O5' : rot 180:sc= -0.365 USER MOD Single : A 3 DT C7 :methyl 150:sc= -0.0125 (180deg=-0.0125) USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : B 13 DG O5' : rot 180:sc= -0.0425 USER MOD Single : B 20 DT C7 :methyl 150:sc=-0.00176 (180deg=-0.00176) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -9.976 10.511 -12.910 1.00 1.50 O ATOM 2 C5' DC A 1 -10.372 9.609 -13.948 1.00 1.49 C ATOM 3 C4' DC A 1 -9.793 8.230 -13.711 1.00 1.35 C ATOM 4 O4' DC A 1 -8.605 8.108 -14.521 1.00 1.27 O ATOM 5 C3' DC A 1 -9.359 7.947 -12.270 1.00 1.28 C ATOM 6 O3' DC A 1 -10.282 7.050 -11.638 1.00 1.35 O ATOM 7 C2' DC A 1 -7.997 7.277 -12.407 1.00 1.12 C ATOM 8 C1' DC A 1 -7.678 7.250 -13.888 1.00 1.12 C ATOM 9 N1 DC A 1 -6.329 7.736 -14.199 1.00 1.05 N ATOM 10 C2 DC A 1 -5.540 7.041 -15.118 1.00 1.00 C ATOM 11 O2 DC A 1 -5.999 6.024 -15.658 1.00 1.01 O ATOM 12 N3 DC A 1 -4.295 7.494 -15.393 1.00 0.97 N ATOM 13 C4 DC A 1 -3.839 8.595 -14.791 1.00 0.99 C ATOM 14 N4 DC A 1 -2.608 9.008 -15.093 1.00 1.00 N ATOM 15 C5 DC A 1 -4.627 9.322 -13.851 1.00 1.04 C ATOM 16 C6 DC A 1 -5.854 8.858 -13.589 1.00 1.06 C ATOM 0 H5' DC A 1 -10.037 9.988 -14.913 1.00 1.49 H new ATOM 0 H5'' DC A 1 -11.460 9.550 -13.989 1.00 1.49 H new ATOM 0 H4' DC A 1 -10.588 7.526 -13.956 1.00 1.35 H new ATOM 0 H3' DC A 1 -9.325 8.852 -11.663 1.00 1.28 H new ATOM 0 H2' DC A 1 -7.236 7.829 -11.856 1.00 1.12 H new ATOM 0 H2'' DC A 1 -8.018 6.268 -11.996 1.00 1.12 H new ATOM 0 HO5' DC A 1 -10.359 11.397 -13.082 1.00 1.50 H new ATOM 0 H1' DC A 1 -7.735 6.217 -14.231 1.00 1.12 H new ATOM 0 H41 DC A 1 -2.228 9.845 -14.651 1.00 1.00 H new ATOM 0 H42 DC A 1 -2.046 8.487 -15.766 1.00 1.00 H new ATOM 0 H5 DC A 1 -4.248 10.212 -13.370 1.00 1.04 H new ATOM 0 H6 DC A 1 -6.479 9.382 -12.881 1.00 1.06 H new ATOM 29 P DC A 2 -9.917 6.398 -10.211 1.00 1.34 P ATOM 30 OP1 DC A 2 -11.181 6.177 -9.464 1.00 1.54 O ATOM 31 OP2 DC A 2 -8.838 7.216 -9.599 1.00 1.30 O ATOM 32 O5' DC A 2 -9.300 4.975 -10.580 1.00 1.20 O ATOM 33 C5' DC A 2 -9.916 4.142 -11.562 1.00 1.22 C ATOM 34 C4' DC A 2 -9.102 2.889 -11.780 1.00 1.12 C ATOM 35 O4' DC A 2 -7.861 3.257 -12.423 1.00 1.02 O ATOM 36 C3' DC A 2 -8.729 2.106 -10.518 1.00 1.10 C ATOM 37 O3' DC A 2 -8.930 0.704 -10.736 1.00 1.14 O ATOM 38 C2' DC A 2 -7.256 2.416 -10.311 1.00 0.97 C ATOM 39 C1' DC A 2 -6.753 2.770 -11.694 1.00 0.90 C ATOM 40 N1 DC A 2 -5.741 3.825 -11.668 1.00 0.81 N ATOM 41 C2 DC A 2 -4.531 3.642 -12.335 1.00 0.71 C ATOM 42 O2 DC A 2 -4.340 2.585 -12.950 1.00 0.70 O ATOM 43 N3 DC A 2 -3.600 4.623 -12.291 1.00 0.64 N ATOM 44 C4 DC A 2 -3.849 5.745 -11.612 1.00 0.67 C ATOM 45 N4 DC A 2 -2.903 6.686 -11.595 1.00 0.61 N ATOM 46 C5 DC A 2 -5.081 5.952 -10.922 1.00 0.77 C ATOM 47 C6 DC A 2 -5.988 4.976 -10.983 1.00 0.84 C ATOM 0 H5' DC A 2 -10.013 4.687 -12.501 1.00 1.22 H new ATOM 0 H5'' DC A 2 -10.924 3.877 -11.242 1.00 1.22 H new ATOM 0 H4' DC A 2 -9.742 2.238 -12.375 1.00 1.12 H new ATOM 0 H3' DC A 2 -9.333 2.377 -9.652 1.00 1.10 H new ATOM 0 H2' DC A 2 -7.117 3.242 -9.613 1.00 0.97 H new ATOM 0 H2'' DC A 2 -6.722 1.559 -9.901 1.00 0.97 H new ATOM 0 H1' DC A 2 -6.301 1.883 -12.137 1.00 0.90 H new ATOM 0 H41 DC A 2 -3.058 7.556 -11.086 1.00 0.61 H new ATOM 0 H42 DC A 2 -2.024 6.535 -12.091 1.00 0.61 H new ATOM 0 H5 DC A 2 -5.271 6.862 -10.373 1.00 0.77 H new ATOM 0 H6 DC A 2 -6.936 5.101 -10.480 1.00 0.84 H new ATOM 59 P DT A 3 -8.262 -0.367 -9.738 1.00 1.15 P ATOM 60 OP1 DT A 3 -8.946 -1.671 -9.930 1.00 1.28 O ATOM 61 OP2 DT A 3 -8.213 0.243 -8.384 1.00 1.19 O ATOM 62 O5' DT A 3 -6.766 -0.502 -10.272 1.00 1.01 O ATOM 63 C5' DT A 3 -6.502 -0.963 -11.598 1.00 0.96 C ATOM 64 C4' DT A 3 -5.281 -1.853 -11.615 1.00 0.92 C ATOM 65 O4' DT A 3 -4.105 -1.038 -11.828 1.00 0.81 O ATOM 66 C3' DT A 3 -5.018 -2.642 -10.332 1.00 0.99 C ATOM 67 O3' DT A 3 -4.501 -3.940 -10.672 1.00 1.05 O ATOM 68 C2' DT A 3 -4.002 -1.784 -9.600 1.00 0.91 C ATOM 69 C1' DT A 3 -3.212 -1.165 -10.735 1.00 0.79 C ATOM 70 N1 DT A 3 -2.686 0.167 -10.437 1.00 0.70 N ATOM 71 C2 DT A 3 -1.405 0.481 -10.820 1.00 0.62 C ATOM 72 O2 DT A 3 -0.667 -0.304 -11.389 1.00 0.63 O ATOM 73 N3 DT A 3 -1.016 1.754 -10.510 1.00 0.54 N ATOM 74 C4 DT A 3 -1.756 2.716 -9.863 1.00 0.55 C ATOM 75 O4 DT A 3 -1.267 3.824 -9.656 1.00 0.49 O ATOM 76 C5 DT A 3 -3.088 2.313 -9.472 1.00 0.66 C ATOM 77 C7 DT A 3 -3.883 3.228 -8.598 1.00 0.72 C ATOM 78 C6 DT A 3 -3.490 1.072 -9.789 1.00 0.72 C ATOM 0 H5' DT A 3 -6.348 -0.112 -12.261 1.00 0.96 H new ATOM 0 H5'' DT A 3 -7.364 -1.511 -11.977 1.00 0.96 H new ATOM 0 H4' DT A 3 -5.481 -2.572 -12.409 1.00 0.92 H new ATOM 0 H3' DT A 3 -5.901 -2.826 -9.720 1.00 0.99 H new ATOM 0 H2' DT A 3 -4.482 -1.027 -8.980 1.00 0.91 H new ATOM 0 H2'' DT A 3 -3.368 -2.379 -8.942 1.00 0.91 H new ATOM 0 H1' DT A 3 -2.353 -1.807 -10.932 1.00 0.79 H new ATOM 0 H3 DT A 3 -0.072 2.020 -10.790 1.00 0.54 H new ATOM 0 H71 DT A 3 -4.945 3.103 -8.811 1.00 0.72 H new ATOM 0 H72 DT A 3 -3.692 2.989 -7.552 1.00 0.72 H new ATOM 0 H73 DT A 3 -3.593 4.260 -8.793 1.00 0.72 H new ATOM 0 H6 DT A 3 -4.492 0.771 -9.522 1.00 0.72 H new ATOM 91 P DC A 4 -3.506 -4.708 -9.666 1.00 1.15 P ATOM 92 OP1 DC A 4 -3.428 -6.119 -10.122 1.00 1.30 O ATOM 93 OP2 DC A 4 -3.920 -4.415 -8.269 1.00 1.25 O ATOM 94 O5' DC A 4 -2.090 -4.025 -9.930 1.00 1.03 O ATOM 95 C5' DC A 4 -1.253 -4.450 -11.011 1.00 0.99 C ATOM 96 C4' DC A 4 0.148 -4.721 -10.514 1.00 0.96 C ATOM 97 O4' DC A 4 0.781 -3.462 -10.179 1.00 0.91 O ATOM 98 C3' DC A 4 0.234 -5.556 -9.239 1.00 1.03 C ATOM 99 O3' DC A 4 1.490 -6.246 -9.183 1.00 1.05 O ATOM 100 C2' DC A 4 0.144 -4.496 -8.158 1.00 1.00 C ATOM 101 C1' DC A 4 0.981 -3.374 -8.773 1.00 0.89 C ATOM 102 N1 DC A 4 0.647 -1.991 -8.367 1.00 0.81 N ATOM 103 C2 DC A 4 1.637 -1.004 -8.487 1.00 0.72 C ATOM 104 O2 DC A 4 2.764 -1.324 -8.893 1.00 0.73 O ATOM 105 N3 DC A 4 1.339 0.274 -8.156 1.00 0.65 N ATOM 106 C4 DC A 4 0.119 0.580 -7.712 1.00 0.68 C ATOM 107 N4 DC A 4 -0.132 1.846 -7.385 1.00 0.63 N ATOM 108 C5 DC A 4 -0.902 -0.401 -7.573 1.00 0.78 C ATOM 109 C6 DC A 4 -0.599 -1.661 -7.904 1.00 0.84 C ATOM 0 H5' DC A 4 -1.230 -3.683 -11.785 1.00 0.99 H new ATOM 0 H5'' DC A 4 -1.665 -5.350 -11.467 1.00 0.99 H new ATOM 0 H4' DC A 4 0.625 -5.272 -11.325 1.00 0.96 H new ATOM 0 H3' DC A 4 -0.532 -6.327 -9.155 1.00 1.03 H new ATOM 0 H2' DC A 4 -0.884 -4.187 -7.969 1.00 1.00 H new ATOM 0 H2'' DC A 4 0.552 -4.841 -7.208 1.00 1.00 H new ATOM 0 H1' DC A 4 2.002 -3.529 -8.425 1.00 0.89 H new ATOM 0 H41 DC A 4 -1.056 2.111 -7.042 1.00 0.63 H new ATOM 0 H42 DC A 4 0.599 2.551 -7.477 1.00 0.63 H new ATOM 0 H5 DC A 4 -1.886 -0.138 -7.213 1.00 0.78 H new ATOM 0 H6 DC A 4 -1.350 -2.431 -7.804 1.00 0.84 H new ATOM 121 P DA A 5 1.814 -7.229 -7.951 1.00 1.16 P ATOM 122 OP1 DA A 5 2.109 -8.567 -8.522 1.00 1.36 O ATOM 123 OP2 DA A 5 0.750 -7.090 -6.924 1.00 1.37 O ATOM 124 O5' DA A 5 3.168 -6.648 -7.343 1.00 0.92 O ATOM 125 C5' DA A 5 4.084 -5.912 -8.158 1.00 0.79 C ATOM 126 C4' DA A 5 5.063 -5.149 -7.294 1.00 0.62 C ATOM 127 O4' DA A 5 4.563 -3.808 -7.124 1.00 0.58 O ATOM 128 C3' DA A 5 5.295 -5.710 -5.886 1.00 0.64 C ATOM 129 O3' DA A 5 6.642 -6.197 -5.787 1.00 0.74 O ATOM 130 C2' DA A 5 5.075 -4.524 -4.952 1.00 0.62 C ATOM 131 C1' DA A 5 4.948 -3.315 -5.861 1.00 0.57 C ATOM 132 N9 DA A 5 3.917 -2.386 -5.422 1.00 0.54 N ATOM 133 C8 DA A 5 2.645 -2.750 -5.103 1.00 0.54 C ATOM 134 N7 DA A 5 1.874 -1.746 -4.760 1.00 0.52 N ATOM 135 C5 DA A 5 2.712 -0.643 -4.849 1.00 0.49 C ATOM 136 C6 DA A 5 2.508 0.727 -4.605 1.00 0.47 C ATOM 137 N6 DA A 5 1.345 1.249 -4.214 1.00 0.46 N ATOM 138 N1 DA A 5 3.558 1.557 -4.779 1.00 0.46 N ATOM 139 C2 DA A 5 4.726 1.038 -5.178 1.00 0.48 C ATOM 140 N3 DA A 5 5.042 -0.228 -5.433 1.00 0.51 N ATOM 141 C4 DA A 5 3.978 -1.026 -5.249 1.00 0.51 C ATOM 0 H5' DA A 5 3.536 -5.219 -8.797 1.00 0.79 H new ATOM 0 H5'' DA A 5 4.624 -6.593 -8.816 1.00 0.79 H new ATOM 0 H4' DA A 5 6.016 -5.217 -7.819 1.00 0.62 H new ATOM 0 H3' DA A 5 4.632 -6.540 -5.641 1.00 0.64 H new ATOM 0 H2' DA A 5 4.177 -4.659 -4.350 1.00 0.62 H new ATOM 0 H2'' DA A 5 5.909 -4.409 -4.259 1.00 0.62 H new ATOM 0 H1' DA A 5 5.897 -2.778 -5.866 1.00 0.57 H new ATOM 0 H8 DA A 5 2.301 -3.774 -5.130 1.00 0.54 H new ATOM 0 H61 DA A 5 1.265 2.253 -4.054 1.00 0.46 H new ATOM 0 H62 DA A 5 0.536 0.644 -4.075 1.00 0.46 H new ATOM 0 H2 DA A 5 5.527 1.750 -5.312 1.00 0.48 H new ATOM 153 P DG A 6 7.309 -6.435 -4.342 1.00 0.85 P ATOM 154 OP1 DG A 6 8.600 -7.141 -4.537 1.00 1.03 O ATOM 155 OP2 DG A 6 6.273 -7.032 -3.460 1.00 0.85 O ATOM 156 O5' DG A 6 7.618 -4.961 -3.818 1.00 0.81 O ATOM 157 C5' DG A 6 8.571 -4.126 -4.481 1.00 0.83 C ATOM 158 C4' DG A 6 8.837 -2.885 -3.661 1.00 0.78 C ATOM 159 O4' DG A 6 7.618 -2.106 -3.549 1.00 0.73 O ATOM 160 C3' DG A 6 9.298 -3.161 -2.224 1.00 0.75 C ATOM 161 O3' DG A 6 10.528 -2.477 -1.956 1.00 0.76 O ATOM 162 C2' DG A 6 8.181 -2.601 -1.355 1.00 0.69 C ATOM 163 C1' DG A 6 7.558 -1.557 -2.250 1.00 0.68 C ATOM 164 N9 DG A 6 6.167 -1.242 -1.944 1.00 0.63 N ATOM 165 C8 DG A 6 5.117 -2.120 -1.846 1.00 0.62 C ATOM 166 N7 DG A 6 3.982 -1.540 -1.572 1.00 0.58 N ATOM 167 C5 DG A 6 4.305 -0.193 -1.473 1.00 0.56 C ATOM 168 C6 DG A 6 3.489 0.925 -1.179 1.00 0.53 C ATOM 169 O6 DG A 6 2.274 0.953 -0.958 1.00 0.50 O ATOM 170 N1 DG A 6 4.225 2.103 -1.153 1.00 0.53 N ATOM 171 C2 DG A 6 5.575 2.195 -1.387 1.00 0.56 C ATOM 172 N2 DG A 6 6.107 3.418 -1.318 1.00 0.57 N ATOM 173 N3 DG A 6 6.347 1.160 -1.667 1.00 0.60 N ATOM 174 C4 DG A 6 5.651 0.005 -1.691 1.00 0.59 C ATOM 0 H5' DG A 6 8.197 -3.847 -5.466 1.00 0.83 H new ATOM 0 H5'' DG A 6 9.500 -4.674 -4.636 1.00 0.83 H new ATOM 0 H4' DG A 6 9.637 -2.366 -4.188 1.00 0.78 H new ATOM 0 H3' DG A 6 9.480 -4.220 -2.040 1.00 0.75 H new ATOM 0 H2' DG A 6 7.464 -3.371 -1.071 1.00 0.69 H new ATOM 0 H2'' DG A 6 8.565 -2.167 -0.432 1.00 0.69 H new ATOM 0 H1' DG A 6 8.099 -0.619 -2.122 1.00 0.68 H new ATOM 0 H8 DG A 6 5.221 -3.186 -1.982 1.00 0.62 H new ATOM 0 H1 DG A 6 3.724 2.966 -0.944 1.00 0.53 H new ATOM 0 H21 DG A 6 7.105 3.550 -1.482 1.00 0.57 H new ATOM 0 H22 DG A 6 5.515 4.220 -1.101 1.00 0.57 H new ATOM 186 P DG A 7 11.187 -2.561 -0.492 1.00 0.72 P ATOM 187 OP1 DG A 7 12.299 -1.578 -0.450 1.00 0.75 O ATOM 188 OP2 DG A 7 11.460 -3.988 -0.187 1.00 0.81 O ATOM 189 O5' DG A 7 10.031 -2.055 0.483 1.00 0.57 O ATOM 190 C5' DG A 7 9.914 -0.676 0.837 1.00 0.55 C ATOM 191 C4' DG A 7 9.157 -0.530 2.138 1.00 0.43 C ATOM 192 O4' DG A 7 7.774 -0.219 1.850 1.00 0.42 O ATOM 193 C3' DG A 7 9.136 -1.783 3.023 1.00 0.38 C ATOM 194 O3' DG A 7 9.770 -1.504 4.275 1.00 0.44 O ATOM 195 C2' DG A 7 7.657 -2.091 3.228 1.00 0.37 C ATOM 196 C1' DG A 7 6.967 -0.789 2.856 1.00 0.37 C ATOM 197 N9 DG A 7 5.602 -0.884 2.337 1.00 0.36 N ATOM 198 C8 DG A 7 5.055 -1.847 1.517 1.00 0.37 C ATOM 199 N7 DG A 7 3.796 -1.633 1.241 1.00 0.38 N ATOM 200 C5 DG A 7 3.495 -0.456 1.913 1.00 0.37 C ATOM 201 C6 DG A 7 2.282 0.277 1.985 1.00 0.38 C ATOM 202 O6 DG A 7 1.193 0.019 1.459 1.00 0.40 O ATOM 203 N1 DG A 7 2.420 1.419 2.768 1.00 0.39 N ATOM 204 C2 DG A 7 3.575 1.801 3.407 1.00 0.39 C ATOM 205 N2 DG A 7 3.519 2.929 4.119 1.00 0.42 N ATOM 206 N3 DG A 7 4.707 1.125 3.352 1.00 0.38 N ATOM 207 C4 DG A 7 4.598 0.017 2.592 1.00 0.37 C ATOM 0 H5' DG A 7 9.398 -0.133 0.045 1.00 0.55 H new ATOM 0 H5'' DG A 7 10.905 -0.233 0.934 1.00 0.55 H new ATOM 0 H4' DG A 7 9.684 0.255 2.680 1.00 0.43 H new ATOM 0 H3' DG A 7 9.668 -2.622 2.575 1.00 0.38 H new ATOM 0 H2' DG A 7 7.327 -2.915 2.595 1.00 0.37 H new ATOM 0 H2'' DG A 7 7.446 -2.377 4.258 1.00 0.37 H new ATOM 0 H1' DG A 7 6.863 -0.212 3.775 1.00 0.37 H new ATOM 0 H8 DG A 7 5.611 -2.693 1.141 1.00 0.37 H new ATOM 0 H1 DG A 7 1.602 2.018 2.876 1.00 0.39 H new ATOM 0 H21 DG A 7 4.346 3.261 4.615 1.00 0.42 H new ATOM 0 H22 DG A 7 2.649 3.459 4.167 1.00 0.42 H new ATOM 219 P DC A 8 10.091 -2.705 5.296 1.00 0.50 P ATOM 220 OP1 DC A 8 11.561 -2.912 5.287 1.00 0.54 O ATOM 221 OP2 DC A 8 9.188 -3.846 4.993 1.00 0.48 O ATOM 222 O5' DC A 8 9.682 -2.114 6.718 1.00 0.60 O ATOM 223 C5' DC A 8 10.346 -0.967 7.253 1.00 0.65 C ATOM 224 C4' DC A 8 9.355 -0.058 7.944 1.00 0.64 C ATOM 225 O4' DC A 8 8.124 -0.037 7.181 1.00 0.62 O ATOM 226 C3' DC A 8 8.974 -0.472 9.369 1.00 0.65 C ATOM 227 O3' DC A 8 9.064 0.662 10.239 1.00 0.70 O ATOM 228 C2' DC A 8 7.534 -0.951 9.250 1.00 0.56 C ATOM 229 C1' DC A 8 7.016 -0.187 8.047 1.00 0.55 C ATOM 230 N1 DC A 8 5.954 -0.879 7.302 1.00 0.50 N ATOM 231 C2 DC A 8 4.691 -0.285 7.192 1.00 0.48 C ATOM 232 O2 DC A 8 4.488 0.805 7.745 1.00 0.49 O ATOM 233 N3 DC A 8 3.726 -0.915 6.486 1.00 0.45 N ATOM 234 C4 DC A 8 3.984 -2.088 5.903 1.00 0.44 C ATOM 235 N4 DC A 8 3.005 -2.671 5.214 1.00 0.42 N ATOM 236 C5 DC A 8 5.259 -2.716 6.003 1.00 0.46 C ATOM 237 C6 DC A 8 6.202 -2.085 6.713 1.00 0.49 C ATOM 0 H5' DC A 8 10.850 -0.425 6.453 1.00 0.65 H new ATOM 0 H5'' DC A 8 11.115 -1.281 7.959 1.00 0.65 H new ATOM 0 H4' DC A 8 9.855 0.909 8.005 1.00 0.64 H new ATOM 0 H3' DC A 8 9.627 -1.241 9.781 1.00 0.65 H new ATOM 0 H2' DC A 8 7.479 -2.029 9.097 1.00 0.56 H new ATOM 0 H2'' DC A 8 6.959 -0.727 10.148 1.00 0.56 H new ATOM 0 H1' DC A 8 6.582 0.749 8.398 1.00 0.55 H new ATOM 0 H41 DC A 8 3.168 -3.568 4.756 1.00 0.42 H new ATOM 0 H42 DC A 8 2.092 -2.221 5.144 1.00 0.42 H new ATOM 0 H5 DC A 8 5.457 -3.664 5.525 1.00 0.46 H new ATOM 0 H6 DC A 8 7.176 -2.538 6.822 1.00 0.49 H new ATOM 249 P DC A 9 8.657 0.520 11.789 1.00 0.70 P ATOM 250 OP1 DC A 9 9.458 1.497 12.570 1.00 0.78 O ATOM 251 OP2 DC A 9 8.708 -0.921 12.145 1.00 0.70 O ATOM 252 O5' DC A 9 7.133 0.981 11.825 1.00 0.61 O ATOM 253 C5' DC A 9 6.674 2.074 11.023 1.00 0.60 C ATOM 254 C4' DC A 9 5.254 2.433 11.393 1.00 0.53 C ATOM 255 O4' DC A 9 4.347 1.736 10.503 1.00 0.50 O ATOM 256 C3' DC A 9 4.849 2.044 12.816 1.00 0.45 C ATOM 257 O3' DC A 9 4.130 3.118 13.430 1.00 0.45 O ATOM 258 C2' DC A 9 3.969 0.820 12.623 1.00 0.40 C ATOM 259 C1' DC A 9 3.366 1.038 11.247 1.00 0.43 C ATOM 260 N1 DC A 9 3.026 -0.187 10.498 1.00 0.41 N ATOM 261 C2 DC A 9 1.731 -0.325 9.976 1.00 0.39 C ATOM 262 O2 DC A 9 0.897 0.570 10.182 1.00 0.39 O ATOM 263 N3 DC A 9 1.423 -1.431 9.261 1.00 0.39 N ATOM 264 C4 DC A 9 2.345 -2.376 9.063 1.00 0.42 C ATOM 265 N4 DC A 9 1.995 -3.449 8.356 1.00 0.44 N ATOM 266 C5 DC A 9 3.666 -2.263 9.585 1.00 0.45 C ATOM 267 C6 DC A 9 3.957 -1.168 10.297 1.00 0.44 C ATOM 0 H5' DC A 9 6.726 1.807 9.968 1.00 0.60 H new ATOM 0 H5'' DC A 9 7.324 2.937 11.166 1.00 0.60 H new ATOM 0 H4' DC A 9 5.199 3.519 11.314 1.00 0.53 H new ATOM 0 H3' DC A 9 5.697 1.837 13.468 1.00 0.45 H new ATOM 0 H2' DC A 9 4.548 -0.103 12.667 1.00 0.40 H new ATOM 0 H2'' DC A 9 3.200 0.751 13.393 1.00 0.40 H new ATOM 0 H1' DC A 9 2.422 1.565 11.386 1.00 0.43 H new ATOM 0 H41 DC A 9 2.674 -4.191 8.185 1.00 0.44 H new ATOM 0 H42 DC A 9 1.048 -3.529 7.985 1.00 0.44 H new ATOM 0 H5 DC A 9 4.404 -3.032 9.413 1.00 0.45 H new ATOM 0 H6 DC A 9 4.944 -1.057 10.720 1.00 0.44 H new ATOM 279 P DT A 10 3.671 2.998 14.967 1.00 0.41 P ATOM 280 OP1 DT A 10 3.776 4.350 15.570 1.00 0.47 O ATOM 281 OP2 DT A 10 4.387 1.857 15.594 1.00 0.37 O ATOM 282 O5' DT A 10 2.127 2.620 14.862 1.00 0.38 O ATOM 283 C5' DT A 10 1.354 3.009 13.725 1.00 0.42 C ATOM 284 C4' DT A 10 0.036 2.273 13.713 1.00 0.39 C ATOM 285 O4' DT A 10 0.136 1.121 12.848 1.00 0.36 O ATOM 286 C3' DT A 10 -0.408 1.731 15.075 1.00 0.37 C ATOM 287 O3' DT A 10 -1.523 2.488 15.561 1.00 0.43 O ATOM 288 C2' DT A 10 -0.817 0.288 14.796 1.00 0.32 C ATOM 289 C1' DT A 10 -0.825 0.191 13.286 1.00 0.32 C ATOM 290 N1 DT A 10 -0.461 -1.137 12.767 1.00 0.29 N ATOM 291 C2 DT A 10 -1.372 -1.798 11.978 1.00 0.29 C ATOM 292 O2 DT A 10 -2.445 -1.318 11.657 1.00 0.31 O ATOM 293 N3 DT A 10 -0.981 -3.046 11.577 1.00 0.29 N ATOM 294 C4 DT A 10 0.199 -3.687 11.882 1.00 0.31 C ATOM 295 O4 DT A 10 0.406 -4.817 11.450 1.00 0.35 O ATOM 296 C5 DT A 10 1.116 -2.935 12.710 1.00 0.30 C ATOM 297 C7 DT A 10 2.367 -3.607 13.186 1.00 0.34 C ATOM 298 C6 DT A 10 0.754 -1.699 13.094 1.00 0.28 C ATOM 0 H5' DT A 10 1.907 2.795 12.810 1.00 0.42 H new ATOM 0 H5'' DT A 10 1.178 4.084 13.747 1.00 0.42 H new ATOM 0 H4' DT A 10 -0.691 3.013 13.381 1.00 0.39 H new ATOM 0 H3' DT A 10 0.373 1.797 15.832 1.00 0.37 H new ATOM 0 H2' DT A 10 -0.113 -0.418 15.237 1.00 0.32 H new ATOM 0 H2'' DT A 10 -1.798 0.064 15.215 1.00 0.32 H new ATOM 0 H1' DT A 10 -1.836 0.383 12.925 1.00 0.32 H new ATOM 0 H3 DT A 10 -1.636 -3.559 10.987 1.00 0.29 H new ATOM 0 H71 DT A 10 3.155 -2.864 13.307 1.00 0.34 H new ATOM 0 H72 DT A 10 2.177 -4.094 14.142 1.00 0.34 H new ATOM 0 H73 DT A 10 2.680 -4.353 12.455 1.00 0.34 H new ATOM 0 H6 DT A 10 1.447 -1.120 13.686 1.00 0.28 H new ATOM 311 P DC A 11 -2.262 2.044 16.918 1.00 0.46 P ATOM 312 OP1 DC A 11 -2.973 3.237 17.444 1.00 0.54 O ATOM 313 OP2 DC A 11 -1.284 1.335 17.782 1.00 0.43 O ATOM 314 O5' DC A 11 -3.355 0.991 16.433 1.00 0.47 O ATOM 315 C5' DC A 11 -4.337 1.348 15.459 1.00 0.55 C ATOM 316 C4' DC A 11 -5.396 0.275 15.364 1.00 0.62 C ATOM 317 O4' DC A 11 -4.848 -0.853 14.642 1.00 0.53 O ATOM 318 C3' DC A 11 -5.889 -0.270 16.708 1.00 0.70 C ATOM 319 O3' DC A 11 -7.314 -0.420 16.682 1.00 0.84 O ATOM 320 C2' DC A 11 -5.211 -1.627 16.829 1.00 0.64 C ATOM 321 C1' DC A 11 -5.006 -2.045 15.388 1.00 0.55 C ATOM 322 N1 DC A 11 -3.814 -2.873 15.167 1.00 0.45 N ATOM 323 C2 DC A 11 -3.909 -4.003 14.358 1.00 0.43 C ATOM 324 O2 DC A 11 -5.001 -4.282 13.847 1.00 0.47 O ATOM 325 N3 DC A 11 -2.810 -4.765 14.154 1.00 0.40 N ATOM 326 C4 DC A 11 -1.654 -4.430 14.728 1.00 0.39 C ATOM 327 N4 DC A 11 -0.596 -5.211 14.495 1.00 0.42 N ATOM 328 C5 DC A 11 -1.532 -3.282 15.565 1.00 0.38 C ATOM 329 C6 DC A 11 -2.629 -2.537 15.749 1.00 0.41 C ATOM 0 H5' DC A 11 -3.862 1.487 14.488 1.00 0.55 H new ATOM 0 H5'' DC A 11 -4.797 2.299 15.728 1.00 0.55 H new ATOM 0 H4' DC A 11 -6.244 0.750 14.870 1.00 0.62 H new ATOM 0 H3' DC A 11 -5.656 0.388 17.546 1.00 0.70 H new ATOM 0 H2' DC A 11 -4.265 -1.557 17.366 1.00 0.64 H new ATOM 0 H2'' DC A 11 -5.833 -2.340 17.370 1.00 0.64 H new ATOM 0 H1' DC A 11 -5.864 -2.648 15.090 1.00 0.55 H new ATOM 0 H41 DC A 11 0.306 -4.987 14.916 1.00 0.42 H new ATOM 0 H42 DC A 11 -0.690 -6.031 13.896 1.00 0.42 H new ATOM 0 H5 DC A 11 -0.593 -3.024 16.032 1.00 0.38 H new ATOM 0 H6 DC A 11 -2.574 -1.655 16.369 1.00 0.41 H new ATOM 341 P DC A 12 -8.082 -1.002 17.970 1.00 1.11 P ATOM 342 OP1 DC A 12 -9.414 -0.351 18.045 1.00 1.28 O ATOM 343 OP2 DC A 12 -7.157 -0.914 19.129 1.00 1.20 O ATOM 344 O5' DC A 12 -8.296 -2.543 17.628 1.00 1.20 O ATOM 345 C5' DC A 12 -9.199 -2.950 16.598 1.00 1.25 C ATOM 346 C4' DC A 12 -9.342 -4.455 16.591 1.00 1.31 C ATOM 347 O4' DC A 12 -8.287 -5.020 15.784 1.00 1.20 O ATOM 348 C3' DC A 12 -9.212 -5.147 17.945 1.00 1.42 C ATOM 349 O3' DC A 12 -10.483 -5.228 18.597 1.00 1.58 O ATOM 350 C2' DC A 12 -8.720 -6.535 17.568 1.00 1.43 C ATOM 351 C1' DC A 12 -7.943 -6.312 16.268 1.00 1.27 C ATOM 352 N1 DC A 12 -6.480 -6.361 16.417 1.00 1.15 N ATOM 353 C2 DC A 12 -5.783 -7.459 15.903 1.00 1.12 C ATOM 354 O2 DC A 12 -6.417 -8.362 15.338 1.00 1.18 O ATOM 355 N3 DC A 12 -4.438 -7.508 16.034 1.00 1.05 N ATOM 356 C4 DC A 12 -3.792 -6.517 16.651 1.00 1.00 C ATOM 357 N4 DC A 12 -2.466 -6.609 16.757 1.00 0.96 N ATOM 358 C5 DC A 12 -4.477 -5.387 17.185 1.00 1.03 C ATOM 359 C6 DC A 12 -5.808 -5.352 17.045 1.00 1.10 C ATOM 0 H5' DC A 12 -8.835 -2.608 15.629 1.00 1.25 H new ATOM 0 H5'' DC A 12 -10.173 -2.486 16.754 1.00 1.25 H new ATOM 0 H4' DC A 12 -10.354 -4.622 16.221 1.00 1.31 H new ATOM 0 H3' DC A 12 -8.552 -4.622 18.636 1.00 1.42 H new ATOM 0 H2' DC A 12 -8.084 -6.958 18.346 1.00 1.43 H new ATOM 0 H2'' DC A 12 -9.550 -7.227 17.423 1.00 1.43 H new ATOM 0 HO3' DC A 12 -10.379 -5.676 19.462 1.00 1.58 H new ATOM 0 H1' DC A 12 -8.215 -7.122 15.591 1.00 1.27 H new ATOM 0 H41 DC A 12 -1.939 -5.870 17.222 1.00 0.96 H new ATOM 0 H42 DC A 12 -1.979 -7.418 16.373 1.00 0.96 H new ATOM 0 H5 DC A 12 -3.944 -4.591 17.683 1.00 1.03 H new ATOM 0 H6 DC A 12 -6.360 -4.510 17.436 1.00 1.10 H new TER 372 DC A 12 ATOM 373 O5' DG B 13 0.765 -14.658 10.463 1.00 1.84 O ATOM 374 C5' DG B 13 0.547 -15.770 11.337 1.00 1.87 C ATOM 375 C4' DG B 13 -0.922 -15.931 11.656 1.00 1.58 C ATOM 376 O4' DG B 13 -1.202 -15.229 12.891 1.00 1.49 O ATOM 377 C3' DG B 13 -1.876 -15.355 10.609 1.00 1.32 C ATOM 378 O3' DG B 13 -3.028 -16.191 10.461 1.00 1.23 O ATOM 379 C2' DG B 13 -2.272 -14.006 11.184 1.00 1.18 C ATOM 380 C1' DG B 13 -2.147 -14.193 12.682 1.00 1.27 C ATOM 381 N9 DG B 13 -1.677 -13.005 13.386 1.00 1.18 N ATOM 382 C8 DG B 13 -0.381 -12.697 13.718 1.00 1.18 C ATOM 383 N7 DG B 13 -0.267 -11.559 14.346 1.00 1.11 N ATOM 384 C5 DG B 13 -1.570 -11.086 14.433 1.00 1.07 C ATOM 385 C6 DG B 13 -2.079 -9.894 15.011 1.00 1.02 C ATOM 386 O6 DG B 13 -1.460 -8.987 15.578 1.00 0.98 O ATOM 387 N1 DG B 13 -3.461 -9.812 14.879 1.00 1.04 N ATOM 388 C2 DG B 13 -4.251 -10.752 14.267 1.00 1.10 C ATOM 389 N2 DG B 13 -5.562 -10.492 14.233 1.00 1.15 N ATOM 390 N3 DG B 13 -3.791 -11.866 13.727 1.00 1.14 N ATOM 391 C4 DG B 13 -2.451 -11.968 13.845 1.00 1.12 C ATOM 0 H5' DG B 13 1.109 -15.627 12.260 1.00 1.87 H new ATOM 0 H5'' DG B 13 0.924 -16.681 10.872 1.00 1.87 H new ATOM 0 H4' DG B 13 -1.094 -17.006 11.704 1.00 1.58 H new ATOM 0 H3' DG B 13 -1.421 -15.280 9.621 1.00 1.32 H new ATOM 0 H2' DG B 13 -1.617 -13.212 10.825 1.00 1.18 H new ATOM 0 H2'' DG B 13 -3.288 -13.734 10.899 1.00 1.18 H new ATOM 0 HO5' DG B 13 1.723 -14.574 10.273 1.00 1.84 H new ATOM 0 H1' DG B 13 -3.138 -14.420 13.075 1.00 1.27 H new ATOM 0 H8 DG B 13 0.460 -13.333 13.483 1.00 1.18 H new ATOM 0 H1 DG B 13 -3.923 -8.990 15.267 1.00 1.04 H new ATOM 0 H21 DG B 13 -6.202 -11.153 13.792 1.00 1.15 H new ATOM 0 H22 DG B 13 -5.922 -9.633 14.648 1.00 1.15 H new ATOM 404 P DG B 14 -4.022 -15.965 9.217 1.00 1.11 P ATOM 405 OP1 DG B 14 -5.211 -16.833 9.414 1.00 1.21 O ATOM 406 OP2 DG B 14 -3.216 -16.096 7.976 1.00 1.27 O ATOM 407 O5' DG B 14 -4.479 -14.445 9.352 1.00 0.86 O ATOM 408 C5' DG B 14 -5.714 -14.103 9.983 1.00 0.85 C ATOM 409 C4' DG B 14 -6.108 -12.686 9.634 1.00 0.76 C ATOM 410 O4' DG B 14 -5.338 -11.768 10.450 1.00 0.73 O ATOM 411 C3' DG B 14 -5.849 -12.262 8.184 1.00 0.71 C ATOM 412 O3' DG B 14 -6.943 -11.454 7.728 1.00 0.65 O ATOM 413 C2' DG B 14 -4.565 -11.464 8.285 1.00 0.68 C ATOM 414 C1' DG B 14 -4.789 -10.774 9.607 1.00 0.65 C ATOM 415 N9 DG B 14 -3.592 -10.244 10.248 1.00 0.65 N ATOM 416 C8 DG B 14 -2.323 -10.763 10.215 1.00 0.72 C ATOM 417 N7 DG B 14 -1.463 -10.065 10.906 1.00 0.70 N ATOM 418 C5 DG B 14 -2.213 -9.013 11.416 1.00 0.60 C ATOM 419 C6 DG B 14 -1.833 -7.921 12.240 1.00 0.54 C ATOM 420 O6 DG B 14 -0.720 -7.655 12.707 1.00 0.56 O ATOM 421 N1 DG B 14 -2.913 -7.088 12.511 1.00 0.47 N ATOM 422 C2 DG B 14 -4.194 -7.283 12.057 1.00 0.47 C ATOM 423 N2 DG B 14 -5.105 -6.381 12.427 1.00 0.46 N ATOM 424 N3 DG B 14 -4.559 -8.292 11.293 1.00 0.52 N ATOM 425 C4 DG B 14 -3.527 -9.111 11.014 1.00 0.57 C ATOM 0 H5' DG B 14 -5.618 -14.205 11.064 1.00 0.85 H new ATOM 0 H5'' DG B 14 -6.496 -14.793 9.666 1.00 0.85 H new ATOM 0 H4' DG B 14 -7.184 -12.655 9.805 1.00 0.76 H new ATOM 0 H3' DG B 14 -5.763 -13.088 7.478 1.00 0.71 H new ATOM 0 H2' DG B 14 -3.679 -12.099 8.291 1.00 0.68 H new ATOM 0 H2'' DG B 14 -4.446 -10.759 7.462 1.00 0.68 H new ATOM 0 H1' DG B 14 -5.423 -9.905 9.433 1.00 0.65 H new ATOM 0 H8 DG B 14 -2.061 -11.659 9.672 1.00 0.72 H new ATOM 0 H1 DG B 14 -2.740 -6.268 13.093 1.00 0.47 H new ATOM 0 H21 DG B 14 -6.072 -6.477 12.118 1.00 0.46 H new ATOM 0 H22 DG B 14 -4.834 -5.596 13.019 1.00 0.46 H new ATOM 437 P DA B 15 -6.988 -10.931 6.207 1.00 0.64 P ATOM 438 OP1 DA B 15 -8.081 -11.671 5.527 1.00 0.71 O ATOM 439 OP2 DA B 15 -5.620 -10.955 5.632 1.00 0.65 O ATOM 440 O5' DA B 15 -7.442 -9.409 6.349 1.00 0.57 O ATOM 441 C5' DA B 15 -8.347 -9.005 7.382 1.00 0.56 C ATOM 442 C4' DA B 15 -8.716 -7.545 7.221 1.00 0.52 C ATOM 443 O4' DA B 15 -7.866 -6.750 8.081 1.00 0.49 O ATOM 444 C3' DA B 15 -8.526 -6.962 5.823 1.00 0.52 C ATOM 445 O3' DA B 15 -9.442 -5.878 5.612 1.00 0.53 O ATOM 446 C2' DA B 15 -7.095 -6.455 5.862 1.00 0.49 C ATOM 447 C1' DA B 15 -6.923 -6.012 7.310 1.00 0.46 C ATOM 448 N9 DA B 15 -5.595 -6.284 7.859 1.00 0.44 N ATOM 449 C8 DA B 15 -4.900 -7.457 7.740 1.00 0.47 C ATOM 450 N7 DA B 15 -3.741 -7.453 8.353 1.00 0.46 N ATOM 451 C5 DA B 15 -3.662 -6.182 8.905 1.00 0.40 C ATOM 452 C6 DA B 15 -2.677 -5.547 9.686 1.00 0.37 C ATOM 453 N6 DA B 15 -1.552 -6.139 10.090 1.00 0.40 N ATOM 454 N1 DA B 15 -2.897 -4.270 10.060 1.00 0.33 N ATOM 455 C2 DA B 15 -4.038 -3.681 9.684 1.00 0.34 C ATOM 456 N3 DA B 15 -5.051 -4.178 8.971 1.00 0.37 N ATOM 457 C4 DA B 15 -4.795 -5.447 8.603 1.00 0.39 C ATOM 0 H5' DA B 15 -7.889 -9.165 8.358 1.00 0.56 H new ATOM 0 H5'' DA B 15 -9.246 -9.620 7.347 1.00 0.56 H new ATOM 0 H4' DA B 15 -9.779 -7.509 7.460 1.00 0.52 H new ATOM 0 H3' DA B 15 -8.707 -7.677 5.020 1.00 0.52 H new ATOM 0 H2' DA B 15 -6.384 -7.236 5.592 1.00 0.49 H new ATOM 0 H2'' DA B 15 -6.941 -5.629 5.167 1.00 0.49 H new ATOM 0 H1' DA B 15 -7.067 -4.932 7.346 1.00 0.46 H new ATOM 0 H8 DA B 15 -5.273 -8.309 7.191 1.00 0.47 H new ATOM 0 H61 DA B 15 -0.878 -5.622 10.655 1.00 0.40 H new ATOM 0 H62 DA B 15 -1.366 -7.109 9.834 1.00 0.40 H new ATOM 0 H2 DA B 15 -4.156 -2.656 10.003 1.00 0.34 H new ATOM 469 P DG B 16 -9.293 -4.940 4.311 1.00 0.56 P ATOM 470 OP1 DG B 16 -10.656 -4.555 3.866 1.00 0.63 O ATOM 471 OP2 DG B 16 -8.375 -5.615 3.358 1.00 0.57 O ATOM 472 O5' DG B 16 -8.565 -3.633 4.861 1.00 0.51 O ATOM 473 C5' DG B 16 -9.213 -2.776 5.803 1.00 0.53 C ATOM 474 C4' DG B 16 -8.303 -1.635 6.195 1.00 0.49 C ATOM 475 O4' DG B 16 -7.058 -2.174 6.703 1.00 0.46 O ATOM 476 C3' DG B 16 -7.920 -0.678 5.057 1.00 0.48 C ATOM 477 O3' DG B 16 -8.217 0.672 5.446 1.00 0.50 O ATOM 478 C2' DG B 16 -6.417 -0.880 4.894 1.00 0.45 C ATOM 479 C1' DG B 16 -6.007 -1.338 6.274 1.00 0.43 C ATOM 480 N9 DG B 16 -4.764 -2.100 6.333 1.00 0.42 N ATOM 481 C8 DG B 16 -4.479 -3.278 5.688 1.00 0.43 C ATOM 482 N7 DG B 16 -3.286 -3.734 5.948 1.00 0.42 N ATOM 483 C5 DG B 16 -2.742 -2.792 6.809 1.00 0.40 C ATOM 484 C6 DG B 16 -1.468 -2.739 7.419 1.00 0.39 C ATOM 485 O6 DG B 16 -0.537 -3.545 7.322 1.00 0.41 O ATOM 486 N1 DG B 16 -1.326 -1.607 8.212 1.00 0.38 N ATOM 487 C2 DG B 16 -2.288 -0.646 8.393 1.00 0.38 C ATOM 488 N2 DG B 16 -1.957 0.375 9.192 1.00 0.39 N ATOM 489 N3 DG B 16 -3.483 -0.682 7.831 1.00 0.39 N ATOM 490 C4 DG B 16 -3.641 -1.775 7.055 1.00 0.40 C ATOM 0 H5' DG B 16 -9.493 -3.346 6.689 1.00 0.53 H new ATOM 0 H5'' DG B 16 -10.134 -2.383 5.372 1.00 0.53 H new ATOM 0 H4' DG B 16 -8.875 -1.066 6.928 1.00 0.49 H new ATOM 0 H3' DG B 16 -8.462 -0.867 4.130 1.00 0.48 H new ATOM 0 H2' DG B 16 -6.186 -1.625 4.132 1.00 0.45 H new ATOM 0 H2'' DG B 16 -5.911 0.041 4.603 1.00 0.45 H new ATOM 0 H1' DG B 16 -5.828 -0.457 6.891 1.00 0.43 H new ATOM 0 H8 DG B 16 -5.175 -3.778 5.030 1.00 0.43 H new ATOM 0 H1 DG B 16 -0.438 -1.481 8.697 1.00 0.38 H new ATOM 0 H21 DG B 16 -2.628 1.123 9.368 1.00 0.39 H new ATOM 0 H22 DG B 16 -1.034 0.405 9.625 1.00 0.39 H new ATOM 502 P DG B 17 -7.609 1.907 4.609 1.00 0.51 P ATOM 503 OP1 DG B 17 -8.509 3.074 4.791 1.00 0.58 O ATOM 504 OP2 DG B 17 -7.301 1.426 3.237 1.00 0.49 O ATOM 505 O5' DG B 17 -6.231 2.224 5.345 1.00 0.53 O ATOM 506 C5' DG B 17 -6.162 2.309 6.772 1.00 0.55 C ATOM 507 C4' DG B 17 -5.241 3.431 7.190 1.00 0.53 C ATOM 508 O4' DG B 17 -3.939 2.879 7.497 1.00 0.50 O ATOM 509 C3' DG B 17 -5.013 4.512 6.136 1.00 0.52 C ATOM 510 O3' DG B 17 -4.941 5.802 6.753 1.00 0.55 O ATOM 511 C2' DG B 17 -3.674 4.151 5.511 1.00 0.47 C ATOM 512 C1' DG B 17 -2.963 3.295 6.555 1.00 0.47 C ATOM 513 N9 DG B 17 -2.326 2.094 6.021 1.00 0.44 N ATOM 514 C8 DG B 17 -2.884 1.173 5.169 1.00 0.43 C ATOM 515 N7 DG B 17 -2.078 0.194 4.867 1.00 0.41 N ATOM 516 C5 DG B 17 -0.911 0.484 5.562 1.00 0.41 C ATOM 517 C6 DG B 17 0.320 -0.217 5.619 1.00 0.41 C ATOM 518 O6 DG B 17 0.636 -1.266 5.046 1.00 0.40 O ATOM 519 N1 DG B 17 1.238 0.424 6.444 1.00 0.43 N ATOM 520 C2 DG B 17 1.000 1.592 7.128 1.00 0.44 C ATOM 521 N2 DG B 17 2.001 2.047 7.897 1.00 0.47 N ATOM 522 N3 DG B 17 -0.139 2.264 7.071 1.00 0.45 N ATOM 523 C4 DG B 17 -1.046 1.655 6.277 1.00 0.43 C ATOM 0 H5' DG B 17 -5.804 1.365 7.182 1.00 0.55 H new ATOM 0 H5'' DG B 17 -7.158 2.477 7.181 1.00 0.55 H new ATOM 0 H4' DG B 17 -5.736 3.900 8.040 1.00 0.53 H new ATOM 0 H3' DG B 17 -5.819 4.558 5.403 1.00 0.52 H new ATOM 0 H2' DG B 17 -3.810 3.603 4.579 1.00 0.47 H new ATOM 0 H2'' DG B 17 -3.096 5.044 5.274 1.00 0.47 H new ATOM 0 H1' DG B 17 -2.169 3.908 6.982 1.00 0.47 H new ATOM 0 H8 DG B 17 -3.891 1.252 4.787 1.00 0.43 H new ATOM 0 H1 DG B 17 2.157 -0.005 6.549 1.00 0.43 H new ATOM 0 H21 DG B 17 1.884 2.909 8.429 1.00 0.47 H new ATOM 0 H22 DG B 17 2.879 1.530 7.950 1.00 0.47 H new ATOM 535 P DC B 18 -5.271 7.119 5.890 1.00 0.52 P ATOM 536 OP1 DC B 18 -5.775 8.146 6.837 1.00 0.57 O ATOM 537 OP2 DC B 18 -6.101 6.733 4.720 1.00 0.52 O ATOM 538 O5' DC B 18 -3.848 7.598 5.357 1.00 0.48 O ATOM 539 C5' DC B 18 -2.839 8.043 6.263 1.00 0.50 C ATOM 540 C4' DC B 18 -1.467 7.735 5.711 1.00 0.45 C ATOM 541 O4' DC B 18 -1.402 6.336 5.375 1.00 0.43 O ATOM 542 C3' DC B 18 -1.100 8.476 4.424 1.00 0.44 C ATOM 543 O3' DC B 18 -0.266 9.602 4.716 1.00 0.44 O ATOM 544 C2' DC B 18 -0.326 7.449 3.609 1.00 0.49 C ATOM 545 C1' DC B 18 -0.376 6.165 4.423 1.00 0.43 C ATOM 546 N1 DC B 18 -0.679 4.964 3.633 1.00 0.42 N ATOM 547 C2 DC B 18 0.312 4.001 3.474 1.00 0.40 C ATOM 548 O2 DC B 18 1.410 4.184 4.010 1.00 0.40 O ATOM 549 N3 DC B 18 0.053 2.895 2.742 1.00 0.39 N ATOM 550 C4 DC B 18 -1.147 2.734 2.184 1.00 0.41 C ATOM 551 N4 DC B 18 -1.357 1.628 1.470 1.00 0.41 N ATOM 552 C5 DC B 18 -2.183 3.702 2.333 1.00 0.43 C ATOM 553 C6 DC B 18 -1.906 4.793 3.059 1.00 0.44 C ATOM 0 H5' DC B 18 -2.968 7.556 7.229 1.00 0.50 H new ATOM 0 H5'' DC B 18 -2.939 9.115 6.431 1.00 0.50 H new ATOM 0 H4' DC B 18 -0.778 8.048 6.495 1.00 0.45 H new ATOM 0 H3' DC B 18 -1.975 8.859 3.899 1.00 0.44 H new ATOM 0 H2' DC B 18 -0.775 7.308 2.626 1.00 0.49 H new ATOM 0 H2'' DC B 18 0.703 7.771 3.446 1.00 0.49 H new ATOM 0 H1' DC B 18 0.610 6.003 4.858 1.00 0.43 H new ATOM 0 H41 DC B 18 -2.263 1.470 1.028 1.00 0.41 H new ATOM 0 H42 DC B 18 -0.612 0.939 1.365 1.00 0.41 H new ATOM 0 H5 DC B 18 -3.153 3.561 1.879 1.00 0.43 H new ATOM 0 H6 DC B 18 -2.665 5.549 3.192 1.00 0.44 H new ATOM 565 P DC B 19 0.365 10.463 3.512 1.00 0.51 P ATOM 566 OP1 DC B 19 0.949 11.693 4.106 1.00 0.65 O ATOM 567 OP2 DC B 19 -0.655 10.580 2.439 1.00 0.59 O ATOM 568 O5' DC B 19 1.554 9.552 2.964 1.00 0.45 O ATOM 569 C5' DC B 19 2.884 9.688 3.471 1.00 0.64 C ATOM 570 C4' DC B 19 3.883 9.154 2.470 1.00 0.62 C ATOM 571 O4' DC B 19 3.572 7.771 2.179 1.00 0.59 O ATOM 572 C3' DC B 19 3.907 9.885 1.126 1.00 0.60 C ATOM 573 O3' DC B 19 5.244 10.317 0.847 1.00 0.63 O ATOM 574 C2' DC B 19 3.451 8.842 0.116 1.00 0.54 C ATOM 575 C1' DC B 19 3.750 7.526 0.800 1.00 0.55 C ATOM 576 N1 DC B 19 2.877 6.398 0.434 1.00 0.52 N ATOM 577 C2 DC B 19 3.464 5.226 -0.050 1.00 0.52 C ATOM 578 O2 DC B 19 4.692 5.188 -0.200 1.00 0.55 O ATOM 579 N3 DC B 19 2.679 4.165 -0.343 1.00 0.51 N ATOM 580 C4 DC B 19 1.358 4.248 -0.178 1.00 0.49 C ATOM 581 N4 DC B 19 0.625 3.177 -0.483 1.00 0.49 N ATOM 582 C5 DC B 19 0.730 5.434 0.303 1.00 0.48 C ATOM 583 C6 DC B 19 1.521 6.479 0.585 1.00 0.50 C ATOM 0 H5' DC B 19 2.979 9.148 4.413 1.00 0.64 H new ATOM 0 H5'' DC B 19 3.095 10.736 3.682 1.00 0.64 H new ATOM 0 H4' DC B 19 4.855 9.295 2.942 1.00 0.62 H new ATOM 0 H3' DC B 19 3.272 10.771 1.106 1.00 0.60 H new ATOM 0 H2' DC B 19 2.390 8.943 -0.112 1.00 0.54 H new ATOM 0 H2'' DC B 19 3.990 8.935 -0.827 1.00 0.54 H new ATOM 0 H1' DC B 19 4.752 7.223 0.498 1.00 0.55 H new ATOM 0 H41 DC B 19 -0.388 3.203 -0.370 1.00 0.49 H new ATOM 0 H42 DC B 19 1.078 2.331 -0.830 1.00 0.49 H new ATOM 0 H5 DC B 19 -0.341 5.488 0.435 1.00 0.48 H new ATOM 0 H6 DC B 19 1.080 7.400 0.937 1.00 0.50 H new ATOM 595 P DT B 20 5.567 11.098 -0.520 1.00 0.64 P ATOM 596 OP1 DT B 20 6.866 11.793 -0.337 1.00 0.71 O ATOM 597 OP2 DT B 20 4.366 11.878 -0.911 1.00 0.62 O ATOM 598 O5' DT B 20 5.773 9.931 -1.585 1.00 0.63 O ATOM 599 C5' DT B 20 6.825 8.973 -1.441 1.00 0.63 C ATOM 600 C4' DT B 20 7.018 8.217 -2.737 1.00 0.58 C ATOM 601 O4' DT B 20 6.102 7.092 -2.780 1.00 0.55 O ATOM 602 C3' DT B 20 6.746 9.016 -4.021 1.00 0.54 C ATOM 603 O3' DT B 20 7.762 8.736 -4.992 1.00 0.53 O ATOM 604 C2' DT B 20 5.402 8.484 -4.485 1.00 0.49 C ATOM 605 C1' DT B 20 5.536 7.036 -4.075 1.00 0.49 C ATOM 606 N1 DT B 20 4.289 6.235 -4.003 1.00 0.46 N ATOM 607 C2 DT B 20 4.404 4.887 -4.259 1.00 0.46 C ATOM 608 O2 DT B 20 5.461 4.352 -4.545 1.00 0.47 O ATOM 609 N3 DT B 20 3.233 4.183 -4.168 1.00 0.45 N ATOM 610 C4 DT B 20 1.987 4.675 -3.852 1.00 0.44 C ATOM 611 O4 DT B 20 1.027 3.911 -3.790 1.00 0.45 O ATOM 612 C5 DT B 20 1.931 6.098 -3.602 1.00 0.45 C ATOM 613 C7 DT B 20 0.603 6.733 -3.331 1.00 0.46 C ATOM 614 C6 DT B 20 3.068 6.804 -3.689 1.00 0.46 C ATOM 0 H5' DT B 20 6.587 8.277 -0.637 1.00 0.63 H new ATOM 0 H5'' DT B 20 7.751 9.477 -1.163 1.00 0.63 H new ATOM 0 H4' DT B 20 8.073 7.941 -2.727 1.00 0.58 H new ATOM 0 H3' DT B 20 6.745 10.096 -3.871 1.00 0.54 H new ATOM 0 H2' DT B 20 4.565 8.980 -3.993 1.00 0.49 H new ATOM 0 H2'' DT B 20 5.256 8.601 -5.559 1.00 0.49 H new ATOM 0 H1' DT B 20 6.121 6.529 -4.842 1.00 0.49 H new ATOM 0 H3 DT B 20 3.291 3.182 -4.355 1.00 0.45 H new ATOM 0 H71 DT B 20 0.738 7.593 -2.676 1.00 0.46 H new ATOM 0 H72 DT B 20 0.157 7.059 -4.271 1.00 0.46 H new ATOM 0 H73 DT B 20 -0.055 6.010 -2.849 1.00 0.46 H new ATOM 0 H6 DT B 20 3.028 7.867 -3.505 1.00 0.46 H new ATOM 627 P DG B 21 7.917 9.681 -6.284 1.00 0.53 P ATOM 628 OP1 DG B 21 9.174 10.454 -6.117 1.00 0.64 O ATOM 629 OP2 DG B 21 6.637 10.401 -6.503 1.00 0.54 O ATOM 630 O5' DG B 21 8.120 8.655 -7.488 1.00 0.49 O ATOM 631 C5' DG B 21 9.255 7.787 -7.533 1.00 0.57 C ATOM 632 C4' DG B 21 9.010 6.653 -8.503 1.00 0.60 C ATOM 633 O4' DG B 21 7.779 5.976 -8.145 1.00 0.54 O ATOM 634 C3' DG B 21 8.855 7.071 -9.971 1.00 0.63 C ATOM 635 O3' DG B 21 9.686 6.245 -10.794 1.00 0.74 O ATOM 636 C2' DG B 21 7.381 6.837 -10.270 1.00 0.56 C ATOM 637 C1' DG B 21 7.026 5.718 -9.315 1.00 0.53 C ATOM 638 N9 DG B 21 5.619 5.625 -8.930 1.00 0.47 N ATOM 639 C8 DG B 21 4.761 6.656 -8.626 1.00 0.42 C ATOM 640 N7 DG B 21 3.577 6.249 -8.261 1.00 0.42 N ATOM 641 C5 DG B 21 3.645 4.866 -8.356 1.00 0.44 C ATOM 642 C6 DG B 21 2.659 3.880 -8.103 1.00 0.47 C ATOM 643 O6 DG B 21 1.495 4.036 -7.723 1.00 0.49 O ATOM 644 N1 DG B 21 3.145 2.598 -8.336 1.00 0.51 N ATOM 645 C2 DG B 21 4.414 2.304 -8.766 1.00 0.54 C ATOM 646 N2 DG B 21 4.689 1.006 -8.945 1.00 0.60 N ATOM 647 N3 DG B 21 5.345 3.213 -9.004 1.00 0.53 N ATOM 648 C4 DG B 21 4.895 4.465 -8.780 1.00 0.47 C ATOM 0 H5' DG B 21 9.455 7.387 -6.539 1.00 0.57 H new ATOM 0 H5'' DG B 21 10.139 8.348 -7.835 1.00 0.57 H new ATOM 0 H4' DG B 21 9.899 6.027 -8.426 1.00 0.60 H new ATOM 0 H3' DG B 21 9.150 8.103 -10.162 1.00 0.63 H new ATOM 0 H2' DG B 21 6.783 7.730 -10.088 1.00 0.56 H new ATOM 0 H2'' DG B 21 7.218 6.551 -11.309 1.00 0.56 H new ATOM 0 H1' DG B 21 7.241 4.776 -9.819 1.00 0.53 H new ATOM 0 H8 DG B 21 5.040 7.698 -8.684 1.00 0.42 H new ATOM 0 H1 DG B 21 2.509 1.817 -8.175 1.00 0.51 H new ATOM 0 H21 DG B 21 5.615 0.720 -9.264 1.00 0.60 H new ATOM 0 H22 DG B 21 3.973 0.303 -8.763 1.00 0.60 H new ATOM 660 P DA B 22 9.721 6.471 -12.386 1.00 0.87 P ATOM 661 OP1 DA B 22 11.148 6.590 -12.780 1.00 1.02 O ATOM 662 OP2 DA B 22 8.769 7.553 -12.745 1.00 0.88 O ATOM 663 O5' DA B 22 9.163 5.099 -12.973 1.00 0.89 O ATOM 664 C5' DA B 22 9.318 3.874 -12.251 1.00 0.86 C ATOM 665 C4' DA B 22 8.524 2.771 -12.911 1.00 0.87 C ATOM 666 O4' DA B 22 7.228 2.677 -12.269 1.00 0.81 O ATOM 667 C3' DA B 22 8.237 2.978 -14.400 1.00 0.95 C ATOM 668 O3' DA B 22 8.293 1.722 -15.088 1.00 1.06 O ATOM 669 C2' DA B 22 6.830 3.547 -14.403 1.00 0.84 C ATOM 670 C1' DA B 22 6.200 2.820 -13.235 1.00 0.75 C ATOM 671 N9 DA B 22 5.088 3.533 -12.612 1.00 0.63 N ATOM 672 C8 DA B 22 5.031 4.866 -12.303 1.00 0.59 C ATOM 673 N7 DA B 22 3.907 5.231 -11.735 1.00 0.49 N ATOM 674 C5 DA B 22 3.170 4.057 -11.674 1.00 0.46 C ATOM 675 C6 DA B 22 1.879 3.772 -11.195 1.00 0.41 C ATOM 676 N6 DA B 22 1.064 4.686 -10.667 1.00 0.38 N ATOM 677 N1 DA B 22 1.444 2.498 -11.285 1.00 0.45 N ATOM 678 C2 DA B 22 2.255 1.580 -11.826 1.00 0.51 C ATOM 679 N3 DA B 22 3.478 1.728 -12.326 1.00 0.57 N ATOM 680 C4 DA B 22 3.884 3.004 -12.215 1.00 0.55 C ATOM 0 H5' DA B 22 8.984 4.006 -11.222 1.00 0.86 H new ATOM 0 H5'' DA B 22 10.372 3.599 -12.211 1.00 0.86 H new ATOM 0 H4' DA B 22 9.143 1.880 -12.807 1.00 0.87 H new ATOM 0 H3' DA B 22 8.953 3.629 -14.902 1.00 0.95 H new ATOM 0 H2' DA B 22 6.826 4.628 -14.262 1.00 0.84 H new ATOM 0 H2'' DA B 22 6.309 3.345 -15.339 1.00 0.84 H new ATOM 0 H1' DA B 22 5.788 1.879 -13.599 1.00 0.75 H new ATOM 0 H8 DA B 22 5.838 5.554 -12.508 1.00 0.59 H new ATOM 0 H61 DA B 22 0.138 4.414 -10.337 1.00 0.38 H new ATOM 0 H62 DA B 22 1.367 5.657 -10.593 1.00 0.38 H new ATOM 0 H2 DA B 22 1.859 0.576 -11.861 1.00 0.51 H new ATOM 692 P DG B 23 8.012 1.663 -16.669 1.00 1.18 P ATOM 693 OP1 DG B 23 8.451 0.328 -17.148 1.00 1.32 O ATOM 694 OP2 DG B 23 8.574 2.888 -17.294 1.00 1.32 O ATOM 695 O5' DG B 23 6.424 1.734 -16.777 1.00 0.99 O ATOM 696 C5' DG B 23 5.604 0.658 -16.318 1.00 0.86 C ATOM 697 C4' DG B 23 4.213 0.780 -16.895 1.00 0.75 C ATOM 698 O4' DG B 23 3.376 1.479 -15.943 1.00 0.64 O ATOM 699 C3' DG B 23 4.130 1.573 -18.205 1.00 0.85 C ATOM 700 O3' DG B 23 3.535 0.776 -19.235 1.00 0.91 O ATOM 701 C2' DG B 23 3.236 2.758 -17.875 1.00 0.80 C ATOM 702 C1' DG B 23 2.475 2.292 -16.657 1.00 0.66 C ATOM 703 N9 DG B 23 2.031 3.370 -15.781 1.00 0.59 N ATOM 704 C8 DG B 23 2.707 4.530 -15.500 1.00 0.61 C ATOM 705 N7 DG B 23 2.051 5.330 -14.704 1.00 0.55 N ATOM 706 C5 DG B 23 0.868 4.652 -14.440 1.00 0.51 C ATOM 707 C6 DG B 23 -0.247 5.022 -13.643 1.00 0.49 C ATOM 708 O6 DG B 23 -0.416 6.056 -12.986 1.00 0.49 O ATOM 709 N1 DG B 23 -1.233 4.042 -13.656 1.00 0.51 N ATOM 710 C2 DG B 23 -1.154 2.854 -14.341 1.00 0.52 C ATOM 711 N2 DG B 23 -2.201 2.032 -14.227 1.00 0.56 N ATOM 712 N3 DG B 23 -0.122 2.495 -15.083 1.00 0.53 N ATOM 713 C4 DG B 23 0.844 3.436 -15.091 1.00 0.53 C ATOM 0 H5' DG B 23 5.556 0.666 -15.229 1.00 0.86 H new ATOM 0 H5'' DG B 23 6.045 -0.295 -16.610 1.00 0.86 H new ATOM 0 H4' DG B 23 3.893 -0.241 -17.101 1.00 0.75 H new ATOM 0 H3' DG B 23 5.111 1.877 -18.569 1.00 0.85 H new ATOM 0 H2' DG B 23 3.819 3.655 -17.666 1.00 0.80 H new ATOM 0 H2'' DG B 23 2.566 2.998 -18.700 1.00 0.80 H new ATOM 0 H1' DG B 23 1.568 1.783 -16.983 1.00 0.66 H new ATOM 0 H8 DG B 23 3.685 4.759 -15.898 1.00 0.61 H new ATOM 0 H1 DG B 23 -2.080 4.219 -13.116 1.00 0.51 H new ATOM 0 H21 DG B 23 -2.200 1.135 -14.713 1.00 0.56 H new ATOM 0 H22 DG B 23 -3.001 2.301 -13.654 1.00 0.56 H new ATOM 725 P DG B 24 3.668 1.229 -20.773 1.00 1.06 P ATOM 726 OP1 DG B 24 4.376 0.154 -21.513 1.00 1.15 O ATOM 727 OP2 DG B 24 4.207 2.613 -20.796 1.00 1.15 O ATOM 728 O5' DG B 24 2.162 1.283 -21.292 1.00 1.07 O ATOM 729 C5' DG B 24 1.305 0.145 -21.183 1.00 1.04 C ATOM 730 C4' DG B 24 -0.143 0.578 -21.193 1.00 1.08 C ATOM 731 O4' DG B 24 -0.345 1.548 -20.137 1.00 0.99 O ATOM 732 C3' DG B 24 -0.610 1.249 -22.490 1.00 1.26 C ATOM 733 O3' DG B 24 -1.792 0.610 -22.980 1.00 1.35 O ATOM 734 C2' DG B 24 -0.926 2.682 -22.084 1.00 1.25 C ATOM 735 C1' DG B 24 -1.207 2.562 -20.602 1.00 1.08 C ATOM 736 N9 DG B 24 -0.948 3.768 -19.819 1.00 1.03 N ATOM 737 C8 DG B 24 0.198 4.527 -19.808 1.00 1.06 C ATOM 738 N7 DG B 24 0.127 5.552 -19.004 1.00 1.04 N ATOM 739 C5 DG B 24 -1.142 5.464 -18.448 1.00 0.99 C ATOM 740 C6 DG B 24 -1.791 6.299 -17.501 1.00 0.96 C ATOM 741 O6 DG B 24 -1.360 7.317 -16.949 1.00 0.98 O ATOM 742 N1 DG B 24 -3.073 5.844 -17.212 1.00 0.95 N ATOM 743 C2 DG B 24 -3.656 4.730 -17.762 1.00 0.97 C ATOM 744 N2 DG B 24 -4.899 4.451 -17.353 1.00 1.00 N ATOM 745 N3 DG B 24 -3.065 3.945 -18.645 1.00 0.99 N ATOM 746 C4 DG B 24 -1.818 4.368 -18.940 1.00 0.99 C ATOM 0 H5' DG B 24 1.524 -0.397 -20.263 1.00 1.04 H new ATOM 0 H5'' DG B 24 1.493 -0.541 -22.009 1.00 1.04 H new ATOM 0 H4' DG B 24 -0.718 -0.340 -21.070 1.00 1.08 H new ATOM 0 H3' DG B 24 0.139 1.191 -23.280 1.00 1.26 H new ATOM 0 H2' DG B 24 -0.089 3.352 -22.283 1.00 1.25 H new ATOM 0 H2'' DG B 24 -1.785 3.075 -22.627 1.00 1.25 H new ATOM 0 HO3' DG B 24 -2.082 1.048 -23.807 1.00 1.35 H new ATOM 0 H1' DG B 24 -2.271 2.359 -20.478 1.00 1.08 H new ATOM 0 H8 DG B 24 1.069 4.298 -20.404 1.00 1.06 H new ATOM 0 H1 DG B 24 -3.622 6.379 -16.540 1.00 0.95 H new ATOM 0 H21 DG B 24 -5.387 3.636 -17.724 1.00 1.00 H new ATOM 0 H22 DG B 24 -5.358 5.053 -16.670 1.00 1.00 H new TER 759 DG B 24 HETATM 760 PT1 CPT A 77 2.739 -2.433 -0.274 1.00 0.48 PT HETATM 761 N1 CPT A 77 1.661 -3.233 -1.794 1.00 0.63 N HETATM 762 N2 CPT A 77 1.491 -3.357 1.028 1.00 0.48 N