USER MOD reduce.3.24.130724 H: found=0, std=0, add=281, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 285 hydrogens (14 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= -0.385 USER MOD Single : A 3 DT C7 :methyl 150:sc= -0.0295 (180deg=-0.0295) 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= -0.0068 USER MOD Single : B 20 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -12.191 -13.863 -6.660 1.00 0.59 O ATOM 2 C5' DC A 1 -13.486 -13.255 -6.637 1.00 0.55 C ATOM 3 C4' DC A 1 -13.419 -11.871 -6.029 1.00 0.42 C ATOM 4 O4' DC A 1 -13.802 -11.984 -4.642 1.00 0.49 O ATOM 5 C3' DC A 1 -12.031 -11.224 -6.037 1.00 0.30 C ATOM 6 O3' DC A 1 -11.976 -10.176 -7.013 1.00 0.26 O ATOM 7 C2' DC A 1 -11.874 -10.638 -4.639 1.00 0.30 C ATOM 8 C1' DC A 1 -13.130 -11.007 -3.875 1.00 0.36 C ATOM 9 N1 DC A 1 -12.857 -11.581 -2.553 1.00 0.43 N ATOM 10 C2 DC A 1 -13.610 -11.167 -1.452 1.00 0.43 C ATOM 11 O2 DC A 1 -14.500 -10.321 -1.615 1.00 0.38 O ATOM 12 N3 DC A 1 -13.347 -11.700 -0.236 1.00 0.50 N ATOM 13 C4 DC A 1 -12.380 -12.611 -0.104 1.00 0.60 C ATOM 14 N4 DC A 1 -12.156 -13.112 1.112 1.00 0.69 N ATOM 15 C5 DC A 1 -11.600 -13.051 -1.213 1.00 0.61 C ATOM 16 C6 DC A 1 -11.872 -12.511 -2.407 1.00 0.51 C ATOM 0 H5' DC A 1 -14.174 -13.876 -6.064 1.00 0.55 H new ATOM 0 H5'' DC A 1 -13.882 -13.193 -7.651 1.00 0.55 H new ATOM 0 H4' DC A 1 -14.073 -11.246 -6.636 1.00 0.42 H new ATOM 0 H3' DC A 1 -11.245 -11.937 -6.285 1.00 0.30 H new ATOM 0 H2' DC A 1 -10.988 -11.040 -4.147 1.00 0.30 H new ATOM 0 H2'' DC A 1 -11.751 -9.556 -4.683 1.00 0.30 H new ATOM 0 HO5' DC A 1 -12.257 -14.757 -7.055 1.00 0.59 H new ATOM 0 H1' DC A 1 -13.713 -10.099 -3.717 1.00 0.36 H new ATOM 0 H41 DC A 1 -11.425 -13.810 1.249 1.00 0.69 H new ATOM 0 H42 DC A 1 -12.716 -12.797 1.904 1.00 0.69 H new ATOM 0 H5 DC A 1 -10.821 -13.790 -1.095 1.00 0.61 H new ATOM 0 H6 DC A 1 -11.300 -12.818 -3.270 1.00 0.51 H new ATOM 29 P DC A 2 -10.710 -9.179 -7.050 1.00 0.37 P ATOM 30 OP1 DC A 2 -10.518 -8.759 -8.461 1.00 0.60 O ATOM 31 OP2 DC A 2 -9.585 -9.811 -6.313 1.00 0.51 O ATOM 32 O5' DC A 2 -11.193 -7.908 -6.217 1.00 0.24 O ATOM 33 C5' DC A 2 -12.502 -7.368 -6.400 1.00 0.33 C ATOM 34 C4' DC A 2 -12.744 -6.229 -5.438 1.00 0.23 C ATOM 35 O4' DC A 2 -12.832 -6.771 -4.101 1.00 0.25 O ATOM 36 C3' DC A 2 -11.665 -5.143 -5.402 1.00 0.16 C ATOM 37 O3' DC A 2 -12.278 -3.847 -5.380 1.00 0.12 O ATOM 38 C2' DC A 2 -10.913 -5.410 -4.109 1.00 0.13 C ATOM 39 C1' DC A 2 -11.921 -6.126 -3.235 1.00 0.18 C ATOM 40 N1 DC A 2 -11.304 -7.151 -2.394 1.00 0.19 N ATOM 41 C2 DC A 2 -11.563 -7.173 -1.025 1.00 0.20 C ATOM 42 O2 DC A 2 -12.323 -6.321 -0.545 1.00 0.19 O ATOM 43 N3 DC A 2 -10.977 -8.121 -0.259 1.00 0.21 N ATOM 44 C4 DC A 2 -10.160 -9.017 -0.819 1.00 0.22 C ATOM 45 N4 DC A 2 -9.602 -9.933 -0.026 1.00 0.24 N ATOM 46 C5 DC A 2 -9.882 -9.011 -2.219 1.00 0.22 C ATOM 47 C6 DC A 2 -10.476 -8.073 -2.958 1.00 0.21 C ATOM 0 H5' DC A 2 -13.248 -8.147 -6.245 1.00 0.33 H new ATOM 0 H5'' DC A 2 -12.617 -7.016 -7.425 1.00 0.33 H new ATOM 0 H4' DC A 2 -13.658 -5.752 -5.792 1.00 0.23 H new ATOM 0 H3' DC A 2 -11.008 -5.163 -6.271 1.00 0.16 H new ATOM 0 H2' DC A 2 -10.029 -6.023 -4.282 1.00 0.13 H new ATOM 0 H2'' DC A 2 -10.573 -4.483 -3.647 1.00 0.13 H new ATOM 0 H1' DC A 2 -12.394 -5.395 -2.579 1.00 0.18 H new ATOM 0 H41 DC A 2 -8.973 -10.633 -0.419 1.00 0.24 H new ATOM 0 H42 DC A 2 -9.805 -9.934 0.974 1.00 0.24 H new ATOM 0 H5 DC A 2 -9.217 -9.737 -2.662 1.00 0.22 H new ATOM 0 H6 DC A 2 -10.297 -8.044 -4.023 1.00 0.21 H new ATOM 59 P DT A 3 -11.420 -2.561 -4.934 1.00 0.14 P ATOM 60 OP1 DT A 3 -12.144 -1.343 -5.381 1.00 0.19 O ATOM 61 OP2 DT A 3 -10.015 -2.779 -5.367 1.00 0.18 O ATOM 62 O5' DT A 3 -11.459 -2.611 -3.342 1.00 0.16 O ATOM 63 C5' DT A 3 -12.700 -2.533 -2.639 1.00 0.17 C ATOM 64 C4' DT A 3 -12.545 -1.704 -1.385 1.00 0.21 C ATOM 65 O4' DT A 3 -12.144 -2.566 -0.294 1.00 0.22 O ATOM 66 C3' DT A 3 -11.496 -0.595 -1.450 1.00 0.23 C ATOM 67 O3' DT A 3 -11.967 0.548 -0.715 1.00 0.27 O ATOM 68 C2' DT A 3 -10.276 -1.234 -0.810 1.00 0.22 C ATOM 69 C1' DT A 3 -10.888 -2.158 0.222 1.00 0.22 C ATOM 70 N1 DT A 3 -10.103 -3.365 0.482 1.00 0.21 N ATOM 71 C2 DT A 3 -9.950 -3.797 1.776 1.00 0.22 C ATOM 72 O2 DT A 3 -10.424 -3.213 2.736 1.00 0.24 O ATOM 73 N3 DT A 3 -9.218 -4.943 1.909 1.00 0.21 N ATOM 74 C4 DT A 3 -8.627 -5.675 0.905 1.00 0.19 C ATOM 75 O4 DT A 3 -7.998 -6.692 1.182 1.00 0.19 O ATOM 76 C5 DT A 3 -8.811 -5.153 -0.430 1.00 0.18 C ATOM 77 C7 DT A 3 -8.041 -5.773 -1.551 1.00 0.17 C ATOM 78 C6 DT A 3 -9.548 -4.040 -0.577 1.00 0.19 C ATOM 0 H5' DT A 3 -13.042 -3.535 -2.380 1.00 0.17 H new ATOM 0 H5'' DT A 3 -13.462 -2.092 -3.282 1.00 0.17 H new ATOM 0 H4' DT A 3 -13.518 -1.231 -1.251 1.00 0.21 H new ATOM 0 H3' DT A 3 -11.279 -0.232 -2.455 1.00 0.23 H new ATOM 0 H2' DT A 3 -9.676 -1.780 -1.538 1.00 0.22 H new ATOM 0 H2'' DT A 3 -9.623 -0.491 -0.352 1.00 0.22 H new ATOM 0 H1' DT A 3 -10.947 -1.613 1.164 1.00 0.22 H new ATOM 0 H3 DT A 3 -9.096 -5.295 2.858 1.00 0.21 H new ATOM 0 H71 DT A 3 -8.614 -5.692 -2.475 1.00 0.17 H new ATOM 0 H72 DT A 3 -7.089 -5.256 -1.668 1.00 0.17 H new ATOM 0 H73 DT A 3 -7.858 -6.824 -1.329 1.00 0.17 H new ATOM 0 H6 DT A 3 -9.712 -3.658 -1.574 1.00 0.19 H new ATOM 91 P DC A 4 -10.921 1.573 -0.047 1.00 0.44 P ATOM 92 OP1 DC A 4 -11.652 2.821 0.287 1.00 0.58 O ATOM 93 OP2 DC A 4 -9.725 1.641 -0.926 1.00 0.41 O ATOM 94 O5' DC A 4 -10.504 0.861 1.317 1.00 0.52 O ATOM 95 C5' DC A 4 -11.345 0.930 2.474 1.00 0.48 C ATOM 96 C4' DC A 4 -10.526 1.268 3.699 1.00 0.41 C ATOM 97 O4' DC A 4 -9.712 0.124 4.053 1.00 0.38 O ATOM 98 C3' DC A 4 -9.536 2.415 3.524 1.00 0.34 C ATOM 99 O3' DC A 4 -9.272 3.036 4.789 1.00 0.30 O ATOM 100 C2' DC A 4 -8.309 1.695 2.998 1.00 0.28 C ATOM 101 C1' DC A 4 -8.337 0.419 3.838 1.00 0.28 C ATOM 102 N1 DC A 4 -7.717 -0.784 3.242 1.00 0.25 N ATOM 103 C2 DC A 4 -7.247 -1.788 4.102 1.00 0.25 C ATOM 104 O2 DC A 4 -7.332 -1.621 5.329 1.00 0.26 O ATOM 105 N3 DC A 4 -6.713 -2.913 3.575 1.00 0.23 N ATOM 106 C4 DC A 4 -6.628 -3.053 2.251 1.00 0.22 C ATOM 107 N4 DC A 4 -6.086 -4.170 1.770 1.00 0.21 N ATOM 108 C5 DC A 4 -7.089 -2.048 1.355 1.00 0.23 C ATOM 109 C6 DC A 4 -7.616 -0.940 1.887 1.00 0.25 C ATOM 0 H5' DC A 4 -11.853 -0.023 2.620 1.00 0.48 H new ATOM 0 H5'' DC A 4 -12.118 1.684 2.326 1.00 0.48 H new ATOM 0 H4' DC A 4 -11.263 1.556 4.448 1.00 0.41 H new ATOM 0 H3' DC A 4 -9.883 3.214 2.869 1.00 0.34 H new ATOM 0 H2' DC A 4 -8.379 1.487 1.930 1.00 0.28 H new ATOM 0 H2'' DC A 4 -7.396 2.270 3.152 1.00 0.28 H new ATOM 0 H1' DC A 4 -7.748 0.626 4.731 1.00 0.28 H new ATOM 0 H41 DC A 4 -6.007 -4.306 0.762 1.00 0.21 H new ATOM 0 H42 DC A 4 -5.749 -4.890 2.409 1.00 0.21 H new ATOM 0 H5 DC A 4 -7.016 -2.175 0.285 1.00 0.23 H new ATOM 0 H6 DC A 4 -7.968 -0.154 1.235 1.00 0.25 H new ATOM 121 P DA A 5 -8.276 4.298 4.876 1.00 0.20 P ATOM 122 OP1 DA A 5 -9.032 5.415 5.494 1.00 0.20 O ATOM 123 OP2 DA A 5 -7.627 4.496 3.554 1.00 0.24 O ATOM 124 O5' DA A 5 -7.157 3.834 5.913 1.00 0.21 O ATOM 125 C5' DA A 5 -7.451 2.874 6.931 1.00 0.18 C ATOM 126 C4' DA A 5 -6.174 2.368 7.564 1.00 0.14 C ATOM 127 O4' DA A 5 -5.805 1.140 6.903 1.00 0.12 O ATOM 128 C3' DA A 5 -4.958 3.299 7.474 1.00 0.12 C ATOM 129 O3' DA A 5 -4.579 3.709 8.797 1.00 0.11 O ATOM 130 C2' DA A 5 -3.863 2.454 6.832 1.00 0.11 C ATOM 131 C1' DA A 5 -4.401 1.035 6.826 1.00 0.11 C ATOM 132 N9 DA A 5 -4.085 0.320 5.598 1.00 0.11 N ATOM 133 C8 DA A 5 -4.294 0.815 4.348 1.00 0.12 C ATOM 134 N7 DA A 5 -3.964 -0.012 3.385 1.00 0.11 N ATOM 135 C5 DA A 5 -3.491 -1.130 4.060 1.00 0.10 C ATOM 136 C6 DA A 5 -2.975 -2.360 3.616 1.00 0.10 C ATOM 137 N6 DA A 5 -2.853 -2.697 2.332 1.00 0.10 N ATOM 138 N1 DA A 5 -2.582 -3.249 4.553 1.00 0.09 N ATOM 139 C2 DA A 5 -2.711 -2.918 5.845 1.00 0.10 C ATOM 140 N3 DA A 5 -3.174 -1.795 6.384 1.00 0.10 N ATOM 141 C4 DA A 5 -3.553 -0.933 5.427 1.00 0.10 C ATOM 0 H5' DA A 5 -8.008 2.040 6.503 1.00 0.18 H new ATOM 0 H5'' DA A 5 -8.088 3.325 7.692 1.00 0.18 H new ATOM 0 H4' DA A 5 -6.405 2.266 8.624 1.00 0.14 H new ATOM 0 H3' DA A 5 -5.154 4.203 6.897 1.00 0.12 H new ATOM 0 H2' DA A 5 -3.645 2.796 5.820 1.00 0.11 H new ATOM 0 H2'' DA A 5 -2.934 2.519 7.398 1.00 0.11 H new ATOM 0 H1' DA A 5 -3.953 0.487 7.655 1.00 0.11 H new ATOM 0 H8 DA A 5 -4.696 1.801 4.165 1.00 0.12 H new ATOM 0 H61 DA A 5 -2.470 -3.607 2.078 1.00 0.10 H new ATOM 0 H62 DA A 5 -3.143 -2.044 1.604 1.00 0.10 H new ATOM 0 H2 DA A 5 -2.393 -3.672 6.550 1.00 0.10 H new ATOM 153 P DG A 6 -3.112 4.314 9.065 1.00 0.08 P ATOM 154 OP1 DG A 6 -3.094 4.827 10.458 1.00 0.08 O ATOM 155 OP2 DG A 6 -2.762 5.225 7.944 1.00 0.08 O ATOM 156 O5' DG A 6 -2.154 3.042 8.991 1.00 0.08 O ATOM 157 C5' DG A 6 -2.204 2.020 9.991 1.00 0.08 C ATOM 158 C4' DG A 6 -1.037 1.073 9.830 1.00 0.06 C ATOM 159 O4' DG A 6 -1.124 0.415 8.539 1.00 0.06 O ATOM 160 C3' DG A 6 0.341 1.746 9.873 1.00 0.06 C ATOM 161 O3' DG A 6 1.167 1.133 10.869 1.00 0.06 O ATOM 162 C2' DG A 6 0.924 1.503 8.489 1.00 0.05 C ATOM 163 C1' DG A 6 0.183 0.272 8.024 1.00 0.05 C ATOM 164 N9 DG A 6 0.097 0.125 6.574 1.00 0.05 N ATOM 165 C8 DG A 6 -0.370 1.045 5.670 1.00 0.05 C ATOM 166 N7 DG A 6 -0.322 0.628 4.437 1.00 0.06 N ATOM 167 C5 DG A 6 0.213 -0.650 4.531 1.00 0.05 C ATOM 168 C6 DG A 6 0.514 -1.595 3.520 1.00 0.05 C ATOM 169 O6 DG A 6 0.346 -1.496 2.300 1.00 0.05 O ATOM 170 N1 DG A 6 1.066 -2.755 4.051 1.00 0.05 N ATOM 171 C2 DG A 6 1.293 -2.979 5.386 1.00 0.06 C ATOM 172 N2 DG A 6 1.829 -4.161 5.707 1.00 0.06 N ATOM 173 N3 DG A 6 1.014 -2.108 6.339 1.00 0.05 N ATOM 174 C4 DG A 6 0.483 -0.972 5.843 1.00 0.05 C ATOM 0 H5' DG A 6 -3.142 1.470 9.912 1.00 0.08 H new ATOM 0 H5'' DG A 6 -2.182 2.471 10.983 1.00 0.08 H new ATOM 0 H4' DG A 6 -1.111 0.388 10.675 1.00 0.06 H new ATOM 0 H3' DG A 6 0.277 2.805 10.123 1.00 0.06 H new ATOM 0 H2' DG A 6 0.756 2.351 7.825 1.00 0.05 H new ATOM 0 H2'' DG A 6 2.001 1.337 8.527 1.00 0.05 H new ATOM 0 H1' DG A 6 0.718 -0.612 8.371 1.00 0.05 H new ATOM 0 H8 DG A 6 -0.741 2.019 5.953 1.00 0.05 H new ATOM 0 H1 DG A 6 1.322 -3.496 3.399 1.00 0.05 H new ATOM 0 H21 DG A 6 2.021 -4.386 6.683 1.00 0.06 H new ATOM 0 H22 DG A 6 2.046 -4.838 4.976 1.00 0.06 H new ATOM 186 P DG A 7 2.673 1.654 11.090 1.00 0.06 P ATOM 187 OP1 DG A 7 3.374 0.684 11.969 1.00 0.08 O ATOM 188 OP2 DG A 7 2.594 3.082 11.490 1.00 0.07 O ATOM 189 O5' DG A 7 3.327 1.587 9.637 1.00 0.05 O ATOM 190 C5' DG A 7 4.122 0.469 9.237 1.00 0.07 C ATOM 191 C4' DG A 7 5.058 0.860 8.116 1.00 0.08 C ATOM 192 O4' DG A 7 4.458 0.490 6.853 1.00 0.06 O ATOM 193 C3' DG A 7 5.373 2.359 8.014 1.00 0.08 C ATOM 194 O3' DG A 7 6.772 2.577 8.230 1.00 0.11 O ATOM 195 C2' DG A 7 4.985 2.744 6.591 1.00 0.07 C ATOM 196 C1' DG A 7 4.876 1.408 5.869 1.00 0.07 C ATOM 197 N9 DG A 7 3.934 1.327 4.751 1.00 0.06 N ATOM 198 C8 DG A 7 2.722 1.964 4.590 1.00 0.05 C ATOM 199 N7 DG A 7 2.131 1.668 3.464 1.00 0.06 N ATOM 200 C5 DG A 7 2.999 0.779 2.846 1.00 0.05 C ATOM 201 C6 DG A 7 2.893 0.107 1.601 1.00 0.06 C ATOM 202 O6 DG A 7 1.986 0.174 0.765 1.00 0.06 O ATOM 203 N1 DG A 7 3.993 -0.712 1.367 1.00 0.06 N ATOM 204 C2 DG A 7 5.062 -0.858 2.218 1.00 0.06 C ATOM 205 N2 DG A 7 6.034 -1.682 1.820 1.00 0.06 N ATOM 206 N3 DG A 7 5.172 -0.237 3.378 1.00 0.06 N ATOM 207 C4 DG A 7 4.113 0.558 3.628 1.00 0.05 C ATOM 0 H5' DG A 7 3.476 -0.346 8.912 1.00 0.07 H new ATOM 0 H5'' DG A 7 4.697 0.101 10.087 1.00 0.07 H new ATOM 0 H4' DG A 7 5.990 0.340 8.339 1.00 0.08 H new ATOM 0 H3' DG A 7 4.837 2.951 8.756 1.00 0.08 H new ATOM 0 H2' DG A 7 4.042 3.289 6.567 1.00 0.07 H new ATOM 0 H2'' DG A 7 5.736 3.387 6.132 1.00 0.07 H new ATOM 0 H1' DG A 7 5.847 1.217 5.412 1.00 0.07 H new ATOM 0 H8 DG A 7 2.304 2.640 5.321 1.00 0.05 H new ATOM 0 H1 DG A 7 4.007 -1.245 0.497 1.00 0.06 H new ATOM 0 H21 DG A 7 6.852 -1.829 2.411 1.00 0.06 H new ATOM 0 H22 DG A 7 5.959 -2.165 0.925 1.00 0.06 H new ATOM 219 P DC A 8 7.344 4.077 8.336 1.00 0.14 P ATOM 220 OP1 DC A 8 7.719 4.332 9.751 1.00 0.17 O ATOM 221 OP2 DC A 8 6.386 4.987 7.657 1.00 0.14 O ATOM 222 O5' DC A 8 8.679 4.035 7.467 1.00 0.16 O ATOM 223 C5' DC A 8 9.758 3.167 7.822 1.00 0.19 C ATOM 224 C4' DC A 8 10.370 2.552 6.584 1.00 0.16 C ATOM 225 O4' DC A 8 9.316 2.244 5.639 1.00 0.15 O ATOM 226 C3' DC A 8 11.372 3.440 5.839 1.00 0.15 C ATOM 227 O3' DC A 8 12.550 2.684 5.533 1.00 0.14 O ATOM 228 C2' DC A 8 10.641 3.845 4.567 1.00 0.12 C ATOM 229 C1' DC A 8 9.676 2.696 4.347 1.00 0.11 C ATOM 230 N1 DC A 8 8.440 3.070 3.643 1.00 0.10 N ATOM 231 C2 DC A 8 8.131 2.455 2.424 1.00 0.10 C ATOM 232 O2 DC A 8 8.916 1.619 1.954 1.00 0.10 O ATOM 233 N3 DC A 8 6.985 2.788 1.790 1.00 0.10 N ATOM 234 C4 DC A 8 6.164 3.692 2.328 1.00 0.10 C ATOM 235 N4 DC A 8 5.045 3.987 1.670 1.00 0.09 N ATOM 236 C5 DC A 8 6.455 4.335 3.565 1.00 0.10 C ATOM 237 C6 DC A 8 7.597 4.002 4.178 1.00 0.10 C ATOM 0 H5' DC A 8 9.397 2.381 8.486 1.00 0.19 H new ATOM 0 H5'' DC A 8 10.516 3.725 8.371 1.00 0.19 H new ATOM 0 H4' DC A 8 10.911 1.677 6.945 1.00 0.16 H new ATOM 0 H3' DC A 8 11.693 4.306 6.418 1.00 0.15 H new ATOM 0 H2' DC A 8 10.118 4.794 4.687 1.00 0.12 H new ATOM 0 H2'' DC A 8 11.326 3.963 3.728 1.00 0.12 H new ATOM 0 H1' DC A 8 10.169 1.950 3.723 1.00 0.11 H new ATOM 0 H41 DC A 8 4.395 4.673 2.052 1.00 0.09 H new ATOM 0 H42 DC A 8 4.838 3.527 0.784 1.00 0.09 H new ATOM 0 H5 DC A 8 5.781 5.063 3.992 1.00 0.10 H new ATOM 0 H6 DC A 8 7.857 4.478 5.112 1.00 0.10 H new ATOM 249 P DC A 9 13.711 3.337 4.632 1.00 0.14 P ATOM 250 OP1 DC A 9 14.992 2.662 4.963 1.00 0.16 O ATOM 251 OP2 DC A 9 13.608 4.814 4.753 1.00 0.16 O ATOM 252 O5' DC A 9 13.305 2.936 3.144 1.00 0.12 O ATOM 253 C5' DC A 9 12.920 1.598 2.820 1.00 0.12 C ATOM 254 C4' DC A 9 12.898 1.410 1.321 1.00 0.12 C ATOM 255 O4' DC A 9 11.574 1.734 0.829 1.00 0.11 O ATOM 256 C3' DC A 9 13.876 2.303 0.555 1.00 0.12 C ATOM 257 O3' DC A 9 14.559 1.543 -0.448 1.00 0.15 O ATOM 258 C2' DC A 9 12.989 3.370 -0.065 1.00 0.11 C ATOM 259 C1' DC A 9 11.658 2.661 -0.237 1.00 0.10 C ATOM 260 N1 DC A 9 10.465 3.527 -0.173 1.00 0.10 N ATOM 261 C2 DC A 9 9.528 3.468 -1.214 1.00 0.10 C ATOM 262 O2 DC A 9 9.738 2.711 -2.175 1.00 0.10 O ATOM 263 N3 DC A 9 8.418 4.238 -1.147 1.00 0.11 N ATOM 264 C4 DC A 9 8.227 5.043 -0.099 1.00 0.14 C ATOM 265 N4 DC A 9 7.121 5.785 -0.078 1.00 0.16 N ATOM 266 C5 DC A 9 9.164 5.124 0.971 1.00 0.14 C ATOM 267 C6 DC A 9 10.262 4.363 0.890 1.00 0.12 C ATOM 0 H5' DC A 9 11.935 1.385 3.235 1.00 0.12 H new ATOM 0 H5'' DC A 9 13.616 0.892 3.272 1.00 0.12 H new ATOM 0 H4' DC A 9 13.187 0.373 1.152 1.00 0.12 H new ATOM 0 H3' DC A 9 14.653 2.732 1.188 1.00 0.12 H new ATOM 0 H2' DC A 9 12.899 4.243 0.581 1.00 0.11 H new ATOM 0 H2'' DC A 9 13.385 3.718 -1.019 1.00 0.11 H new ATOM 0 H1' DC A 9 11.648 2.223 -1.235 1.00 0.10 H new ATOM 0 H41 DC A 9 6.942 6.411 0.707 1.00 0.16 H new ATOM 0 H42 DC A 9 6.453 5.727 -0.847 1.00 0.16 H new ATOM 0 H5 DC A 9 8.995 5.775 1.816 1.00 0.14 H new ATOM 0 H6 DC A 9 11.000 4.410 1.677 1.00 0.12 H new ATOM 279 P DT A 10 15.719 2.233 -1.323 1.00 0.19 P ATOM 280 OP1 DT A 10 16.804 1.240 -1.525 1.00 0.22 O ATOM 281 OP2 DT A 10 16.034 3.550 -0.711 1.00 0.19 O ATOM 282 O5' DT A 10 15.016 2.499 -2.727 1.00 0.21 O ATOM 283 C5' DT A 10 13.893 1.719 -3.140 1.00 0.19 C ATOM 284 C4' DT A 10 13.168 2.403 -4.275 1.00 0.20 C ATOM 285 O4' DT A 10 12.057 3.155 -3.745 1.00 0.14 O ATOM 286 C3' DT A 10 14.006 3.409 -5.072 1.00 0.24 C ATOM 287 O3' DT A 10 14.310 2.872 -6.367 1.00 0.30 O ATOM 288 C2' DT A 10 13.109 4.637 -5.189 1.00 0.20 C ATOM 289 C1' DT A 10 11.765 4.165 -4.680 1.00 0.15 C ATOM 290 N1 DT A 10 10.979 5.211 -4.011 1.00 0.13 N ATOM 291 C2 DT A 10 9.751 5.531 -4.537 1.00 0.12 C ATOM 292 O2 DT A 10 9.275 4.962 -5.503 1.00 0.11 O ATOM 293 N3 DT A 10 9.099 6.544 -3.890 1.00 0.14 N ATOM 294 C4 DT A 10 9.541 7.254 -2.796 1.00 0.17 C ATOM 295 O4 DT A 10 8.839 8.142 -2.322 1.00 0.21 O ATOM 296 C5 DT A 10 10.840 6.866 -2.289 1.00 0.16 C ATOM 297 C7 DT A 10 11.457 7.686 -1.199 1.00 0.20 C ATOM 298 C6 DT A 10 11.483 5.859 -2.905 1.00 0.14 C ATOM 0 H5' DT A 10 13.213 1.575 -2.300 1.00 0.19 H new ATOM 0 H5'' DT A 10 14.225 0.730 -3.455 1.00 0.19 H new ATOM 0 H4' DT A 10 12.881 1.592 -4.945 1.00 0.20 H new ATOM 0 H3' DT A 10 14.959 3.642 -4.597 1.00 0.24 H new ATOM 0 H2' DT A 10 13.491 5.467 -4.595 1.00 0.20 H new ATOM 0 H2'' DT A 10 13.044 4.986 -6.220 1.00 0.20 H new ATOM 0 H1' DT A 10 11.160 3.835 -5.525 1.00 0.15 H new ATOM 0 H3 DT A 10 8.184 6.802 -4.259 1.00 0.14 H new ATOM 0 H71 DT A 10 12.090 7.051 -0.580 1.00 0.20 H new ATOM 0 H72 DT A 10 12.060 8.481 -1.638 1.00 0.20 H new ATOM 0 H73 DT A 10 10.671 8.124 -0.584 1.00 0.20 H new ATOM 0 H6 DT A 10 12.439 5.543 -2.515 1.00 0.14 H new ATOM 311 P DC A 11 14.840 3.843 -7.536 1.00 0.36 P ATOM 312 OP1 DC A 11 15.399 2.984 -8.611 1.00 0.44 O ATOM 313 OP2 DC A 11 15.689 4.897 -6.925 1.00 0.39 O ATOM 314 O5' DC A 11 13.514 4.531 -8.094 1.00 0.32 O ATOM 315 C5' DC A 11 12.413 3.744 -8.556 1.00 0.28 C ATOM 316 C4' DC A 11 11.522 4.568 -9.455 1.00 0.24 C ATOM 317 O4' DC A 11 10.683 5.410 -8.629 1.00 0.24 O ATOM 318 C3' DC A 11 12.263 5.502 -10.415 1.00 0.23 C ATOM 319 O3' DC A 11 11.640 5.492 -11.704 1.00 0.39 O ATOM 320 C2' DC A 11 12.120 6.875 -9.778 1.00 0.36 C ATOM 321 C1' DC A 11 10.830 6.772 -8.989 1.00 0.29 C ATOM 322 N1 DC A 11 10.821 7.566 -7.753 1.00 0.24 N ATOM 323 C2 DC A 11 9.704 8.348 -7.447 1.00 0.21 C ATOM 324 O2 DC A 11 8.744 8.357 -8.230 1.00 0.20 O ATOM 325 N3 DC A 11 9.702 9.074 -6.305 1.00 0.20 N ATOM 326 C4 DC A 11 10.755 9.033 -5.488 1.00 0.21 C ATOM 327 N4 DC A 11 10.705 9.760 -4.372 1.00 0.23 N ATOM 328 C5 DC A 11 11.906 8.244 -5.780 1.00 0.23 C ATOM 329 C6 DC A 11 11.894 7.536 -6.914 1.00 0.25 C ATOM 0 H5' DC A 11 11.840 3.373 -7.706 1.00 0.28 H new ATOM 0 H5'' DC A 11 12.782 2.873 -9.097 1.00 0.28 H new ATOM 0 H4' DC A 11 10.970 3.846 -10.057 1.00 0.24 H new ATOM 0 H3' DC A 11 13.302 5.209 -10.565 1.00 0.23 H new ATOM 0 H2' DC A 11 12.967 7.107 -9.132 1.00 0.36 H new ATOM 0 H2'' DC A 11 12.068 7.662 -10.530 1.00 0.36 H new ATOM 0 H1' DC A 11 10.024 7.156 -9.614 1.00 0.29 H new ATOM 0 H41 DC A 11 11.492 9.753 -3.723 1.00 0.23 H new ATOM 0 H42 DC A 11 9.880 10.323 -4.167 1.00 0.23 H new ATOM 0 H5 DC A 11 12.754 8.219 -5.112 1.00 0.23 H new ATOM 0 H6 DC A 11 12.750 6.929 -7.170 1.00 0.25 H new ATOM 341 P DC A 12 12.543 5.589 -13.032 1.00 0.17 P ATOM 342 OP1 DC A 12 11.968 4.665 -14.042 1.00 0.19 O ATOM 343 OP2 DC A 12 13.967 5.445 -12.635 1.00 0.20 O ATOM 344 O5' DC A 12 12.329 7.084 -13.543 1.00 0.33 O ATOM 345 C5' DC A 12 11.211 7.428 -14.364 1.00 0.24 C ATOM 346 C4' DC A 12 11.049 8.930 -14.424 1.00 0.29 C ATOM 347 O4' DC A 12 10.462 9.379 -13.186 1.00 0.24 O ATOM 348 C3' DC A 12 12.330 9.749 -14.568 1.00 0.40 C ATOM 349 O3' DC A 12 12.654 9.940 -15.948 1.00 0.51 O ATOM 350 C2' DC A 12 11.958 11.077 -13.925 1.00 0.40 C ATOM 351 C1' DC A 12 10.861 10.716 -12.919 1.00 0.27 C ATOM 352 N1 DC A 12 11.259 10.787 -11.503 1.00 0.19 N ATOM 353 C2 DC A 12 10.567 11.653 -10.653 1.00 0.17 C ATOM 354 O2 DC A 12 9.651 12.343 -11.120 1.00 0.27 O ATOM 355 N3 DC A 12 10.912 11.716 -9.347 1.00 0.19 N ATOM 356 C4 DC A 12 11.911 10.961 -8.886 1.00 0.30 C ATOM 357 N4 DC A 12 12.220 11.055 -7.592 1.00 0.42 N ATOM 358 C5 DC A 12 12.638 10.074 -9.731 1.00 0.35 C ATOM 359 C6 DC A 12 12.279 10.019 -11.020 1.00 0.26 C ATOM 0 H5' DC A 12 10.304 6.973 -13.965 1.00 0.24 H new ATOM 0 H5'' DC A 12 11.352 7.030 -15.369 1.00 0.24 H new ATOM 0 H4' DC A 12 10.449 9.092 -15.319 1.00 0.29 H new ATOM 0 H3' DC A 12 13.199 9.272 -14.114 1.00 0.40 H new ATOM 0 H2' DC A 12 12.816 11.534 -13.431 1.00 0.40 H new ATOM 0 H2'' DC A 12 11.599 11.791 -14.666 1.00 0.40 H new ATOM 0 HO3' DC A 12 13.476 10.468 -16.021 1.00 0.51 H new ATOM 0 H1' DC A 12 10.069 11.454 -13.050 1.00 0.27 H new ATOM 0 H41 DC A 12 12.978 10.492 -7.207 1.00 0.42 H new ATOM 0 H42 DC A 12 11.698 11.690 -6.988 1.00 0.42 H new ATOM 0 H5 DC A 12 13.447 9.470 -9.347 1.00 0.35 H new ATOM 0 H6 DC A 12 12.806 9.355 -11.689 1.00 0.26 H new TER 372 DC A 12 ATOM 373 O5' DG B 13 6.947 19.007 -2.583 1.00 1.25 O ATOM 374 C5' DG B 13 6.233 19.729 -3.591 1.00 1.15 C ATOM 375 C4' DG B 13 5.661 18.790 -4.628 1.00 0.77 C ATOM 376 O4' DG B 13 6.748 18.137 -5.317 1.00 0.47 O ATOM 377 C3' DG B 13 4.798 17.658 -4.078 1.00 0.58 C ATOM 378 O3' DG B 13 3.420 18.052 -4.068 1.00 0.39 O ATOM 379 C2' DG B 13 5.020 16.525 -5.068 1.00 0.66 C ATOM 380 C1' DG B 13 6.337 16.854 -5.765 1.00 0.47 C ATOM 381 N9 DG B 13 7.422 15.919 -5.485 1.00 0.29 N ATOM 382 C8 DG B 13 8.047 15.704 -4.282 1.00 0.25 C ATOM 383 N7 DG B 13 8.994 14.808 -4.347 1.00 0.25 N ATOM 384 C5 DG B 13 8.993 14.407 -5.677 1.00 0.17 C ATOM 385 C6 DG B 13 9.804 13.458 -6.355 1.00 0.18 C ATOM 386 O6 DG B 13 10.711 12.752 -5.898 1.00 0.33 O ATOM 387 N1 DG B 13 9.469 13.369 -7.702 1.00 0.10 N ATOM 388 C2 DG B 13 8.477 14.091 -8.316 1.00 0.23 C ATOM 389 N2 DG B 13 8.299 13.861 -9.620 1.00 0.34 N ATOM 390 N3 DG B 13 7.714 14.974 -7.698 1.00 0.31 N ATOM 391 C4 DG B 13 8.026 15.082 -6.390 1.00 0.22 C ATOM 0 H5' DG B 13 6.900 20.445 -4.072 1.00 1.15 H new ATOM 0 H5'' DG B 13 5.428 20.302 -3.131 1.00 1.15 H new ATOM 0 H4' DG B 13 5.035 19.423 -5.257 1.00 0.77 H new ATOM 0 H3' DG B 13 5.053 17.381 -3.055 1.00 0.58 H new ATOM 0 H2' DG B 13 5.074 15.563 -4.559 1.00 0.66 H new ATOM 0 H2'' DG B 13 4.201 16.462 -5.784 1.00 0.66 H new ATOM 0 HO5' DG B 13 7.309 19.636 -1.925 1.00 1.25 H new ATOM 0 H1' DG B 13 6.148 16.801 -6.837 1.00 0.47 H new ATOM 0 H8 DG B 13 7.782 16.224 -3.373 1.00 0.25 H new ATOM 0 H1 DG B 13 10.002 12.717 -8.278 1.00 0.10 H new ATOM 0 H21 DG B 13 7.577 14.367 -10.133 1.00 0.34 H new ATOM 0 H22 DG B 13 8.885 13.180 -10.102 1.00 0.34 H new ATOM 404 P DG B 14 2.348 17.200 -3.224 1.00 0.26 P ATOM 405 OP1 DG B 14 1.162 18.060 -2.984 1.00 0.27 O ATOM 406 OP2 DG B 14 3.058 16.592 -2.069 1.00 0.40 O ATOM 407 O5' DG B 14 1.917 16.024 -4.211 1.00 0.35 O ATOM 408 C5' DG B 14 1.675 16.274 -5.597 1.00 0.30 C ATOM 409 C4' DG B 14 1.727 14.980 -6.379 1.00 0.33 C ATOM 410 O4' DG B 14 3.083 14.460 -6.342 1.00 0.35 O ATOM 411 C3' DG B 14 0.855 13.838 -5.848 1.00 0.32 C ATOM 412 O3' DG B 14 0.438 13.009 -6.943 1.00 0.33 O ATOM 413 C2' DG B 14 1.813 13.113 -4.929 1.00 0.35 C ATOM 414 C1' DG B 14 3.054 13.152 -5.786 1.00 0.36 C ATOM 415 N9 DG B 14 4.286 12.934 -5.040 1.00 0.38 N ATOM 416 C8 DG B 14 4.621 13.501 -3.842 1.00 0.46 C ATOM 417 N7 DG B 14 5.786 13.116 -3.396 1.00 0.45 N ATOM 418 C5 DG B 14 6.245 12.234 -4.367 1.00 0.37 C ATOM 419 C6 DG B 14 7.450 11.489 -4.441 1.00 0.33 C ATOM 420 O6 DG B 14 8.391 11.460 -3.638 1.00 0.35 O ATOM 421 N1 DG B 14 7.503 10.717 -5.596 1.00 0.26 N ATOM 422 C2 DG B 14 6.526 10.672 -6.559 1.00 0.23 C ATOM 423 N2 DG B 14 6.756 9.871 -7.604 1.00 0.19 N ATOM 424 N3 DG B 14 5.402 11.360 -6.504 1.00 0.26 N ATOM 425 C4 DG B 14 5.328 12.114 -5.389 1.00 0.33 C ATOM 0 H5' DG B 14 2.419 16.971 -5.983 1.00 0.30 H new ATOM 0 H5'' DG B 14 0.700 16.745 -5.724 1.00 0.30 H new ATOM 0 H4' DG B 14 1.360 15.256 -7.368 1.00 0.33 H new ATOM 0 H3' DG B 14 -0.060 14.150 -5.344 1.00 0.32 H new ATOM 0 H2' DG B 14 1.946 13.623 -3.975 1.00 0.35 H new ATOM 0 H2'' DG B 14 1.490 12.096 -4.704 1.00 0.35 H new ATOM 0 H1' DG B 14 3.007 12.353 -6.526 1.00 0.36 H new ATOM 0 H8 DG B 14 3.985 14.198 -3.317 1.00 0.46 H new ATOM 0 H1 DG B 14 8.332 10.140 -5.739 1.00 0.26 H new ATOM 0 H21 DG B 14 6.066 9.797 -8.351 1.00 0.19 H new ATOM 0 H22 DG B 14 7.622 9.334 -7.654 1.00 0.19 H new ATOM 437 P DA B 15 -0.486 11.719 -6.677 1.00 0.33 P ATOM 438 OP1 DA B 15 -1.729 11.878 -7.475 1.00 0.35 O ATOM 439 OP2 DA B 15 -0.582 11.497 -5.211 1.00 0.34 O ATOM 440 O5' DA B 15 0.351 10.516 -7.304 1.00 0.34 O ATOM 441 C5' DA B 15 1.053 10.671 -8.542 1.00 0.32 C ATOM 442 C4' DA B 15 1.260 9.324 -9.200 1.00 0.27 C ATOM 443 O4' DA B 15 2.557 8.811 -8.821 1.00 0.24 O ATOM 444 C3' DA B 15 0.281 8.230 -8.788 1.00 0.27 C ATOM 445 O3' DA B 15 0.216 7.218 -9.802 1.00 0.24 O ATOM 446 C2' DA B 15 0.919 7.687 -7.522 1.00 0.25 C ATOM 447 C1' DA B 15 2.412 7.811 -7.814 1.00 0.22 C ATOM 448 N9 DA B 15 3.210 8.227 -6.663 1.00 0.23 N ATOM 449 C8 DA B 15 2.908 9.239 -5.791 1.00 0.28 C ATOM 450 N7 DA B 15 3.817 9.431 -4.866 1.00 0.28 N ATOM 451 C5 DA B 15 4.779 8.468 -5.140 1.00 0.23 C ATOM 452 C6 DA B 15 6.003 8.149 -4.524 1.00 0.21 C ATOM 453 N6 DA B 15 6.501 8.805 -3.475 1.00 0.23 N ATOM 454 N1 DA B 15 6.716 7.126 -5.038 1.00 0.16 N ATOM 455 C2 DA B 15 6.230 6.475 -6.101 1.00 0.14 C ATOM 456 N3 DA B 15 5.103 6.691 -6.778 1.00 0.16 N ATOM 457 C4 DA B 15 4.413 7.712 -6.239 1.00 0.20 C ATOM 0 H5' DA B 15 2.017 11.149 -8.364 1.00 0.32 H new ATOM 0 H5'' DA B 15 0.491 11.326 -9.207 1.00 0.32 H new ATOM 0 H4' DA B 15 1.130 9.524 -10.263 1.00 0.27 H new ATOM 0 H3' DA B 15 -0.742 8.578 -8.644 1.00 0.27 H new ATOM 0 H2' DA B 15 0.630 8.264 -6.644 1.00 0.25 H new ATOM 0 H2'' DA B 15 0.628 6.653 -7.334 1.00 0.25 H new ATOM 0 H1' DA B 15 2.772 6.826 -8.112 1.00 0.22 H new ATOM 0 H8 DA B 15 2.004 9.825 -5.859 1.00 0.28 H new ATOM 0 H61 DA B 15 7.396 8.523 -3.075 1.00 0.23 H new ATOM 0 H62 DA B 15 5.987 9.589 -3.073 1.00 0.23 H new ATOM 0 H2 DA B 15 6.838 5.658 -6.462 1.00 0.14 H new ATOM 469 P DG B 16 -0.517 5.818 -9.496 1.00 0.24 P ATOM 470 OP1 DG B 16 -1.095 5.319 -10.769 1.00 0.23 O ATOM 471 OP2 DG B 16 -1.401 6.010 -8.317 1.00 0.27 O ATOM 472 O5' DG B 16 0.671 4.842 -9.075 1.00 0.20 O ATOM 473 C5' DG B 16 1.568 4.317 -10.055 1.00 0.15 C ATOM 474 C4' DG B 16 2.551 3.363 -9.417 1.00 0.14 C ATOM 475 O4' DG B 16 3.200 4.026 -8.305 1.00 0.15 O ATOM 476 C3' DG B 16 1.944 2.073 -8.849 1.00 0.15 C ATOM 477 O3' DG B 16 2.631 0.939 -9.400 1.00 0.15 O ATOM 478 C2' DG B 16 2.184 2.180 -7.346 1.00 0.14 C ATOM 479 C1' DG B 16 3.398 3.077 -7.282 1.00 0.15 C ATOM 480 N9 DG B 16 3.580 3.793 -6.023 1.00 0.15 N ATOM 481 C8 DG B 16 2.687 4.637 -5.410 1.00 0.18 C ATOM 482 N7 DG B 16 3.140 5.147 -4.299 1.00 0.18 N ATOM 483 C5 DG B 16 4.406 4.595 -4.162 1.00 0.15 C ATOM 484 C6 DG B 16 5.373 4.765 -3.144 1.00 0.14 C ATOM 485 O6 DG B 16 5.305 5.464 -2.128 1.00 0.16 O ATOM 486 N1 DG B 16 6.517 4.015 -3.394 1.00 0.12 N ATOM 487 C2 DG B 16 6.704 3.203 -4.484 1.00 0.11 C ATOM 488 N2 DG B 16 7.875 2.560 -4.547 1.00 0.11 N ATOM 489 N3 DG B 16 5.809 3.034 -5.441 1.00 0.12 N ATOM 490 C4 DG B 16 4.691 3.754 -5.217 1.00 0.14 C ATOM 0 H5' DG B 16 2.106 5.133 -10.538 1.00 0.15 H new ATOM 0 H5'' DG B 16 1.005 3.801 -10.833 1.00 0.15 H new ATOM 0 H4' DG B 16 3.226 3.082 -10.225 1.00 0.14 H new ATOM 0 H3' DG B 16 0.887 1.949 -9.086 1.00 0.15 H new ATOM 0 H2' DG B 16 1.329 2.613 -6.827 1.00 0.14 H new ATOM 0 H2'' DG B 16 2.372 1.207 -6.893 1.00 0.14 H new ATOM 0 H1' DG B 16 4.289 2.457 -7.384 1.00 0.15 H new ATOM 0 H8 DG B 16 1.707 4.856 -5.808 1.00 0.18 H new ATOM 0 H1 DG B 16 7.276 4.073 -2.715 1.00 0.12 H new ATOM 0 H21 DG B 16 8.075 1.941 -5.333 1.00 0.11 H new ATOM 0 H22 DG B 16 8.568 2.689 -3.809 1.00 0.11 H new ATOM 502 P DG B 17 2.462 -0.514 -8.728 1.00 0.16 P ATOM 503 OP1 DG B 17 2.722 -1.521 -9.788 1.00 0.18 O ATOM 504 OP2 DG B 17 1.179 -0.553 -7.979 1.00 0.17 O ATOM 505 O5' DG B 17 3.659 -0.587 -7.677 1.00 0.15 O ATOM 506 C5' DG B 17 4.983 -0.192 -8.044 1.00 0.15 C ATOM 507 C4' DG B 17 6.003 -1.104 -7.402 1.00 0.13 C ATOM 508 O4' DG B 17 6.505 -0.474 -6.201 1.00 0.12 O ATOM 509 C3' DG B 17 5.478 -2.475 -6.981 1.00 0.13 C ATOM 510 O3' DG B 17 6.472 -3.480 -7.208 1.00 0.12 O ATOM 511 C2' DG B 17 5.209 -2.329 -5.491 1.00 0.11 C ATOM 512 C1' DG B 17 6.106 -1.181 -5.038 1.00 0.11 C ATOM 513 N9 DG B 17 5.468 -0.223 -4.138 1.00 0.11 N ATOM 514 C8 DG B 17 4.236 0.364 -4.292 1.00 0.11 C ATOM 515 N7 DG B 17 3.933 1.188 -3.327 1.00 0.11 N ATOM 516 C5 DG B 17 5.034 1.145 -2.481 1.00 0.11 C ATOM 517 C6 DG B 17 5.281 1.826 -1.262 1.00 0.10 C ATOM 518 O6 DG B 17 4.552 2.626 -0.668 1.00 0.10 O ATOM 519 N1 DG B 17 6.524 1.494 -0.732 1.00 0.10 N ATOM 520 C2 DG B 17 7.415 0.619 -1.302 1.00 0.10 C ATOM 521 N2 DG B 17 8.577 0.443 -0.655 1.00 0.10 N ATOM 522 N3 DG B 17 7.190 -0.035 -2.431 1.00 0.11 N ATOM 523 C4 DG B 17 5.990 0.276 -2.965 1.00 0.11 C ATOM 0 H5' DG B 17 5.161 0.838 -7.734 1.00 0.15 H new ATOM 0 H5'' DG B 17 5.091 -0.222 -9.128 1.00 0.15 H new ATOM 0 H4' DG B 17 6.760 -1.263 -8.170 1.00 0.13 H new ATOM 0 H3' DG B 17 4.593 -2.775 -7.542 1.00 0.13 H new ATOM 0 H2' DG B 17 4.159 -2.109 -5.299 1.00 0.11 H new ATOM 0 H2'' DG B 17 5.444 -3.249 -4.956 1.00 0.11 H new ATOM 0 H1' DG B 17 6.931 -1.627 -4.482 1.00 0.11 H new ATOM 0 H8 DG B 17 3.583 0.163 -5.129 1.00 0.11 H new ATOM 0 H1 DG B 17 6.794 1.935 0.147 1.00 0.10 H new ATOM 0 H21 DG B 17 9.278 -0.195 -1.031 1.00 0.10 H new ATOM 0 H22 DG B 17 8.759 0.947 0.213 1.00 0.10 H new ATOM 535 P DC B 18 6.025 -5.006 -7.452 1.00 0.13 P ATOM 536 OP1 DC B 18 7.063 -5.633 -8.309 1.00 0.14 O ATOM 537 OP2 DC B 18 4.604 -5.029 -7.887 1.00 0.14 O ATOM 538 O5' DC B 18 6.114 -5.670 -6.006 1.00 0.11 O ATOM 539 C5' DC B 18 7.374 -5.841 -5.355 1.00 0.12 C ATOM 540 C4' DC B 18 7.200 -5.787 -3.856 1.00 0.11 C ATOM 541 O4' DC B 18 6.529 -4.560 -3.509 1.00 0.10 O ATOM 542 C3' DC B 18 6.339 -6.902 -3.260 1.00 0.10 C ATOM 543 O3' DC B 18 7.168 -7.925 -2.697 1.00 0.10 O ATOM 544 C2' DC B 18 5.538 -6.213 -2.162 1.00 0.08 C ATOM 545 C1' DC B 18 5.912 -4.740 -2.254 1.00 0.09 C ATOM 546 N1 DC B 18 4.766 -3.822 -2.174 1.00 0.08 N ATOM 547 C2 DC B 18 4.665 -2.970 -1.077 1.00 0.08 C ATOM 548 O2 DC B 18 5.548 -3.005 -0.213 1.00 0.07 O ATOM 549 N3 DC B 18 3.609 -2.132 -0.982 1.00 0.07 N ATOM 550 C4 DC B 18 2.677 -2.127 -1.936 1.00 0.08 C ATOM 551 N4 DC B 18 1.650 -1.288 -1.798 1.00 0.08 N ATOM 552 C5 DC B 18 2.757 -2.983 -3.073 1.00 0.09 C ATOM 553 C6 DC B 18 3.811 -3.806 -3.151 1.00 0.09 C ATOM 0 H5' DC B 18 8.066 -5.062 -5.676 1.00 0.12 H new ATOM 0 H5'' DC B 18 7.813 -6.796 -5.643 1.00 0.12 H new ATOM 0 H4' DC B 18 8.209 -5.883 -3.456 1.00 0.11 H new ATOM 0 H3' DC B 18 5.705 -7.382 -4.005 1.00 0.10 H new ATOM 0 H2' DC B 18 4.467 -6.357 -2.308 1.00 0.08 H new ATOM 0 H2'' DC B 18 5.784 -6.620 -1.181 1.00 0.08 H new ATOM 0 H1' DC B 18 6.555 -4.504 -1.406 1.00 0.09 H new ATOM 0 H41 DC B 18 0.918 -1.257 -2.508 1.00 0.08 H new ATOM 0 H42 DC B 18 1.596 -0.678 -0.983 1.00 0.08 H new ATOM 0 H5 DC B 18 1.998 -2.969 -3.841 1.00 0.09 H new ATOM 0 H6 DC B 18 3.907 -4.467 -3.999 1.00 0.09 H new ATOM 565 P DC B 19 6.493 -9.192 -1.972 1.00 0.10 P ATOM 566 OP1 DC B 19 7.561 -10.203 -1.767 1.00 0.11 O ATOM 567 OP2 DC B 19 5.267 -9.564 -2.724 1.00 0.11 O ATOM 568 O5' DC B 19 6.047 -8.633 -0.547 1.00 0.09 O ATOM 569 C5' DC B 19 6.935 -8.674 0.573 1.00 0.08 C ATOM 570 C4' DC B 19 6.160 -8.516 1.862 1.00 0.08 C ATOM 571 O4' DC B 19 5.438 -7.263 1.832 1.00 0.07 O ATOM 572 C3' DC B 19 5.121 -9.608 2.132 1.00 0.09 C ATOM 573 O3' DC B 19 5.378 -10.196 3.414 1.00 0.11 O ATOM 574 C2' DC B 19 3.786 -8.876 2.124 1.00 0.08 C ATOM 575 C1' DC B 19 4.162 -7.440 2.410 1.00 0.07 C ATOM 576 N1 DC B 19 3.269 -6.419 1.835 1.00 0.06 N ATOM 577 C2 DC B 19 2.695 -5.474 2.688 1.00 0.06 C ATOM 578 O2 DC B 19 2.918 -5.550 3.904 1.00 0.07 O ATOM 579 N3 DC B 19 1.911 -4.503 2.169 1.00 0.05 N ATOM 580 C4 DC B 19 1.684 -4.462 0.855 1.00 0.06 C ATOM 581 N4 DC B 19 0.901 -3.488 0.390 1.00 0.06 N ATOM 582 C5 DC B 19 2.247 -5.419 -0.039 1.00 0.06 C ATOM 583 C6 DC B 19 3.021 -6.376 0.491 1.00 0.06 C ATOM 0 H5' DC B 19 7.677 -7.880 0.487 1.00 0.08 H new ATOM 0 H5'' DC B 19 7.478 -9.619 0.581 1.00 0.08 H new ATOM 0 H4' DC B 19 6.912 -8.571 2.649 1.00 0.08 H new ATOM 0 H3' DC B 19 5.141 -10.414 1.399 1.00 0.09 H new ATOM 0 H2' DC B 19 3.282 -8.974 1.163 1.00 0.08 H new ATOM 0 H2'' DC B 19 3.108 -9.271 2.881 1.00 0.08 H new ATOM 0 H1' DC B 19 4.109 -7.296 3.489 1.00 0.07 H new ATOM 0 H41 DC B 19 0.705 -3.424 -0.609 1.00 0.06 H new ATOM 0 H42 DC B 19 0.498 -2.806 1.033 1.00 0.06 H new ATOM 0 H5 DC B 19 2.057 -5.375 -1.101 1.00 0.06 H new ATOM 0 H6 DC B 19 3.456 -7.125 -0.154 1.00 0.06 H new ATOM 595 P DT B 20 4.363 -11.288 4.015 1.00 0.12 P ATOM 596 OP1 DT B 20 5.066 -11.984 5.123 1.00 0.15 O ATOM 597 OP2 DT B 20 3.804 -12.080 2.889 1.00 0.12 O ATOM 598 O5' DT B 20 3.188 -10.413 4.641 1.00 0.11 O ATOM 599 C5' DT B 20 3.426 -9.531 5.741 1.00 0.11 C ATOM 600 C4' DT B 20 2.119 -9.181 6.417 1.00 0.11 C ATOM 601 O4' DT B 20 1.493 -8.078 5.710 1.00 0.10 O ATOM 602 C3' DT B 20 1.062 -10.296 6.451 1.00 0.13 C ATOM 603 O3' DT B 20 0.434 -10.330 7.739 1.00 0.15 O ATOM 604 C2' DT B 20 0.071 -9.870 5.384 1.00 0.13 C ATOM 605 C1' DT B 20 0.117 -8.370 5.564 1.00 0.11 C ATOM 606 N1 DT B 20 -0.421 -7.539 4.459 1.00 0.10 N ATOM 607 C2 DT B 20 -0.972 -6.326 4.810 1.00 0.09 C ATOM 608 O2 DT B 20 -1.042 -5.937 5.963 1.00 0.10 O ATOM 609 N3 DT B 20 -1.439 -5.582 3.760 1.00 0.09 N ATOM 610 C4 DT B 20 -1.410 -5.915 2.425 1.00 0.09 C ATOM 611 O4 DT B 20 -1.853 -5.130 1.591 1.00 0.09 O ATOM 612 C5 DT B 20 -0.826 -7.203 2.123 1.00 0.09 C ATOM 613 C7 DT B 20 -0.805 -7.673 0.702 1.00 0.10 C ATOM 614 C6 DT B 20 -0.368 -7.948 3.139 1.00 0.10 C ATOM 0 H5' DT B 20 3.918 -8.624 5.390 1.00 0.11 H new ATOM 0 H5'' DT B 20 4.100 -10.002 6.456 1.00 0.11 H new ATOM 0 H4' DT B 20 2.406 -8.959 7.445 1.00 0.11 H new ATOM 0 H3' DT B 20 1.471 -11.291 6.276 1.00 0.13 H new ATOM 0 H2' DT B 20 0.377 -10.179 4.384 1.00 0.13 H new ATOM 0 H2'' DT B 20 -0.925 -10.279 5.553 1.00 0.13 H new ATOM 0 H1' DT B 20 -0.526 -8.120 6.408 1.00 0.11 H new ATOM 0 H3 DT B 20 -1.855 -4.680 3.993 1.00 0.09 H new ATOM 0 H71 DT B 20 0.062 -8.315 0.544 1.00 0.10 H new ATOM 0 H72 DT B 20 -1.716 -8.234 0.491 1.00 0.10 H new ATOM 0 H73 DT B 20 -0.746 -6.813 0.035 1.00 0.10 H new ATOM 0 H6 DT B 20 0.063 -8.913 2.916 1.00 0.10 H new ATOM 627 P DG B 21 -0.464 -11.595 8.161 1.00 0.19 P ATOM 628 OP1 DG B 21 0.284 -12.337 9.208 1.00 0.24 O ATOM 629 OP2 DG B 21 -0.897 -12.304 6.929 1.00 0.19 O ATOM 630 O5' DG B 21 -1.753 -10.944 8.836 1.00 0.20 O ATOM 631 C5' DG B 21 -1.644 -10.157 10.025 1.00 0.21 C ATOM 632 C4' DG B 21 -2.888 -9.319 10.216 1.00 0.21 C ATOM 633 O4' DG B 21 -3.127 -8.540 9.015 1.00 0.19 O ATOM 634 C3' DG B 21 -4.177 -10.108 10.474 1.00 0.23 C ATOM 635 O3' DG B 21 -4.861 -9.552 11.603 1.00 0.21 O ATOM 636 C2' DG B 21 -4.988 -9.924 9.199 1.00 0.23 C ATOM 637 C1' DG B 21 -4.504 -8.582 8.695 1.00 0.21 C ATOM 638 N9 DG B 21 -4.638 -8.355 7.257 1.00 0.20 N ATOM 639 C8 DG B 21 -4.379 -9.241 6.239 1.00 0.21 C ATOM 640 N7 DG B 21 -4.540 -8.723 5.052 1.00 0.21 N ATOM 641 C5 DG B 21 -4.957 -7.423 5.299 1.00 0.21 C ATOM 642 C6 DG B 21 -5.303 -6.384 4.400 1.00 0.21 C ATOM 643 O6 DG B 21 -5.299 -6.404 3.165 1.00 0.21 O ATOM 644 N1 DG B 21 -5.683 -5.229 5.073 1.00 0.20 N ATOM 645 C2 DG B 21 -5.731 -5.093 6.437 1.00 0.20 C ATOM 646 N2 DG B 21 -6.135 -3.902 6.895 1.00 0.20 N ATOM 647 N3 DG B 21 -5.411 -6.052 7.288 1.00 0.20 N ATOM 648 C4 DG B 21 -5.035 -7.183 6.655 1.00 0.20 C ATOM 0 H5' DG B 21 -0.768 -9.511 9.963 1.00 0.21 H new ATOM 0 H5'' DG B 21 -1.499 -10.807 10.888 1.00 0.21 H new ATOM 0 H4' DG B 21 -2.682 -8.719 11.102 1.00 0.21 H new ATOM 0 H3' DG B 21 -4.003 -11.160 10.698 1.00 0.23 H new ATOM 0 H2' DG B 21 -4.799 -10.720 8.479 1.00 0.23 H new ATOM 0 H2'' DG B 21 -6.060 -9.921 9.397 1.00 0.23 H new ATOM 0 H1' DG B 21 -5.120 -7.812 9.160 1.00 0.21 H new ATOM 0 H8 DG B 21 -4.073 -10.263 6.405 1.00 0.21 H new ATOM 0 H1 DG B 21 -5.946 -4.421 4.510 1.00 0.20 H new ATOM 0 H21 DG B 21 -6.193 -3.735 7.900 1.00 0.20 H new ATOM 0 H22 DG B 21 -6.385 -3.162 6.239 1.00 0.20 H new ATOM 660 P DA B 22 -6.236 -10.209 12.117 1.00 0.34 P ATOM 661 OP1 DA B 22 -6.095 -10.494 13.567 1.00 0.38 O ATOM 662 OP2 DA B 22 -6.604 -11.307 11.187 1.00 0.41 O ATOM 663 O5' DA B 22 -7.301 -9.036 11.942 1.00 0.35 O ATOM 664 C5' DA B 22 -6.900 -7.665 12.002 1.00 0.29 C ATOM 665 C4' DA B 22 -8.038 -6.766 11.576 1.00 0.34 C ATOM 666 O4' DA B 22 -7.897 -6.468 10.164 1.00 0.37 O ATOM 667 C3' DA B 22 -9.436 -7.365 11.739 1.00 0.41 C ATOM 668 O3' DA B 22 -10.359 -6.349 12.151 1.00 0.48 O ATOM 669 C2' DA B 22 -9.760 -7.870 10.344 1.00 0.40 C ATOM 670 C1' DA B 22 -9.080 -6.836 9.474 1.00 0.36 C ATOM 671 N9 DA B 22 -8.701 -7.321 8.150 1.00 0.32 N ATOM 672 C8 DA B 22 -8.103 -8.517 7.852 1.00 0.31 C ATOM 673 N7 DA B 22 -7.864 -8.686 6.574 1.00 0.27 N ATOM 674 C5 DA B 22 -8.347 -7.523 5.989 1.00 0.25 C ATOM 675 C6 DA B 22 -8.407 -7.089 4.654 1.00 0.22 C ATOM 676 N6 DA B 22 -7.964 -7.804 3.619 1.00 0.20 N ATOM 677 N1 DA B 22 -8.952 -5.878 4.412 1.00 0.21 N ATOM 678 C2 DA B 22 -9.409 -5.162 5.448 1.00 0.24 C ATOM 679 N3 DA B 22 -9.424 -5.469 6.742 1.00 0.28 N ATOM 680 C4 DA B 22 -8.869 -6.675 6.949 1.00 0.28 C ATOM 0 H5' DA B 22 -6.038 -7.503 11.355 1.00 0.29 H new ATOM 0 H5'' DA B 22 -6.589 -7.414 13.016 1.00 0.29 H new ATOM 0 H4' DA B 22 -7.967 -5.896 12.228 1.00 0.34 H new ATOM 0 H3' DA B 22 -9.494 -8.150 12.493 1.00 0.41 H new ATOM 0 H2' DA B 22 -9.367 -8.872 10.171 1.00 0.40 H new ATOM 0 H2'' DA B 22 -10.834 -7.913 10.164 1.00 0.40 H new ATOM 0 H1' DA B 22 -9.778 -6.016 9.306 1.00 0.36 H new ATOM 0 H8 DA B 22 -7.852 -9.253 8.601 1.00 0.31 H new ATOM 0 H61 DA B 22 -8.037 -7.431 2.673 1.00 0.20 H new ATOM 0 H62 DA B 22 -7.552 -8.724 3.774 1.00 0.20 H new ATOM 0 H2 DA B 22 -9.825 -4.197 5.196 1.00 0.24 H new ATOM 692 P DG B 23 -11.907 -6.718 12.376 1.00 0.57 P ATOM 693 OP1 DG B 23 -12.534 -5.580 13.094 1.00 0.65 O ATOM 694 OP2 DG B 23 -11.986 -8.083 12.956 1.00 0.64 O ATOM 695 O5' DG B 23 -12.506 -6.769 10.901 1.00 0.48 O ATOM 696 C5' DG B 23 -12.609 -5.587 10.105 1.00 0.41 C ATOM 697 C4' DG B 23 -13.566 -5.812 8.958 1.00 0.34 C ATOM 698 O4' DG B 23 -12.807 -6.212 7.792 1.00 0.31 O ATOM 699 C3' DG B 23 -14.604 -6.917 9.196 1.00 0.38 C ATOM 700 O3' DG B 23 -15.929 -6.399 9.038 1.00 0.38 O ATOM 701 C2' DG B 23 -14.310 -7.950 8.121 1.00 0.37 C ATOM 702 C1' DG B 23 -13.559 -7.162 7.074 1.00 0.31 C ATOM 703 N9 DG B 23 -12.644 -7.960 6.266 1.00 0.30 N ATOM 704 C8 DG B 23 -11.884 -9.018 6.693 1.00 0.32 C ATOM 705 N7 DG B 23 -11.176 -9.562 5.741 1.00 0.30 N ATOM 706 C5 DG B 23 -11.488 -8.812 4.614 1.00 0.27 C ATOM 707 C6 DG B 23 -11.034 -8.932 3.275 1.00 0.25 C ATOM 708 O6 DG B 23 -10.236 -9.750 2.801 1.00 0.25 O ATOM 709 N1 DG B 23 -11.608 -7.970 2.452 1.00 0.22 N ATOM 710 C2 DG B 23 -12.498 -7.009 2.866 1.00 0.22 C ATOM 711 N2 DG B 23 -12.938 -6.164 1.929 1.00 0.20 N ATOM 712 N3 DG B 23 -12.926 -6.884 4.109 1.00 0.24 N ATOM 713 C4 DG B 23 -12.387 -7.814 4.924 1.00 0.27 C ATOM 0 H5' DG B 23 -11.627 -5.312 9.720 1.00 0.41 H new ATOM 0 H5'' DG B 23 -12.955 -4.755 10.719 1.00 0.41 H new ATOM 0 H4' DG B 23 -14.101 -4.870 8.837 1.00 0.34 H new ATOM 0 H3' DG B 23 -14.546 -7.333 10.202 1.00 0.38 H new ATOM 0 H2' DG B 23 -13.712 -8.775 8.509 1.00 0.37 H new ATOM 0 H2'' DG B 23 -15.226 -8.382 7.718 1.00 0.37 H new ATOM 0 H1' DG B 23 -14.277 -6.736 6.373 1.00 0.31 H new ATOM 0 H8 DG B 23 -11.872 -9.367 7.715 1.00 0.32 H new ATOM 0 H1 DG B 23 -11.349 -7.978 1.466 1.00 0.22 H new ATOM 0 H21 DG B 23 -13.601 -5.429 2.176 1.00 0.20 H new ATOM 0 H22 DG B 23 -12.611 -6.254 0.967 1.00 0.20 H new ATOM 725 P DG B 24 -17.186 -7.241 9.586 1.00 0.37 P ATOM 726 OP1 DG B 24 -17.885 -6.391 10.584 1.00 0.36 O ATOM 727 OP2 DG B 24 -16.720 -8.597 9.976 1.00 0.57 O ATOM 728 O5' DG B 24 -18.134 -7.392 8.315 1.00 0.36 O ATOM 729 C5' DG B 24 -18.593 -6.243 7.600 1.00 0.31 C ATOM 730 C4' DG B 24 -18.972 -6.624 6.187 1.00 0.42 C ATOM 731 O4' DG B 24 -17.843 -7.281 5.565 1.00 0.42 O ATOM 732 C3' DG B 24 -20.153 -7.594 6.072 1.00 0.63 C ATOM 733 O3' DG B 24 -21.132 -7.077 5.166 1.00 0.71 O ATOM 734 C2' DG B 24 -19.544 -8.869 5.506 1.00 0.65 C ATOM 735 C1' DG B 24 -18.308 -8.366 4.793 1.00 0.53 C ATOM 736 N9 DG B 24 -17.219 -9.333 4.673 1.00 0.55 N ATOM 737 C8 DG B 24 -16.655 -10.086 5.676 1.00 0.62 C ATOM 738 N7 DG B 24 -15.695 -10.864 5.257 1.00 0.66 N ATOM 739 C5 DG B 24 -15.619 -10.610 3.894 1.00 0.60 C ATOM 740 C6 DG B 24 -14.762 -11.156 2.904 1.00 0.62 C ATOM 741 O6 DG B 24 -13.872 -12.003 3.037 1.00 0.70 O ATOM 742 N1 DG B 24 -15.023 -10.617 1.649 1.00 0.54 N ATOM 743 C2 DG B 24 -15.983 -9.674 1.380 1.00 0.49 C ATOM 744 N2 DG B 24 -16.080 -9.276 0.107 1.00 0.46 N ATOM 745 N3 DG B 24 -16.789 -9.159 2.291 1.00 0.49 N ATOM 746 C4 DG B 24 -16.553 -9.667 3.519 1.00 0.54 C ATOM 0 H5' DG B 24 -17.813 -5.481 7.582 1.00 0.31 H new ATOM 0 H5'' DG B 24 -19.452 -5.808 8.110 1.00 0.31 H new ATOM 0 H4' DG B 24 -19.263 -5.690 5.706 1.00 0.42 H new ATOM 0 H3' DG B 24 -20.653 -7.755 7.027 1.00 0.63 H new ATOM 0 H2' DG B 24 -19.295 -9.581 6.292 1.00 0.65 H new ATOM 0 H2'' DG B 24 -20.227 -9.374 4.823 1.00 0.65 H new ATOM 0 HO3' DG B 24 -21.881 -7.706 5.099 1.00 0.71 H new ATOM 0 H1' DG B 24 -18.590 -8.120 3.769 1.00 0.53 H new ATOM 0 H8 DG B 24 -16.974 -10.038 6.707 1.00 0.62 H new ATOM 0 H1 DG B 24 -14.457 -10.948 0.868 1.00 0.54 H new ATOM 0 H21 DG B 24 -16.774 -8.577 -0.157 1.00 0.46 H new ATOM 0 H22 DG B 24 -15.460 -9.671 -0.600 1.00 0.46 H new TER 759 DG B 24 HETATM 760 PT 1PT A 77 0.189 1.956 3.021 1.00 0.06 PT HETATM 761 N1 1PT A 77 -1.748 2.314 2.553 1.00 0.08 N HETATM 762 N2 1PT A 77 0.625 3.324 1.590 1.00 0.09 N HETATM 763 C1 1PT A 77 -1.811 3.650 1.789 1.00 0.11 C HETATM 764 C2 1PT A 77 -0.662 3.639 0.796 1.00 0.12 C HETATM 765 C3 1PT A 77 -0.579 4.939 0.051 1.00 0.16 C HETATM 766 C4 1PT A 77 -1.873 5.220 -0.678 1.00 0.19 C HETATM 767 C5 1PT A 77 -3.125 5.240 0.333 1.00 0.18 C HETATM 768 C6 1PT A 77 -3.116 3.866 1.097 1.00 0.14 C HETATM 0 H62 1PT A 77 -3.298 3.053 0.394 1.00 0.14 H new HETATM 0 H61 1PT A 77 -3.926 3.845 1.826 1.00 0.14 H new HETATM 0 H52 1PT A 77 -3.043 6.072 1.033 1.00 0.18 H new HETATM 0 H51 1PT A 77 -4.060 5.373 -0.212 1.00 0.18 H new HETATM 0 H42 1PT A 77 -1.802 6.179 -1.191 1.00 0.19 H new HETATM 0 H41 1PT A 77 -2.034 4.460 -1.443 1.00 0.19 H new HETATM 0 H32 1PT A 77 -0.364 5.750 0.747 1.00 0.16 H new HETATM 0 H31 1PT A 77 0.245 4.904 -0.661 1.00 0.16 H new HETATM 0 H2 1PT A 77 -0.812 2.877 0.032 1.00 0.12 H new HETATM 0 H1 1PT A 77 -1.724 4.477 2.493 1.00 0.11 H new