USER MOD reduce.3.24.130724 H: found=0, std=0, add=242, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 242 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 1 DT C7 :methyl 150:sc= -13.2! (180deg=-10.2!) USER MOD Set 1.2: A 12 DT C7 :methyl 150:sc= -4.17! (180deg=-3.03!) USER MOD Set 1.3: A 18 DT C7 :methyl -30:sc= -2.65! (180deg=-6.21!) USER MOD Set 2.1: A 5 DT C7 :methyl 150:sc= -7.24! (180deg=-7.24!) USER MOD Set 2.2: A 7 DT C7 :methyl -30:sc= -8.66! (180deg=-10.1!) USER MOD Single : A 1 DT O5' : rot -151:sc= -5.55! USER MOD Single : A 6 DT C7 :methyl -30:sc= -3.98! (180deg=-6.77!) USER MOD Single : A 11 DT C7 :methyl 150:sc= -10! (180deg=-10!) USER MOD Single : A 16 DT C7 :methyl -30:sc= -3.32 (180deg=-7.24!) USER MOD Single : A 17 DT C7 :methyl 150:sc= -10.2! (180deg=-10.2!) USER MOD Single : A 21 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -4.086 -3.073 5.669 1.00 0.19 O ATOM 2 C5' DT A 1 -2.816 -3.702 5.532 1.00 0.16 C ATOM 3 C4' DT A 1 -2.877 -5.177 5.916 1.00 0.15 C ATOM 4 O4' DT A 1 -3.710 -5.877 4.999 1.00 0.18 O ATOM 5 C3' DT A 1 -1.523 -5.865 5.878 1.00 0.16 C ATOM 6 O3' DT A 1 -0.979 -5.909 7.197 1.00 0.19 O ATOM 7 C2' DT A 1 -1.816 -7.286 5.393 1.00 0.20 C ATOM 8 C1' DT A 1 -3.276 -7.237 4.934 1.00 0.17 C ATOM 9 N1 DT A 1 -3.485 -7.699 3.545 1.00 0.19 N ATOM 10 C2 DT A 1 -4.342 -8.764 3.341 1.00 0.28 C ATOM 11 O2 DT A 1 -4.903 -9.343 4.269 1.00 0.35 O ATOM 12 N3 DT A 1 -4.524 -9.155 2.029 1.00 0.32 N ATOM 13 C4 DT A 1 -3.932 -8.584 0.918 1.00 0.26 C ATOM 14 O4 DT A 1 -4.170 -9.017 -0.207 1.00 0.33 O ATOM 15 C5 DT A 1 -3.046 -7.479 1.224 1.00 0.18 C ATOM 16 C7 DT A 1 -2.289 -6.777 0.094 1.00 0.20 C ATOM 17 C6 DT A 1 -2.854 -7.077 2.500 1.00 0.16 C ATOM 0 H5' DT A 1 -2.086 -3.191 6.161 1.00 0.16 H new ATOM 0 H5'' DT A 1 -2.471 -3.607 4.502 1.00 0.16 H new ATOM 0 H4' DT A 1 -3.260 -5.202 6.936 1.00 0.15 H new ATOM 0 H3' DT A 1 -0.809 -5.350 5.235 1.00 0.16 H new ATOM 0 H2' DT A 1 -1.152 -7.572 4.577 1.00 0.20 H new ATOM 0 H2'' DT A 1 -1.674 -8.015 6.190 1.00 0.20 H new ATOM 0 HO5' DT A 1 -4.158 -2.338 5.025 1.00 0.19 H new ATOM 0 H1' DT A 1 -3.836 -7.906 5.588 1.00 0.17 H new ATOM 0 H3 DT A 1 -5.155 -9.939 1.864 1.00 0.32 H new ATOM 0 H71 DT A 1 -2.124 -5.733 0.360 1.00 0.20 H new ATOM 0 H72 DT A 1 -1.328 -7.268 -0.060 1.00 0.20 H new ATOM 0 H73 DT A 1 -2.875 -6.829 -0.824 1.00 0.20 H new ATOM 0 H6 DT A 1 -2.190 -6.249 2.700 1.00 0.16 H new ATOM 31 P DG A 2 -0.073 -4.695 7.742 1.00 0.20 P ATOM 32 OP1 DG A 2 0.511 -5.103 9.041 1.00 0.30 O ATOM 33 OP2 DG A 2 -0.857 -3.444 7.639 1.00 0.34 O ATOM 34 O5' DG A 2 1.112 -4.634 6.651 1.00 0.37 O ATOM 35 C5' DG A 2 2.386 -4.056 6.966 1.00 0.29 C ATOM 36 C4' DG A 2 3.424 -5.124 7.323 1.00 0.27 C ATOM 37 O4' DG A 2 3.474 -6.120 6.295 1.00 0.31 O ATOM 38 C3' DG A 2 4.851 -4.573 7.475 1.00 0.25 C ATOM 39 O3' DG A 2 5.313 -4.813 8.806 1.00 0.29 O ATOM 40 C2' DG A 2 5.682 -5.384 6.482 1.00 0.30 C ATOM 41 C1' DG A 2 4.620 -5.850 5.500 1.00 0.29 C ATOM 42 N9 DG A 2 4.218 -4.837 4.508 1.00 0.23 N ATOM 43 C8 DG A 2 4.819 -3.646 4.195 1.00 0.25 C ATOM 44 N7 DG A 2 4.152 -2.934 3.334 1.00 0.24 N ATOM 45 C5 DG A 2 3.032 -3.709 3.054 1.00 0.19 C ATOM 46 C6 DG A 2 1.940 -3.447 2.189 1.00 0.21 C ATOM 47 O6 DG A 2 1.748 -2.462 1.493 1.00 0.29 O ATOM 48 N1 DG A 2 1.014 -4.479 2.187 1.00 0.21 N ATOM 49 C2 DG A 2 1.140 -5.665 2.952 1.00 0.21 C ATOM 50 N2 DG A 2 0.230 -6.671 2.851 1.00 0.28 N ATOM 51 N3 DG A 2 2.174 -5.879 3.761 1.00 0.21 N ATOM 52 C4 DG A 2 3.069 -4.874 3.764 1.00 0.18 C ATOM 0 H5' DG A 2 2.275 -3.364 7.801 1.00 0.29 H new ATOM 0 H5'' DG A 2 2.741 -3.474 6.115 1.00 0.29 H new ATOM 0 H4' DG A 2 3.103 -5.530 8.282 1.00 0.27 H new ATOM 0 H3' DG A 2 4.913 -3.501 7.290 1.00 0.25 H new ATOM 0 H2' DG A 2 6.449 -4.778 5.999 1.00 0.30 H new ATOM 0 H2'' DG A 2 6.191 -6.220 6.961 1.00 0.30 H new ATOM 0 H1' DG A 2 5.020 -6.695 4.940 1.00 0.29 H new ATOM 0 H8 DG A 2 5.758 -3.328 4.623 1.00 0.25 H new ATOM 0 H1 DG A 2 0.188 -4.378 1.596 1.00 0.21 H new ATOM 0 H21 DG A 2 0.340 -7.516 3.411 1.00 0.28 H new ATOM 0 H22 DG A 2 -0.562 -6.580 2.215 1.00 0.28 H new ATOM 64 P DG A 3 5.022 -3.737 9.967 1.00 0.32 P ATOM 65 OP1 DG A 3 5.575 -4.263 11.236 1.00 0.44 O ATOM 66 OP2 DG A 3 3.596 -3.351 9.886 1.00 0.44 O ATOM 67 O5' DG A 3 5.910 -2.479 9.504 1.00 0.27 O ATOM 68 C5' DG A 3 7.283 -2.651 9.135 1.00 0.24 C ATOM 69 C4' DG A 3 7.789 -1.479 8.315 1.00 0.21 C ATOM 70 O4' DG A 3 7.280 -1.588 7.004 1.00 0.22 O ATOM 71 C3' DG A 3 7.356 -0.100 8.835 1.00 0.24 C ATOM 72 O3' DG A 3 8.454 0.590 9.483 1.00 0.33 O ATOM 73 C2' DG A 3 6.897 0.662 7.592 1.00 0.20 C ATOM 74 C1' DG A 3 7.280 -0.288 6.461 1.00 0.18 C ATOM 75 N9 DG A 3 6.370 -0.299 5.313 1.00 0.17 N ATOM 76 C8 DG A 3 6.721 -0.300 4.015 1.00 0.18 C ATOM 77 N7 DG A 3 5.719 -0.311 3.187 1.00 0.18 N ATOM 78 C5 DG A 3 4.605 -0.323 4.017 1.00 0.15 C ATOM 79 C6 DG A 3 3.229 -0.341 3.681 1.00 0.15 C ATOM 80 O6 DG A 3 2.730 -0.330 2.562 1.00 0.17 O ATOM 81 N1 DG A 3 2.415 -0.357 4.804 1.00 0.14 N ATOM 82 C2 DG A 3 2.895 -0.352 6.139 1.00 0.15 C ATOM 83 N2 DG A 3 2.040 -0.377 7.200 1.00 0.15 N ATOM 84 N3 DG A 3 4.205 -0.330 6.424 1.00 0.15 N ATOM 85 C4 DG A 3 4.991 -0.317 5.328 1.00 0.15 C ATOM 0 H5' DG A 3 7.394 -3.572 8.563 1.00 0.24 H new ATOM 0 H5'' DG A 3 7.892 -2.758 10.033 1.00 0.24 H new ATOM 0 H4' DG A 3 8.876 -1.532 8.371 1.00 0.21 H new ATOM 0 H3' DG A 3 6.569 -0.182 9.585 1.00 0.24 H new ATOM 0 H2' DG A 3 5.825 0.860 7.610 1.00 0.20 H new ATOM 0 H2'' DG A 3 7.397 1.626 7.499 1.00 0.20 H new ATOM 0 H1' DG A 3 8.244 0.052 6.082 1.00 0.18 H new ATOM 0 H8 DG A 3 7.750 -0.292 3.688 1.00 0.18 H new ATOM 0 H1 DG A 3 1.405 -0.373 4.661 1.00 0.14 H new ATOM 0 H21 DG A 3 2.408 -0.373 8.151 1.00 0.15 H new ATOM 0 H22 DG A 3 1.032 -0.400 7.043 1.00 0.15 H new ATOM 97 P DG A 4 9.992 0.497 8.972 1.00 0.37 P ATOM 98 OP1 DG A 4 10.338 -0.930 8.779 1.00 0.44 O ATOM 99 OP2 DG A 4 10.822 1.338 9.861 1.00 0.50 O ATOM 100 O5' DG A 4 9.926 1.195 7.524 1.00 0.29 O ATOM 101 C5' DG A 4 9.723 2.603 7.404 1.00 0.24 C ATOM 102 C4' DG A 4 9.527 3.011 5.950 1.00 0.22 C ATOM 103 O4' DG A 4 8.383 2.372 5.409 1.00 0.21 O ATOM 104 C3' DG A 4 9.319 4.502 5.751 1.00 0.25 C ATOM 105 O3' DG A 4 10.603 5.091 5.479 1.00 0.38 O ATOM 106 C2' DG A 4 8.392 4.596 4.540 1.00 0.23 C ATOM 107 C1' DG A 4 7.918 3.159 4.314 1.00 0.19 C ATOM 108 N9 DG A 4 6.460 3.020 4.265 1.00 0.17 N ATOM 109 C8 DG A 4 5.574 3.088 5.288 1.00 0.19 C ATOM 110 N7 DG A 4 4.326 2.968 4.927 1.00 0.20 N ATOM 111 C5 DG A 4 4.407 2.807 3.546 1.00 0.17 C ATOM 112 C6 DG A 4 3.377 2.633 2.586 1.00 0.17 C ATOM 113 O6 DG A 4 2.164 2.599 2.777 1.00 0.22 O ATOM 114 N1 DG A 4 3.883 2.505 1.297 1.00 0.14 N ATOM 115 C2 DG A 4 5.274 2.544 0.982 1.00 0.12 C ATOM 116 N2 DG A 4 5.723 2.396 -0.281 1.00 0.13 N ATOM 117 N3 DG A 4 6.210 2.713 1.904 1.00 0.13 N ATOM 118 C4 DG A 4 5.714 2.835 3.142 1.00 0.14 C ATOM 0 H5' DG A 4 10.580 3.133 7.821 1.00 0.24 H new ATOM 0 H5'' DG A 4 8.851 2.898 7.988 1.00 0.24 H new ATOM 0 H4' DG A 4 10.449 2.713 5.450 1.00 0.22 H new ATOM 0 H3' DG A 4 8.892 5.018 6.611 1.00 0.25 H new ATOM 0 H2' DG A 4 7.554 5.266 4.732 1.00 0.23 H new ATOM 0 H2'' DG A 4 8.917 4.984 3.667 1.00 0.23 H new ATOM 0 H1' DG A 4 8.311 2.839 3.349 1.00 0.19 H new ATOM 0 H8 DG A 4 5.875 3.230 6.315 1.00 0.19 H new ATOM 0 H1 DG A 4 3.221 2.376 0.532 1.00 0.14 H new ATOM 0 H21 DG A 4 6.724 2.429 -0.473 1.00 0.13 H new ATOM 0 H22 DG A 4 5.061 2.251 -1.044 1.00 0.13 H new ATOM 130 P DT A 5 10.775 6.568 4.862 1.00 0.47 P ATOM 131 OP1 DT A 5 11.899 7.224 5.560 1.00 0.47 O ATOM 132 OP2 DT A 5 9.446 7.220 4.816 1.00 0.69 O ATOM 133 O5' DT A 5 11.239 6.256 3.352 1.00 0.60 O ATOM 134 C5' DT A 5 11.326 4.905 2.874 1.00 0.47 C ATOM 135 C4' DT A 5 10.620 4.739 1.533 1.00 0.30 C ATOM 136 O4' DT A 5 9.247 5.087 1.658 1.00 0.23 O ATOM 137 C3' DT A 5 11.206 5.605 0.435 1.00 0.30 C ATOM 138 O3' DT A 5 11.562 4.779 -0.667 1.00 0.31 O ATOM 139 C2' DT A 5 10.093 6.576 0.045 1.00 0.27 C ATOM 140 C1' DT A 5 8.854 5.874 0.537 1.00 0.20 C ATOM 141 N1 DT A 5 7.758 6.715 1.003 1.00 0.22 N ATOM 142 C2 DT A 5 7.705 8.085 0.753 1.00 0.30 C ATOM 143 O2 DT A 5 8.555 8.689 0.108 1.00 0.34 O ATOM 144 N3 DT A 5 6.591 8.733 1.259 1.00 0.35 N ATOM 145 C4 DT A 5 5.562 8.136 1.965 1.00 0.33 C ATOM 146 O4 DT A 5 4.611 8.799 2.376 1.00 0.40 O ATOM 147 C5 DT A 5 5.740 6.712 2.149 1.00 0.24 C ATOM 148 C7 DT A 5 4.710 5.889 2.878 1.00 0.23 C ATOM 149 C6 DT A 5 6.805 6.086 1.672 1.00 0.19 C ATOM 0 H5' DT A 5 10.882 4.230 3.606 1.00 0.47 H new ATOM 0 H5'' DT A 5 12.373 4.621 2.772 1.00 0.47 H new ATOM 0 H4' DT A 5 10.751 3.693 1.258 1.00 0.30 H new ATOM 0 H3' DT A 5 12.102 6.140 0.752 1.00 0.30 H new ATOM 0 H2' DT A 5 10.221 7.550 0.517 1.00 0.27 H new ATOM 0 H2'' DT A 5 10.062 6.745 -1.031 1.00 0.27 H new ATOM 0 H1' DT A 5 8.470 5.331 -0.327 1.00 0.20 H new ATOM 0 H3 DT A 5 6.523 9.738 1.097 1.00 0.35 H new ATOM 0 H71 DT A 5 4.711 4.873 2.484 1.00 0.23 H new ATOM 0 H72 DT A 5 4.949 5.866 3.941 1.00 0.23 H new ATOM 0 H73 DT A 5 3.724 6.332 2.737 1.00 0.23 H new ATOM 0 H6 DT A 5 6.899 5.023 1.835 1.00 0.19 H new ATOM 162 P DT A 6 12.378 5.391 -1.901 1.00 0.31 P ATOM 163 OP1 DT A 6 13.201 4.313 -2.490 1.00 0.38 O ATOM 164 OP2 DT A 6 13.014 6.651 -1.463 1.00 0.35 O ATOM 165 O5' DT A 6 11.204 5.749 -2.940 1.00 0.29 O ATOM 166 C5' DT A 6 10.516 4.703 -3.628 1.00 0.23 C ATOM 167 C4' DT A 6 9.411 5.245 -4.530 1.00 0.21 C ATOM 168 O4' DT A 6 8.726 4.170 -5.157 1.00 0.23 O ATOM 169 C3' DT A 6 8.361 6.089 -3.812 1.00 0.18 C ATOM 170 O3' DT A 6 8.033 7.210 -4.644 1.00 0.20 O ATOM 171 C2' DT A 6 7.141 5.171 -3.675 1.00 0.16 C ATOM 172 C1' DT A 6 7.553 3.877 -4.407 1.00 0.19 C ATOM 173 N1 DT A 6 7.875 2.724 -3.531 1.00 0.18 N ATOM 174 C2 DT A 6 8.006 1.488 -4.136 1.00 0.23 C ATOM 175 O2 DT A 6 7.852 1.330 -5.343 1.00 0.27 O ATOM 176 N3 DT A 6 8.338 0.436 -3.307 1.00 0.26 N ATOM 177 C4 DT A 6 8.554 0.511 -1.946 1.00 0.25 C ATOM 178 O4 DT A 6 8.843 -0.492 -1.300 1.00 0.31 O ATOM 179 C5 DT A 6 8.400 1.841 -1.403 1.00 0.20 C ATOM 180 C7 DT A 6 8.680 2.093 0.071 1.00 0.24 C ATOM 181 C6 DT A 6 8.066 2.877 -2.187 1.00 0.17 C ATOM 0 H5' DT A 6 10.086 4.013 -2.902 1.00 0.23 H new ATOM 0 H5'' DT A 6 11.227 4.134 -4.227 1.00 0.23 H new ATOM 0 H4' DT A 6 9.924 5.889 -5.244 1.00 0.21 H new ATOM 0 H3' DT A 6 8.700 6.461 -2.845 1.00 0.18 H new ATOM 0 H2' DT A 6 6.904 4.978 -2.629 1.00 0.16 H new ATOM 0 H2'' DT A 6 6.255 5.618 -4.125 1.00 0.16 H new ATOM 0 H1' DT A 6 6.692 3.580 -5.005 1.00 0.19 H new ATOM 0 H3 DT A 6 8.433 -0.482 -3.740 1.00 0.26 H new ATOM 0 H71 DT A 6 8.459 1.192 0.643 1.00 0.24 H new ATOM 0 H72 DT A 6 9.729 2.358 0.202 1.00 0.24 H new ATOM 0 H73 DT A 6 8.053 2.911 0.426 1.00 0.24 H new ATOM 0 H6 DT A 6 7.945 3.855 -1.745 1.00 0.17 H new ATOM 194 P DT A 7 7.040 8.379 -4.139 1.00 0.23 P ATOM 195 OP1 DT A 7 6.998 9.428 -5.184 1.00 0.30 O ATOM 196 OP2 DT A 7 7.401 8.738 -2.752 1.00 0.28 O ATOM 197 O5' DT A 7 5.605 7.641 -4.112 1.00 0.19 O ATOM 198 C5' DT A 7 5.023 7.139 -5.320 1.00 0.19 C ATOM 199 C4' DT A 7 3.619 7.667 -5.533 1.00 0.18 C ATOM 200 O4' DT A 7 2.692 6.960 -4.715 1.00 0.19 O ATOM 201 C3' DT A 7 3.473 9.160 -5.243 1.00 0.20 C ATOM 202 O3' DT A 7 2.907 9.866 -6.377 1.00 0.24 O ATOM 203 C2' DT A 7 2.537 9.265 -4.037 1.00 0.25 C ATOM 204 C1' DT A 7 2.024 7.848 -3.814 1.00 0.22 C ATOM 205 N1 DT A 7 2.254 7.313 -2.467 1.00 0.21 N ATOM 206 C2 DT A 7 1.220 7.369 -1.549 1.00 0.24 C ATOM 207 O2 DT A 7 0.175 7.974 -1.765 1.00 0.30 O ATOM 208 N3 DT A 7 1.433 6.699 -0.363 1.00 0.26 N ATOM 209 C4 DT A 7 2.573 5.994 -0.025 1.00 0.24 C ATOM 210 O4 DT A 7 2.647 5.401 1.048 1.00 0.28 O ATOM 211 C5 DT A 7 3.590 6.014 -1.051 1.00 0.20 C ATOM 212 C7 DT A 7 4.882 5.253 -0.887 1.00 0.20 C ATOM 213 C6 DT A 7 3.407 6.655 -2.191 1.00 0.20 C ATOM 0 H5' DT A 7 5.000 6.050 -5.286 1.00 0.19 H new ATOM 0 H5'' DT A 7 5.648 7.419 -6.168 1.00 0.19 H new ATOM 0 H4' DT A 7 3.408 7.512 -6.591 1.00 0.18 H new ATOM 0 H3' DT A 7 4.445 9.612 -5.046 1.00 0.20 H new ATOM 0 H2' DT A 7 3.065 9.637 -3.159 1.00 0.25 H new ATOM 0 H2'' DT A 7 1.717 9.956 -4.232 1.00 0.25 H new ATOM 0 H1' DT A 7 0.947 7.910 -3.973 1.00 0.22 H new ATOM 0 H3 DT A 7 0.682 6.726 0.327 1.00 0.26 H new ATOM 0 H71 DT A 7 5.138 5.194 0.171 1.00 0.20 H new ATOM 0 H72 DT A 7 4.765 4.246 -1.289 1.00 0.20 H new ATOM 0 H73 DT A 7 5.678 5.768 -1.425 1.00 0.20 H new ATOM 0 H6 DT A 7 4.199 6.655 -2.925 1.00 0.20 H new ATOM 226 P DG A 8 1.901 9.187 -7.464 1.00 0.24 P ATOM 227 OP1 DG A 8 2.371 7.816 -7.765 1.00 0.26 O ATOM 228 OP2 DG A 8 1.729 10.149 -8.574 1.00 0.31 O ATOM 229 O5' DG A 8 0.495 9.092 -6.679 1.00 0.25 O ATOM 230 C5' DG A 8 -0.647 8.449 -7.278 1.00 0.29 C ATOM 231 C4' DG A 8 -0.414 6.970 -7.466 1.00 0.19 C ATOM 232 O4' DG A 8 0.165 6.466 -6.280 1.00 0.21 O ATOM 233 C3' DG A 8 -1.694 6.149 -7.738 1.00 0.20 C ATOM 234 O3' DG A 8 -1.489 5.146 -8.768 1.00 0.25 O ATOM 235 C2' DG A 8 -1.930 5.450 -6.407 1.00 0.21 C ATOM 236 C1' DG A 8 -0.500 5.271 -5.952 1.00 0.18 C ATOM 237 N9 DG A 8 -0.266 5.063 -4.532 1.00 0.15 N ATOM 238 C8 DG A 8 0.950 4.955 -3.958 1.00 0.15 C ATOM 239 N7 DG A 8 0.924 4.866 -2.668 1.00 0.15 N ATOM 240 C5 DG A 8 -0.429 4.909 -2.361 1.00 0.14 C ATOM 241 C6 DG A 8 -1.045 4.840 -1.102 1.00 0.14 C ATOM 242 O6 DG A 8 -0.492 4.759 -0.028 1.00 0.16 O ATOM 243 N1 DG A 8 -2.433 4.896 -1.172 1.00 0.14 N ATOM 244 C2 DG A 8 -3.154 5.026 -2.386 1.00 0.14 C ATOM 245 N2 DG A 8 -4.517 5.110 -2.387 1.00 0.17 N ATOM 246 N3 DG A 8 -2.535 5.092 -3.585 1.00 0.15 N ATOM 247 C4 DG A 8 -1.181 5.027 -3.493 1.00 0.14 C ATOM 0 H5' DG A 8 -0.861 8.910 -8.242 1.00 0.29 H new ATOM 0 H5'' DG A 8 -1.524 8.603 -6.649 1.00 0.29 H new ATOM 0 H4' DG A 8 0.224 6.868 -8.344 1.00 0.19 H new ATOM 0 H3' DG A 8 -2.517 6.774 -8.083 1.00 0.20 H new ATOM 0 H2' DG A 8 -2.515 6.056 -5.715 1.00 0.21 H new ATOM 0 H2'' DG A 8 -2.454 4.501 -6.521 1.00 0.21 H new ATOM 0 H1' DG A 8 -0.155 4.360 -6.440 1.00 0.18 H new ATOM 0 H8 DG A 8 1.868 4.944 -4.527 1.00 0.15 H new ATOM 0 H1 DG A 8 -2.962 4.840 -0.301 1.00 0.14 H new ATOM 0 H21 DG A 8 -5.022 5.203 -3.269 1.00 0.17 H new ATOM 0 H22 DG A 8 -5.030 5.079 -1.506 1.00 0.17 H new ATOM 259 P DG A 9 -0.047 4.826 -9.445 1.00 0.27 P ATOM 260 OP1 DG A 9 0.502 6.093 -9.979 1.00 0.35 O ATOM 261 OP2 DG A 9 -0.214 3.664 -10.348 1.00 0.41 O ATOM 262 O5' DG A 9 0.863 4.358 -8.192 1.00 0.24 O ATOM 263 C5' DG A 9 2.209 4.835 -8.045 1.00 0.23 C ATOM 264 C4' DG A 9 3.138 3.789 -7.430 1.00 0.17 C ATOM 265 O4' DG A 9 3.129 3.870 -6.021 1.00 0.17 O ATOM 266 C3' DG A 9 2.766 2.344 -7.736 1.00 0.19 C ATOM 267 O3' DG A 9 3.441 1.899 -8.927 1.00 0.24 O ATOM 268 C2' DG A 9 3.244 1.564 -6.518 1.00 0.18 C ATOM 269 C1' DG A 9 3.712 2.654 -5.574 1.00 0.15 C ATOM 270 N9 DG A 9 3.337 2.449 -4.175 1.00 0.13 N ATOM 271 C8 DG A 9 4.164 2.434 -3.104 1.00 0.14 C ATOM 272 N7 DG A 9 3.551 2.365 -1.973 1.00 0.15 N ATOM 273 C5 DG A 9 2.221 2.315 -2.304 1.00 0.13 C ATOM 274 C6 DG A 9 1.118 2.229 -1.449 1.00 0.14 C ATOM 275 O6 DG A 9 1.137 2.236 -0.221 1.00 0.16 O ATOM 276 N1 DG A 9 -0.086 2.186 -2.147 1.00 0.14 N ATOM 277 C2 DG A 9 -0.186 2.232 -3.576 1.00 0.14 C ATOM 278 N2 DG A 9 -1.394 2.214 -4.224 1.00 0.18 N ATOM 279 N3 DG A 9 0.902 2.319 -4.358 1.00 0.14 N ATOM 280 C4 DG A 9 2.060 2.354 -3.657 1.00 0.12 C ATOM 0 H5' DG A 9 2.208 5.728 -7.420 1.00 0.23 H new ATOM 0 H5'' DG A 9 2.595 5.130 -9.021 1.00 0.23 H new ATOM 0 H4' DG A 9 4.105 4.022 -7.875 1.00 0.17 H new ATOM 0 H3' DG A 9 1.699 2.212 -7.916 1.00 0.19 H new ATOM 0 H2' DG A 9 2.443 0.969 -6.081 1.00 0.18 H new ATOM 0 H2'' DG A 9 4.051 0.876 -6.771 1.00 0.18 H new ATOM 0 H1' DG A 9 4.802 2.658 -5.595 1.00 0.15 H new ATOM 0 H8 DG A 9 5.240 2.476 -3.190 1.00 0.14 H new ATOM 0 H1 DG A 9 -0.950 2.118 -1.608 1.00 0.14 H new ATOM 0 H21 DG A 9 -1.427 2.248 -5.243 1.00 0.18 H new ATOM 0 H22 DG A 9 -2.260 2.166 -3.687 1.00 0.18 H new ATOM 292 P DG A 10 5.055 1.815 -9.014 1.00 0.24 P ATOM 293 OP1 DG A 10 5.634 2.806 -8.080 1.00 0.24 O ATOM 294 OP2 DG A 10 5.443 1.841 -10.443 1.00 0.35 O ATOM 295 O5' DG A 10 5.361 0.349 -8.442 1.00 0.22 O ATOM 296 C5' DG A 10 6.643 0.037 -7.900 1.00 0.23 C ATOM 297 C4' DG A 10 6.519 -0.889 -6.701 1.00 0.16 C ATOM 298 O4' DG A 10 5.784 -0.254 -5.662 1.00 0.16 O ATOM 299 C3' DG A 10 5.770 -2.188 -6.989 1.00 0.17 C ATOM 300 O3' DG A 10 6.701 -3.233 -7.318 1.00 0.23 O ATOM 301 C2' DG A 10 5.047 -2.494 -5.670 1.00 0.15 C ATOM 302 C1' DG A 10 5.385 -1.293 -4.790 1.00 0.13 C ATOM 303 N9 DG A 10 4.253 -0.851 -3.963 1.00 0.13 N ATOM 304 C8 DG A 10 2.931 -0.740 -4.311 1.00 0.15 C ATOM 305 N7 DG A 10 2.130 -0.562 -3.299 1.00 0.14 N ATOM 306 C5 DG A 10 2.982 -0.546 -2.203 1.00 0.14 C ATOM 307 C6 DG A 10 2.689 -0.397 -0.824 1.00 0.15 C ATOM 308 O6 DG A 10 1.596 -0.284 -0.289 1.00 0.17 O ATOM 309 N1 DG A 10 3.839 -0.440 -0.059 1.00 0.16 N ATOM 310 C2 DG A 10 5.091 -0.600 -0.541 1.00 0.15 C ATOM 311 N2 DG A 10 6.037 -0.601 0.367 1.00 0.17 N ATOM 312 N3 DG A 10 5.386 -0.744 -1.831 1.00 0.15 N ATOM 313 C4 DG A 10 4.281 -0.709 -2.603 1.00 0.13 C ATOM 0 H5' DG A 10 7.149 0.956 -7.603 1.00 0.23 H new ATOM 0 H5'' DG A 10 7.260 -0.434 -8.665 1.00 0.23 H new ATOM 0 H4' DG A 10 7.549 -1.117 -6.426 1.00 0.16 H new ATOM 0 H3' DG A 10 5.083 -2.110 -7.832 1.00 0.17 H new ATOM 0 H2' DG A 10 3.971 -2.594 -5.816 1.00 0.15 H new ATOM 0 H2'' DG A 10 5.397 -3.427 -5.228 1.00 0.15 H new ATOM 0 H1' DG A 10 6.173 -1.570 -4.090 1.00 0.13 H new ATOM 0 H8 DG A 10 2.585 -0.795 -5.333 1.00 0.15 H new ATOM 0 H1 DG A 10 3.734 -0.343 0.951 1.00 0.16 H new ATOM 0 H21 DG A 10 7.011 -0.716 0.088 1.00 0.17 H new ATOM 0 H22 DG A 10 5.798 -0.486 1.352 1.00 0.17 H new ATOM 325 P DT A 11 7.626 -3.951 -6.206 1.00 0.28 P ATOM 326 OP1 DT A 11 7.872 -2.994 -5.101 1.00 0.28 O ATOM 327 OP2 DT A 11 8.770 -4.572 -6.907 1.00 0.35 O ATOM 328 O5' DT A 11 6.660 -5.122 -5.649 1.00 0.34 O ATOM 329 C5' DT A 11 6.815 -6.481 -6.081 1.00 0.26 C ATOM 330 C4' DT A 11 5.905 -7.437 -5.318 1.00 0.21 C ATOM 331 O4' DT A 11 6.213 -7.352 -3.922 1.00 0.20 O ATOM 332 C3' DT A 11 4.414 -7.152 -5.501 1.00 0.22 C ATOM 333 O3' DT A 11 3.701 -8.352 -5.871 1.00 0.29 O ATOM 334 C2' DT A 11 3.936 -6.649 -4.149 1.00 0.21 C ATOM 335 C1' DT A 11 5.027 -7.118 -3.167 1.00 0.19 C ATOM 336 N1 DT A 11 5.375 -6.149 -2.093 1.00 0.23 N ATOM 337 C2 DT A 11 4.948 -6.457 -0.811 1.00 0.37 C ATOM 338 O2 DT A 11 4.301 -7.472 -0.562 1.00 0.44 O ATOM 339 N3 DT A 11 5.290 -5.558 0.180 1.00 0.45 N ATOM 340 C4 DT A 11 6.008 -4.391 0.013 1.00 0.40 C ATOM 341 O4 DT A 11 6.250 -3.666 0.972 1.00 0.50 O ATOM 342 C5 DT A 11 6.416 -4.139 -1.354 1.00 0.25 C ATOM 343 C7 DT A 11 7.171 -2.852 -1.689 1.00 0.25 C ATOM 344 C6 DT A 11 6.104 -5.002 -2.346 1.00 0.19 C ATOM 0 H5' DT A 11 7.853 -6.786 -5.948 1.00 0.26 H new ATOM 0 H5'' DT A 11 6.597 -6.548 -7.147 1.00 0.26 H new ATOM 0 H4' DT A 11 6.091 -8.432 -5.722 1.00 0.21 H new ATOM 0 H3' DT A 11 4.238 -6.427 -6.296 1.00 0.22 H new ATOM 0 H2' DT A 11 3.832 -5.564 -4.141 1.00 0.21 H new ATOM 0 H2'' DT A 11 2.962 -7.064 -3.891 1.00 0.21 H new ATOM 0 H1' DT A 11 4.627 -8.002 -2.670 1.00 0.19 H new ATOM 0 H3 DT A 11 4.982 -5.778 1.127 1.00 0.45 H new ATOM 0 H71 DT A 11 7.836 -3.030 -2.534 1.00 0.25 H new ATOM 0 H72 DT A 11 6.458 -2.069 -1.947 1.00 0.25 H new ATOM 0 H73 DT A 11 7.757 -2.539 -0.825 1.00 0.25 H new ATOM 0 H6 DT A 11 6.430 -4.792 -3.354 1.00 0.19 H new ATOM 357 P DT A 12 3.966 -9.786 -5.172 1.00 0.32 P ATOM 358 OP1 DT A 12 3.827 -9.634 -3.704 1.00 0.36 O ATOM 359 OP2 DT A 12 5.206 -10.362 -5.741 1.00 0.44 O ATOM 360 O5' DT A 12 2.720 -10.663 -5.700 1.00 0.34 O ATOM 361 C5' DT A 12 1.457 -10.616 -5.024 1.00 0.31 C ATOM 362 C4' DT A 12 0.364 -9.992 -5.894 1.00 0.31 C ATOM 363 O4' DT A 12 -0.802 -9.780 -5.111 1.00 0.28 O ATOM 364 C3' DT A 12 0.722 -8.632 -6.470 1.00 0.29 C ATOM 365 O3' DT A 12 0.015 -8.428 -7.704 1.00 0.33 O ATOM 366 C2' DT A 12 0.233 -7.646 -5.416 1.00 0.28 C ATOM 367 C1' DT A 12 -0.726 -8.468 -4.547 1.00 0.24 C ATOM 368 N1 DT A 12 -0.302 -8.556 -3.125 1.00 0.23 N ATOM 369 C2 DT A 12 -0.362 -9.781 -2.456 1.00 0.29 C ATOM 370 O2 DT A 12 -0.776 -10.814 -2.975 1.00 0.34 O ATOM 371 N3 DT A 12 0.045 -9.767 -1.139 1.00 0.33 N ATOM 372 C4 DT A 12 0.492 -8.668 -0.432 1.00 0.30 C ATOM 373 O4 DT A 12 0.822 -8.774 0.746 1.00 0.38 O ATOM 374 C5 DT A 12 0.510 -7.445 -1.203 1.00 0.21 C ATOM 375 C7 DT A 12 0.904 -6.138 -0.533 1.00 0.20 C ATOM 376 C6 DT A 12 0.129 -7.427 -2.489 1.00 0.20 C ATOM 0 H5' DT A 12 1.560 -10.041 -4.103 1.00 0.31 H new ATOM 0 H5'' DT A 12 1.161 -11.625 -4.738 1.00 0.31 H new ATOM 0 H4' DT A 12 0.221 -10.696 -6.714 1.00 0.31 H new ATOM 0 H3' DT A 12 1.785 -8.525 -6.685 1.00 0.29 H new ATOM 0 H2' DT A 12 1.061 -7.248 -4.829 1.00 0.28 H new ATOM 0 H2'' DT A 12 -0.273 -6.795 -5.871 1.00 0.28 H new ATOM 0 H1' DT A 12 -1.696 -7.970 -4.542 1.00 0.24 H new ATOM 0 H3 DT A 12 0.013 -10.655 -0.638 1.00 0.33 H new ATOM 0 H71 DT A 12 1.371 -5.480 -1.266 1.00 0.20 H new ATOM 0 H72 DT A 12 0.015 -5.655 -0.126 1.00 0.20 H new ATOM 0 H73 DT A 12 1.608 -6.341 0.274 1.00 0.20 H new ATOM 0 H6 DT A 12 0.164 -6.496 -3.035 1.00 0.20 H new ATOM 389 P DG A 13 0.341 -7.158 -8.648 1.00 0.31 P ATOM 390 OP1 DG A 13 -0.116 -7.470 -10.022 1.00 0.35 O ATOM 391 OP2 DG A 13 1.745 -6.754 -8.415 1.00 0.32 O ATOM 392 O5' DG A 13 -0.617 -6.006 -8.049 1.00 0.29 O ATOM 393 C5' DG A 13 -2.008 -6.248 -7.812 1.00 0.26 C ATOM 394 C4' DG A 13 -2.583 -5.257 -6.800 1.00 0.24 C ATOM 395 O4' DG A 13 -1.821 -5.335 -5.597 1.00 0.24 O ATOM 396 C3' DG A 13 -2.583 -3.803 -7.290 1.00 0.25 C ATOM 397 O3' DG A 13 -3.929 -3.306 -7.379 1.00 0.38 O ATOM 398 C2' DG A 13 -1.865 -2.995 -6.193 1.00 0.26 C ATOM 399 C1' DG A 13 -1.385 -4.043 -5.182 1.00 0.21 C ATOM 400 N9 DG A 13 0.081 -4.082 -5.051 1.00 0.18 N ATOM 401 C8 DG A 13 1.031 -4.354 -5.999 1.00 0.20 C ATOM 402 N7 DG A 13 2.253 -4.229 -5.565 1.00 0.19 N ATOM 403 C5 DG A 13 2.093 -3.851 -4.232 1.00 0.15 C ATOM 404 C6 DG A 13 3.065 -3.565 -3.236 1.00 0.15 C ATOM 405 O6 DG A 13 4.280 -3.549 -3.344 1.00 0.18 O ATOM 406 N1 DG A 13 2.487 -3.226 -2.023 1.00 0.15 N ATOM 407 C2 DG A 13 1.096 -3.163 -1.798 1.00 0.15 C ATOM 408 N2 DG A 13 0.586 -2.796 -0.597 1.00 0.20 N ATOM 409 N3 DG A 13 0.215 -3.435 -2.748 1.00 0.16 N ATOM 410 C4 DG A 13 0.771 -3.766 -3.920 1.00 0.15 C ATOM 0 H5' DG A 13 -2.144 -7.265 -7.445 1.00 0.26 H new ATOM 0 H5'' DG A 13 -2.557 -6.172 -8.750 1.00 0.26 H new ATOM 0 H4' DG A 13 -3.625 -5.537 -6.642 1.00 0.24 H new ATOM 0 H3' DG A 13 -2.109 -3.725 -8.268 1.00 0.25 H new ATOM 0 H2' DG A 13 -1.028 -2.429 -6.603 1.00 0.26 H new ATOM 0 H2'' DG A 13 -2.539 -2.276 -5.727 1.00 0.26 H new ATOM 0 H1' DG A 13 -1.807 -3.764 -4.217 1.00 0.21 H new ATOM 0 H8 DG A 13 0.790 -4.645 -7.011 1.00 0.20 H new ATOM 0 H1 DG A 13 3.107 -3.008 -1.243 1.00 0.15 H new ATOM 0 H21 DG A 13 -0.424 -2.759 -0.462 1.00 0.20 H new ATOM 0 H22 DG A 13 1.213 -2.557 0.172 1.00 0.20 H new ATOM 422 P DG A 14 -5.126 -4.119 -8.099 1.00 0.34 P ATOM 423 OP1 DG A 14 -4.647 -5.468 -8.478 1.00 0.51 O ATOM 424 OP2 DG A 14 -5.721 -3.235 -9.126 1.00 0.62 O ATOM 425 O5' DG A 14 -6.194 -4.272 -6.896 1.00 0.29 O ATOM 426 C5' DG A 14 -5.780 -4.144 -5.523 1.00 0.23 C ATOM 427 C4' DG A 14 -6.270 -2.852 -4.887 1.00 0.17 C ATOM 428 O4' DG A 14 -5.470 -2.562 -3.767 1.00 0.17 O ATOM 429 C3' DG A 14 -6.196 -1.602 -5.794 1.00 0.17 C ATOM 430 O3' DG A 14 -7.527 -1.124 -6.133 1.00 0.19 O ATOM 431 C2' DG A 14 -5.465 -0.564 -4.922 1.00 0.17 C ATOM 432 C1' DG A 14 -5.639 -1.187 -3.558 1.00 0.14 C ATOM 433 N9 DG A 14 -4.713 -0.796 -2.500 1.00 0.14 N ATOM 434 C8 DG A 14 -5.021 -0.612 -1.194 1.00 0.15 C ATOM 435 N7 DG A 14 -3.994 -0.447 -0.430 1.00 0.16 N ATOM 436 C5 DG A 14 -2.919 -0.516 -1.288 1.00 0.14 C ATOM 437 C6 DG A 14 -1.546 -0.405 -0.997 1.00 0.14 C ATOM 438 O6 DG A 14 -1.018 -0.297 0.104 1.00 0.17 O ATOM 439 N1 DG A 14 -0.766 -0.515 -2.129 1.00 0.13 N ATOM 440 C2 DG A 14 -1.271 -0.724 -3.440 1.00 0.12 C ATOM 441 N2 DG A 14 -0.437 -0.786 -4.521 1.00 0.15 N ATOM 442 N3 DG A 14 -2.583 -0.838 -3.683 1.00 0.13 N ATOM 443 C4 DG A 14 -3.339 -0.723 -2.570 1.00 0.13 C ATOM 0 H5' DG A 14 -4.692 -4.182 -5.469 1.00 0.23 H new ATOM 0 H5'' DG A 14 -6.157 -4.993 -4.952 1.00 0.23 H new ATOM 0 H4' DG A 14 -7.319 -3.037 -4.654 1.00 0.17 H new ATOM 0 H3' DG A 14 -5.693 -1.802 -6.740 1.00 0.17 H new ATOM 0 H2' DG A 14 -4.416 -0.454 -5.198 1.00 0.17 H new ATOM 0 H2'' DG A 14 -5.917 0.426 -4.987 1.00 0.17 H new ATOM 0 H1' DG A 14 -6.610 -0.852 -3.193 1.00 0.14 H new ATOM 0 H8 DG A 14 -6.036 -0.604 -0.825 1.00 0.15 H new ATOM 0 H1 DG A 14 0.245 -0.441 -2.017 1.00 0.13 H new ATOM 0 H21 DG A 14 -0.821 -0.937 -5.454 1.00 0.15 H new ATOM 0 H22 DG A 14 0.570 -0.681 -4.395 1.00 0.15 H new ATOM 455 P DG A 15 -8.828 -1.340 -5.182 1.00 0.21 P ATOM 456 OP1 DG A 15 -8.878 -2.761 -4.778 1.00 0.26 O ATOM 457 OP2 DG A 15 -9.994 -0.733 -5.860 1.00 0.29 O ATOM 458 O5' DG A 15 -8.474 -0.449 -3.878 1.00 0.20 O ATOM 459 C5' DG A 15 -8.473 0.976 -3.966 1.00 0.16 C ATOM 460 C4' DG A 15 -8.600 1.651 -2.609 1.00 0.15 C ATOM 461 O4' DG A 15 -7.469 1.342 -1.793 1.00 0.15 O ATOM 462 C3' DG A 15 -8.712 3.169 -2.716 1.00 0.22 C ATOM 463 O3' DG A 15 -9.866 3.611 -1.984 1.00 0.31 O ATOM 464 C2' DG A 15 -7.431 3.706 -2.089 1.00 0.20 C ATOM 465 C1' DG A 15 -6.938 2.543 -1.245 1.00 0.15 C ATOM 466 N9 DG A 15 -5.505 2.386 -1.218 1.00 0.14 N ATOM 467 C8 DG A 15 -4.620 2.289 -2.241 1.00 0.15 C ATOM 468 N7 DG A 15 -3.376 2.228 -1.844 1.00 0.15 N ATOM 469 C5 DG A 15 -3.482 2.279 -0.448 1.00 0.14 C ATOM 470 C6 DG A 15 -2.485 2.246 0.555 1.00 0.14 C ATOM 471 O6 DG A 15 -1.277 2.210 0.414 1.00 0.16 O ATOM 472 N1 DG A 15 -3.025 2.304 1.833 1.00 0.14 N ATOM 473 C2 DG A 15 -4.412 2.390 2.107 1.00 0.14 C ATOM 474 N2 DG A 15 -4.896 2.418 3.369 1.00 0.18 N ATOM 475 N3 DG A 15 -5.313 2.429 1.151 1.00 0.14 N ATOM 476 C4 DG A 15 -4.784 2.368 -0.080 1.00 0.13 C ATOM 0 H5' DG A 15 -9.296 1.296 -4.604 1.00 0.16 H new ATOM 0 H5'' DG A 15 -7.551 1.305 -4.445 1.00 0.16 H new ATOM 0 H4' DG A 15 -9.517 1.268 -2.162 1.00 0.15 H new ATOM 0 H3' DG A 15 -8.826 3.516 -3.743 1.00 0.22 H new ATOM 0 H2' DG A 15 -6.701 3.990 -2.847 1.00 0.20 H new ATOM 0 H2'' DG A 15 -7.621 4.591 -1.482 1.00 0.20 H new ATOM 0 H1' DG A 15 -7.265 2.750 -0.226 1.00 0.15 H new ATOM 0 H8 DG A 15 -4.914 2.265 -3.280 1.00 0.15 H new ATOM 0 H1 DG A 15 -2.382 2.283 2.625 1.00 0.14 H new ATOM 0 H21 DG A 15 -5.902 2.480 3.528 1.00 0.18 H new ATOM 0 H22 DG A 15 -4.256 2.377 4.162 1.00 0.18 H new ATOM 488 P DT A 16 -11.189 4.101 -2.773 1.00 0.44 P ATOM 489 OP1 DT A 16 -10.799 4.431 -4.162 1.00 0.63 O ATOM 490 OP2 DT A 16 -11.871 5.112 -1.942 1.00 0.63 O ATOM 491 O5' DT A 16 -12.116 2.784 -2.819 1.00 0.30 O ATOM 492 C5' DT A 16 -11.746 1.675 -3.638 1.00 0.28 C ATOM 493 C4' DT A 16 -12.906 0.697 -3.847 1.00 0.24 C ATOM 494 O4' DT A 16 -13.827 1.248 -4.798 1.00 0.28 O ATOM 495 C3' DT A 16 -12.484 -0.689 -4.366 1.00 0.26 C ATOM 496 O3' DT A 16 -12.909 -1.695 -3.441 1.00 0.27 O ATOM 497 C2' DT A 16 -13.228 -0.857 -5.696 1.00 0.31 C ATOM 498 C1' DT A 16 -13.677 0.562 -6.039 1.00 0.32 C ATOM 499 N1 DT A 16 -12.732 1.347 -6.882 1.00 0.41 N ATOM 500 C2 DT A 16 -13.268 2.178 -7.848 1.00 0.57 C ATOM 501 O2 DT A 16 -14.476 2.240 -8.069 1.00 0.63 O ATOM 502 N3 DT A 16 -12.360 2.936 -8.564 1.00 0.69 N ATOM 503 C4 DT A 16 -10.985 2.937 -8.403 1.00 0.67 C ATOM 504 O4 DT A 16 -10.273 3.657 -9.099 1.00 0.81 O ATOM 505 C5 DT A 16 -10.524 2.036 -7.373 1.00 0.50 C ATOM 506 C7 DT A 16 -9.041 1.945 -7.018 1.00 0.50 C ATOM 507 C6 DT A 16 -11.383 1.292 -6.675 1.00 0.39 C ATOM 0 H5' DT A 16 -10.909 1.150 -3.179 1.00 0.28 H new ATOM 0 H5'' DT A 16 -11.401 2.039 -4.606 1.00 0.28 H new ATOM 0 H4' DT A 16 -13.350 0.558 -2.861 1.00 0.24 H new ATOM 0 H3' DT A 16 -11.404 -0.779 -4.485 1.00 0.26 H new ATOM 0 H2' DT A 16 -12.579 -1.270 -6.469 1.00 0.31 H new ATOM 0 H2'' DT A 16 -14.077 -1.533 -5.598 1.00 0.31 H new ATOM 0 H1' DT A 16 -14.591 0.474 -6.627 1.00 0.32 H new ATOM 0 H3 DT A 16 -12.740 3.555 -9.280 1.00 0.69 H new ATOM 0 H71 DT A 16 -8.441 2.168 -7.900 1.00 0.50 H new ATOM 0 H72 DT A 16 -8.810 2.663 -6.231 1.00 0.50 H new ATOM 0 H73 DT A 16 -8.812 0.938 -6.669 1.00 0.50 H new ATOM 0 H6 DT A 16 -10.999 0.623 -5.920 1.00 0.39 H new ATOM 520 P DT A 17 -12.329 -3.194 -3.567 1.00 0.31 P ATOM 521 OP1 DT A 17 -11.943 -3.414 -4.979 1.00 0.42 O ATOM 522 OP2 DT A 17 -13.286 -4.114 -2.914 1.00 0.45 O ATOM 523 O5' DT A 17 -10.977 -3.167 -2.687 1.00 0.25 O ATOM 524 C5' DT A 17 -10.013 -4.228 -2.807 1.00 0.23 C ATOM 525 C4' DT A 17 -9.039 -4.251 -1.641 1.00 0.21 C ATOM 526 O4' DT A 17 -8.373 -2.992 -1.549 1.00 0.19 O ATOM 527 C3' DT A 17 -9.688 -4.503 -0.292 1.00 0.23 C ATOM 528 O3' DT A 17 -9.732 -5.925 -0.046 1.00 0.29 O ATOM 529 C2' DT A 17 -8.727 -3.822 0.671 1.00 0.25 C ATOM 530 C1' DT A 17 -8.072 -2.730 -0.177 1.00 0.19 C ATOM 531 N1 DT A 17 -8.556 -1.375 0.139 1.00 0.18 N ATOM 532 C2 DT A 17 -7.949 -0.708 1.186 1.00 0.19 C ATOM 533 O2 DT A 17 -6.961 -1.149 1.760 1.00 0.22 O ATOM 534 N3 DT A 17 -8.507 0.501 1.541 1.00 0.21 N ATOM 535 C4 DT A 17 -9.603 1.094 0.954 1.00 0.22 C ATOM 536 O4 DT A 17 -10.021 2.169 1.367 1.00 0.30 O ATOM 537 C5 DT A 17 -10.170 0.331 -0.135 1.00 0.19 C ATOM 538 C7 DT A 17 -11.430 0.836 -0.826 1.00 0.22 C ATOM 539 C6 DT A 17 -9.636 -0.847 -0.513 1.00 0.18 C ATOM 0 H5' DT A 17 -9.460 -4.110 -3.739 1.00 0.23 H new ATOM 0 H5'' DT A 17 -10.533 -5.184 -2.863 1.00 0.23 H new ATOM 0 H4' DT A 17 -8.359 -5.077 -1.851 1.00 0.21 H new ATOM 0 H3' DT A 17 -10.710 -4.134 -0.207 1.00 0.23 H new ATOM 0 H2' DT A 17 -9.252 -3.401 1.529 1.00 0.25 H new ATOM 0 H2'' DT A 17 -7.988 -4.522 1.061 1.00 0.25 H new ATOM 0 H1' DT A 17 -7.003 -2.755 0.035 1.00 0.19 H new ATOM 0 H3 DT A 17 -8.067 1.004 2.311 1.00 0.21 H new ATOM 0 H71 DT A 17 -11.428 0.514 -1.867 1.00 0.22 H new ATOM 0 H72 DT A 17 -12.308 0.431 -0.323 1.00 0.22 H new ATOM 0 H73 DT A 17 -11.457 1.925 -0.783 1.00 0.22 H new ATOM 0 H6 DT A 17 -10.068 -1.383 -1.345 1.00 0.18 H new ATOM 552 P DT A 18 -10.339 -6.538 1.323 1.00 0.32 P ATOM 553 OP1 DT A 18 -10.533 -7.994 1.134 1.00 0.40 O ATOM 554 OP2 DT A 18 -11.473 -5.690 1.752 1.00 0.35 O ATOM 555 O5' DT A 18 -9.129 -6.324 2.368 1.00 0.27 O ATOM 556 C5' DT A 18 -7.803 -6.769 2.051 1.00 0.24 C ATOM 557 C4' DT A 18 -6.761 -6.154 2.984 1.00 0.18 C ATOM 558 O4' DT A 18 -5.524 -6.026 2.279 1.00 0.19 O ATOM 559 C3' DT A 18 -7.134 -4.764 3.516 1.00 0.17 C ATOM 560 O3' DT A 18 -7.153 -4.795 4.947 1.00 0.23 O ATOM 561 C2' DT A 18 -6.017 -3.839 3.037 1.00 0.18 C ATOM 562 C1' DT A 18 -4.906 -4.800 2.654 1.00 0.16 C ATOM 563 N1 DT A 18 -4.094 -4.338 1.515 1.00 0.15 N ATOM 564 C2 DT A 18 -2.946 -3.621 1.796 1.00 0.18 C ATOM 565 O2 DT A 18 -2.559 -3.414 2.938 1.00 0.25 O ATOM 566 N3 DT A 18 -2.234 -3.175 0.710 1.00 0.21 N ATOM 567 C4 DT A 18 -2.560 -3.384 -0.613 1.00 0.21 C ATOM 568 O4 DT A 18 -1.840 -2.966 -1.500 1.00 0.26 O ATOM 569 C5 DT A 18 -3.768 -4.141 -0.813 1.00 0.20 C ATOM 570 C7 DT A 18 -4.243 -4.446 -2.226 1.00 0.25 C ATOM 571 C6 DT A 18 -4.481 -4.586 0.225 1.00 0.17 C ATOM 0 H5' DT A 18 -7.568 -6.506 1.020 1.00 0.24 H new ATOM 0 H5'' DT A 18 -7.758 -7.856 2.121 1.00 0.24 H new ATOM 0 H4' DT A 18 -6.693 -6.825 3.840 1.00 0.18 H new ATOM 0 H3' DT A 18 -8.114 -4.436 3.170 1.00 0.17 H new ATOM 0 H2' DT A 18 -6.334 -3.232 2.189 1.00 0.18 H new ATOM 0 H2'' DT A 18 -5.701 -3.151 3.821 1.00 0.18 H new ATOM 0 H1' DT A 18 -4.236 -4.893 3.509 1.00 0.16 H new ATOM 0 H3 DT A 18 -1.386 -2.640 0.899 1.00 0.21 H new ATOM 0 H71 DT A 18 -3.928 -3.646 -2.896 1.00 0.25 H new ATOM 0 H72 DT A 18 -3.812 -5.390 -2.559 1.00 0.25 H new ATOM 0 H73 DT A 18 -5.330 -4.520 -2.236 1.00 0.25 H new ATOM 0 H6 DT A 18 -5.382 -5.153 0.043 1.00 0.17 H new ATOM 584 P DG A 19 -8.007 -3.708 5.776 1.00 0.22 P ATOM 585 OP1 DG A 19 -9.408 -4.175 5.838 1.00 0.29 O ATOM 586 OP2 DG A 19 -7.702 -2.362 5.234 1.00 0.27 O ATOM 587 O5' DG A 19 -7.375 -3.820 7.256 1.00 0.22 O ATOM 588 C5' DG A 19 -5.980 -3.577 7.472 1.00 0.19 C ATOM 589 C4' DG A 19 -5.732 -2.253 8.194 1.00 0.17 C ATOM 590 O4' DG A 19 -4.334 -1.909 8.101 1.00 0.17 O ATOM 591 C3' DG A 19 -6.502 -1.062 7.618 1.00 0.17 C ATOM 592 O3' DG A 19 -6.714 -0.119 8.684 1.00 0.23 O ATOM 593 C2' DG A 19 -5.511 -0.535 6.600 1.00 0.15 C ATOM 594 C1' DG A 19 -4.227 -0.663 7.397 1.00 0.14 C ATOM 595 N9 DG A 19 -2.982 -0.672 6.630 1.00 0.14 N ATOM 596 C8 DG A 19 -1.722 -0.658 7.115 1.00 0.15 C ATOM 597 N7 DG A 19 -0.796 -0.631 6.197 1.00 0.15 N ATOM 598 C5 DG A 19 -1.524 -0.629 5.010 1.00 0.13 C ATOM 599 C6 DG A 19 -1.084 -0.606 3.663 1.00 0.14 C ATOM 600 O6 DG A 19 0.069 -0.581 3.239 1.00 0.17 O ATOM 601 N1 DG A 19 -2.151 -0.616 2.775 1.00 0.13 N ATOM 602 C2 DG A 19 -3.520 -0.648 3.174 1.00 0.12 C ATOM 603 N2 DG A 19 -4.542 -0.692 2.294 1.00 0.12 N ATOM 604 N3 DG A 19 -3.884 -0.661 4.433 1.00 0.13 N ATOM 605 C4 DG A 19 -2.862 -0.653 5.281 1.00 0.12 C ATOM 0 H5' DG A 19 -5.461 -3.569 6.513 1.00 0.19 H new ATOM 0 H5'' DG A 19 -5.557 -4.393 8.057 1.00 0.19 H new ATOM 0 H4' DG A 19 -6.072 -2.421 9.216 1.00 0.17 H new ATOM 0 H3' DG A 19 -7.479 -1.280 7.187 1.00 0.17 H new ATOM 0 H2' DG A 19 -5.496 -1.129 5.686 1.00 0.15 H new ATOM 0 H2'' DG A 19 -5.720 0.494 6.308 1.00 0.15 H new ATOM 0 H1' DG A 19 -4.149 0.224 8.025 1.00 0.14 H new ATOM 0 H8 DG A 19 -1.500 -0.668 8.172 1.00 0.15 H new ATOM 0 H1 DG A 19 -1.943 -0.599 1.776 1.00 0.13 H new ATOM 0 H21 DG A 19 -5.505 -0.714 2.631 1.00 0.12 H new ATOM 0 H22 DG A 19 -4.352 -0.704 1.292 1.00 0.12 H new ATOM 617 P DG A 20 -7.312 1.368 8.467 1.00 0.19 P ATOM 618 OP1 DG A 20 -8.587 1.468 9.208 1.00 0.31 O ATOM 619 OP2 DG A 20 -7.258 1.720 7.033 1.00 0.23 O ATOM 620 O5' DG A 20 -6.226 2.262 9.244 1.00 0.23 O ATOM 621 C5' DG A 20 -5.697 1.805 10.493 1.00 0.21 C ATOM 622 C4' DG A 20 -4.249 2.227 10.669 1.00 0.18 C ATOM 623 O4' DG A 20 -3.490 1.777 9.533 1.00 0.19 O ATOM 624 C3' DG A 20 -4.069 3.738 10.791 1.00 0.21 C ATOM 625 O3' DG A 20 -3.140 4.064 11.844 1.00 0.25 O ATOM 626 C2' DG A 20 -3.513 4.125 9.440 1.00 0.20 C ATOM 627 C1' DG A 20 -2.740 2.874 9.036 1.00 0.17 C ATOM 628 N9 DG A 20 -2.549 2.700 7.585 1.00 0.15 N ATOM 629 C8 DG A 20 -3.490 2.620 6.600 1.00 0.17 C ATOM 630 N7 DG A 20 -2.993 2.522 5.410 1.00 0.17 N ATOM 631 C5 DG A 20 -1.628 2.529 5.605 1.00 0.15 C ATOM 632 C6 DG A 20 -0.592 2.445 4.649 1.00 0.16 C ATOM 633 O6 DG A 20 -0.696 2.351 3.432 1.00 0.19 O ATOM 634 N1 DG A 20 0.658 2.481 5.233 1.00 0.17 N ATOM 635 C2 DG A 20 0.888 2.592 6.630 1.00 0.17 C ATOM 636 N2 DG A 20 2.155 2.634 7.129 1.00 0.20 N ATOM 637 N3 DG A 20 -0.115 2.671 7.515 1.00 0.17 N ATOM 638 C4 DG A 20 -1.335 2.634 6.934 1.00 0.15 C ATOM 0 H5' DG A 20 -5.770 0.719 10.545 1.00 0.21 H new ATOM 0 H5'' DG A 20 -6.296 2.204 11.311 1.00 0.21 H new ATOM 0 H4' DG A 20 -3.902 1.777 11.599 1.00 0.18 H new ATOM 0 H3' DG A 20 -4.991 4.262 11.042 1.00 0.21 H new ATOM 0 H2' DG A 20 -4.303 4.362 8.728 1.00 0.20 H new ATOM 0 H2'' DG A 20 -2.866 5.000 9.502 1.00 0.20 H new ATOM 0 H1' DG A 20 -1.733 2.953 9.446 1.00 0.17 H new ATOM 0 H8 DG A 20 -4.552 2.637 6.796 1.00 0.17 H new ATOM 0 H1 DG A 20 1.471 2.424 4.620 1.00 0.17 H new ATOM 0 H21 DG A 20 2.305 2.714 8.135 1.00 0.20 H new ATOM 0 H22 DG A 20 2.954 2.586 6.497 1.00 0.20 H new ATOM 650 P DG A 21 -1.628 3.501 11.869 1.00 0.25 P ATOM 651 OP1 DG A 21 -1.679 2.024 11.830 1.00 0.30 O ATOM 652 OP2 DG A 21 -0.901 4.182 12.963 1.00 0.32 O ATOM 653 O5' DG A 21 -1.028 4.019 10.466 1.00 0.24 O ATOM 654 C5' DG A 21 -0.088 5.093 10.394 1.00 0.27 C ATOM 655 C4' DG A 21 -0.507 6.159 9.377 1.00 0.26 C ATOM 656 O4' DG A 21 -0.934 5.562 8.149 1.00 0.23 O ATOM 657 C3' DG A 21 -1.671 7.056 9.825 1.00 0.27 C ATOM 658 O3' DG A 21 -1.194 8.305 10.343 1.00 0.35 O ATOM 659 C2' DG A 21 -2.490 7.263 8.537 1.00 0.27 C ATOM 660 C1' DG A 21 -1.624 6.597 7.473 1.00 0.23 C ATOM 661 N9 DG A 21 -2.365 6.050 6.309 1.00 0.20 N ATOM 662 C8 DG A 21 -3.719 5.931 6.121 1.00 0.22 C ATOM 663 N7 DG A 21 -4.060 5.602 4.900 1.00 0.20 N ATOM 664 C5 DG A 21 -2.843 5.485 4.230 1.00 0.16 C ATOM 665 C6 DG A 21 -2.553 5.150 2.865 1.00 0.15 C ATOM 666 O6 DG A 21 -3.318 4.967 1.897 1.00 0.16 O ATOM 667 N1 DG A 21 -1.202 5.130 2.634 1.00 0.13 N ATOM 668 C2 DG A 21 -0.195 5.416 3.583 1.00 0.15 C ATOM 669 N2 DG A 21 1.130 5.374 3.248 1.00 0.16 N ATOM 670 N3 DG A 21 -0.483 5.736 4.839 1.00 0.17 N ATOM 671 C4 DG A 21 -1.805 5.749 5.094 1.00 0.17 C ATOM 0 H5' DG A 21 0.892 4.699 10.123 1.00 0.27 H new ATOM 0 H5'' DG A 21 0.014 5.551 11.378 1.00 0.27 H new ATOM 0 H4' DG A 21 0.391 6.767 9.265 1.00 0.26 H new ATOM 0 H3' DG A 21 -2.258 6.613 10.630 1.00 0.27 H new ATOM 0 H2' DG A 21 -3.474 6.800 8.605 1.00 0.27 H new ATOM 0 H2'' DG A 21 -2.649 8.320 8.325 1.00 0.27 H new ATOM 0 HO3' DG A 21 -1.955 8.857 10.619 1.00 0.35 H new ATOM 0 H1' DG A 21 -0.968 7.347 7.031 1.00 0.23 H new ATOM 0 H8 DG A 21 -4.439 6.094 6.909 1.00 0.22 H new ATOM 0 H1 DG A 21 -0.896 4.887 1.692 1.00 0.13 H new ATOM 0 H21 DG A 21 1.840 5.584 3.949 1.00 0.16 H new ATOM 0 H22 DG A 21 1.408 5.132 2.297 1.00 0.16 H new TER 684 DG A 21