USER MOD reduce.3.24.130724 H: found=0, std=0, add=242, rem=0, adj=9 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 6 DT C7 :methyl 150:sc= -11.2! (180deg=-11.2!) USER MOD Set 1.2: A 11 DT C7 :methyl -30:sc= -9.79! (180deg=-10.5!) USER MOD Set 2.1: A 1 DT C7 :methyl -30:sc= -10.5! (180deg=-4.93!) USER MOD Set 2.2: A 12 DT C7 :methyl -30:sc= -5.71! (180deg=-3.89!) USER MOD Single : A 1 DT O5' : rot -178:sc= 1.5 USER MOD Single : A 5 DT C7 :methyl 150:sc= -8.33! (180deg=-8.33!) USER MOD Single : A 7 DT C7 :methyl -30:sc= -8.16! (180deg=-10.4!) USER MOD Single : A 16 DT C7 :methyl -30:sc= -0.196 (180deg=-2.12!) USER MOD Single : A 17 DT C7 :methyl -30:sc= -15.9! (180deg=-22!) USER MOD Single : A 18 DT C7 :methyl -30:sc= -2.48 (180deg=-6.82!) USER MOD Single : A 21 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -2.300 -3.313 7.087 1.00 0.29 O ATOM 2 C5' DT A 1 -2.511 -3.941 5.816 1.00 0.23 C ATOM 3 C4' DT A 1 -2.267 -5.451 5.906 1.00 0.23 C ATOM 4 O4' DT A 1 -2.740 -6.115 4.729 1.00 0.23 O ATOM 5 C3' DT A 1 -0.788 -5.841 6.061 1.00 0.26 C ATOM 6 O3' DT A 1 -0.606 -6.533 7.300 1.00 0.36 O ATOM 7 C2' DT A 1 -0.525 -6.804 4.903 1.00 0.35 C ATOM 8 C1' DT A 1 -1.928 -7.269 4.571 1.00 0.29 C ATOM 9 N1 DT A 1 -2.102 -7.790 3.201 1.00 0.29 N ATOM 10 C2 DT A 1 -2.526 -9.097 3.073 1.00 0.36 C ATOM 11 O2 DT A 1 -2.724 -9.822 4.043 1.00 0.42 O ATOM 12 N3 DT A 1 -2.699 -9.555 1.786 1.00 0.40 N ATOM 13 C4 DT A 1 -2.487 -8.831 0.630 1.00 0.38 C ATOM 14 O4 DT A 1 -2.672 -9.346 -0.470 1.00 0.47 O ATOM 15 C5 DT A 1 -2.045 -7.475 0.856 1.00 0.30 C ATOM 16 C7 DT A 1 -1.803 -6.554 -0.339 1.00 0.33 C ATOM 17 C6 DT A 1 -1.867 -7.005 2.107 1.00 0.27 C ATOM 0 H5' DT A 1 -1.842 -3.504 5.074 1.00 0.23 H new ATOM 0 H5'' DT A 1 -3.530 -3.753 5.477 1.00 0.23 H new ATOM 0 H4' DT A 1 -2.809 -5.758 6.800 1.00 0.23 H new ATOM 0 H3' DT A 1 -0.123 -4.978 6.053 1.00 0.26 H new ATOM 0 H2' DT A 1 -0.047 -6.308 4.058 1.00 0.35 H new ATOM 0 H2'' DT A 1 0.122 -7.631 5.196 1.00 0.35 H new ATOM 0 HO5' DT A 1 -2.489 -2.354 7.013 1.00 0.29 H new ATOM 0 H1' DT A 1 -2.186 -8.104 5.222 1.00 0.29 H new ATOM 0 H3 DT A 1 -3.013 -10.519 1.677 1.00 0.40 H new ATOM 0 H71 DT A 1 -1.490 -7.147 -1.198 1.00 0.33 H new ATOM 0 H72 DT A 1 -2.723 -6.023 -0.581 1.00 0.33 H new ATOM 0 H73 DT A 1 -1.023 -5.834 -0.091 1.00 0.33 H new ATOM 0 H6 DT A 1 -1.532 -5.988 2.248 1.00 0.27 H new ATOM 31 P DG A 2 0.786 -6.446 8.101 1.00 0.24 P ATOM 32 OP1 DG A 2 0.925 -7.676 8.914 1.00 0.36 O ATOM 33 OP2 DG A 2 0.864 -5.121 8.757 1.00 0.46 O ATOM 34 O5' DG A 2 1.896 -6.488 6.930 1.00 0.35 O ATOM 35 C5' DG A 2 3.196 -7.049 7.170 1.00 0.33 C ATOM 36 C4' DG A 2 4.302 -5.987 7.164 1.00 0.24 C ATOM 37 O4' DG A 2 4.349 -5.345 5.885 1.00 0.31 O ATOM 38 C3' DG A 2 4.142 -4.896 8.227 1.00 0.22 C ATOM 39 O3' DG A 2 5.099 -5.116 9.273 1.00 0.26 O ATOM 40 C2' DG A 2 4.481 -3.605 7.491 1.00 0.31 C ATOM 41 C1' DG A 2 4.136 -3.942 6.046 1.00 0.30 C ATOM 42 N9 DG A 2 2.742 -3.661 5.666 1.00 0.24 N ATOM 43 C8 DG A 2 1.694 -3.231 6.438 1.00 0.27 C ATOM 44 N7 DG A 2 0.578 -3.098 5.779 1.00 0.27 N ATOM 45 C5 DG A 2 0.914 -3.463 4.481 1.00 0.22 C ATOM 46 C6 DG A 2 0.109 -3.520 3.318 1.00 0.22 C ATOM 47 O6 DG A 2 -1.080 -3.251 3.204 1.00 0.28 O ATOM 48 N1 DG A 2 0.823 -3.935 2.210 1.00 0.19 N ATOM 49 C2 DG A 2 2.198 -4.262 2.222 1.00 0.20 C ATOM 50 N2 DG A 2 2.859 -4.572 1.073 1.00 0.24 N ATOM 51 N3 DG A 2 2.933 -4.208 3.329 1.00 0.21 N ATOM 52 C4 DG A 2 2.234 -3.805 4.407 1.00 0.21 C ATOM 0 H5' DG A 2 3.412 -7.798 6.408 1.00 0.33 H new ATOM 0 H5'' DG A 2 3.195 -7.563 8.131 1.00 0.33 H new ATOM 0 H4' DG A 2 5.220 -6.529 7.390 1.00 0.24 H new ATOM 0 H3' DG A 2 3.148 -4.877 8.675 1.00 0.22 H new ATOM 0 H2' DG A 2 3.896 -2.763 7.861 1.00 0.31 H new ATOM 0 H2'' DG A 2 5.532 -3.338 7.605 1.00 0.31 H new ATOM 0 H1' DG A 2 4.763 -3.316 5.412 1.00 0.30 H new ATOM 0 H8 DG A 2 1.785 -3.022 7.494 1.00 0.27 H new ATOM 0 H1 DG A 2 0.324 -4.010 1.324 1.00 0.19 H new ATOM 0 H21 DG A 2 3.852 -4.805 1.103 1.00 0.24 H new ATOM 0 H22 DG A 2 2.362 -4.571 0.182 1.00 0.24 H new ATOM 64 P DG A 3 5.289 -4.052 10.473 1.00 0.29 P ATOM 65 OP1 DG A 3 6.296 -4.595 11.411 1.00 0.38 O ATOM 66 OP2 DG A 3 3.951 -3.667 10.974 1.00 0.35 O ATOM 67 O5' DG A 3 5.937 -2.776 9.724 1.00 0.25 O ATOM 68 C5' DG A 3 7.308 -2.793 9.306 1.00 0.26 C ATOM 69 C4' DG A 3 7.685 -1.539 8.519 1.00 0.22 C ATOM 70 O4' DG A 3 7.178 -1.615 7.199 1.00 0.21 O ATOM 71 C3' DG A 3 7.134 -0.226 9.096 1.00 0.20 C ATOM 72 O3' DG A 3 8.151 0.487 9.846 1.00 0.24 O ATOM 73 C2' DG A 3 6.691 0.586 7.873 1.00 0.19 C ATOM 74 C1' DG A 3 7.163 -0.288 6.712 1.00 0.18 C ATOM 75 N9 DG A 3 6.316 -0.274 5.509 1.00 0.16 N ATOM 76 C8 DG A 3 6.742 -0.311 4.226 1.00 0.16 C ATOM 77 N7 DG A 3 5.789 -0.341 3.343 1.00 0.15 N ATOM 78 C5 DG A 3 4.630 -0.321 4.108 1.00 0.13 C ATOM 79 C6 DG A 3 3.276 -0.339 3.695 1.00 0.12 C ATOM 80 O6 DG A 3 2.838 -0.399 2.554 1.00 0.15 O ATOM 81 N1 DG A 3 2.400 -0.305 4.763 1.00 0.12 N ATOM 82 C2 DG A 3 2.797 -0.259 6.122 1.00 0.13 C ATOM 83 N2 DG A 3 1.875 -0.216 7.123 1.00 0.15 N ATOM 84 N3 DG A 3 4.085 -0.246 6.488 1.00 0.15 N ATOM 85 C4 DG A 3 4.938 -0.277 5.441 1.00 0.14 C ATOM 0 H5' DG A 3 7.488 -3.674 8.690 1.00 0.26 H new ATOM 0 H5'' DG A 3 7.952 -2.879 10.181 1.00 0.26 H new ATOM 0 H4' DG A 3 8.774 -1.517 8.566 1.00 0.22 H new ATOM 0 H3' DG A 3 6.315 -0.403 9.793 1.00 0.20 H new ATOM 0 H2' DG A 3 5.612 0.738 7.855 1.00 0.19 H new ATOM 0 H2'' DG A 3 7.152 1.573 7.852 1.00 0.19 H new ATOM 0 H1' DG A 3 8.128 0.107 6.395 1.00 0.18 H new ATOM 0 H8 DG A 3 7.788 -0.315 3.957 1.00 0.16 H new ATOM 0 H1 DG A 3 1.401 -0.314 4.559 1.00 0.12 H new ATOM 0 H21 DG A 3 2.180 -0.183 8.096 1.00 0.15 H new ATOM 0 H22 DG A 3 0.880 -0.217 6.900 1.00 0.15 H new ATOM 97 P DG A 4 9.717 0.512 9.417 1.00 0.26 P ATOM 98 OP1 DG A 4 10.205 -0.883 9.343 1.00 0.29 O ATOM 99 OP2 DG A 4 10.414 1.488 10.283 1.00 0.34 O ATOM 100 O5' DG A 4 9.661 1.109 7.918 1.00 0.25 O ATOM 101 C5' DG A 4 9.491 2.512 7.697 1.00 0.22 C ATOM 102 C4' DG A 4 9.352 2.839 6.212 1.00 0.17 C ATOM 103 O4' DG A 4 8.179 2.231 5.680 1.00 0.18 O ATOM 104 C3' DG A 4 9.221 4.334 5.925 1.00 0.18 C ATOM 105 O3' DG A 4 10.494 4.905 5.540 1.00 0.22 O ATOM 106 C2' DG A 4 8.226 4.426 4.770 1.00 0.15 C ATOM 107 C1' DG A 4 7.777 2.989 4.538 1.00 0.15 C ATOM 108 N9 DG A 4 6.324 2.847 4.392 1.00 0.14 N ATOM 109 C8 DG A 4 5.376 2.833 5.364 1.00 0.15 C ATOM 110 N7 DG A 4 4.157 2.736 4.919 1.00 0.15 N ATOM 111 C5 DG A 4 4.319 2.681 3.538 1.00 0.13 C ATOM 112 C6 DG A 4 3.348 2.577 2.517 1.00 0.12 C ATOM 113 O6 DG A 4 2.129 2.514 2.638 1.00 0.16 O ATOM 114 N1 DG A 4 3.923 2.554 1.254 1.00 0.12 N ATOM 115 C2 DG A 4 5.319 2.627 1.008 1.00 0.13 C ATOM 116 N2 DG A 4 5.819 2.619 -0.253 1.00 0.16 N ATOM 117 N3 DG A 4 6.206 2.725 1.989 1.00 0.14 N ATOM 118 C4 DG A 4 5.644 2.747 3.211 1.00 0.13 C ATOM 0 H5' DG A 4 10.344 3.051 8.110 1.00 0.22 H new ATOM 0 H5'' DG A 4 8.606 2.859 8.230 1.00 0.22 H new ATOM 0 H4' DG A 4 10.266 2.462 5.753 1.00 0.17 H new ATOM 0 H3' DG A 4 8.890 4.886 6.805 1.00 0.18 H new ATOM 0 H2' DG A 4 7.383 5.069 5.023 1.00 0.15 H new ATOM 0 H2'' DG A 4 8.691 4.845 3.878 1.00 0.15 H new ATOM 0 H1' DG A 4 8.229 2.644 3.608 1.00 0.15 H new ATOM 0 H8 DG A 4 5.613 2.897 6.416 1.00 0.15 H new ATOM 0 H1 DG A 4 3.301 2.480 0.449 1.00 0.12 H new ATOM 0 H21 DG A 4 6.827 2.673 -0.402 1.00 0.16 H new ATOM 0 H22 DG A 4 5.187 2.559 -1.052 1.00 0.16 H new ATOM 130 P DT A 5 11.573 4.131 4.615 1.00 0.24 P ATOM 131 OP1 DT A 5 11.725 2.745 5.113 1.00 0.28 O ATOM 132 OP2 DT A 5 12.767 4.995 4.487 1.00 0.44 O ATOM 133 O5' DT A 5 10.853 4.067 3.188 1.00 0.31 O ATOM 134 C5' DT A 5 11.257 3.093 2.226 1.00 0.26 C ATOM 135 C4' DT A 5 10.610 3.359 0.879 1.00 0.22 C ATOM 136 O4' DT A 5 9.195 3.453 1.059 1.00 0.22 O ATOM 137 C3' DT A 5 11.080 4.649 0.216 1.00 0.21 C ATOM 138 O3' DT A 5 11.957 4.334 -0.869 1.00 0.24 O ATOM 139 C2' DT A 5 9.817 5.277 -0.339 1.00 0.19 C ATOM 140 C1' DT A 5 8.720 4.683 0.518 1.00 0.16 C ATOM 141 N1 DT A 5 8.238 5.526 1.627 1.00 0.16 N ATOM 142 C2 DT A 5 9.039 6.527 2.170 1.00 0.24 C ATOM 143 O2 DT A 5 10.212 6.697 1.855 1.00 0.29 O ATOM 144 N3 DT A 5 8.431 7.318 3.130 1.00 0.28 N ATOM 145 C4 DT A 5 7.126 7.196 3.578 1.00 0.24 C ATOM 146 O4 DT A 5 6.681 7.951 4.439 1.00 0.30 O ATOM 147 C5 DT A 5 6.400 6.124 2.946 1.00 0.15 C ATOM 148 C7 DT A 5 4.947 5.876 3.272 1.00 0.16 C ATOM 149 C6 DT A 5 6.969 5.350 2.032 1.00 0.13 C ATOM 0 H5' DT A 5 10.984 2.097 2.575 1.00 0.26 H new ATOM 0 H5'' DT A 5 12.342 3.108 2.122 1.00 0.26 H new ATOM 0 H4' DT A 5 10.897 2.532 0.229 1.00 0.22 H new ATOM 0 H3' DT A 5 11.610 5.303 0.908 1.00 0.21 H new ATOM 0 H2' DT A 5 9.842 6.364 -0.262 1.00 0.19 H new ATOM 0 H2'' DT A 5 9.678 5.035 -1.393 1.00 0.19 H new ATOM 0 H1' DT A 5 7.863 4.564 -0.145 1.00 0.16 H new ATOM 0 H3 DT A 5 8.996 8.059 3.546 1.00 0.28 H new ATOM 0 H71 DT A 5 4.447 5.450 2.402 1.00 0.16 H new ATOM 0 H72 DT A 5 4.875 5.181 4.109 1.00 0.16 H new ATOM 0 H73 DT A 5 4.469 6.818 3.541 1.00 0.16 H new ATOM 0 H6 DT A 5 6.391 4.548 1.597 1.00 0.13 H new ATOM 162 P DT A 6 12.447 5.478 -1.893 1.00 0.26 P ATOM 163 OP1 DT A 6 13.335 4.843 -2.886 1.00 0.34 O ATOM 164 OP2 DT A 6 12.937 6.628 -1.100 1.00 0.32 O ATOM 165 O5' DT A 6 11.086 5.930 -2.647 1.00 0.24 O ATOM 166 C5' DT A 6 10.372 5.041 -3.525 1.00 0.23 C ATOM 167 C4' DT A 6 9.230 5.761 -4.247 1.00 0.22 C ATOM 168 O4' DT A 6 8.613 4.881 -5.175 1.00 0.24 O ATOM 169 C3' DT A 6 8.125 6.279 -3.325 1.00 0.20 C ATOM 170 O3' DT A 6 7.747 7.595 -3.742 1.00 0.23 O ATOM 171 C2' DT A 6 6.952 5.317 -3.532 1.00 0.18 C ATOM 172 C1' DT A 6 7.485 4.290 -4.545 1.00 0.21 C ATOM 173 N1 DT A 6 7.938 2.986 -3.993 1.00 0.21 N ATOM 174 C2 DT A 6 8.378 2.044 -4.912 1.00 0.30 C ATOM 175 O2 DT A 6 8.352 2.246 -6.124 1.00 0.36 O ATOM 176 N3 DT A 6 8.847 0.857 -4.392 1.00 0.33 N ATOM 177 C4 DT A 6 8.918 0.524 -3.057 1.00 0.29 C ATOM 178 O4 DT A 6 9.361 -0.566 -2.710 1.00 0.34 O ATOM 179 C5 DT A 6 8.438 1.557 -2.164 1.00 0.22 C ATOM 180 C7 DT A 6 8.491 1.328 -0.657 1.00 0.23 C ATOM 181 C6 DT A 6 7.966 2.728 -2.642 1.00 0.19 C ATOM 0 H5' DT A 6 9.971 4.206 -2.951 1.00 0.23 H new ATOM 0 H5'' DT A 6 11.061 4.622 -4.259 1.00 0.23 H new ATOM 0 H4' DT A 6 9.700 6.619 -4.728 1.00 0.22 H new ATOM 0 H3' DT A 6 8.437 6.327 -2.282 1.00 0.20 H new ATOM 0 H2' DT A 6 6.658 4.840 -2.597 1.00 0.18 H new ATOM 0 H2'' DT A 6 6.073 5.836 -3.915 1.00 0.18 H new ATOM 0 H1' DT A 6 6.645 4.059 -5.200 1.00 0.21 H new ATOM 0 H3 DT A 6 9.173 0.158 -5.060 1.00 0.33 H new ATOM 0 H71 DT A 6 8.618 2.283 -0.148 1.00 0.23 H new ATOM 0 H72 DT A 6 7.563 0.862 -0.327 1.00 0.23 H new ATOM 0 H73 DT A 6 9.330 0.675 -0.417 1.00 0.23 H new ATOM 0 H6 DT A 6 7.604 3.475 -1.952 1.00 0.19 H new ATOM 194 P DT A 7 6.716 8.467 -2.862 1.00 0.24 P ATOM 195 OP1 DT A 7 6.756 9.864 -3.346 1.00 0.33 O ATOM 196 OP2 DT A 7 6.961 8.174 -1.429 1.00 0.28 O ATOM 197 O5' DT A 7 5.287 7.835 -3.262 1.00 0.20 O ATOM 198 C5' DT A 7 4.865 7.751 -4.633 1.00 0.23 C ATOM 199 C4' DT A 7 3.460 8.310 -4.845 1.00 0.21 C ATOM 200 O4' DT A 7 2.491 7.595 -4.084 1.00 0.20 O ATOM 201 C3' DT A 7 3.320 9.776 -4.479 1.00 0.25 C ATOM 202 O3' DT A 7 2.479 10.440 -5.441 1.00 0.28 O ATOM 203 C2' DT A 7 2.644 9.780 -3.108 1.00 0.28 C ATOM 204 C1' DT A 7 1.979 8.412 -3.018 1.00 0.22 C ATOM 205 N1 DT A 7 2.273 7.682 -1.785 1.00 0.17 N ATOM 206 C2 DT A 7 1.348 7.663 -0.755 1.00 0.23 C ATOM 207 O2 DT A 7 0.298 8.298 -0.784 1.00 0.29 O ATOM 208 N3 DT A 7 1.680 6.864 0.321 1.00 0.25 N ATOM 209 C4 DT A 7 2.828 6.101 0.439 1.00 0.20 C ATOM 210 O4 DT A 7 3.023 5.411 1.431 1.00 0.25 O ATOM 211 C5 DT A 7 3.708 6.213 -0.702 1.00 0.14 C ATOM 212 C7 DT A 7 4.988 5.424 -0.811 1.00 0.17 C ATOM 213 C6 DT A 7 3.409 6.973 -1.720 1.00 0.15 C ATOM 0 H5' DT A 7 4.891 6.710 -4.955 1.00 0.23 H new ATOM 0 H5'' DT A 7 5.569 8.297 -5.261 1.00 0.23 H new ATOM 0 H4' DT A 7 3.287 8.195 -5.915 1.00 0.21 H new ATOM 0 H3' DT A 7 4.280 10.292 -4.466 1.00 0.25 H new ATOM 0 H2' DT A 7 3.369 9.925 -2.307 1.00 0.28 H new ATOM 0 H2'' DT A 7 1.913 10.585 -3.026 1.00 0.28 H new ATOM 0 H1' DT A 7 0.905 8.595 -3.064 1.00 0.22 H new ATOM 0 H3 DT A 7 1.020 6.834 1.098 1.00 0.25 H new ATOM 0 H71 DT A 7 5.387 5.239 0.186 1.00 0.17 H new ATOM 0 H72 DT A 7 4.788 4.473 -1.304 1.00 0.17 H new ATOM 0 H73 DT A 7 5.715 5.989 -1.394 1.00 0.17 H new ATOM 0 H6 DT A 7 4.105 7.033 -2.544 1.00 0.15 H new ATOM 226 P DG A 8 2.829 10.437 -7.021 1.00 0.30 P ATOM 227 OP1 DG A 8 4.300 10.467 -7.170 1.00 0.35 O ATOM 228 OP2 DG A 8 2.000 11.471 -7.679 1.00 0.34 O ATOM 229 O5' DG A 8 2.314 8.988 -7.505 1.00 0.26 O ATOM 230 C5' DG A 8 0.948 8.764 -7.871 1.00 0.25 C ATOM 231 C4' DG A 8 0.592 7.297 -7.747 1.00 0.19 C ATOM 232 O4' DG A 8 0.939 6.848 -6.457 1.00 0.18 O ATOM 233 C3' DG A 8 -0.895 6.978 -7.933 1.00 0.20 C ATOM 234 O3' DG A 8 -1.080 6.306 -9.193 1.00 0.21 O ATOM 235 C2' DG A 8 -1.236 6.058 -6.748 1.00 0.20 C ATOM 236 C1' DG A 8 0.141 5.721 -6.201 1.00 0.16 C ATOM 237 N9 DG A 8 0.246 5.469 -4.772 1.00 0.14 N ATOM 238 C8 DG A 8 1.393 5.264 -4.100 1.00 0.14 C ATOM 239 N7 DG A 8 1.248 5.124 -2.820 1.00 0.14 N ATOM 240 C5 DG A 8 -0.123 5.240 -2.636 1.00 0.13 C ATOM 241 C6 DG A 8 -0.871 5.157 -1.448 1.00 0.14 C ATOM 242 O6 DG A 8 -0.454 4.996 -0.311 1.00 0.17 O ATOM 243 N1 DG A 8 -2.230 5.303 -1.674 1.00 0.15 N ATOM 244 C2 DG A 8 -2.808 5.533 -2.947 1.00 0.16 C ATOM 245 N2 DG A 8 -4.147 5.726 -3.087 1.00 0.20 N ATOM 246 N3 DG A 8 -2.074 5.607 -4.059 1.00 0.16 N ATOM 247 C4 DG A 8 -0.752 5.450 -3.831 1.00 0.14 C ATOM 0 H5' DG A 8 0.782 9.098 -8.895 1.00 0.25 H new ATOM 0 H5'' DG A 8 0.294 9.357 -7.232 1.00 0.25 H new ATOM 0 H4' DG A 8 1.142 6.801 -8.547 1.00 0.19 H new ATOM 0 H3' DG A 8 -1.534 7.861 -7.950 1.00 0.20 H new ATOM 0 H2' DG A 8 -1.857 6.561 -6.007 1.00 0.20 H new ATOM 0 H2'' DG A 8 -1.778 5.167 -7.066 1.00 0.20 H new ATOM 0 H1' DG A 8 0.432 4.788 -6.683 1.00 0.16 H new ATOM 0 H8 DG A 8 2.356 5.220 -4.587 1.00 0.14 H new ATOM 0 H1 DG A 8 -2.856 5.241 -0.871 1.00 0.15 H new ATOM 0 H21 DG A 8 -4.545 5.890 -4.012 1.00 0.20 H new ATOM 0 H22 DG A 8 -4.753 5.707 -2.267 1.00 0.20 H new ATOM 259 P DG A 9 -0.673 4.758 -9.450 1.00 0.22 P ATOM 260 OP1 DG A 9 -0.350 4.622 -10.887 1.00 0.29 O ATOM 261 OP2 DG A 9 -1.715 3.895 -8.852 1.00 0.29 O ATOM 262 O5' DG A 9 0.695 4.550 -8.619 1.00 0.21 O ATOM 263 C5' DG A 9 1.224 3.227 -8.441 1.00 0.22 C ATOM 264 C4' DG A 9 2.642 3.225 -7.865 1.00 0.17 C ATOM 265 O4' DG A 9 2.614 3.553 -6.480 1.00 0.14 O ATOM 266 C3' DG A 9 3.323 1.864 -7.956 1.00 0.20 C ATOM 267 O3' DG A 9 4.186 1.829 -9.095 1.00 0.30 O ATOM 268 C2' DG A 9 4.161 1.757 -6.681 1.00 0.18 C ATOM 269 C1' DG A 9 3.776 2.986 -5.873 1.00 0.14 C ATOM 270 N9 DG A 9 3.481 2.712 -4.458 1.00 0.13 N ATOM 271 C8 DG A 9 4.368 2.649 -3.426 1.00 0.14 C ATOM 272 N7 DG A 9 3.811 2.555 -2.256 1.00 0.14 N ATOM 273 C5 DG A 9 2.450 2.544 -2.532 1.00 0.12 C ATOM 274 C6 DG A 9 1.352 2.463 -1.643 1.00 0.13 C ATOM 275 O6 DG A 9 1.380 2.421 -0.418 1.00 0.17 O ATOM 276 N1 DG A 9 0.135 2.477 -2.308 1.00 0.13 N ATOM 277 C2 DG A 9 -0.004 2.564 -3.730 1.00 0.12 C ATOM 278 N2 DG A 9 -1.227 2.602 -4.343 1.00 0.15 N ATOM 279 N3 DG A 9 1.056 2.640 -4.539 1.00 0.12 N ATOM 280 C4 DG A 9 2.236 2.627 -3.881 1.00 0.12 C ATOM 0 H5' DG A 9 1.226 2.710 -9.401 1.00 0.22 H new ATOM 0 H5'' DG A 9 0.567 2.665 -7.778 1.00 0.22 H new ATOM 0 H4' DG A 9 3.193 3.955 -8.458 1.00 0.17 H new ATOM 0 H3' DG A 9 2.604 1.050 -8.054 1.00 0.20 H new ATOM 0 H2' DG A 9 3.941 0.839 -6.137 1.00 0.18 H new ATOM 0 H2'' DG A 9 5.228 1.747 -6.906 1.00 0.18 H new ATOM 0 H1' DG A 9 4.633 3.659 -5.879 1.00 0.14 H new ATOM 0 H8 DG A 9 5.438 2.675 -3.568 1.00 0.14 H new ATOM 0 H1 DG A 9 -0.716 2.422 -1.748 1.00 0.13 H new ATOM 0 H21 DG A 9 -1.286 2.664 -5.359 1.00 0.15 H new ATOM 0 H22 DG A 9 -2.079 2.568 -3.783 1.00 0.15 H new ATOM 292 P DG A 10 4.593 0.420 -9.749 1.00 0.35 P ATOM 293 OP1 DG A 10 5.645 0.665 -10.756 1.00 0.46 O ATOM 294 OP2 DG A 10 3.346 -0.274 -10.135 1.00 0.46 O ATOM 295 O5' DG A 10 5.238 -0.363 -8.501 1.00 0.31 O ATOM 296 C5' DG A 10 6.568 -0.069 -8.061 1.00 0.25 C ATOM 297 C4' DG A 10 6.844 -0.657 -6.680 1.00 0.19 C ATOM 298 O4' DG A 10 5.982 -0.057 -5.708 1.00 0.18 O ATOM 299 C3' DG A 10 6.628 -2.174 -6.594 1.00 0.20 C ATOM 300 O3' DG A 10 7.869 -2.813 -6.284 1.00 0.30 O ATOM 301 C2' DG A 10 5.652 -2.355 -5.434 1.00 0.21 C ATOM 302 C1' DG A 10 5.752 -1.032 -4.704 1.00 0.15 C ATOM 303 N9 DG A 10 4.533 -0.700 -3.951 1.00 0.14 N ATOM 304 C8 DG A 10 3.243 -0.601 -4.403 1.00 0.14 C ATOM 305 N7 DG A 10 2.362 -0.441 -3.458 1.00 0.13 N ATOM 306 C5 DG A 10 3.123 -0.432 -2.294 1.00 0.12 C ATOM 307 C6 DG A 10 2.718 -0.300 -0.942 1.00 0.12 C ATOM 308 O6 DG A 10 1.590 -0.188 -0.496 1.00 0.15 O ATOM 309 N1 DG A 10 3.799 -0.349 -0.086 1.00 0.12 N ATOM 310 C2 DG A 10 5.085 -0.499 -0.458 1.00 0.14 C ATOM 311 N2 DG A 10 5.949 -0.536 0.533 1.00 0.16 N ATOM 312 N3 DG A 10 5.488 -0.624 -1.718 1.00 0.14 N ATOM 313 C4 DG A 10 4.450 -0.584 -2.586 1.00 0.13 C ATOM 0 H5' DG A 10 6.713 1.011 -8.033 1.00 0.25 H new ATOM 0 H5'' DG A 10 7.286 -0.468 -8.778 1.00 0.25 H new ATOM 0 H4' DG A 10 7.896 -0.448 -6.487 1.00 0.19 H new ATOM 0 H3' DG A 10 6.255 -2.602 -7.525 1.00 0.20 H new ATOM 0 H2' DG A 10 4.638 -2.548 -5.784 1.00 0.21 H new ATOM 0 H2'' DG A 10 5.933 -3.192 -4.795 1.00 0.21 H new ATOM 0 H1' DG A 10 6.551 -1.075 -3.964 1.00 0.15 H new ATOM 0 H8 DG A 10 2.981 -0.651 -5.449 1.00 0.14 H new ATOM 0 H1 DG A 10 3.608 -0.265 0.912 1.00 0.12 H new ATOM 0 H21 DG A 10 6.944 -0.647 0.338 1.00 0.16 H new ATOM 0 H22 DG A 10 5.624 -0.453 1.496 1.00 0.16 H new ATOM 325 P DT A 11 8.285 -4.199 -6.987 1.00 0.46 P ATOM 326 OP1 DT A 11 9.761 -4.289 -6.985 1.00 0.65 O ATOM 327 OP2 DT A 11 7.544 -4.320 -8.265 1.00 0.58 O ATOM 328 O5' DT A 11 7.720 -5.306 -5.968 1.00 0.48 O ATOM 329 C5' DT A 11 6.339 -5.667 -5.968 1.00 0.36 C ATOM 330 C4' DT A 11 6.121 -7.007 -5.302 1.00 0.24 C ATOM 331 O4' DT A 11 6.700 -6.985 -4.000 1.00 0.26 O ATOM 332 C3' DT A 11 4.655 -7.365 -5.130 1.00 0.29 C ATOM 333 O3' DT A 11 4.522 -8.787 -5.106 1.00 0.35 O ATOM 334 C2' DT A 11 4.330 -6.783 -3.770 1.00 0.30 C ATOM 335 C1' DT A 11 5.652 -7.008 -3.027 1.00 0.25 C ATOM 336 N1 DT A 11 5.984 -5.991 -2.008 1.00 0.23 N ATOM 337 C2 DT A 11 5.753 -6.316 -0.687 1.00 0.28 C ATOM 338 O2 DT A 11 5.248 -7.384 -0.352 1.00 0.34 O ATOM 339 N3 DT A 11 6.115 -5.366 0.243 1.00 0.32 N ATOM 340 C4 DT A 11 6.678 -4.133 -0.023 1.00 0.30 C ATOM 341 O4 DT A 11 6.964 -3.367 0.893 1.00 0.36 O ATOM 342 C5 DT A 11 6.881 -3.871 -1.430 1.00 0.24 C ATOM 343 C7 DT A 11 7.462 -2.529 -1.868 1.00 0.28 C ATOM 344 C6 DT A 11 6.540 -4.786 -2.361 1.00 0.22 C ATOM 0 H5' DT A 11 5.971 -5.704 -6.993 1.00 0.36 H new ATOM 0 H5'' DT A 11 5.761 -4.902 -5.449 1.00 0.36 H new ATOM 0 H4' DT A 11 6.583 -7.748 -5.955 1.00 0.24 H new ATOM 0 H3' DT A 11 4.005 -6.994 -5.922 1.00 0.29 H new ATOM 0 H2' DT A 11 4.064 -5.727 -3.827 1.00 0.30 H new ATOM 0 H2'' DT A 11 3.496 -7.296 -3.291 1.00 0.30 H new ATOM 0 H1' DT A 11 5.546 -7.955 -2.498 1.00 0.25 H new ATOM 0 H3 DT A 11 5.951 -5.596 1.223 1.00 0.32 H new ATOM 0 H71 DT A 11 7.174 -1.757 -1.154 1.00 0.28 H new ATOM 0 H72 DT A 11 8.549 -2.599 -1.908 1.00 0.28 H new ATOM 0 H73 DT A 11 7.078 -2.271 -2.855 1.00 0.28 H new ATOM 0 H6 DT A 11 6.708 -4.566 -3.405 1.00 0.22 H new ATOM 357 P DT A 12 4.529 -9.636 -6.474 1.00 0.37 P ATOM 358 OP1 DT A 12 5.084 -10.973 -6.180 1.00 0.48 O ATOM 359 OP2 DT A 12 5.125 -8.805 -7.544 1.00 0.47 O ATOM 360 O5' DT A 12 2.957 -9.797 -6.768 1.00 0.28 O ATOM 361 C5' DT A 12 2.091 -10.308 -5.748 1.00 0.27 C ATOM 362 C4' DT A 12 0.619 -10.113 -6.099 1.00 0.28 C ATOM 363 O4' DT A 12 -0.174 -10.300 -4.925 1.00 0.36 O ATOM 364 C3' DT A 12 0.287 -8.727 -6.625 1.00 0.27 C ATOM 365 O3' DT A 12 -0.884 -8.789 -7.449 1.00 0.36 O ATOM 366 C2' DT A 12 -0.008 -7.947 -5.357 1.00 0.26 C ATOM 367 C1' DT A 12 -0.575 -9.018 -4.413 1.00 0.27 C ATOM 368 N1 DT A 12 -0.105 -8.914 -3.005 1.00 0.32 N ATOM 369 C2 DT A 12 -0.298 -10.008 -2.169 1.00 0.48 C ATOM 370 O2 DT A 12 -0.807 -11.057 -2.554 1.00 0.57 O ATOM 371 N3 DT A 12 0.104 -9.849 -0.856 1.00 0.58 N ATOM 372 C4 DT A 12 0.675 -8.717 -0.308 1.00 0.51 C ATOM 373 O4 DT A 12 0.978 -8.681 0.882 1.00 0.63 O ATOM 374 C5 DT A 12 0.841 -7.631 -1.249 1.00 0.34 C ATOM 375 C7 DT A 12 1.437 -6.310 -0.780 1.00 0.33 C ATOM 376 C6 DT A 12 0.460 -7.756 -2.532 1.00 0.28 C ATOM 0 H5' DT A 12 2.308 -9.808 -4.804 1.00 0.27 H new ATOM 0 H5'' DT A 12 2.291 -11.369 -5.600 1.00 0.27 H new ATOM 0 H4' DT A 12 0.406 -10.840 -6.883 1.00 0.28 H new ATOM 0 H3' DT A 12 1.079 -8.286 -7.231 1.00 0.27 H new ATOM 0 H2' DT A 12 0.891 -7.486 -4.949 1.00 0.26 H new ATOM 0 H2'' DT A 12 -0.725 -7.146 -5.534 1.00 0.26 H new ATOM 0 H1' DT A 12 -1.656 -8.878 -4.386 1.00 0.27 H new ATOM 0 H3 DT A 12 -0.034 -10.644 -0.232 1.00 0.58 H new ATOM 0 H71 DT A 12 1.190 -6.152 0.270 1.00 0.33 H new ATOM 0 H72 DT A 12 2.520 -6.337 -0.898 1.00 0.33 H new ATOM 0 H73 DT A 12 1.028 -5.494 -1.376 1.00 0.33 H new ATOM 0 H6 DT A 12 0.602 -6.925 -3.207 1.00 0.28 H new ATOM 389 P DG A 13 -1.173 -7.663 -8.567 1.00 0.41 P ATOM 390 OP1 DG A 13 -2.244 -8.163 -9.457 1.00 0.56 O ATOM 391 OP2 DG A 13 0.122 -7.235 -9.144 1.00 0.46 O ATOM 392 O5' DG A 13 -1.769 -6.438 -7.704 1.00 0.34 O ATOM 393 C5' DG A 13 -3.048 -6.543 -7.062 1.00 0.33 C ATOM 394 C4' DG A 13 -3.224 -5.466 -5.993 1.00 0.25 C ATOM 395 O4' DG A 13 -2.140 -5.552 -5.079 1.00 0.24 O ATOM 396 C3' DG A 13 -3.249 -4.043 -6.547 1.00 0.23 C ATOM 397 O3' DG A 13 -4.585 -3.539 -6.485 1.00 0.24 O ATOM 398 C2' DG A 13 -2.374 -3.216 -5.589 1.00 0.22 C ATOM 399 C1' DG A 13 -1.787 -4.251 -4.623 1.00 0.19 C ATOM 400 N9 DG A 13 -0.324 -4.208 -4.558 1.00 0.16 N ATOM 401 C8 DG A 13 0.586 -4.558 -5.516 1.00 0.17 C ATOM 402 N7 DG A 13 1.823 -4.405 -5.149 1.00 0.18 N ATOM 403 C5 DG A 13 1.723 -3.914 -3.852 1.00 0.16 C ATOM 404 C6 DG A 13 2.742 -3.556 -2.943 1.00 0.20 C ATOM 405 O6 DG A 13 3.956 -3.583 -3.111 1.00 0.25 O ATOM 406 N1 DG A 13 2.230 -3.109 -1.739 1.00 0.20 N ATOM 407 C2 DG A 13 0.847 -3.012 -1.440 1.00 0.19 C ATOM 408 N2 DG A 13 0.421 -2.563 -0.229 1.00 0.25 N ATOM 409 N3 DG A 13 -0.097 -3.353 -2.317 1.00 0.17 N ATOM 410 C4 DG A 13 0.410 -3.791 -3.487 1.00 0.14 C ATOM 0 H5' DG A 13 -3.149 -7.529 -6.608 1.00 0.33 H new ATOM 0 H5'' DG A 13 -3.839 -6.452 -7.806 1.00 0.33 H new ATOM 0 H4' DG A 13 -4.190 -5.652 -5.523 1.00 0.25 H new ATOM 0 H3' DG A 13 -2.898 -4.001 -7.578 1.00 0.23 H new ATOM 0 H2' DG A 13 -1.589 -2.684 -6.127 1.00 0.22 H new ATOM 0 H2'' DG A 13 -2.962 -2.467 -5.060 1.00 0.22 H new ATOM 0 H1' DG A 13 -2.188 -4.023 -3.635 1.00 0.19 H new ATOM 0 H8 DG A 13 0.302 -4.928 -6.490 1.00 0.17 H new ATOM 0 H1 DG A 13 2.893 -2.830 -1.016 1.00 0.20 H new ATOM 0 H21 DG A 13 -0.578 -2.500 -0.031 1.00 0.25 H new ATOM 0 H22 DG A 13 1.100 -2.290 0.481 1.00 0.25 H new ATOM 422 P DG A 14 -5.713 -4.062 -7.501 1.00 0.23 P ATOM 423 OP1 DG A 14 -6.056 -5.456 -7.138 1.00 0.31 O ATOM 424 OP2 DG A 14 -5.278 -3.742 -8.879 1.00 0.33 O ATOM 425 O5' DG A 14 -6.972 -3.119 -7.137 1.00 0.19 O ATOM 426 C5' DG A 14 -7.264 -2.782 -5.775 1.00 0.18 C ATOM 427 C4' DG A 14 -6.760 -1.392 -5.405 1.00 0.14 C ATOM 428 O4' DG A 14 -6.080 -1.461 -4.174 1.00 0.14 O ATOM 429 C3' DG A 14 -5.749 -0.762 -6.395 1.00 0.15 C ATOM 430 O3' DG A 14 -6.354 0.271 -7.202 1.00 0.16 O ATOM 431 C2' DG A 14 -4.686 -0.132 -5.485 1.00 0.16 C ATOM 432 C1' DG A 14 -5.334 -0.275 -4.119 1.00 0.13 C ATOM 433 N9 DG A 14 -4.442 -0.366 -2.985 1.00 0.14 N ATOM 434 C8 DG A 14 -4.807 -0.401 -1.692 1.00 0.16 C ATOM 435 N7 DG A 14 -3.816 -0.385 -0.868 1.00 0.16 N ATOM 436 C5 DG A 14 -2.705 -0.334 -1.683 1.00 0.13 C ATOM 437 C6 DG A 14 -1.351 -0.285 -1.328 1.00 0.14 C ATOM 438 O6 DG A 14 -0.874 -0.302 -0.200 1.00 0.17 O ATOM 439 N1 DG A 14 -0.527 -0.227 -2.438 1.00 0.13 N ATOM 440 C2 DG A 14 -0.989 -0.240 -3.780 1.00 0.13 C ATOM 441 N2 DG A 14 -0.125 -0.261 -4.830 1.00 0.16 N ATOM 442 N3 DG A 14 -2.283 -0.283 -4.078 1.00 0.12 N ATOM 443 C4 DG A 14 -3.074 -0.325 -2.992 1.00 0.13 C ATOM 0 H5' DG A 14 -6.808 -3.520 -5.114 1.00 0.18 H new ATOM 0 H5'' DG A 14 -8.341 -2.831 -5.613 1.00 0.18 H new ATOM 0 H4' DG A 14 -7.658 -0.774 -5.396 1.00 0.14 H new ATOM 0 H3' DG A 14 -5.358 -1.505 -7.090 1.00 0.15 H new ATOM 0 H2' DG A 14 -3.732 -0.657 -5.544 1.00 0.16 H new ATOM 0 H2'' DG A 14 -4.493 0.910 -5.740 1.00 0.16 H new ATOM 0 H1' DG A 14 -5.906 0.636 -3.946 1.00 0.13 H new ATOM 0 H8 DG A 14 -5.838 -0.439 -1.372 1.00 0.16 H new ATOM 0 H1 DG A 14 0.479 -0.171 -2.281 1.00 0.13 H new ATOM 0 H21 DG A 14 -0.483 -0.270 -5.785 1.00 0.16 H new ATOM 0 H22 DG A 14 0.881 -0.268 -4.662 1.00 0.16 H new ATOM 455 P DG A 15 -7.391 1.365 -6.618 1.00 0.16 P ATOM 456 OP1 DG A 15 -8.494 0.645 -5.948 1.00 0.24 O ATOM 457 OP2 DG A 15 -7.697 2.318 -7.708 1.00 0.22 O ATOM 458 O5' DG A 15 -6.545 2.158 -5.502 1.00 0.20 O ATOM 459 C5' DG A 15 -7.040 3.399 -4.981 1.00 0.18 C ATOM 460 C4' DG A 15 -7.997 3.185 -3.812 1.00 0.14 C ATOM 461 O4' DG A 15 -7.367 2.387 -2.806 1.00 0.14 O ATOM 462 C3' DG A 15 -8.425 4.460 -3.110 1.00 0.17 C ATOM 463 O3' DG A 15 -9.641 4.220 -2.368 1.00 0.22 O ATOM 464 C2' DG A 15 -7.261 4.688 -2.155 1.00 0.16 C ATOM 465 C1' DG A 15 -6.872 3.258 -1.779 1.00 0.12 C ATOM 466 N9 DG A 15 -5.442 3.016 -1.662 1.00 0.12 N ATOM 467 C8 DG A 15 -4.499 2.902 -2.634 1.00 0.15 C ATOM 468 N7 DG A 15 -3.294 2.698 -2.171 1.00 0.16 N ATOM 469 C5 DG A 15 -3.478 2.677 -0.787 1.00 0.14 C ATOM 470 C6 DG A 15 -2.540 2.496 0.261 1.00 0.15 C ATOM 471 O6 DG A 15 -1.332 2.326 0.173 1.00 0.19 O ATOM 472 N1 DG A 15 -3.141 2.542 1.513 1.00 0.14 N ATOM 473 C2 DG A 15 -4.530 2.741 1.726 1.00 0.13 C ATOM 474 N2 DG A 15 -5.069 2.735 2.972 1.00 0.15 N ATOM 475 N3 DG A 15 -5.377 2.911 0.723 1.00 0.12 N ATOM 476 C4 DG A 15 -4.790 2.868 -0.483 1.00 0.12 C ATOM 0 H5' DG A 15 -7.551 3.947 -5.773 1.00 0.18 H new ATOM 0 H5'' DG A 15 -6.202 4.016 -4.656 1.00 0.18 H new ATOM 0 H4' DG A 15 -8.873 2.714 -4.258 1.00 0.14 H new ATOM 0 H3' DG A 15 -8.626 5.300 -3.775 1.00 0.17 H new ATOM 0 H2' DG A 15 -6.440 5.222 -2.633 1.00 0.16 H new ATOM 0 H2'' DG A 15 -7.557 5.273 -1.284 1.00 0.16 H new ATOM 0 H1' DG A 15 -7.301 3.077 -0.793 1.00 0.12 H new ATOM 0 H8 DG A 15 -4.724 2.973 -3.688 1.00 0.15 H new ATOM 0 H1 DG A 15 -2.545 2.425 2.332 1.00 0.14 H new ATOM 0 H21 DG A 15 -6.071 2.881 3.095 1.00 0.15 H new ATOM 0 H22 DG A 15 -4.472 2.585 3.785 1.00 0.15 H new ATOM 488 P DT A 16 -11.091 4.227 -3.094 1.00 0.25 P ATOM 489 OP1 DT A 16 -10.909 3.796 -4.501 1.00 0.29 O ATOM 490 OP2 DT A 16 -11.748 5.521 -2.803 1.00 0.36 O ATOM 491 O5' DT A 16 -11.908 3.065 -2.319 1.00 0.24 O ATOM 492 C5' DT A 16 -11.622 1.690 -2.590 1.00 0.22 C ATOM 493 C4' DT A 16 -12.738 0.745 -2.183 1.00 0.27 C ATOM 494 O4' DT A 16 -13.938 1.079 -2.890 1.00 0.38 O ATOM 495 C3' DT A 16 -12.391 -0.713 -2.486 1.00 0.22 C ATOM 496 O3' DT A 16 -12.162 -1.428 -1.267 1.00 0.25 O ATOM 497 C2' DT A 16 -13.619 -1.267 -3.192 1.00 0.24 C ATOM 498 C1' DT A 16 -14.359 -0.029 -3.688 1.00 0.30 C ATOM 499 N1 DT A 16 -14.102 0.307 -5.107 1.00 0.39 N ATOM 500 C2 DT A 16 -15.189 0.637 -5.895 1.00 0.57 C ATOM 501 O2 DT A 16 -16.337 0.664 -5.459 1.00 0.64 O ATOM 502 N3 DT A 16 -14.909 0.932 -7.214 1.00 0.71 N ATOM 503 C4 DT A 16 -13.661 0.929 -7.807 1.00 0.70 C ATOM 504 O4 DT A 16 -13.535 1.202 -8.998 1.00 0.85 O ATOM 505 C5 DT A 16 -12.586 0.575 -6.908 1.00 0.51 C ATOM 506 C7 DT A 16 -11.148 0.528 -7.420 1.00 0.52 C ATOM 507 C6 DT A 16 -12.832 0.284 -5.618 1.00 0.37 C ATOM 0 H5' DT A 16 -10.709 1.407 -2.066 1.00 0.22 H new ATOM 0 H5'' DT A 16 -11.428 1.571 -3.656 1.00 0.22 H new ATOM 0 H4' DT A 16 -12.877 0.855 -1.108 1.00 0.27 H new ATOM 0 H3' DT A 16 -11.489 -0.806 -3.090 1.00 0.22 H new ATOM 0 H2' DT A 16 -13.341 -1.922 -4.018 1.00 0.24 H new ATOM 0 H2'' DT A 16 -14.237 -1.855 -2.513 1.00 0.24 H new ATOM 0 H1' DT A 16 -15.425 -0.242 -3.605 1.00 0.30 H new ATOM 0 H3 DT A 16 -15.701 1.176 -7.809 1.00 0.71 H new ATOM 0 H71 DT A 16 -11.146 0.257 -8.476 1.00 0.52 H new ATOM 0 H72 DT A 16 -10.685 1.507 -7.296 1.00 0.52 H new ATOM 0 H73 DT A 16 -10.585 -0.214 -6.854 1.00 0.52 H new ATOM 0 H6 DT A 16 -12.008 0.026 -4.970 1.00 0.37 H new ATOM 520 P DT A 17 -11.670 -2.971 -1.287 1.00 0.27 P ATOM 521 OP1 DT A 17 -12.546 -3.724 -2.213 1.00 0.34 O ATOM 522 OP2 DT A 17 -11.529 -3.421 0.115 1.00 0.39 O ATOM 523 O5' DT A 17 -10.191 -2.888 -1.950 1.00 0.20 O ATOM 524 C5' DT A 17 -9.473 -4.082 -2.334 1.00 0.20 C ATOM 525 C4' DT A 17 -8.462 -4.528 -1.277 1.00 0.18 C ATOM 526 O4' DT A 17 -7.340 -3.635 -1.260 1.00 0.14 O ATOM 527 C3' DT A 17 -9.022 -4.592 0.138 1.00 0.19 C ATOM 528 O3' DT A 17 -9.139 -5.973 0.520 1.00 0.25 O ATOM 529 C2' DT A 17 -7.973 -3.890 0.983 1.00 0.17 C ATOM 530 C1' DT A 17 -7.295 -2.967 0.000 1.00 0.13 C ATOM 531 N1 DT A 17 -7.907 -1.646 -0.192 1.00 0.12 N ATOM 532 C2 DT A 17 -8.100 -0.817 0.901 1.00 0.16 C ATOM 533 O2 DT A 17 -7.829 -1.155 2.051 1.00 0.21 O ATOM 534 N3 DT A 17 -8.603 0.438 0.613 1.00 0.20 N ATOM 535 C4 DT A 17 -8.920 0.918 -0.647 1.00 0.20 C ATOM 536 O4 DT A 17 -9.368 2.051 -0.787 1.00 0.27 O ATOM 537 C5 DT A 17 -8.679 -0.031 -1.713 1.00 0.16 C ATOM 538 C7 DT A 17 -8.928 0.357 -3.168 1.00 0.22 C ATOM 539 C6 DT A 17 -8.197 -1.246 -1.447 1.00 0.13 C ATOM 0 H5' DT A 17 -8.953 -3.902 -3.275 1.00 0.20 H new ATOM 0 H5'' DT A 17 -10.185 -4.888 -2.513 1.00 0.20 H new ATOM 0 H4' DT A 17 -8.176 -5.539 -1.566 1.00 0.18 H new ATOM 0 H3' DT A 17 -10.005 -4.133 0.246 1.00 0.19 H new ATOM 0 H2' DT A 17 -8.424 -3.338 1.807 1.00 0.17 H new ATOM 0 H2'' DT A 17 -7.269 -4.598 1.421 1.00 0.17 H new ATOM 0 H1' DT A 17 -6.301 -2.768 0.401 1.00 0.13 H new ATOM 0 H3 DT A 17 -8.755 1.068 1.401 1.00 0.20 H new ATOM 0 H71 DT A 17 -9.730 1.094 -3.216 1.00 0.22 H new ATOM 0 H72 DT A 17 -8.018 0.782 -3.592 1.00 0.22 H new ATOM 0 H73 DT A 17 -9.214 -0.528 -3.737 1.00 0.22 H new ATOM 0 H6 DT A 17 -8.033 -1.933 -2.264 1.00 0.13 H new ATOM 552 P DT A 18 -9.747 -6.418 1.949 1.00 0.26 P ATOM 553 OP1 DT A 18 -10.127 -7.846 1.859 1.00 0.35 O ATOM 554 OP2 DT A 18 -10.750 -5.413 2.369 1.00 0.32 O ATOM 555 O5' DT A 18 -8.470 -6.302 2.922 1.00 0.23 O ATOM 556 C5' DT A 18 -7.199 -6.840 2.534 1.00 0.21 C ATOM 557 C4' DT A 18 -6.077 -6.219 3.357 1.00 0.18 C ATOM 558 O4' DT A 18 -4.808 -6.487 2.776 1.00 0.20 O ATOM 559 C3' DT A 18 -6.199 -4.713 3.506 1.00 0.17 C ATOM 560 O3' DT A 18 -5.997 -4.378 4.878 1.00 0.22 O ATOM 561 C2' DT A 18 -5.097 -4.129 2.624 1.00 0.16 C ATOM 562 C1' DT A 18 -4.415 -5.362 2.005 1.00 0.19 C ATOM 563 N1 DT A 18 -4.735 -5.630 0.566 1.00 0.20 N ATOM 564 C2 DT A 18 -5.087 -6.923 0.163 1.00 0.25 C ATOM 565 O2 DT A 18 -5.174 -7.873 0.934 1.00 0.30 O ATOM 566 N3 DT A 18 -5.308 -7.093 -1.188 1.00 0.26 N ATOM 567 C4 DT A 18 -5.215 -6.122 -2.162 1.00 0.23 C ATOM 568 O4 DT A 18 -5.412 -6.405 -3.341 1.00 0.26 O ATOM 569 C5 DT A 18 -4.849 -4.820 -1.660 1.00 0.19 C ATOM 570 C7 DT A 18 -4.721 -3.642 -2.627 1.00 0.20 C ATOM 571 C6 DT A 18 -4.627 -4.624 -0.346 1.00 0.17 C ATOM 0 H5' DT A 18 -7.027 -6.651 1.474 1.00 0.21 H new ATOM 0 H5'' DT A 18 -7.200 -7.922 2.669 1.00 0.21 H new ATOM 0 H4' DT A 18 -6.165 -6.677 4.342 1.00 0.18 H new ATOM 0 H3' DT A 18 -7.174 -4.326 3.210 1.00 0.17 H new ATOM 0 H2' DT A 18 -5.507 -3.473 1.856 1.00 0.16 H new ATOM 0 H2'' DT A 18 -4.393 -3.535 3.207 1.00 0.16 H new ATOM 0 H1' DT A 18 -3.343 -5.166 2.022 1.00 0.19 H new ATOM 0 H3 DT A 18 -5.566 -8.030 -1.497 1.00 0.26 H new ATOM 0 H71 DT A 18 -4.412 -4.007 -3.606 1.00 0.20 H new ATOM 0 H72 DT A 18 -5.683 -3.137 -2.715 1.00 0.20 H new ATOM 0 H73 DT A 18 -3.977 -2.941 -2.250 1.00 0.20 H new ATOM 0 H6 DT A 18 -4.354 -3.636 -0.004 1.00 0.17 H new ATOM 584 P DG A 19 -7.065 -4.892 5.976 1.00 0.22 P ATOM 585 OP1 DG A 19 -6.579 -6.178 6.527 1.00 0.29 O ATOM 586 OP2 DG A 19 -8.420 -4.807 5.382 1.00 0.25 O ATOM 587 O5' DG A 19 -6.953 -3.772 7.125 1.00 0.25 O ATOM 588 C5' DG A 19 -5.671 -3.354 7.594 1.00 0.26 C ATOM 589 C4' DG A 19 -5.685 -1.906 8.073 1.00 0.17 C ATOM 590 O4' DG A 19 -4.359 -1.378 7.957 1.00 0.17 O ATOM 591 C3' DG A 19 -6.596 -0.980 7.255 1.00 0.15 C ATOM 592 O3' DG A 19 -7.066 0.128 8.049 1.00 0.21 O ATOM 593 C2' DG A 19 -5.649 -0.455 6.199 1.00 0.12 C ATOM 594 C1' DG A 19 -4.380 -0.303 7.015 1.00 0.13 C ATOM 595 N9 DG A 19 -3.134 -0.351 6.267 1.00 0.11 N ATOM 596 C8 DG A 19 -1.898 -0.308 6.786 1.00 0.12 C ATOM 597 N7 DG A 19 -0.941 -0.329 5.900 1.00 0.12 N ATOM 598 C5 DG A 19 -1.628 -0.385 4.688 1.00 0.10 C ATOM 599 C6 DG A 19 -1.135 -0.423 3.357 1.00 0.10 C ATOM 600 O6 DG A 19 0.036 -0.408 2.986 1.00 0.14 O ATOM 601 N1 DG A 19 -2.165 -0.473 2.421 1.00 0.09 N ATOM 602 C2 DG A 19 -3.553 -0.484 2.757 1.00 0.10 C ATOM 603 N2 DG A 19 -4.542 -0.517 1.819 1.00 0.13 N ATOM 604 N3 DG A 19 -3.971 -0.445 4.013 1.00 0.11 N ATOM 605 C4 DG A 19 -2.976 -0.399 4.911 1.00 0.10 C ATOM 0 H5' DG A 19 -4.938 -3.465 6.795 1.00 0.26 H new ATOM 0 H5'' DG A 19 -5.354 -4.003 8.410 1.00 0.26 H new ATOM 0 H4' DG A 19 -6.062 -1.931 9.096 1.00 0.17 H new ATOM 0 H3' DG A 19 -7.482 -1.488 6.873 1.00 0.15 H new ATOM 0 H2' DG A 19 -5.527 -1.151 5.369 1.00 0.12 H new ATOM 0 H2'' DG A 19 -5.985 0.491 5.775 1.00 0.12 H new ATOM 0 H1' DG A 19 -4.419 0.692 7.458 1.00 0.13 H new ATOM 0 H8 DG A 19 -1.711 -0.260 7.849 1.00 0.12 H new ATOM 0 H1 DG A 19 -1.912 -0.504 1.433 1.00 0.09 H new ATOM 0 H21 DG A 19 -5.520 -0.524 2.109 1.00 0.13 H new ATOM 0 H22 DG A 19 -4.304 -0.535 0.827 1.00 0.13 H new ATOM 617 P DG A 20 -7.572 -0.034 9.576 1.00 0.24 P ATOM 618 OP1 DG A 20 -7.509 -1.462 9.963 1.00 0.29 O ATOM 619 OP2 DG A 20 -8.842 0.713 9.725 1.00 0.31 O ATOM 620 O5' DG A 20 -6.429 0.764 10.383 1.00 0.23 O ATOM 621 C5' DG A 20 -6.211 2.150 10.111 1.00 0.22 C ATOM 622 C4' DG A 20 -4.740 2.530 10.168 1.00 0.20 C ATOM 623 O4' DG A 20 -4.044 1.959 9.060 1.00 0.20 O ATOM 624 C3' DG A 20 -4.532 4.031 10.120 1.00 0.21 C ATOM 625 O3' DG A 20 -3.988 4.500 11.352 1.00 0.26 O ATOM 626 C2' DG A 20 -3.537 4.249 9.003 1.00 0.19 C ATOM 627 C1' DG A 20 -3.020 2.865 8.677 1.00 0.18 C ATOM 628 N9 DG A 20 -2.771 2.697 7.239 1.00 0.14 N ATOM 629 C8 DG A 20 -3.693 2.647 6.231 1.00 0.14 C ATOM 630 N7 DG A 20 -3.170 2.599 5.048 1.00 0.14 N ATOM 631 C5 DG A 20 -1.806 2.613 5.276 1.00 0.12 C ATOM 632 C6 DG A 20 -0.747 2.574 4.346 1.00 0.13 C ATOM 633 O6 DG A 20 -0.821 2.541 3.125 1.00 0.18 O ATOM 634 N1 DG A 20 0.490 2.595 4.961 1.00 0.11 N ATOM 635 C2 DG A 20 0.687 2.658 6.364 1.00 0.12 C ATOM 636 N2 DG A 20 1.941 2.703 6.899 1.00 0.15 N ATOM 637 N3 DG A 20 -0.338 2.694 7.228 1.00 0.13 N ATOM 638 C4 DG A 20 -1.544 2.668 6.616 1.00 0.12 C ATOM 0 H5' DG A 20 -6.766 2.750 10.832 1.00 0.22 H new ATOM 0 H5'' DG A 20 -6.607 2.390 9.124 1.00 0.22 H new ATOM 0 H4' DG A 20 -4.356 2.149 11.114 1.00 0.20 H new ATOM 0 H3' DG A 20 -5.467 4.567 9.958 1.00 0.21 H new ATOM 0 H2' DG A 20 -4.009 4.710 8.136 1.00 0.19 H new ATOM 0 H2'' DG A 20 -2.729 4.911 9.315 1.00 0.19 H new ATOM 0 H1' DG A 20 -2.078 2.694 9.198 1.00 0.18 H new ATOM 0 H8 DG A 20 -4.759 2.648 6.406 1.00 0.14 H new ATOM 0 H1 DG A 20 1.318 2.563 4.366 1.00 0.11 H new ATOM 0 H21 DG A 20 2.063 2.748 7.911 1.00 0.15 H new ATOM 0 H22 DG A 20 2.757 2.692 6.287 1.00 0.15 H new ATOM 650 P DG A 21 -4.136 6.055 11.738 1.00 0.27 P ATOM 651 OP1 DG A 21 -2.793 6.676 11.703 1.00 0.36 O ATOM 652 OP2 DG A 21 -4.955 6.143 12.967 1.00 0.41 O ATOM 653 O5' DG A 21 -5.009 6.639 10.512 1.00 0.26 O ATOM 654 C5' DG A 21 -4.622 7.839 9.836 1.00 0.25 C ATOM 655 C4' DG A 21 -3.326 7.657 9.049 1.00 0.23 C ATOM 656 O4' DG A 21 -3.531 6.727 7.980 1.00 0.20 O ATOM 657 C3' DG A 21 -2.799 8.951 8.424 1.00 0.27 C ATOM 658 O3' DG A 21 -1.550 9.341 9.008 1.00 0.34 O ATOM 659 C2' DG A 21 -2.641 8.612 6.941 1.00 0.24 C ATOM 660 C1' DG A 21 -2.663 7.098 6.922 1.00 0.19 C ATOM 661 N9 DG A 21 -3.190 6.577 5.660 1.00 0.16 N ATOM 662 C8 DG A 21 -4.477 6.595 5.237 1.00 0.16 C ATOM 663 N7 DG A 21 -4.635 6.261 3.985 1.00 0.16 N ATOM 664 C5 DG A 21 -3.338 5.997 3.549 1.00 0.14 C ATOM 665 C6 DG A 21 -2.864 5.594 2.270 1.00 0.14 C ATOM 666 O6 DG A 21 -3.493 5.445 1.214 1.00 0.14 O ATOM 667 N1 DG A 21 -1.494 5.426 2.261 1.00 0.14 N ATOM 668 C2 DG A 21 -0.639 5.637 3.373 1.00 0.15 C ATOM 669 N2 DG A 21 0.712 5.461 3.269 1.00 0.19 N ATOM 670 N3 DG A 21 -1.107 6.022 4.564 1.00 0.15 N ATOM 671 C4 DG A 21 -2.448 6.180 4.578 1.00 0.14 C ATOM 0 H5' DG A 21 -4.495 8.641 10.564 1.00 0.25 H new ATOM 0 H5'' DG A 21 -5.418 8.147 9.158 1.00 0.25 H new ATOM 0 H4' DG A 21 -2.593 7.301 9.773 1.00 0.23 H new ATOM 0 H3' DG A 21 -3.469 9.795 8.587 1.00 0.27 H new ATOM 0 H2' DG A 21 -3.450 9.033 6.344 1.00 0.24 H new ATOM 0 H2'' DG A 21 -1.709 9.005 6.536 1.00 0.24 H new ATOM 0 HO3' DG A 21 -1.237 10.169 8.588 1.00 0.34 H new ATOM 0 H1' DG A 21 -1.656 6.696 7.031 1.00 0.19 H new ATOM 0 H8 DG A 21 -5.302 6.863 5.881 1.00 0.16 H new ATOM 0 H1 DG A 21 -1.063 5.127 1.386 1.00 0.14 H new ATOM 0 H21 DG A 21 1.311 5.618 4.080 1.00 0.19 H new ATOM 0 H22 DG A 21 1.122 5.173 2.380 1.00 0.19 H new TER 684 DG A 21