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 5 DT C7 :methyl 150:sc= -6.47! (180deg=-5.77!) USER MOD Set 1.2: A 6 DT C7 :methyl -30:sc= -5.11! (180deg=-8.03!) USER MOD Single : A 1 DG O5' : rot -64:sc= -0.0868 USER MOD Single : A 4 DT C7 :methyl -30:sc= -27.3! (180deg=-34.5!) USER MOD Single : A 7 DT C7 :methyl -30:sc= -4.12! (180deg=-5.22!) USER MOD Single : A 11 DT C7 :methyl -30:sc= 0 (180deg=-0.699) USER MOD Single : A 15 DT C7 :methyl -30:sc= -0.354 (180deg=-1.94!) USER MOD Single : A 16 DT C7 :methyl -30:sc= 0 (180deg=-0.167) USER MOD Single : A 17 DT C7 :methyl -30:sc= 0 (180deg=-1.66!) USER MOD Single : A 18 DT C7 :methyl 150:sc= -1.24 (180deg=-1.24) USER MOD Single : A 21 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -3.250 -7.143 -4.953 1.00 0.37 O ATOM 2 C5' DG A 1 -3.882 -5.901 -5.265 1.00 0.29 C ATOM 3 C4' DG A 1 -5.374 -5.934 -4.931 1.00 0.24 C ATOM 4 O4' DG A 1 -5.544 -5.803 -3.513 1.00 0.26 O ATOM 5 C3' DG A 1 -6.181 -4.803 -5.553 1.00 0.22 C ATOM 6 O3' DG A 1 -7.561 -5.207 -5.644 1.00 0.24 O ATOM 7 C2' DG A 1 -6.017 -3.699 -4.523 1.00 0.22 C ATOM 8 C1' DG A 1 -6.073 -4.496 -3.229 1.00 0.22 C ATOM 9 N9 DG A 1 -5.298 -3.948 -2.096 1.00 0.23 N ATOM 10 C8 DG A 1 -5.731 -3.746 -0.813 1.00 0.23 C ATOM 11 N7 DG A 1 -4.791 -3.412 0.021 1.00 0.23 N ATOM 12 C5 DG A 1 -3.645 -3.381 -0.761 1.00 0.22 C ATOM 13 C6 DG A 1 -2.310 -3.088 -0.387 1.00 0.22 C ATOM 14 O6 DG A 1 -1.880 -2.796 0.717 1.00 0.24 O ATOM 15 N1 DG A 1 -1.445 -3.174 -1.459 1.00 0.21 N ATOM 16 C2 DG A 1 -1.814 -3.483 -2.752 1.00 0.22 C ATOM 17 N2 DG A 1 -0.849 -3.458 -3.679 1.00 0.24 N ATOM 18 N3 DG A 1 -3.075 -3.762 -3.111 1.00 0.23 N ATOM 19 C4 DG A 1 -3.937 -3.697 -2.064 1.00 0.22 C ATOM 0 H5' DG A 1 -3.750 -5.680 -6.324 1.00 0.29 H new ATOM 0 H5'' DG A 1 -3.401 -5.096 -4.709 1.00 0.29 H new ATOM 0 H4' DG A 1 -5.736 -6.881 -5.331 1.00 0.24 H new ATOM 0 H3' DG A 1 -5.868 -4.513 -6.556 1.00 0.22 H new ATOM 0 H2' DG A 1 -5.074 -3.165 -4.638 1.00 0.22 H new ATOM 0 H2'' DG A 1 -6.813 -2.957 -4.584 1.00 0.22 H new ATOM 0 HO5' DG A 1 -3.287 -7.295 -3.986 1.00 0.37 H new ATOM 0 H1' DG A 1 -7.116 -4.480 -2.913 1.00 0.22 H new ATOM 0 H8 DG A 1 -6.764 -3.855 -0.519 1.00 0.23 H new ATOM 0 H1 DG A 1 -0.457 -2.995 -1.282 1.00 0.21 H new ATOM 0 H21 DG A 1 -1.069 -3.679 -4.650 1.00 0.24 H new ATOM 0 H22 DG A 1 0.106 -3.218 -3.414 1.00 0.24 H new ATOM 32 P DG A 2 -8.649 -4.342 -6.461 1.00 0.24 P ATOM 33 OP1 DG A 2 -9.845 -5.187 -6.682 1.00 0.34 O ATOM 34 OP2 DG A 2 -7.968 -3.711 -7.613 1.00 0.28 O ATOM 35 O5' DG A 2 -9.023 -3.193 -5.412 1.00 0.23 O ATOM 36 C5' DG A 2 -9.838 -3.479 -4.274 1.00 0.22 C ATOM 37 C4' DG A 2 -9.779 -2.330 -3.288 1.00 0.21 C ATOM 38 O4' DG A 2 -8.485 -2.296 -2.692 1.00 0.24 O ATOM 39 C3' DG A 2 -10.023 -0.974 -3.951 1.00 0.20 C ATOM 40 O3' DG A 2 -11.218 -0.395 -3.423 1.00 0.22 O ATOM 41 C2' DG A 2 -8.810 -0.120 -3.581 1.00 0.21 C ATOM 42 C1' DG A 2 -8.091 -0.944 -2.524 1.00 0.20 C ATOM 43 N9 DG A 2 -6.637 -0.886 -2.630 1.00 0.21 N ATOM 44 C8 DG A 2 -5.859 -0.892 -3.753 1.00 0.20 C ATOM 45 N7 DG A 2 -4.597 -0.716 -3.515 1.00 0.23 N ATOM 46 C5 DG A 2 -4.533 -0.594 -2.142 1.00 0.25 C ATOM 47 C6 DG A 2 -3.419 -0.386 -1.311 1.00 0.29 C ATOM 48 O6 DG A 2 -2.250 -0.252 -1.618 1.00 0.31 O ATOM 49 N1 DG A 2 -3.777 -0.322 0.003 1.00 0.32 N ATOM 50 C2 DG A 2 -5.037 -0.440 0.497 1.00 0.31 C ATOM 51 N2 DG A 2 -5.155 -0.344 1.830 1.00 0.35 N ATOM 52 N3 DG A 2 -6.109 -0.639 -0.276 1.00 0.28 N ATOM 53 C4 DG A 2 -5.775 -0.702 -1.587 1.00 0.24 C ATOM 0 H5' DG A 2 -9.498 -4.397 -3.795 1.00 0.22 H new ATOM 0 H5'' DG A 2 -10.868 -3.646 -4.588 1.00 0.22 H new ATOM 0 H4' DG A 2 -10.564 -2.499 -2.551 1.00 0.21 H new ATOM 0 H3' DG A 2 -10.144 -1.053 -5.031 1.00 0.20 H new ATOM 0 H2' DG A 2 -8.173 0.064 -4.446 1.00 0.21 H new ATOM 0 H2'' DG A 2 -9.110 0.853 -3.193 1.00 0.21 H new ATOM 0 H1' DG A 2 -8.361 -0.535 -1.550 1.00 0.20 H new ATOM 0 H8 DG A 2 -6.258 -1.031 -4.747 1.00 0.20 H new ATOM 0 H1 DG A 2 -3.028 -0.171 0.679 1.00 0.32 H new ATOM 0 H21 DG A 2 -6.073 -0.423 2.268 1.00 0.35 H new ATOM 0 H22 DG A 2 -4.327 -0.192 2.406 1.00 0.35 H new ATOM 65 P DG A 3 -11.671 1.086 -3.862 1.00 0.23 P ATOM 66 OP1 DG A 3 -13.145 1.166 -3.766 1.00 0.28 O ATOM 67 OP2 DG A 3 -10.994 1.427 -5.131 1.00 0.27 O ATOM 68 O5' DG A 3 -11.033 1.994 -2.703 1.00 0.20 O ATOM 69 C5' DG A 3 -11.331 1.738 -1.328 1.00 0.22 C ATOM 70 C4' DG A 3 -10.428 2.548 -0.405 1.00 0.19 C ATOM 71 O4' DG A 3 -9.055 2.184 -0.627 1.00 0.18 O ATOM 72 C3' DG A 3 -10.517 4.072 -0.621 1.00 0.19 C ATOM 73 O3' DG A 3 -10.396 4.762 0.637 1.00 0.24 O ATOM 74 C2' DG A 3 -9.270 4.351 -1.440 1.00 0.18 C ATOM 75 C1' DG A 3 -8.325 3.398 -0.744 1.00 0.15 C ATOM 76 N9 DG A 3 -7.058 3.122 -1.431 1.00 0.16 N ATOM 77 C8 DG A 3 -6.827 2.818 -2.740 1.00 0.18 C ATOM 78 N7 DG A 3 -5.567 2.630 -3.021 1.00 0.21 N ATOM 79 C5 DG A 3 -4.926 2.820 -1.801 1.00 0.19 C ATOM 80 C6 DG A 3 -3.550 2.742 -1.466 1.00 0.20 C ATOM 81 O6 DG A 3 -2.601 2.518 -2.211 1.00 0.26 O ATOM 82 N1 DG A 3 -3.344 2.989 -0.113 1.00 0.18 N ATOM 83 C2 DG A 3 -4.321 3.283 0.788 1.00 0.16 C ATOM 84 N2 DG A 3 -3.921 3.467 2.040 1.00 0.19 N ATOM 85 N3 DG A 3 -5.609 3.367 0.477 1.00 0.16 N ATOM 86 C4 DG A 3 -5.834 3.119 -0.829 1.00 0.16 C ATOM 0 H5' DG A 3 -11.209 0.675 -1.119 1.00 0.22 H new ATOM 0 H5'' DG A 3 -12.374 1.984 -1.128 1.00 0.22 H new ATOM 0 H4' DG A 3 -10.770 2.319 0.604 1.00 0.19 H new ATOM 0 H3' DG A 3 -11.453 4.388 -1.082 1.00 0.19 H new ATOM 0 H2' DG A 3 -9.399 4.122 -2.498 1.00 0.18 H new ATOM 0 H2'' DG A 3 -8.946 5.390 -1.376 1.00 0.18 H new ATOM 0 H1' DG A 3 -8.019 3.856 0.197 1.00 0.15 H new ATOM 0 H8 DG A 3 -7.614 2.740 -3.476 1.00 0.18 H new ATOM 0 H1 DG A 3 -2.385 2.946 0.231 1.00 0.18 H new ATOM 0 H21 DG A 3 -4.602 3.690 2.765 1.00 0.19 H new ATOM 0 H22 DG A 3 -2.932 3.385 2.277 1.00 0.19 H new ATOM 98 P DT A 4 -11.291 4.378 1.922 1.00 0.29 P ATOM 99 OP1 DT A 4 -11.375 2.903 2.028 1.00 0.33 O ATOM 100 OP2 DT A 4 -12.530 5.185 1.882 1.00 0.40 O ATOM 101 O5' DT A 4 -10.381 4.909 3.144 1.00 0.37 O ATOM 102 C5' DT A 4 -10.423 6.276 3.573 1.00 0.48 C ATOM 103 C4' DT A 4 -9.030 6.914 3.605 1.00 0.45 C ATOM 104 O4' DT A 4 -8.211 6.278 4.601 1.00 0.46 O ATOM 105 C3' DT A 4 -8.282 6.826 2.269 1.00 0.37 C ATOM 106 O3' DT A 4 -8.092 8.141 1.732 1.00 0.45 O ATOM 107 C2' DT A 4 -6.924 6.202 2.607 1.00 0.33 C ATOM 108 C1' DT A 4 -7.171 5.523 3.959 1.00 0.36 C ATOM 109 N1 DT A 4 -7.597 4.101 3.845 1.00 0.34 N ATOM 110 C2 DT A 4 -8.665 3.653 4.624 1.00 0.43 C ATOM 111 O2 DT A 4 -9.131 4.301 5.557 1.00 0.51 O ATOM 112 N3 DT A 4 -9.149 2.398 4.324 1.00 0.42 N ATOM 113 C4 DT A 4 -8.682 1.557 3.340 1.00 0.34 C ATOM 114 O4 DT A 4 -9.200 0.460 3.158 1.00 0.40 O ATOM 115 C5 DT A 4 -7.573 2.091 2.587 1.00 0.24 C ATOM 116 C7 DT A 4 -7.085 1.354 1.351 1.00 0.18 C ATOM 117 C6 DT A 4 -7.055 3.302 2.868 1.00 0.24 C ATOM 0 H5' DT A 4 -10.869 6.330 4.566 1.00 0.48 H new ATOM 0 H5'' DT A 4 -11.067 6.846 2.903 1.00 0.48 H new ATOM 0 H4' DT A 4 -9.200 7.966 3.834 1.00 0.45 H new ATOM 0 H3' DT A 4 -8.829 6.241 1.530 1.00 0.37 H new ATOM 0 H2' DT A 4 -6.612 5.484 1.848 1.00 0.33 H new ATOM 0 H2'' DT A 4 -6.140 6.957 2.674 1.00 0.33 H new ATOM 0 H1' DT A 4 -6.238 5.508 4.522 1.00 0.36 H new ATOM 0 H3 DT A 4 -9.930 2.059 4.886 1.00 0.42 H new ATOM 0 H71 DT A 4 -7.265 0.286 1.470 1.00 0.18 H new ATOM 0 H72 DT A 4 -7.622 1.718 0.475 1.00 0.18 H new ATOM 0 H73 DT A 4 -6.017 1.529 1.221 1.00 0.18 H new ATOM 0 H6 DT A 4 -6.196 3.652 2.314 1.00 0.24 H new ATOM 130 P DT A 5 -8.561 8.482 0.226 1.00 0.45 P ATOM 131 OP1 DT A 5 -8.071 9.835 -0.113 1.00 0.56 O ATOM 132 OP2 DT A 5 -10.004 8.168 0.108 1.00 0.50 O ATOM 133 O5' DT A 5 -7.743 7.401 -0.648 1.00 0.41 O ATOM 134 C5' DT A 5 -7.259 7.715 -1.961 1.00 0.45 C ATOM 135 C4' DT A 5 -5.770 8.050 -1.939 1.00 0.40 C ATOM 136 O4' DT A 5 -5.565 9.245 -1.190 1.00 0.40 O ATOM 137 C3' DT A 5 -4.913 6.973 -1.276 1.00 0.36 C ATOM 138 O3' DT A 5 -4.359 6.090 -2.272 1.00 0.42 O ATOM 139 C2' DT A 5 -3.798 7.747 -0.566 1.00 0.36 C ATOM 140 C1' DT A 5 -4.264 9.206 -0.599 1.00 0.39 C ATOM 141 N1 DT A 5 -4.362 9.804 0.744 1.00 0.43 N ATOM 142 C2 DT A 5 -3.696 10.992 0.983 1.00 0.61 C ATOM 143 O2 DT A 5 -3.071 11.586 0.108 1.00 0.72 O ATOM 144 N3 DT A 5 -3.770 11.473 2.275 1.00 0.71 N ATOM 145 C4 DT A 5 -4.440 10.881 3.331 1.00 0.64 C ATOM 146 O4 DT A 5 -4.433 11.399 4.445 1.00 0.76 O ATOM 147 C5 DT A 5 -5.107 9.644 2.983 1.00 0.48 C ATOM 148 C7 DT A 5 -5.851 8.842 4.053 1.00 0.48 C ATOM 149 C6 DT A 5 -5.050 9.162 1.729 1.00 0.39 C ATOM 0 H5' DT A 5 -7.818 8.560 -2.364 1.00 0.45 H new ATOM 0 H5'' DT A 5 -7.434 6.870 -2.627 1.00 0.45 H new ATOM 0 H4' DT A 5 -5.471 8.145 -2.983 1.00 0.40 H new ATOM 0 H3' DT A 5 -5.486 6.351 -0.588 1.00 0.36 H new ATOM 0 H2' DT A 5 -3.661 7.397 0.457 1.00 0.36 H new ATOM 0 H2'' DT A 5 -2.842 7.624 -1.076 1.00 0.36 H new ATOM 0 H1' DT A 5 -3.528 9.774 -1.168 1.00 0.39 H new ATOM 0 H3 DT A 5 -3.284 12.349 2.470 1.00 0.71 H new ATOM 0 H71 DT A 5 -6.680 8.304 3.594 1.00 0.48 H new ATOM 0 H72 DT A 5 -5.167 8.129 4.514 1.00 0.48 H new ATOM 0 H73 DT A 5 -6.236 9.521 4.814 1.00 0.48 H new ATOM 0 H6 DT A 5 -5.564 8.241 1.496 1.00 0.39 H new ATOM 162 P DT A 6 -3.393 6.605 -3.462 1.00 0.46 P ATOM 163 OP1 DT A 6 -3.067 8.033 -3.244 1.00 0.48 O ATOM 164 OP2 DT A 6 -3.993 6.183 -4.748 1.00 0.73 O ATOM 165 O5' DT A 6 -2.049 5.732 -3.233 1.00 0.48 O ATOM 166 C5' DT A 6 -1.334 5.760 -1.987 1.00 0.50 C ATOM 167 C4' DT A 6 -0.261 6.866 -1.951 1.00 0.37 C ATOM 168 O4' DT A 6 -0.436 7.662 -0.768 1.00 0.57 O ATOM 169 C3' DT A 6 1.183 6.357 -1.923 1.00 0.38 C ATOM 170 O3' DT A 6 2.060 7.297 -2.577 1.00 0.37 O ATOM 171 C2' DT A 6 1.495 6.283 -0.431 1.00 0.41 C ATOM 172 C1' DT A 6 0.633 7.397 0.161 1.00 0.44 C ATOM 173 N1 DT A 6 0.023 7.089 1.482 1.00 0.34 N ATOM 174 C2 DT A 6 0.847 7.145 2.595 1.00 0.35 C ATOM 175 O2 DT A 6 2.055 7.332 2.508 1.00 0.48 O ATOM 176 N3 DT A 6 0.229 6.969 3.819 1.00 0.32 N ATOM 177 C4 DT A 6 -1.114 6.748 4.029 1.00 0.28 C ATOM 178 O4 DT A 6 -1.563 6.645 5.168 1.00 0.33 O ATOM 179 C5 DT A 6 -1.894 6.693 2.819 1.00 0.32 C ATOM 180 C7 DT A 6 -3.396 6.450 2.916 1.00 0.43 C ATOM 181 C6 DT A 6 -1.319 6.857 1.609 1.00 0.35 C ATOM 0 H5' DT A 6 -0.860 4.792 -1.821 1.00 0.50 H new ATOM 0 H5'' DT A 6 -2.039 5.914 -1.170 1.00 0.50 H new ATOM 0 H4' DT A 6 -0.402 7.426 -2.875 1.00 0.37 H new ATOM 0 H3' DT A 6 1.316 5.405 -2.438 1.00 0.38 H new ATOM 0 H2' DT A 6 1.238 5.310 -0.014 1.00 0.41 H new ATOM 0 H2'' DT A 6 2.554 6.445 -0.233 1.00 0.41 H new ATOM 0 H1' DT A 6 1.297 8.246 0.324 1.00 0.44 H new ATOM 0 H3 DT A 6 0.825 7.006 4.646 1.00 0.32 H new ATOM 0 H71 DT A 6 -3.611 5.845 3.797 1.00 0.43 H new ATOM 0 H72 DT A 6 -3.915 7.405 2.996 1.00 0.43 H new ATOM 0 H73 DT A 6 -3.738 5.925 2.024 1.00 0.43 H new ATOM 0 H6 DT A 6 -1.932 6.804 0.721 1.00 0.35 H new ATOM 194 P DT A 7 2.373 7.165 -4.163 1.00 0.37 P ATOM 195 OP1 DT A 7 2.716 8.505 -4.682 1.00 0.41 O ATOM 196 OP2 DT A 7 1.254 6.417 -4.780 1.00 0.45 O ATOM 197 O5' DT A 7 3.691 6.221 -4.224 1.00 0.34 O ATOM 198 C5' DT A 7 4.964 6.602 -3.664 1.00 0.31 C ATOM 199 C4' DT A 7 5.741 7.581 -4.563 1.00 0.34 C ATOM 200 O4' DT A 7 5.146 8.881 -4.536 1.00 0.36 O ATOM 201 C3' DT A 7 7.182 7.791 -4.143 1.00 0.39 C ATOM 202 O3' DT A 7 7.958 8.212 -5.274 1.00 0.44 O ATOM 203 C2' DT A 7 7.086 8.926 -3.138 1.00 0.44 C ATOM 204 C1' DT A 7 5.924 9.749 -3.683 1.00 0.41 C ATOM 205 N1 DT A 7 5.011 10.272 -2.645 1.00 0.43 N ATOM 206 C2 DT A 7 5.547 10.991 -1.589 1.00 0.58 C ATOM 207 O2 DT A 7 6.741 11.265 -1.513 1.00 0.71 O ATOM 208 N3 DT A 7 4.648 11.400 -0.622 1.00 0.62 N ATOM 209 C4 DT A 7 3.286 11.159 -0.619 1.00 0.52 C ATOM 210 O4 DT A 7 2.580 11.574 0.297 1.00 0.59 O ATOM 211 C5 DT A 7 2.822 10.405 -1.764 1.00 0.38 C ATOM 212 C7 DT A 7 1.349 10.021 -1.878 1.00 0.34 C ATOM 213 C6 DT A 7 3.681 10.004 -2.718 1.00 0.36 C ATOM 0 H5' DT A 7 5.567 5.708 -3.502 1.00 0.31 H new ATOM 0 H5'' DT A 7 4.804 7.060 -2.688 1.00 0.31 H new ATOM 0 H4' DT A 7 5.707 7.119 -5.550 1.00 0.34 H new ATOM 0 H3' DT A 7 7.653 6.894 -3.741 1.00 0.39 H new ATOM 0 H2' DT A 7 6.888 8.561 -2.130 1.00 0.44 H new ATOM 0 H2'' DT A 7 8.008 9.506 -3.091 1.00 0.44 H new ATOM 0 H1' DT A 7 6.355 10.609 -4.196 1.00 0.41 H new ATOM 0 H3 DT A 7 5.025 11.930 0.164 1.00 0.62 H new ATOM 0 H71 DT A 7 0.927 9.897 -0.881 1.00 0.34 H new ATOM 0 H72 DT A 7 0.808 10.806 -2.406 1.00 0.34 H new ATOM 0 H73 DT A 7 1.259 9.085 -2.429 1.00 0.34 H new ATOM 0 H6 DT A 7 3.303 9.453 -3.566 1.00 0.36 H new ATOM 226 P DG A 8 8.474 7.163 -6.387 1.00 0.41 P ATOM 227 OP1 DG A 8 9.686 6.496 -5.865 1.00 0.45 O ATOM 228 OP2 DG A 8 8.528 7.869 -7.688 1.00 0.54 O ATOM 229 O5' DG A 8 7.286 6.074 -6.461 1.00 0.39 O ATOM 230 C5' DG A 8 7.582 4.671 -6.512 1.00 0.36 C ATOM 231 C4' DG A 8 8.142 4.170 -5.177 1.00 0.28 C ATOM 232 O4' DG A 8 7.231 4.517 -4.129 1.00 0.25 O ATOM 233 C3' DG A 8 8.366 2.645 -5.091 1.00 0.30 C ATOM 234 O3' DG A 8 9.688 2.358 -4.569 1.00 0.37 O ATOM 235 C2' DG A 8 7.301 2.171 -4.107 1.00 0.24 C ATOM 236 C1' DG A 8 7.131 3.406 -3.253 1.00 0.19 C ATOM 237 N9 DG A 8 5.873 3.507 -2.529 1.00 0.16 N ATOM 238 C8 DG A 8 5.708 3.714 -1.195 1.00 0.16 C ATOM 239 N7 DG A 8 4.465 3.712 -0.808 1.00 0.15 N ATOM 240 C5 DG A 8 3.761 3.491 -1.989 1.00 0.14 C ATOM 241 C6 DG A 8 2.371 3.387 -2.207 1.00 0.15 C ATOM 242 O6 DG A 8 1.469 3.425 -1.385 1.00 0.18 O ATOM 243 N1 DG A 8 2.083 3.179 -3.537 1.00 0.16 N ATOM 244 C2 DG A 8 3.007 3.074 -4.546 1.00 0.17 C ATOM 245 N2 DG A 8 2.529 2.894 -5.774 1.00 0.18 N ATOM 246 N3 DG A 8 4.319 3.158 -4.350 1.00 0.17 N ATOM 247 C4 DG A 8 4.621 3.369 -3.049 1.00 0.15 C ATOM 0 H5' DG A 8 8.303 4.478 -7.306 1.00 0.36 H new ATOM 0 H5'' DG A 8 6.678 4.115 -6.761 1.00 0.36 H new ATOM 0 H4' DG A 8 9.118 4.646 -5.082 1.00 0.28 H new ATOM 0 H3' DG A 8 8.296 2.155 -6.062 1.00 0.30 H new ATOM 0 H2' DG A 8 6.376 1.884 -4.607 1.00 0.24 H new ATOM 0 H2'' DG A 8 7.630 1.309 -3.526 1.00 0.24 H new ATOM 0 H1' DG A 8 7.899 3.366 -2.481 1.00 0.19 H new ATOM 0 H8 DG A 8 6.535 3.866 -0.517 1.00 0.16 H new ATOM 0 H1 DG A 8 1.099 3.096 -3.794 1.00 0.16 H new ATOM 0 H21 DG A 8 3.170 2.809 -6.563 1.00 0.18 H new ATOM 0 H22 DG A 8 1.522 2.841 -5.926 1.00 0.18 H new ATOM 259 P DG A 9 10.325 3.122 -3.284 1.00 0.38 P ATOM 260 OP1 DG A 9 10.097 4.576 -3.440 1.00 0.42 O ATOM 261 OP2 DG A 9 11.705 2.617 -3.089 1.00 0.55 O ATOM 262 O5' DG A 9 9.417 2.598 -2.044 1.00 0.30 O ATOM 263 C5' DG A 9 9.403 3.317 -0.798 1.00 0.28 C ATOM 264 C4' DG A 9 8.889 2.471 0.376 1.00 0.24 C ATOM 265 O4' DG A 9 7.468 2.552 0.520 1.00 0.20 O ATOM 266 C3' DG A 9 9.194 0.969 0.282 1.00 0.27 C ATOM 267 O3' DG A 9 10.392 0.634 1.028 1.00 0.40 O ATOM 268 C2' DG A 9 7.953 0.303 0.915 1.00 0.25 C ATOM 269 C1' DG A 9 7.162 1.498 1.422 1.00 0.20 C ATOM 270 N9 DG A 9 5.688 1.304 1.538 1.00 0.19 N ATOM 271 C8 DG A 9 4.950 1.338 2.692 1.00 0.19 C ATOM 272 N7 DG A 9 3.673 1.132 2.524 1.00 0.19 N ATOM 273 C5 DG A 9 3.542 0.941 1.149 1.00 0.17 C ATOM 274 C6 DG A 9 2.370 0.675 0.377 1.00 0.18 C ATOM 275 O6 DG A 9 1.212 0.555 0.774 1.00 0.20 O ATOM 276 N1 DG A 9 2.663 0.549 -0.974 1.00 0.17 N ATOM 277 C2 DG A 9 3.925 0.661 -1.515 1.00 0.17 C ATOM 278 N2 DG A 9 4.015 0.499 -2.833 1.00 0.18 N ATOM 279 N3 DG A 9 5.032 0.912 -0.796 1.00 0.17 N ATOM 280 C4 DG A 9 4.769 1.042 0.528 1.00 0.17 C ATOM 0 H5' DG A 9 8.776 4.203 -0.903 1.00 0.28 H new ATOM 0 H5'' DG A 9 10.411 3.665 -0.574 1.00 0.28 H new ATOM 0 H4' DG A 9 9.425 2.903 1.221 1.00 0.24 H new ATOM 0 H3' DG A 9 9.377 0.641 -0.741 1.00 0.27 H new ATOM 0 H2' DG A 9 7.388 -0.278 0.186 1.00 0.25 H new ATOM 0 H2'' DG A 9 8.225 -0.376 1.723 1.00 0.25 H new ATOM 0 H1' DG A 9 7.454 1.700 2.453 1.00 0.20 H new ATOM 0 H8 DG A 9 5.390 1.520 3.661 1.00 0.19 H new ATOM 0 H1 DG A 9 1.889 0.360 -1.611 1.00 0.17 H new ATOM 0 H21 DG A 9 4.922 0.570 -3.295 1.00 0.18 H new ATOM 0 H22 DG A 9 3.177 0.304 -3.381 1.00 0.18 H new ATOM 292 P DG A 10 10.725 1.234 2.499 1.00 0.49 P ATOM 293 OP1 DG A 10 10.794 2.710 2.403 1.00 0.56 O ATOM 294 OP2 DG A 10 11.879 0.481 3.050 1.00 0.65 O ATOM 295 O5' DG A 10 9.414 0.845 3.353 1.00 0.40 O ATOM 296 C5' DG A 10 9.348 -0.391 4.069 1.00 0.36 C ATOM 297 C4' DG A 10 8.152 -0.421 5.012 1.00 0.28 C ATOM 298 O4' DG A 10 6.943 -0.338 4.255 1.00 0.28 O ATOM 299 C3' DG A 10 8.074 -1.683 5.873 1.00 0.26 C ATOM 300 O3' DG A 10 7.809 -1.308 7.229 1.00 0.33 O ATOM 301 C2' DG A 10 6.894 -2.458 5.300 1.00 0.27 C ATOM 302 C1' DG A 10 6.044 -1.356 4.691 1.00 0.25 C ATOM 303 N9 DG A 10 5.259 -1.763 3.516 1.00 0.23 N ATOM 304 C8 DG A 10 5.688 -1.919 2.229 1.00 0.23 C ATOM 305 N7 DG A 10 4.744 -2.209 1.385 1.00 0.23 N ATOM 306 C5 DG A 10 3.601 -2.251 2.170 1.00 0.24 C ATOM 307 C6 DG A 10 2.263 -2.520 1.800 1.00 0.27 C ATOM 308 O6 DG A 10 1.818 -2.751 0.687 1.00 0.30 O ATOM 309 N1 DG A 10 1.416 -2.470 2.888 1.00 0.30 N ATOM 310 C2 DG A 10 1.804 -2.196 4.176 1.00 0.31 C ATOM 311 N2 DG A 10 0.843 -2.183 5.084 1.00 0.36 N ATOM 312 N3 DG A 10 3.061 -1.940 4.534 1.00 0.28 N ATOM 313 C4 DG A 10 3.905 -1.984 3.480 1.00 0.24 C ATOM 0 H5' DG A 10 10.266 -0.533 4.638 1.00 0.36 H new ATOM 0 H5'' DG A 10 9.279 -1.219 3.364 1.00 0.36 H new ATOM 0 H4' DG A 10 8.280 0.431 5.680 1.00 0.28 H new ATOM 0 H3' DG A 10 8.994 -2.268 5.865 1.00 0.26 H new ATOM 0 H2' DG A 10 7.211 -3.186 4.553 1.00 0.27 H new ATOM 0 H2'' DG A 10 6.355 -3.007 6.072 1.00 0.27 H new ATOM 0 H1' DG A 10 5.332 -1.043 5.455 1.00 0.25 H new ATOM 0 H8 DG A 10 6.722 -1.811 1.938 1.00 0.23 H new ATOM 0 H1 DG A 10 0.426 -2.650 2.723 1.00 0.30 H new ATOM 0 H21 DG A 10 1.066 -1.986 6.060 1.00 0.36 H new ATOM 0 H22 DG A 10 -0.121 -2.370 4.809 1.00 0.36 H new ATOM 325 P DT A 11 8.904 -0.471 8.068 1.00 0.38 P ATOM 326 OP1 DT A 11 10.256 -0.874 7.612 1.00 0.43 O ATOM 327 OP2 DT A 11 8.551 -0.565 9.498 1.00 0.49 O ATOM 328 O5' DT A 11 8.641 1.046 7.595 1.00 0.39 O ATOM 329 C5' DT A 11 7.884 1.941 8.421 1.00 0.39 C ATOM 330 C4' DT A 11 7.831 3.350 7.835 1.00 0.33 C ATOM 331 O4' DT A 11 9.167 3.808 7.577 1.00 0.40 O ATOM 332 C3' DT A 11 7.052 3.451 6.523 1.00 0.26 C ATOM 333 O3' DT A 11 6.321 4.685 6.500 1.00 0.28 O ATOM 334 C2' DT A 11 8.142 3.469 5.463 1.00 0.34 C ATOM 335 C1' DT A 11 9.273 4.188 6.202 1.00 0.39 C ATOM 336 N1 DT A 11 10.622 3.809 5.739 1.00 0.48 N ATOM 337 C2 DT A 11 11.328 4.736 4.993 1.00 0.59 C ATOM 338 O2 DT A 11 10.877 5.847 4.728 1.00 0.65 O ATOM 339 N3 DT A 11 12.580 4.343 4.568 1.00 0.68 N ATOM 340 C4 DT A 11 13.182 3.126 4.819 1.00 0.68 C ATOM 341 O4 DT A 11 14.308 2.888 4.394 1.00 0.79 O ATOM 342 C5 DT A 11 12.374 2.221 5.607 1.00 0.61 C ATOM 343 C7 DT A 11 12.918 0.838 5.960 1.00 0.71 C ATOM 344 C6 DT A 11 11.148 2.579 6.033 1.00 0.52 C ATOM 0 H5' DT A 11 8.327 1.978 9.416 1.00 0.39 H new ATOM 0 H5'' DT A 11 6.870 1.558 8.537 1.00 0.39 H new ATOM 0 H4' DT A 11 7.314 3.960 8.576 1.00 0.33 H new ATOM 0 H3' DT A 11 6.334 2.644 6.378 1.00 0.26 H new ATOM 0 H2' DT A 11 8.429 2.464 5.152 1.00 0.34 H new ATOM 0 H2'' DT A 11 7.833 4.005 4.565 1.00 0.34 H new ATOM 0 H1' DT A 11 9.164 5.258 6.025 1.00 0.39 H new ATOM 0 H3 DT A 11 13.112 5.016 4.016 1.00 0.68 H new ATOM 0 H71 DT A 11 13.593 0.501 5.173 1.00 0.71 H new ATOM 0 H72 DT A 11 13.459 0.890 6.905 1.00 0.71 H new ATOM 0 H73 DT A 11 12.091 0.135 6.054 1.00 0.71 H new ATOM 0 H6 DT A 11 10.567 1.882 6.619 1.00 0.52 H new ATOM 357 P DG A 12 5.233 4.982 5.352 1.00 0.30 P ATOM 358 OP1 DG A 12 4.385 3.782 5.196 1.00 0.33 O ATOM 359 OP2 DG A 12 5.948 5.530 4.177 1.00 0.44 O ATOM 360 O5' DG A 12 4.354 6.167 6.017 1.00 0.29 O ATOM 361 C5' DG A 12 2.954 6.320 5.731 1.00 0.27 C ATOM 362 C4' DG A 12 2.077 5.867 6.887 1.00 0.23 C ATOM 363 O4' DG A 12 0.781 5.636 6.406 1.00 0.19 O ATOM 364 C3' DG A 12 2.528 4.583 7.567 1.00 0.21 C ATOM 365 O3' DG A 12 2.034 4.571 8.916 1.00 0.29 O ATOM 366 C2' DG A 12 1.835 3.527 6.729 1.00 0.18 C ATOM 367 C1' DG A 12 0.543 4.244 6.383 1.00 0.16 C ATOM 368 N9 DG A 12 -0.004 3.992 5.072 1.00 0.13 N ATOM 369 C8 DG A 12 -1.299 3.928 4.781 1.00 0.13 C ATOM 370 N7 DG A 12 -1.564 3.763 3.514 1.00 0.12 N ATOM 371 C5 DG A 12 -0.302 3.730 2.929 1.00 0.11 C ATOM 372 C6 DG A 12 0.072 3.585 1.571 1.00 0.12 C ATOM 373 O6 DG A 12 -0.647 3.417 0.596 1.00 0.14 O ATOM 374 N1 DG A 12 1.442 3.626 1.421 1.00 0.11 N ATOM 375 C2 DG A 12 2.346 3.775 2.442 1.00 0.12 C ATOM 376 N2 DG A 12 3.617 3.810 2.094 1.00 0.15 N ATOM 377 N3 DG A 12 2.003 3.903 3.719 1.00 0.12 N ATOM 378 C4 DG A 12 0.665 3.873 3.886 1.00 0.11 C ATOM 0 H5' DG A 12 2.702 5.745 4.840 1.00 0.27 H new ATOM 0 H5'' DG A 12 2.743 7.365 5.506 1.00 0.27 H new ATOM 0 H4' DG A 12 2.135 6.666 7.626 1.00 0.23 H new ATOM 0 H3' DG A 12 3.608 4.446 7.627 1.00 0.21 H new ATOM 0 H2' DG A 12 2.410 3.260 5.842 1.00 0.18 H new ATOM 0 H2'' DG A 12 1.661 2.606 7.285 1.00 0.18 H new ATOM 0 H1' DG A 12 -0.167 3.869 7.120 1.00 0.16 H new ATOM 0 H8 DG A 12 -2.070 4.006 5.533 1.00 0.13 H new ATOM 0 H1 DG A 12 1.813 3.539 0.475 1.00 0.11 H new ATOM 0 H21 DG A 12 4.338 3.919 2.807 1.00 0.15 H new ATOM 0 H22 DG A 12 3.879 3.728 1.112 1.00 0.15 H new ATOM 390 P DG A 13 2.092 3.239 9.823 1.00 0.36 P ATOM 391 OP1 DG A 13 2.011 3.643 11.245 1.00 0.49 O ATOM 392 OP2 DG A 13 3.230 2.408 9.360 1.00 0.41 O ATOM 393 O5' DG A 13 0.713 2.490 9.428 1.00 0.33 O ATOM 394 C5' DG A 13 -0.551 3.046 9.824 1.00 0.26 C ATOM 395 C4' DG A 13 -1.730 2.115 9.517 1.00 0.19 C ATOM 396 O4' DG A 13 -2.069 2.158 8.128 1.00 0.22 O ATOM 397 C3' DG A 13 -1.490 0.635 9.858 1.00 0.21 C ATOM 398 O3' DG A 13 -2.284 0.275 11.002 1.00 0.26 O ATOM 399 C2' DG A 13 -1.992 -0.121 8.619 1.00 0.23 C ATOM 400 C1' DG A 13 -2.766 0.950 7.869 1.00 0.18 C ATOM 401 N9 DG A 13 -2.873 0.755 6.400 1.00 0.19 N ATOM 402 C8 DG A 13 -4.009 0.540 5.652 1.00 0.20 C ATOM 403 N7 DG A 13 -3.801 0.444 4.377 1.00 0.18 N ATOM 404 C5 DG A 13 -2.434 0.610 4.257 1.00 0.16 C ATOM 405 C6 DG A 13 -1.646 0.612 3.099 1.00 0.15 C ATOM 406 O6 DG A 13 -1.991 0.480 1.958 1.00 0.18 O ATOM 407 N1 DG A 13 -0.336 0.810 3.364 1.00 0.14 N ATOM 408 C2 DG A 13 0.206 0.985 4.612 1.00 0.15 C ATOM 409 N2 DG A 13 1.523 1.173 4.658 1.00 0.18 N ATOM 410 N3 DG A 13 -0.526 0.987 5.738 1.00 0.17 N ATOM 411 C4 DG A 13 -1.845 0.796 5.480 1.00 0.16 C ATOM 0 H5' DG A 13 -0.701 3.997 9.312 1.00 0.26 H new ATOM 0 H5'' DG A 13 -0.531 3.259 10.893 1.00 0.26 H new ATOM 0 H4' DG A 13 -2.529 2.493 10.155 1.00 0.19 H new ATOM 0 H3' DG A 13 -0.449 0.414 10.093 1.00 0.21 H new ATOM 0 H2' DG A 13 -1.169 -0.517 8.025 1.00 0.23 H new ATOM 0 H2'' DG A 13 -2.626 -0.966 8.889 1.00 0.23 H new ATOM 0 H1' DG A 13 -3.799 0.933 8.217 1.00 0.18 H new ATOM 0 H8 DG A 13 -4.992 0.458 6.092 1.00 0.20 H new ATOM 0 H1 DG A 13 0.303 0.831 2.570 1.00 0.14 H new ATOM 0 H21 DG A 13 1.988 1.309 5.556 1.00 0.18 H new ATOM 0 H22 DG A 13 2.067 1.181 3.795 1.00 0.18 H new ATOM 423 P DG A 14 -2.013 -1.096 11.807 1.00 0.32 P ATOM 424 OP1 DG A 14 -2.576 -0.951 13.169 1.00 0.43 O ATOM 425 OP2 DG A 14 -0.589 -1.465 11.633 1.00 0.41 O ATOM 426 O5' DG A 14 -2.908 -2.159 11.005 1.00 0.31 O ATOM 427 C5' DG A 14 -4.313 -2.253 11.248 1.00 0.30 C ATOM 428 C4' DG A 14 -4.999 -3.053 10.154 1.00 0.28 C ATOM 429 O4' DG A 14 -4.809 -2.391 8.910 1.00 0.27 O ATOM 430 C3' DG A 14 -4.440 -4.462 9.991 1.00 0.30 C ATOM 431 O3' DG A 14 -5.248 -5.386 10.728 1.00 0.37 O ATOM 432 C2' DG A 14 -4.549 -4.749 8.493 1.00 0.30 C ATOM 433 C1' DG A 14 -4.792 -3.360 7.865 1.00 0.27 C ATOM 434 N9 DG A 14 -3.732 -2.977 6.923 1.00 0.23 N ATOM 435 C8 DG A 14 -2.425 -2.669 7.181 1.00 0.22 C ATOM 436 N7 DG A 14 -1.721 -2.430 6.123 1.00 0.20 N ATOM 437 C5 DG A 14 -2.621 -2.593 5.084 1.00 0.19 C ATOM 438 C6 DG A 14 -2.420 -2.469 3.694 1.00 0.17 C ATOM 439 O6 DG A 14 -1.390 -2.172 3.105 1.00 0.18 O ATOM 440 N1 DG A 14 -3.581 -2.728 2.990 1.00 0.18 N ATOM 441 C2 DG A 14 -4.789 -3.054 3.560 1.00 0.21 C ATOM 442 N2 DG A 14 -5.796 -3.265 2.723 1.00 0.23 N ATOM 443 N3 DG A 14 -4.983 -3.166 4.871 1.00 0.22 N ATOM 444 C4 DG A 14 -3.855 -2.925 5.567 1.00 0.20 C ATOM 0 H5' DG A 14 -4.745 -1.254 11.299 1.00 0.30 H new ATOM 0 H5'' DG A 14 -4.488 -2.726 12.214 1.00 0.30 H new ATOM 0 H4' DG A 14 -6.048 -3.128 10.442 1.00 0.28 H new ATOM 0 H3' DG A 14 -3.417 -4.555 10.356 1.00 0.30 H new ATOM 0 H2' DG A 14 -3.639 -5.208 8.107 1.00 0.30 H new ATOM 0 H2'' DG A 14 -5.368 -5.434 8.276 1.00 0.30 H new ATOM 0 H1' DG A 14 -5.736 -3.404 7.322 1.00 0.27 H new ATOM 0 H8 DG A 14 -2.017 -2.629 8.180 1.00 0.22 H new ATOM 0 H1 DG A 14 -3.538 -2.673 1.972 1.00 0.18 H new ATOM 0 H21 DG A 14 -6.717 -3.510 3.085 1.00 0.23 H new ATOM 0 H22 DG A 14 -5.649 -3.182 1.717 1.00 0.23 H new ATOM 456 P DT A 15 -4.826 -6.939 10.809 1.00 0.41 P ATOM 457 OP1 DT A 15 -5.644 -7.592 11.856 1.00 0.52 O ATOM 458 OP2 DT A 15 -3.349 -7.019 10.868 1.00 0.43 O ATOM 459 O5' DT A 15 -5.312 -7.495 9.380 1.00 0.38 O ATOM 460 C5' DT A 15 -4.567 -8.492 8.670 1.00 0.35 C ATOM 461 C4' DT A 15 -4.901 -8.455 7.182 1.00 0.32 C ATOM 462 O4' DT A 15 -4.471 -7.224 6.621 1.00 0.32 O ATOM 463 C3' DT A 15 -4.204 -9.511 6.337 1.00 0.30 C ATOM 464 O3' DT A 15 -4.963 -10.731 6.296 1.00 0.34 O ATOM 465 C2' DT A 15 -4.209 -8.883 4.943 1.00 0.27 C ATOM 466 C1' DT A 15 -4.485 -7.413 5.210 1.00 0.28 C ATOM 467 N1 DT A 15 -3.500 -6.535 4.568 1.00 0.25 N ATOM 468 C2 DT A 15 -3.860 -5.989 3.361 1.00 0.27 C ATOM 469 O2 DT A 15 -4.996 -6.103 2.907 1.00 0.32 O ATOM 470 N3 DT A 15 -2.884 -5.283 2.696 1.00 0.26 N ATOM 471 C4 DT A 15 -1.598 -5.069 3.133 1.00 0.24 C ATOM 472 O4 DT A 15 -0.791 -4.465 2.431 1.00 0.27 O ATOM 473 C5 DT A 15 -1.312 -5.652 4.417 1.00 0.22 C ATOM 474 C7 DT A 15 0.044 -5.392 5.047 1.00 0.23 C ATOM 475 C6 DT A 15 -2.249 -6.364 5.087 1.00 0.24 C ATOM 0 H5' DT A 15 -4.793 -9.479 9.074 1.00 0.35 H new ATOM 0 H5'' DT A 15 -3.499 -8.326 8.813 1.00 0.35 H new ATOM 0 H4' DT A 15 -5.978 -8.619 7.155 1.00 0.32 H new ATOM 0 H3' DT A 15 -3.216 -9.767 6.721 1.00 0.30 H new ATOM 0 H2' DT A 15 -3.254 -9.025 4.436 1.00 0.27 H new ATOM 0 H2'' DT A 15 -4.976 -9.325 4.307 1.00 0.27 H new ATOM 0 H1' DT A 15 -5.453 -7.148 4.786 1.00 0.28 H new ATOM 0 H3 DT A 15 -3.138 -4.881 1.794 1.00 0.26 H new ATOM 0 H71 DT A 15 0.789 -5.254 4.263 1.00 0.23 H new ATOM 0 H72 DT A 15 -0.007 -4.493 5.662 1.00 0.23 H new ATOM 0 H73 DT A 15 0.325 -6.242 5.669 1.00 0.23 H new ATOM 0 H6 DT A 15 -2.004 -6.802 6.043 1.00 0.24 H new ATOM 488 P DT A 16 -4.452 -12.031 5.459 1.00 0.36 P ATOM 489 OP1 DT A 16 -5.620 -12.606 4.756 1.00 0.47 O ATOM 490 OP2 DT A 16 -3.663 -12.882 6.376 1.00 0.52 O ATOM 491 O5' DT A 16 -3.431 -11.436 4.340 1.00 0.28 O ATOM 492 C5' DT A 16 -3.834 -11.169 2.974 1.00 0.23 C ATOM 493 C4' DT A 16 -2.630 -10.798 2.096 1.00 0.23 C ATOM 494 O4' DT A 16 -1.750 -9.930 2.819 1.00 0.26 O ATOM 495 C3' DT A 16 -1.797 -11.988 1.604 1.00 0.24 C ATOM 496 O3' DT A 16 -1.458 -11.756 0.233 1.00 0.26 O ATOM 497 C2' DT A 16 -0.519 -11.931 2.458 1.00 0.30 C ATOM 498 C1' DT A 16 -0.414 -10.446 2.771 1.00 0.30 C ATOM 499 N1 DT A 16 0.212 -10.139 4.068 1.00 0.35 N ATOM 500 C2 DT A 16 1.333 -9.330 4.068 1.00 0.43 C ATOM 501 O2 DT A 16 1.833 -8.893 3.035 1.00 0.48 O ATOM 502 N3 DT A 16 1.856 -9.027 5.307 1.00 0.49 N ATOM 503 C4 DT A 16 1.364 -9.452 6.527 1.00 0.48 C ATOM 504 O4 DT A 16 1.901 -9.100 7.574 1.00 0.56 O ATOM 505 C5 DT A 16 0.194 -10.292 6.429 1.00 0.39 C ATOM 506 C7 DT A 16 -0.473 -10.806 7.700 1.00 0.40 C ATOM 507 C6 DT A 16 -0.333 -10.608 5.231 1.00 0.33 C ATOM 0 H5' DT A 16 -4.560 -10.357 2.960 1.00 0.23 H new ATOM 0 H5'' DT A 16 -4.330 -12.047 2.561 1.00 0.23 H new ATOM 0 H4' DT A 16 -3.064 -10.320 1.218 1.00 0.23 H new ATOM 0 H3' DT A 16 -2.312 -12.945 1.684 1.00 0.24 H new ATOM 0 H2' DT A 16 -0.605 -12.533 3.362 1.00 0.30 H new ATOM 0 H2'' DT A 16 0.352 -12.296 1.914 1.00 0.30 H new ATOM 0 H1' DT A 16 0.214 -10.002 1.999 1.00 0.30 H new ATOM 0 H3 DT A 16 2.685 -8.433 5.325 1.00 0.49 H new ATOM 0 H71 DT A 16 0.276 -10.920 8.483 1.00 0.40 H new ATOM 0 H72 DT A 16 -1.233 -10.095 8.025 1.00 0.40 H new ATOM 0 H73 DT A 16 -0.940 -11.771 7.501 1.00 0.40 H new ATOM 0 H6 DT A 16 -1.204 -11.245 5.188 1.00 0.33 H new ATOM 520 P DT A 17 -0.749 -12.885 -0.676 1.00 0.30 P ATOM 521 OP1 DT A 17 -1.775 -13.871 -1.084 1.00 0.36 O ATOM 522 OP2 DT A 17 0.485 -13.342 0.003 1.00 0.39 O ATOM 523 O5' DT A 17 -0.317 -12.037 -1.975 1.00 0.32 O ATOM 524 C5' DT A 17 -1.155 -10.983 -2.458 1.00 0.26 C ATOM 525 C4' DT A 17 -0.498 -10.228 -3.630 1.00 0.27 C ATOM 526 O4' DT A 17 -1.368 -9.189 -4.102 1.00 0.29 O ATOM 527 C3' DT A 17 0.834 -9.572 -3.259 1.00 0.28 C ATOM 528 O3' DT A 17 1.869 -9.934 -4.169 1.00 0.26 O ATOM 529 C2' DT A 17 0.617 -8.067 -3.364 1.00 0.35 C ATOM 530 C1' DT A 17 -0.882 -7.917 -3.650 1.00 0.29 C ATOM 531 N1 DT A 17 -1.669 -7.518 -2.468 1.00 0.22 N ATOM 532 C2 DT A 17 -1.270 -6.376 -1.793 1.00 0.20 C ATOM 533 O2 DT A 17 -0.292 -5.715 -2.127 1.00 0.24 O ATOM 534 N3 DT A 17 -2.042 -6.013 -0.718 1.00 0.18 N ATOM 535 C4 DT A 17 -3.159 -6.671 -0.262 1.00 0.17 C ATOM 536 O4 DT A 17 -3.804 -6.216 0.666 1.00 0.20 O ATOM 537 C5 DT A 17 -3.501 -7.854 -1.009 1.00 0.19 C ATOM 538 C7 DT A 17 -4.689 -8.700 -0.552 1.00 0.21 C ATOM 539 C6 DT A 17 -2.765 -8.235 -2.074 1.00 0.21 C ATOM 0 H5' DT A 17 -1.366 -10.285 -1.648 1.00 0.26 H new ATOM 0 H5'' DT A 17 -2.111 -11.396 -2.781 1.00 0.26 H new ATOM 0 H4' DT A 17 -0.314 -10.981 -4.396 1.00 0.27 H new ATOM 0 H3' DT A 17 1.135 -9.892 -2.261 1.00 0.28 H new ATOM 0 H2' DT A 17 0.898 -7.560 -2.441 1.00 0.35 H new ATOM 0 H2'' DT A 17 1.219 -7.633 -4.162 1.00 0.35 H new ATOM 0 H1' DT A 17 -0.998 -7.128 -4.393 1.00 0.29 H new ATOM 0 H3 DT A 17 -1.760 -5.175 -0.209 1.00 0.18 H new ATOM 0 H71 DT A 17 -4.800 -8.617 0.529 1.00 0.21 H new ATOM 0 H72 DT A 17 -5.597 -8.345 -1.039 1.00 0.21 H new ATOM 0 H73 DT A 17 -4.518 -9.743 -0.820 1.00 0.21 H new ATOM 0 H6 DT A 17 -3.046 -9.121 -2.624 1.00 0.21 H new ATOM 552 P DT A 18 3.401 -9.856 -3.666 1.00 0.30 P ATOM 553 OP1 DT A 18 4.279 -10.153 -4.811 1.00 0.34 O ATOM 554 OP2 DT A 18 3.508 -10.693 -2.450 1.00 0.38 O ATOM 555 O5' DT A 18 3.583 -8.298 -3.195 1.00 0.31 O ATOM 556 C5' DT A 18 3.804 -7.163 -4.079 1.00 0.25 C ATOM 557 C4' DT A 18 5.055 -7.310 -4.949 1.00 0.29 C ATOM 558 O4' DT A 18 4.837 -8.271 -5.985 1.00 0.33 O ATOM 559 C3' DT A 18 5.459 -6.031 -5.648 1.00 0.28 C ATOM 560 O3' DT A 18 6.871 -6.039 -5.885 1.00 0.32 O ATOM 561 C2' DT A 18 4.712 -6.100 -6.966 1.00 0.33 C ATOM 562 C1' DT A 18 4.651 -7.600 -7.238 1.00 0.35 C ATOM 563 N1 DT A 18 3.362 -8.044 -7.806 1.00 0.36 N ATOM 564 C2 DT A 18 2.923 -7.418 -8.961 1.00 0.44 C ATOM 565 O2 DT A 18 3.589 -6.565 -9.543 1.00 0.52 O ATOM 566 N3 DT A 18 1.691 -7.817 -9.436 1.00 0.47 N ATOM 567 C4 DT A 18 0.871 -8.771 -8.868 1.00 0.43 C ATOM 568 O4 DT A 18 -0.210 -9.051 -9.380 1.00 0.47 O ATOM 569 C5 DT A 18 1.410 -9.369 -7.668 1.00 0.36 C ATOM 570 C7 DT A 18 0.587 -10.382 -6.891 1.00 0.36 C ATOM 571 C6 DT A 18 2.610 -9.007 -7.187 1.00 0.34 C ATOM 0 H5' DT A 18 3.890 -6.256 -3.480 1.00 0.25 H new ATOM 0 H5'' DT A 18 2.934 -7.038 -4.723 1.00 0.25 H new ATOM 0 H4' DT A 18 5.841 -7.612 -4.257 1.00 0.29 H new ATOM 0 H3' DT A 18 5.232 -5.132 -5.074 1.00 0.28 H new ATOM 0 H2' DT A 18 3.717 -5.661 -6.891 1.00 0.33 H new ATOM 0 H2'' DT A 18 5.237 -5.566 -7.758 1.00 0.33 H new ATOM 0 H1' DT A 18 5.423 -7.835 -7.971 1.00 0.35 H new ATOM 0 H3 DT A 18 1.355 -7.365 -10.286 1.00 0.47 H new ATOM 0 H71 DT A 18 1.253 -11.088 -6.395 1.00 0.36 H new ATOM 0 H72 DT A 18 -0.016 -9.865 -6.144 1.00 0.36 H new ATOM 0 H73 DT A 18 -0.068 -10.921 -7.576 1.00 0.36 H new ATOM 0 H6 DT A 18 2.989 -9.484 -6.295 1.00 0.34 H new ATOM 584 P DG A 19 7.895 -5.767 -4.676 1.00 0.36 P ATOM 585 OP1 DG A 19 9.200 -5.383 -5.257 1.00 0.43 O ATOM 586 OP2 DG A 19 7.818 -6.908 -3.734 1.00 0.45 O ATOM 587 O5' DG A 19 7.259 -4.473 -3.958 1.00 0.34 O ATOM 588 C5' DG A 19 7.513 -3.147 -4.443 1.00 0.32 C ATOM 589 C4' DG A 19 7.187 -2.992 -5.931 1.00 0.23 C ATOM 590 O4' DG A 19 5.922 -3.583 -6.210 1.00 0.22 O ATOM 591 C3' DG A 19 7.113 -1.547 -6.402 1.00 0.21 C ATOM 592 O3' DG A 19 7.571 -1.429 -7.764 1.00 0.23 O ATOM 593 C2' DG A 19 5.642 -1.210 -6.323 1.00 0.20 C ATOM 594 C1' DG A 19 4.950 -2.567 -6.452 1.00 0.20 C ATOM 595 N9 DG A 19 3.841 -2.781 -5.503 1.00 0.20 N ATOM 596 C8 DG A 19 2.533 -3.094 -5.769 1.00 0.21 C ATOM 597 N7 DG A 19 1.783 -3.180 -4.709 1.00 0.21 N ATOM 598 C5 DG A 19 2.656 -2.911 -3.664 1.00 0.20 C ATOM 599 C6 DG A 19 2.410 -2.865 -2.273 1.00 0.20 C ATOM 600 O6 DG A 19 1.355 -3.041 -1.691 1.00 0.22 O ATOM 601 N1 DG A 19 3.555 -2.565 -1.559 1.00 0.21 N ATOM 602 C2 DG A 19 4.790 -2.337 -2.117 1.00 0.21 C ATOM 603 N2 DG A 19 5.783 -2.094 -1.277 1.00 0.22 N ATOM 604 N3 DG A 19 5.027 -2.374 -3.426 1.00 0.21 N ATOM 605 C4 DG A 19 3.917 -2.668 -4.138 1.00 0.20 C ATOM 0 H5' DG A 19 8.561 -2.898 -4.277 1.00 0.32 H new ATOM 0 H5'' DG A 19 6.921 -2.434 -3.869 1.00 0.32 H new ATOM 0 H4' DG A 19 8.006 -3.482 -6.458 1.00 0.23 H new ATOM 0 H3' DG A 19 7.737 -0.884 -5.803 1.00 0.21 H new ATOM 0 H2' DG A 19 5.393 -0.722 -5.381 1.00 0.20 H new ATOM 0 H2'' DG A 19 5.344 -0.531 -7.122 1.00 0.20 H new ATOM 0 H1' DG A 19 4.523 -2.601 -7.454 1.00 0.20 H new ATOM 0 H8 DG A 19 2.158 -3.255 -6.769 1.00 0.21 H new ATOM 0 H1 DG A 19 3.478 -2.509 -0.544 1.00 0.21 H new ATOM 0 H21 DG A 19 6.722 -1.918 -1.635 1.00 0.22 H new ATOM 0 H22 DG A 19 5.610 -2.083 -0.272 1.00 0.22 H new ATOM 617 P DG A 20 6.902 -2.243 -8.996 1.00 0.22 P ATOM 618 OP1 DG A 20 6.951 -3.691 -8.692 1.00 0.25 O ATOM 619 OP2 DG A 20 7.517 -1.745 -10.246 1.00 0.29 O ATOM 620 O5' DG A 20 5.355 -1.779 -8.991 1.00 0.22 O ATOM 621 C5' DG A 20 4.413 -2.454 -9.831 1.00 0.23 C ATOM 622 C4' DG A 20 3.017 -1.843 -9.775 1.00 0.22 C ATOM 623 O4' DG A 20 2.540 -1.809 -8.440 1.00 0.21 O ATOM 624 C3' DG A 20 2.944 -0.412 -10.288 1.00 0.22 C ATOM 625 O3' DG A 20 2.517 -0.425 -11.654 1.00 0.28 O ATOM 626 C2' DG A 20 1.868 0.247 -9.417 1.00 0.21 C ATOM 627 C1' DG A 20 1.494 -0.841 -8.395 1.00 0.20 C ATOM 628 N9 DG A 20 1.406 -0.386 -6.998 1.00 0.18 N ATOM 629 C8 DG A 20 2.409 0.016 -6.182 1.00 0.16 C ATOM 630 N7 DG A 20 2.085 0.136 -4.937 1.00 0.16 N ATOM 631 C5 DG A 20 0.750 -0.188 -4.926 1.00 0.18 C ATOM 632 C6 DG A 20 -0.142 -0.226 -3.843 1.00 0.19 C ATOM 633 O6 DG A 20 0.113 -0.007 -2.648 1.00 0.20 O ATOM 634 N1 DG A 20 -1.417 -0.589 -4.273 1.00 0.21 N ATOM 635 C2 DG A 20 -1.763 -0.872 -5.581 1.00 0.21 C ATOM 636 N2 DG A 20 -3.043 -1.108 -5.832 1.00 0.24 N ATOM 637 N3 DG A 20 -0.908 -0.849 -6.587 1.00 0.21 N ATOM 638 C4 DG A 20 0.321 -0.499 -6.189 1.00 0.19 C ATOM 0 H5' DG A 20 4.357 -3.502 -9.535 1.00 0.23 H new ATOM 0 H5'' DG A 20 4.772 -2.432 -10.860 1.00 0.23 H new ATOM 0 H4' DG A 20 2.414 -2.483 -10.419 1.00 0.22 H new ATOM 0 H3' DG A 20 3.900 0.110 -10.239 1.00 0.22 H new ATOM 0 H2' DG A 20 2.247 1.143 -8.925 1.00 0.21 H new ATOM 0 H2'' DG A 20 1.005 0.550 -10.010 1.00 0.21 H new ATOM 0 H1' DG A 20 0.504 -1.205 -8.669 1.00 0.20 H new ATOM 0 H8 DG A 20 3.405 0.221 -6.545 1.00 0.16 H new ATOM 0 H1 DG A 20 -2.152 -0.651 -3.568 1.00 0.21 H new ATOM 0 H21 DG A 20 -3.345 -1.321 -6.783 1.00 0.24 H new ATOM 0 H22 DG A 20 -3.725 -1.076 -5.075 1.00 0.24 H new ATOM 650 P DG A 21 2.487 0.934 -12.518 1.00 0.30 P ATOM 651 OP1 DG A 21 2.491 0.569 -13.951 1.00 0.40 O ATOM 652 OP2 DG A 21 3.523 1.849 -11.989 1.00 0.36 O ATOM 653 O5' DG A 21 1.045 1.550 -12.160 1.00 0.27 O ATOM 654 C5' DG A 21 -0.117 1.175 -12.910 1.00 0.36 C ATOM 655 C4' DG A 21 -1.372 1.838 -12.353 1.00 0.33 C ATOM 656 O4' DG A 21 -1.600 1.387 -11.023 1.00 0.28 O ATOM 657 C3' DG A 21 -1.291 3.355 -12.285 1.00 0.36 C ATOM 658 O3' DG A 21 -1.704 3.961 -13.514 1.00 0.47 O ATOM 659 C2' DG A 21 -2.247 3.694 -11.151 1.00 0.33 C ATOM 660 C1' DG A 21 -2.225 2.437 -10.279 1.00 0.26 C ATOM 661 N9 DG A 21 -1.485 2.584 -9.016 1.00 0.20 N ATOM 662 C8 DG A 21 -0.145 2.775 -8.814 1.00 0.19 C ATOM 663 N7 DG A 21 0.200 2.814 -7.560 1.00 0.17 N ATOM 664 C5 DG A 21 -1.001 2.646 -6.887 1.00 0.16 C ATOM 665 C6 DG A 21 -1.263 2.608 -5.501 1.00 0.16 C ATOM 666 O6 DG A 21 -0.481 2.715 -4.579 1.00 0.18 O ATOM 667 N1 DG A 21 -2.597 2.427 -5.238 1.00 0.17 N ATOM 668 C2 DG A 21 -3.585 2.304 -6.196 1.00 0.20 C ATOM 669 N2 DG A 21 -4.836 2.212 -5.764 1.00 0.22 N ATOM 670 N3 DG A 21 -3.342 2.332 -7.502 1.00 0.21 N ATOM 671 C4 DG A 21 -2.034 2.507 -7.770 1.00 0.18 C ATOM 0 H5' DG A 21 -0.234 0.092 -12.886 1.00 0.36 H new ATOM 0 H5'' DG A 21 0.014 1.459 -13.954 1.00 0.36 H new ATOM 0 H4' DG A 21 -2.173 1.563 -13.040 1.00 0.33 H new ATOM 0 H3' DG A 21 -0.278 3.722 -12.120 1.00 0.36 H new ATOM 0 H2' DG A 21 -1.917 4.573 -10.597 1.00 0.33 H new ATOM 0 H2'' DG A 21 -3.249 3.908 -11.521 1.00 0.33 H new ATOM 0 HO3' DG A 21 -1.641 4.936 -13.435 1.00 0.47 H new ATOM 0 H1' DG A 21 -3.263 2.227 -10.019 1.00 0.26 H new ATOM 0 H8 DG A 21 0.563 2.884 -9.623 1.00 0.19 H new ATOM 0 H1 DG A 21 -2.882 2.380 -4.260 1.00 0.17 H new ATOM 0 H21 DG A 21 -5.601 2.120 -6.432 1.00 0.22 H new ATOM 0 H22 DG A 21 -5.033 2.234 -4.763 1.00 0.22 H new TER 684 DG A 21