USER MOD reduce.3.24.130724 H: found=0, std=0, add=229, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 227 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 4 DT C7 :methyl 150:sc= -1.3 (180deg=-1.3) USER MOD Set 1.2: A 6 DT C7 :methyl 150:sc= -2.31 (180deg=-2.31) USER MOD Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 10 DT C7 :methyl -30:sc= -0.437 (180deg=-2.2!) USER MOD Single : A 11 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DT C7 :methyl -30:sc= -4.14! (180deg=-7.05!) USER MOD Single : A 13 DT C7 :methyl 150:sc= -8.4! (180deg=-8.4!) USER MOD Single : A 20 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -4.257 -4.091 -6.666 1.00 0.74 O ATOM 2 C5' DG A 1 -4.648 -4.214 -5.295 1.00 0.54 C ATOM 3 C4' DG A 1 -6.083 -3.738 -5.084 1.00 0.41 C ATOM 4 O4' DG A 1 -6.419 -3.791 -3.696 1.00 0.38 O ATOM 5 C3' DG A 1 -6.331 -2.308 -5.523 1.00 0.33 C ATOM 6 O3' DG A 1 -7.714 -2.165 -5.854 1.00 0.36 O ATOM 7 C2' DG A 1 -6.001 -1.500 -4.277 1.00 0.25 C ATOM 8 C1' DG A 1 -6.377 -2.461 -3.149 1.00 0.24 C ATOM 9 N9 DG A 1 -5.419 -2.492 -2.037 1.00 0.21 N ATOM 10 C8 DG A 1 -5.663 -2.498 -0.698 1.00 0.21 C ATOM 11 N7 DG A 1 -4.597 -2.625 0.034 1.00 0.20 N ATOM 12 C5 DG A 1 -3.571 -2.719 -0.890 1.00 0.19 C ATOM 13 C6 DG A 1 -2.178 -2.891 -0.687 1.00 0.20 C ATOM 14 O6 DG A 1 -1.574 -3.002 0.375 1.00 0.23 O ATOM 15 N1 DG A 1 -1.501 -2.953 -1.895 1.00 0.20 N ATOM 16 C2 DG A 1 -2.102 -2.859 -3.137 1.00 0.21 C ATOM 17 N2 DG A 1 -1.336 -3.020 -4.188 1.00 0.25 N ATOM 18 N3 DG A 1 -3.399 -2.684 -3.319 1.00 0.21 N ATOM 19 C4 DG A 1 -4.069 -2.630 -2.161 1.00 0.19 C ATOM 0 H5' DG A 1 -3.973 -3.631 -4.668 1.00 0.54 H new ATOM 0 H5'' DG A 1 -4.557 -5.254 -4.980 1.00 0.54 H new ATOM 0 H4' DG A 1 -6.691 -4.405 -5.695 1.00 0.41 H new ATOM 0 H3' DG A 1 -5.749 -1.999 -6.392 1.00 0.33 H new ATOM 0 H2' DG A 1 -4.947 -1.224 -4.240 1.00 0.25 H new ATOM 0 H2'' DG A 1 -6.575 -0.575 -4.230 1.00 0.25 H new ATOM 0 HO5' DG A 1 -3.333 -4.401 -6.772 1.00 0.74 H new ATOM 0 H1' DG A 1 -7.331 -2.113 -2.753 1.00 0.24 H new ATOM 0 H8 DG A 1 -6.655 -2.405 -0.281 1.00 0.21 H new ATOM 0 H1 DG A 1 -0.489 -3.077 -1.866 1.00 0.20 H new ATOM 0 H21 DG A 1 -1.736 -2.959 -5.124 1.00 0.25 H new ATOM 0 H22 DG A 1 -0.340 -3.206 -4.070 1.00 0.25 H new ATOM 31 P DG A 2 -8.292 -0.783 -6.430 1.00 0.39 P ATOM 32 OP1 DG A 2 -9.586 -1.067 -7.094 1.00 0.52 O ATOM 33 OP2 DG A 2 -7.212 -0.102 -7.178 1.00 0.47 O ATOM 34 O5' DG A 2 -8.580 0.057 -5.097 1.00 0.32 O ATOM 35 C5' DG A 2 -9.428 -0.453 -4.062 1.00 0.29 C ATOM 36 C4' DG A 2 -9.304 0.407 -2.817 1.00 0.23 C ATOM 37 O4' DG A 2 -8.088 0.080 -2.136 1.00 0.24 O ATOM 38 C3' DG A 2 -9.262 1.904 -3.148 1.00 0.23 C ATOM 39 O3' DG A 2 -10.336 2.577 -2.488 1.00 0.26 O ATOM 40 C2' DG A 2 -7.927 2.393 -2.577 1.00 0.25 C ATOM 41 C1' DG A 2 -7.509 1.280 -1.632 1.00 0.20 C ATOM 42 N9 DG A 2 -6.052 1.081 -1.573 1.00 0.17 N ATOM 43 C8 DG A 2 -5.133 1.268 -2.566 1.00 0.18 C ATOM 44 N7 DG A 2 -3.928 0.939 -2.242 1.00 0.18 N ATOM 45 C5 DG A 2 -4.041 0.515 -0.935 1.00 0.15 C ATOM 46 C6 DG A 2 -3.040 0.049 -0.068 1.00 0.15 C ATOM 47 O6 DG A 2 -1.851 -0.108 -0.323 1.00 0.21 O ATOM 48 N1 DG A 2 -3.550 -0.268 1.179 1.00 0.15 N ATOM 49 C2 DG A 2 -4.885 -0.150 1.535 1.00 0.16 C ATOM 50 N2 DG A 2 -5.205 -0.466 2.784 1.00 0.19 N ATOM 51 N3 DG A 2 -5.834 0.285 0.705 1.00 0.16 N ATOM 52 C4 DG A 2 -5.338 0.600 -0.509 1.00 0.15 C ATOM 0 H5' DG A 2 -9.155 -1.483 -3.831 1.00 0.29 H new ATOM 0 H5'' DG A 2 -10.463 -0.467 -4.403 1.00 0.29 H new ATOM 0 H4' DG A 2 -10.180 0.207 -2.200 1.00 0.23 H new ATOM 0 H3' DG A 2 -9.356 2.093 -4.217 1.00 0.23 H new ATOM 0 H2' DG A 2 -7.188 2.549 -3.363 1.00 0.25 H new ATOM 0 H2'' DG A 2 -8.040 3.342 -2.053 1.00 0.25 H new ATOM 0 H1' DG A 2 -7.840 1.543 -0.627 1.00 0.20 H new ATOM 0 H8 DG A 2 -5.393 1.658 -3.539 1.00 0.18 H new ATOM 0 H1 DG A 2 -2.899 -0.612 1.885 1.00 0.15 H new ATOM 0 H21 DG A 2 -6.174 -0.396 3.096 1.00 0.19 H new ATOM 0 H22 DG A 2 -4.482 -0.779 3.432 1.00 0.19 H new ATOM 64 P DG A 3 -11.279 3.594 -3.308 1.00 0.30 P ATOM 65 OP1 DG A 3 -11.992 4.451 -2.337 1.00 0.34 O ATOM 66 OP2 DG A 3 -12.055 2.799 -4.286 1.00 0.41 O ATOM 67 O5' DG A 3 -10.227 4.512 -4.140 1.00 0.31 O ATOM 68 C5' DG A 3 -9.203 5.312 -3.508 1.00 0.27 C ATOM 69 C4' DG A 3 -9.591 5.765 -2.102 1.00 0.23 C ATOM 70 O4' DG A 3 -9.369 4.684 -1.181 1.00 0.23 O ATOM 71 C3' DG A 3 -8.778 6.959 -1.577 1.00 0.23 C ATOM 72 O3' DG A 3 -9.492 8.183 -1.793 1.00 0.27 O ATOM 73 C2' DG A 3 -8.654 6.690 -0.076 1.00 0.23 C ATOM 74 C1' DG A 3 -8.692 5.168 -0.007 1.00 0.23 C ATOM 75 N9 DG A 3 -7.336 4.557 0.082 1.00 0.21 N ATOM 76 C8 DG A 3 -6.718 4.061 1.198 1.00 0.23 C ATOM 77 N7 DG A 3 -5.480 3.710 1.008 1.00 0.23 N ATOM 78 C5 DG A 3 -5.249 3.983 -0.332 1.00 0.20 C ATOM 79 C6 DG A 3 -4.068 3.803 -1.104 1.00 0.19 C ATOM 80 O6 DG A 3 -3.002 3.375 -0.748 1.00 0.22 O ATOM 81 N1 DG A 3 -4.224 4.185 -2.410 1.00 0.17 N ATOM 82 C2 DG A 3 -5.421 4.693 -2.926 1.00 0.19 C ATOM 83 N2 DG A 3 -5.471 4.994 -4.211 1.00 0.22 N ATOM 84 N3 DG A 3 -6.526 4.869 -2.198 1.00 0.20 N ATOM 85 C4 DG A 3 -6.374 4.495 -0.915 1.00 0.19 C ATOM 0 H5' DG A 3 -9.000 6.188 -4.124 1.00 0.27 H new ATOM 0 H5'' DG A 3 -8.278 4.737 -3.458 1.00 0.27 H new ATOM 0 H4' DG A 3 -10.636 6.068 -2.171 1.00 0.23 H new ATOM 0 H3' DG A 3 -7.814 7.060 -2.075 1.00 0.23 H new ATOM 0 H2' DG A 3 -7.727 7.091 0.333 1.00 0.23 H new ATOM 0 H2'' DG A 3 -9.472 7.142 0.486 1.00 0.23 H new ATOM 0 H1' DG A 3 -9.219 4.882 0.903 1.00 0.23 H new ATOM 0 H8 DG A 3 -7.215 3.969 2.153 1.00 0.23 H new ATOM 0 H1 DG A 3 -3.426 4.094 -3.039 1.00 0.17 H new ATOM 0 H21 DG A 3 -6.331 5.366 -4.615 1.00 0.22 H new ATOM 0 H22 DG A 3 -4.650 4.854 -4.800 1.00 0.22 H new ATOM 97 P DT A 4 -8.734 9.609 -1.695 1.00 0.29 P ATOM 98 OP1 DT A 4 -9.677 10.586 -1.104 1.00 0.42 O ATOM 99 OP2 DT A 4 -8.107 9.900 -3.005 1.00 0.39 O ATOM 100 O5' DT A 4 -7.560 9.325 -0.613 1.00 0.25 O ATOM 101 C5' DT A 4 -6.162 9.416 -0.957 1.00 0.22 C ATOM 102 C4' DT A 4 -5.475 8.038 -0.906 1.00 0.22 C ATOM 103 O4' DT A 4 -5.416 7.492 -2.228 1.00 0.22 O ATOM 104 C3' DT A 4 -4.041 8.019 -0.339 1.00 0.24 C ATOM 105 O3' DT A 4 -4.034 7.320 0.917 1.00 0.35 O ATOM 106 C2' DT A 4 -3.255 7.202 -1.358 1.00 0.19 C ATOM 107 C1' DT A 4 -4.053 7.417 -2.640 1.00 0.20 C ATOM 108 N1 DT A 4 -3.730 8.655 -3.412 1.00 0.21 N ATOM 109 C2 DT A 4 -4.762 9.276 -4.113 1.00 0.30 C ATOM 110 O2 DT A 4 -5.903 8.827 -4.161 1.00 0.41 O ATOM 111 N3 DT A 4 -4.423 10.423 -4.801 1.00 0.34 N ATOM 112 C4 DT A 4 -3.174 11.003 -4.861 1.00 0.33 C ATOM 113 O4 DT A 4 -2.995 12.035 -5.502 1.00 0.41 O ATOM 114 C5 DT A 4 -2.161 10.291 -4.112 1.00 0.28 C ATOM 115 C7 DT A 4 -0.729 10.819 -4.083 1.00 0.38 C ATOM 116 C6 DT A 4 -2.460 9.168 -3.430 1.00 0.22 C ATOM 0 H5' DT A 4 -5.661 10.099 -0.270 1.00 0.22 H new ATOM 0 H5'' DT A 4 -6.059 9.838 -1.957 1.00 0.22 H new ATOM 0 H4' DT A 4 -6.088 7.454 -0.219 1.00 0.22 H new ATOM 0 H3' DT A 4 -3.636 9.018 -0.178 1.00 0.24 H new ATOM 0 H2' DT A 4 -2.228 7.554 -1.455 1.00 0.19 H new ATOM 0 H2'' DT A 4 -3.206 6.149 -1.082 1.00 0.19 H new ATOM 0 H1' DT A 4 -3.813 6.598 -3.318 1.00 0.20 H new ATOM 0 H3 DT A 4 -5.171 10.888 -5.316 1.00 0.34 H new ATOM 0 H71 DT A 4 -0.259 10.544 -3.139 1.00 0.38 H new ATOM 0 H72 DT A 4 -0.165 10.386 -4.909 1.00 0.38 H new ATOM 0 H73 DT A 4 -0.739 11.905 -4.180 1.00 0.38 H new ATOM 0 H6 DT A 4 -1.679 8.660 -2.884 1.00 0.22 H new ATOM 129 P DT A 5 -4.956 7.781 2.164 1.00 0.32 P ATOM 130 OP1 DT A 5 -5.925 6.699 2.451 1.00 0.50 O ATOM 131 OP2 DT A 5 -5.439 9.156 1.908 1.00 0.47 O ATOM 132 O5' DT A 5 -3.896 7.836 3.378 1.00 0.33 O ATOM 133 C5' DT A 5 -2.995 8.939 3.515 1.00 0.45 C ATOM 134 C4' DT A 5 -2.074 9.072 2.304 1.00 0.32 C ATOM 135 O4' DT A 5 -2.346 10.290 1.629 1.00 0.41 O ATOM 136 C3' DT A 5 -0.586 9.089 2.652 1.00 0.27 C ATOM 137 O3' DT A 5 -0.010 7.818 2.319 1.00 0.30 O ATOM 138 C2' DT A 5 0.006 10.194 1.769 1.00 0.28 C ATOM 139 C1' DT A 5 -1.175 10.638 0.910 1.00 0.37 C ATOM 140 N1 DT A 5 -1.231 12.086 0.645 1.00 0.56 N ATOM 141 C2 DT A 5 -1.460 12.485 -0.656 1.00 0.83 C ATOM 142 O2 DT A 5 -1.580 11.682 -1.575 1.00 0.97 O ATOM 143 N3 DT A 5 -1.539 13.844 -0.868 1.00 1.03 N ATOM 144 C4 DT A 5 -1.406 14.830 0.094 1.00 1.02 C ATOM 145 O4 DT A 5 -1.493 16.016 -0.212 1.00 1.25 O ATOM 146 C5 DT A 5 -1.166 14.321 1.427 1.00 0.83 C ATOM 147 C7 DT A 5 -0.999 15.297 2.589 1.00 1.01 C ATOM 148 C6 DT A 5 -1.087 12.994 1.657 1.00 0.62 C ATOM 0 H5' DT A 5 -2.395 8.809 4.416 1.00 0.45 H new ATOM 0 H5'' DT A 5 -3.564 9.860 3.642 1.00 0.45 H new ATOM 0 H4' DT A 5 -2.275 8.193 1.692 1.00 0.32 H new ATOM 0 H3' DT A 5 -0.396 9.269 3.710 1.00 0.27 H new ATOM 0 H2' DT A 5 0.399 11.017 2.366 1.00 0.28 H new ATOM 0 H2'' DT A 5 0.829 9.822 1.158 1.00 0.28 H new ATOM 0 H1' DT A 5 -1.076 10.151 -0.060 1.00 0.37 H new ATOM 0 H3 DT A 5 -1.712 14.153 -1.825 1.00 1.03 H new ATOM 0 H71 DT A 5 -1.351 14.831 3.509 1.00 1.01 H new ATOM 0 H72 DT A 5 0.054 15.560 2.695 1.00 1.01 H new ATOM 0 H73 DT A 5 -1.580 16.198 2.394 1.00 1.01 H new ATOM 0 H6 DT A 5 -0.906 12.641 2.662 1.00 0.62 H new ATOM 161 P DT A 6 -0.514 6.476 3.064 1.00 0.31 P ATOM 162 OP1 DT A 6 -1.603 5.876 2.256 1.00 0.41 O ATOM 163 OP2 DT A 6 -0.752 6.804 4.489 1.00 0.39 O ATOM 164 O5' DT A 6 0.773 5.504 2.966 1.00 0.28 O ATOM 165 C5' DT A 6 1.642 5.294 4.090 1.00 0.29 C ATOM 166 C4' DT A 6 2.734 6.361 4.191 1.00 0.27 C ATOM 167 O4' DT A 6 3.293 6.591 2.905 1.00 0.25 O ATOM 168 C3' DT A 6 2.252 7.714 4.716 1.00 0.28 C ATOM 169 O3' DT A 6 2.740 7.897 6.052 1.00 0.35 O ATOM 170 C2' DT A 6 2.893 8.754 3.788 1.00 0.29 C ATOM 171 C1' DT A 6 3.779 7.927 2.859 1.00 0.26 C ATOM 172 N1 DT A 6 3.737 8.357 1.447 1.00 0.24 N ATOM 173 C2 DT A 6 4.899 8.856 0.882 1.00 0.27 C ATOM 174 O2 DT A 6 5.949 8.964 1.513 1.00 0.32 O ATOM 175 N3 DT A 6 4.813 9.235 -0.441 1.00 0.29 N ATOM 176 C4 DT A 6 3.686 9.163 -1.239 1.00 0.28 C ATOM 177 O4 DT A 6 3.726 9.529 -2.409 1.00 0.34 O ATOM 178 C5 DT A 6 2.521 8.631 -0.568 1.00 0.25 C ATOM 179 C7 DT A 6 1.200 8.501 -1.329 1.00 0.30 C ATOM 180 C6 DT A 6 2.581 8.252 0.723 1.00 0.23 C ATOM 0 H5' DT A 6 2.105 4.311 4.009 1.00 0.29 H new ATOM 0 H5'' DT A 6 1.052 5.294 5.007 1.00 0.29 H new ATOM 0 H4' DT A 6 3.456 5.964 4.904 1.00 0.27 H new ATOM 0 H3' DT A 6 1.165 7.794 4.733 1.00 0.28 H new ATOM 0 H2' DT A 6 2.139 9.309 3.230 1.00 0.29 H new ATOM 0 H2'' DT A 6 3.476 9.484 4.350 1.00 0.29 H new ATOM 0 H1' DT A 6 4.808 8.042 3.201 1.00 0.26 H new ATOM 0 H3 DT A 6 5.661 9.603 -0.872 1.00 0.29 H new ATOM 0 H71 DT A 6 0.631 7.662 -0.929 1.00 0.30 H new ATOM 0 H72 DT A 6 0.623 9.419 -1.215 1.00 0.30 H new ATOM 0 H73 DT A 6 1.404 8.330 -2.386 1.00 0.30 H new ATOM 0 H6 DT A 6 1.696 7.856 1.198 1.00 0.23 H new ATOM 193 P DG A 7 1.778 7.680 7.328 1.00 0.40 P ATOM 194 OP1 DG A 7 0.617 8.591 7.196 1.00 0.48 O ATOM 195 OP2 DG A 7 2.615 7.729 8.551 1.00 0.49 O ATOM 196 O5' DG A 7 1.259 6.165 7.135 1.00 0.37 O ATOM 197 C5' DG A 7 2.120 5.052 7.395 1.00 0.34 C ATOM 198 C4' DG A 7 1.353 3.732 7.363 1.00 0.28 C ATOM 199 O4' DG A 7 0.720 3.578 6.104 1.00 0.28 O ATOM 200 C3' DG A 7 2.229 2.501 7.556 1.00 0.29 C ATOM 201 O3' DG A 7 2.291 2.133 8.949 1.00 0.39 O ATOM 202 C2' DG A 7 1.527 1.409 6.750 1.00 0.25 C ATOM 203 C1' DG A 7 0.623 2.186 5.788 1.00 0.23 C ATOM 204 N9 DG A 7 0.980 2.068 4.365 1.00 0.20 N ATOM 205 C8 DG A 7 2.207 1.830 3.782 1.00 0.19 C ATOM 206 N7 DG A 7 2.197 1.886 2.496 1.00 0.18 N ATOM 207 C5 DG A 7 0.881 2.177 2.191 1.00 0.17 C ATOM 208 C6 DG A 7 0.285 2.355 0.941 1.00 0.17 C ATOM 209 O6 DG A 7 0.789 2.254 -0.138 1.00 0.18 O ATOM 210 N1 DG A 7 -1.041 2.644 1.038 1.00 0.17 N ATOM 211 C2 DG A 7 -1.745 2.744 2.200 1.00 0.19 C ATOM 212 N2 DG A 7 -3.033 3.048 2.070 1.00 0.21 N ATOM 213 N3 DG A 7 -1.201 2.568 3.408 1.00 0.20 N ATOM 214 C4 DG A 7 0.125 2.288 3.320 1.00 0.19 C ATOM 0 H5' DG A 7 2.592 5.176 8.369 1.00 0.34 H new ATOM 0 H5'' DG A 7 2.919 5.028 6.654 1.00 0.34 H new ATOM 0 H4' DG A 7 0.647 3.791 8.191 1.00 0.28 H new ATOM 0 H3' DG A 7 3.256 2.668 7.233 1.00 0.29 H new ATOM 0 H2' DG A 7 2.242 0.787 6.212 1.00 0.25 H new ATOM 0 H2'' DG A 7 0.949 0.746 7.394 1.00 0.25 H new ATOM 0 H1' DG A 7 -0.372 1.760 5.918 1.00 0.23 H new ATOM 0 H8 DG A 7 3.098 1.616 4.354 1.00 0.19 H new ATOM 0 H1 DG A 7 -1.551 2.799 0.168 1.00 0.17 H new ATOM 0 H21 DG A 7 -3.622 3.139 2.898 1.00 0.21 H new ATOM 0 H22 DG A 7 -3.432 3.190 1.142 1.00 0.21 H new ATOM 226 P DG A 8 1.023 2.226 9.958 1.00 0.44 P ATOM 227 OP1 DG A 8 0.339 3.523 9.749 1.00 0.59 O ATOM 228 OP2 DG A 8 1.497 1.862 11.312 1.00 0.67 O ATOM 229 O5' DG A 8 0.047 1.051 9.441 1.00 0.37 O ATOM 230 C5' DG A 8 -1.171 0.768 10.141 1.00 0.37 C ATOM 231 C4' DG A 8 -1.861 -0.483 9.606 1.00 0.31 C ATOM 232 O4' DG A 8 -2.286 -0.269 8.252 1.00 0.28 O ATOM 233 C3' DG A 8 -0.968 -1.736 9.593 1.00 0.28 C ATOM 234 O3' DG A 8 -1.727 -2.873 10.035 1.00 0.33 O ATOM 235 C2' DG A 8 -0.646 -1.896 8.118 1.00 0.22 C ATOM 236 C1' DG A 8 -1.950 -1.442 7.527 1.00 0.21 C ATOM 237 N9 DG A 8 -1.935 -1.123 6.097 1.00 0.19 N ATOM 238 C8 DG A 8 -3.012 -0.876 5.325 1.00 0.21 C ATOM 239 N7 DG A 8 -2.739 -0.662 4.075 1.00 0.20 N ATOM 240 C5 DG A 8 -1.358 -0.777 4.015 1.00 0.16 C ATOM 241 C6 DG A 8 -0.489 -0.648 2.905 1.00 0.16 C ATOM 242 O6 DG A 8 -0.786 -0.424 1.745 1.00 0.21 O ATOM 243 N1 DG A 8 0.833 -0.833 3.265 1.00 0.16 N ATOM 244 C2 DG A 8 1.260 -1.116 4.547 1.00 0.15 C ATOM 245 N2 DG A 8 2.560 -1.253 4.725 1.00 0.19 N ATOM 246 N3 DG A 8 0.444 -1.242 5.588 1.00 0.16 N ATOM 247 C4 DG A 8 -0.848 -1.059 5.253 1.00 0.15 C ATOM 0 H5' DG A 8 -1.846 1.620 10.053 1.00 0.37 H new ATOM 0 H5'' DG A 8 -0.958 0.638 11.202 1.00 0.37 H new ATOM 0 H4' DG A 8 -2.694 -0.658 10.286 1.00 0.31 H new ATOM 0 H3' DG A 8 -0.090 -1.655 10.235 1.00 0.28 H new ATOM 0 H2' DG A 8 0.194 -1.277 7.803 1.00 0.22 H new ATOM 0 H2'' DG A 8 -0.401 -2.924 7.852 1.00 0.22 H new ATOM 0 H1' DG A 8 -2.661 -2.264 7.606 1.00 0.21 H new ATOM 0 H8 DG A 8 -4.019 -0.858 5.715 1.00 0.21 H new ATOM 0 H1 DG A 8 1.540 -0.755 2.534 1.00 0.16 H new ATOM 0 H21 DG A 8 2.928 -1.462 5.653 1.00 0.19 H new ATOM 0 H22 DG A 8 3.197 -1.149 3.935 1.00 0.19 H new ATOM 259 P DG A 9 -2.203 -3.014 11.565 1.00 0.46 P ATOM 260 OP1 DG A 9 -2.538 -1.667 12.075 1.00 0.60 O ATOM 261 OP2 DG A 9 -1.210 -3.846 12.279 1.00 0.61 O ATOM 262 O5' DG A 9 -3.568 -3.862 11.450 1.00 0.38 O ATOM 263 C5' DG A 9 -4.733 -3.334 10.799 1.00 0.37 C ATOM 264 C4' DG A 9 -5.073 -4.129 9.541 1.00 0.27 C ATOM 265 O4' DG A 9 -4.340 -3.619 8.420 1.00 0.28 O ATOM 266 C3' DG A 9 -4.752 -5.627 9.648 1.00 0.24 C ATOM 267 O3' DG A 9 -5.948 -6.401 9.466 1.00 0.24 O ATOM 268 C2' DG A 9 -3.820 -5.875 8.477 1.00 0.27 C ATOM 269 C1' DG A 9 -4.150 -4.721 7.557 1.00 0.20 C ATOM 270 N9 DG A 9 -3.094 -4.418 6.580 1.00 0.18 N ATOM 271 C8 DG A 9 -1.742 -4.501 6.739 1.00 0.19 C ATOM 272 N7 DG A 9 -1.069 -4.297 5.647 1.00 0.18 N ATOM 273 C5 DG A 9 -2.042 -4.056 4.693 1.00 0.16 C ATOM 274 C6 DG A 9 -1.899 -3.778 3.310 1.00 0.16 C ATOM 275 O6 DG A 9 -0.860 -3.690 2.666 1.00 0.18 O ATOM 276 N1 DG A 9 -3.133 -3.600 2.696 1.00 0.16 N ATOM 277 C2 DG A 9 -4.350 -3.676 3.347 1.00 0.18 C ATOM 278 N2 DG A 9 -5.432 -3.442 2.620 1.00 0.21 N ATOM 279 N3 DG A 9 -4.479 -3.942 4.647 1.00 0.18 N ATOM 280 C4 DG A 9 -3.288 -4.121 5.253 1.00 0.17 C ATOM 0 H5' DG A 9 -4.564 -2.289 10.537 1.00 0.37 H new ATOM 0 H5'' DG A 9 -5.579 -3.358 11.486 1.00 0.37 H new ATOM 0 H4' DG A 9 -6.150 -4.016 9.414 1.00 0.27 H new ATOM 0 H3' DG A 9 -4.326 -5.899 10.614 1.00 0.24 H new ATOM 0 H2' DG A 9 -2.773 -5.867 8.781 1.00 0.27 H new ATOM 0 H2'' DG A 9 -4.007 -6.839 8.004 1.00 0.27 H new ATOM 0 H1' DG A 9 -5.024 -4.964 6.953 1.00 0.20 H new ATOM 0 H8 DG A 9 -1.273 -4.717 7.688 1.00 0.19 H new ATOM 0 H1 DG A 9 -3.141 -3.399 1.696 1.00 0.16 H new ATOM 0 H21 DG A 9 -6.355 -3.485 3.051 1.00 0.21 H new ATOM 0 H22 DG A 9 -5.342 -3.219 1.629 1.00 0.21 H new ATOM 292 P DT A 10 -5.950 -8.002 9.701 1.00 0.25 P ATOM 293 OP1 DT A 10 -6.317 -8.258 11.110 1.00 0.35 O ATOM 294 OP2 DT A 10 -4.693 -8.567 9.157 1.00 0.28 O ATOM 295 O5' DT A 10 -7.173 -8.498 8.769 1.00 0.28 O ATOM 296 C5' DT A 10 -6.930 -9.235 7.562 1.00 0.27 C ATOM 297 C4' DT A 10 -6.629 -8.320 6.389 1.00 0.23 C ATOM 298 O4' DT A 10 -5.359 -7.686 6.559 1.00 0.21 O ATOM 299 C3' DT A 10 -6.595 -9.071 5.068 1.00 0.23 C ATOM 300 O3' DT A 10 -7.546 -8.489 4.175 1.00 0.31 O ATOM 301 C2' DT A 10 -5.181 -8.866 4.542 1.00 0.21 C ATOM 302 C1' DT A 10 -4.719 -7.625 5.287 1.00 0.17 C ATOM 303 N1 DT A 10 -3.252 -7.545 5.518 1.00 0.16 N ATOM 304 C2 DT A 10 -2.464 -7.018 4.522 1.00 0.15 C ATOM 305 O2 DT A 10 -2.926 -6.603 3.478 1.00 0.18 O ATOM 306 N3 DT A 10 -1.114 -6.955 4.779 1.00 0.19 N ATOM 307 C4 DT A 10 -0.486 -7.364 5.936 1.00 0.23 C ATOM 308 O4 DT A 10 0.729 -7.269 6.056 1.00 0.29 O ATOM 309 C5 DT A 10 -1.385 -7.899 6.925 1.00 0.22 C ATOM 310 C7 DT A 10 -0.832 -8.373 8.265 1.00 0.29 C ATOM 311 C6 DT A 10 -2.709 -7.972 6.687 1.00 0.19 C ATOM 0 H5' DT A 10 -7.801 -9.848 7.330 1.00 0.27 H new ATOM 0 H5'' DT A 10 -6.093 -9.916 7.715 1.00 0.27 H new ATOM 0 H4' DT A 10 -7.432 -7.583 6.364 1.00 0.23 H new ATOM 0 H3' DT A 10 -6.840 -10.128 5.172 1.00 0.23 H new ATOM 0 H2' DT A 10 -4.543 -9.724 4.752 1.00 0.21 H new ATOM 0 H2'' DT A 10 -5.169 -8.717 3.462 1.00 0.21 H new ATOM 0 H1' DT A 10 -4.971 -6.753 4.684 1.00 0.17 H new ATOM 0 H3 DT A 10 -0.522 -6.569 4.044 1.00 0.19 H new ATOM 0 H71 DT A 10 0.188 -8.734 8.131 1.00 0.29 H new ATOM 0 H72 DT A 10 -0.834 -7.544 8.973 1.00 0.29 H new ATOM 0 H73 DT A 10 -1.454 -9.181 8.650 1.00 0.29 H new ATOM 0 H6 DT A 10 -3.357 -8.382 7.448 1.00 0.19 H new ATOM 324 P DT A 11 -8.282 -9.402 3.079 1.00 0.39 P ATOM 325 OP1 DT A 11 -9.052 -8.515 2.180 1.00 0.53 O ATOM 326 OP2 DT A 11 -8.962 -10.513 3.779 1.00 0.50 O ATOM 327 O5' DT A 11 -7.041 -10.011 2.265 1.00 0.34 O ATOM 328 C5' DT A 11 -6.509 -9.313 1.143 1.00 0.28 C ATOM 329 C4' DT A 11 -5.129 -9.829 0.757 1.00 0.26 C ATOM 330 O4' DT A 11 -4.158 -9.531 1.780 1.00 0.24 O ATOM 331 C3' DT A 11 -5.084 -11.348 0.534 1.00 0.30 C ATOM 332 O3' DT A 11 -4.341 -11.644 -0.657 1.00 0.32 O ATOM 333 C2' DT A 11 -4.313 -11.841 1.746 1.00 0.29 C ATOM 334 C1' DT A 11 -3.348 -10.690 1.920 1.00 0.25 C ATOM 335 N1 DT A 11 -2.631 -10.649 3.213 1.00 0.25 N ATOM 336 C2 DT A 11 -1.527 -9.826 3.289 1.00 0.29 C ATOM 337 O2 DT A 11 -1.204 -9.081 2.374 1.00 0.39 O ATOM 338 N3 DT A 11 -0.806 -9.877 4.456 1.00 0.32 N ATOM 339 C4 DT A 11 -1.084 -10.664 5.554 1.00 0.33 C ATOM 340 O4 DT A 11 -0.352 -10.641 6.538 1.00 0.38 O ATOM 341 C5 DT A 11 -2.264 -11.488 5.399 1.00 0.34 C ATOM 342 C7 DT A 11 -2.698 -12.406 6.540 1.00 0.47 C ATOM 343 C6 DT A 11 -2.987 -11.457 4.259 1.00 0.29 C ATOM 0 H5' DT A 11 -6.448 -8.249 1.373 1.00 0.28 H new ATOM 0 H5'' DT A 11 -7.186 -9.418 0.295 1.00 0.28 H new ATOM 0 H4' DT A 11 -4.896 -9.321 -0.179 1.00 0.26 H new ATOM 0 H3' DT A 11 -6.069 -11.801 0.422 1.00 0.30 H new ATOM 0 H2' DT A 11 -4.952 -11.986 2.617 1.00 0.29 H new ATOM 0 H2'' DT A 11 -3.805 -12.788 1.562 1.00 0.29 H new ATOM 0 H1' DT A 11 -2.546 -10.781 1.188 1.00 0.25 H new ATOM 0 H3 DT A 11 0.015 -9.275 4.517 1.00 0.32 H new ATOM 0 H71 DT A 11 -3.781 -12.526 6.519 1.00 0.47 H new ATOM 0 H72 DT A 11 -2.223 -13.380 6.424 1.00 0.47 H new ATOM 0 H73 DT A 11 -2.400 -11.968 7.493 1.00 0.47 H new ATOM 0 H6 DT A 11 -3.863 -12.082 4.171 1.00 0.29 H new ATOM 356 P DT A 12 -4.677 -10.922 -2.061 1.00 0.31 P ATOM 357 OP1 DT A 12 -5.867 -10.058 -1.869 1.00 0.33 O ATOM 358 OP2 DT A 12 -4.687 -11.957 -3.116 1.00 0.40 O ATOM 359 O5' DT A 12 -3.391 -9.972 -2.293 1.00 0.27 O ATOM 360 C5' DT A 12 -3.378 -8.601 -1.858 1.00 0.22 C ATOM 361 C4' DT A 12 -2.650 -7.706 -2.838 1.00 0.22 C ATOM 362 O4' DT A 12 -3.284 -6.446 -2.844 1.00 0.23 O ATOM 363 C3' DT A 12 -1.196 -7.439 -2.474 1.00 0.24 C ATOM 364 O3' DT A 12 -0.441 -7.229 -3.678 1.00 0.31 O ATOM 365 C2' DT A 12 -1.257 -6.133 -1.664 1.00 0.23 C ATOM 366 C1' DT A 12 -2.740 -5.724 -1.755 1.00 0.20 C ATOM 367 N1 DT A 12 -3.614 -5.985 -0.558 1.00 0.18 N ATOM 368 C2 DT A 12 -3.188 -6.832 0.463 1.00 0.19 C ATOM 369 O2 DT A 12 -2.134 -7.444 0.430 1.00 0.24 O ATOM 370 N3 DT A 12 -4.061 -6.999 1.516 1.00 0.19 N ATOM 371 C4 DT A 12 -5.300 -6.423 1.652 1.00 0.20 C ATOM 372 O4 DT A 12 -5.980 -6.632 2.649 1.00 0.24 O ATOM 373 C5 DT A 12 -5.674 -5.578 0.556 1.00 0.21 C ATOM 374 C7 DT A 12 -7.057 -4.929 0.563 1.00 0.28 C ATOM 375 C6 DT A 12 -4.841 -5.383 -0.487 1.00 0.19 C ATOM 0 H5' DT A 12 -2.900 -8.534 -0.881 1.00 0.22 H new ATOM 0 H5'' DT A 12 -4.402 -8.249 -1.736 1.00 0.22 H new ATOM 0 H4' DT A 12 -2.677 -8.225 -3.796 1.00 0.22 H new ATOM 0 H3' DT A 12 -0.728 -8.256 -1.925 1.00 0.24 H new ATOM 0 H2' DT A 12 -0.945 -6.286 -0.631 1.00 0.23 H new ATOM 0 H2'' DT A 12 -0.603 -5.369 -2.084 1.00 0.23 H new ATOM 0 H1' DT A 12 -2.737 -4.638 -1.852 1.00 0.20 H new ATOM 0 H3 DT A 12 -3.756 -7.613 2.271 1.00 0.19 H new ATOM 0 H71 DT A 12 -7.758 -5.572 1.096 1.00 0.28 H new ATOM 0 H72 DT A 12 -7.002 -3.961 1.061 1.00 0.28 H new ATOM 0 H73 DT A 12 -7.399 -4.791 -0.463 1.00 0.28 H new ATOM 0 H6 DT A 12 -5.152 -4.732 -1.291 1.00 0.19 H new ATOM 388 P DT A 13 0.659 -8.303 -4.174 1.00 0.30 P ATOM 389 OP1 DT A 13 0.806 -8.167 -5.638 1.00 0.46 O ATOM 390 OP2 DT A 13 0.330 -9.621 -3.584 1.00 0.37 O ATOM 391 O5' DT A 13 2.011 -7.768 -3.482 1.00 0.37 O ATOM 392 C5' DT A 13 2.746 -6.676 -4.051 1.00 0.34 C ATOM 393 C4' DT A 13 4.245 -6.800 -3.763 1.00 0.30 C ATOM 394 O4' DT A 13 4.498 -6.401 -2.412 1.00 0.30 O ATOM 395 C3' DT A 13 4.807 -8.216 -3.927 1.00 0.30 C ATOM 396 O3' DT A 13 6.171 -8.151 -4.359 1.00 0.32 O ATOM 397 C2' DT A 13 4.751 -8.782 -2.506 1.00 0.31 C ATOM 398 C1' DT A 13 4.913 -7.537 -1.638 1.00 0.29 C ATOM 399 N1 DT A 13 4.096 -7.573 -0.412 1.00 0.29 N ATOM 400 C2 DT A 13 4.721 -7.305 0.793 1.00 0.33 C ATOM 401 O2 DT A 13 5.918 -7.029 0.870 1.00 0.38 O ATOM 402 N3 DT A 13 3.924 -7.383 1.917 1.00 0.35 N ATOM 403 C4 DT A 13 2.581 -7.702 1.944 1.00 0.34 C ATOM 404 O4 DT A 13 1.970 -7.744 3.010 1.00 0.39 O ATOM 405 C5 DT A 13 2.016 -7.968 0.640 1.00 0.31 C ATOM 406 C7 DT A 13 0.553 -8.372 0.521 1.00 0.36 C ATOM 407 C6 DT A 13 2.770 -7.892 -0.472 1.00 0.29 C ATOM 0 H5' DT A 13 2.373 -5.735 -3.647 1.00 0.34 H new ATOM 0 H5'' DT A 13 2.582 -6.647 -5.128 1.00 0.34 H new ATOM 0 H4' DT A 13 4.737 -6.162 -4.497 1.00 0.30 H new ATOM 0 H3' DT A 13 4.261 -8.813 -4.657 1.00 0.30 H new ATOM 0 H2' DT A 13 3.807 -9.291 -2.311 1.00 0.31 H new ATOM 0 H2'' DT A 13 5.546 -9.506 -2.327 1.00 0.31 H new ATOM 0 H1' DT A 13 5.958 -7.483 -1.334 1.00 0.29 H new ATOM 0 H3 DT A 13 4.370 -7.186 2.813 1.00 0.35 H new ATOM 0 H71 DT A 13 0.157 -8.028 -0.435 1.00 0.36 H new ATOM 0 H72 DT A 13 0.469 -9.457 0.579 1.00 0.36 H new ATOM 0 H73 DT A 13 -0.016 -7.920 1.333 1.00 0.36 H new ATOM 0 H6 DT A 13 2.316 -8.088 -1.432 1.00 0.29 H new ATOM 420 P DG A 14 6.554 -8.309 -5.916 1.00 0.32 P ATOM 421 OP1 DG A 14 5.652 -9.317 -6.521 1.00 0.39 O ATOM 422 OP2 DG A 14 8.018 -8.483 -6.005 1.00 0.40 O ATOM 423 O5' DG A 14 6.175 -6.868 -6.516 1.00 0.31 O ATOM 424 C5' DG A 14 6.855 -5.690 -6.077 1.00 0.27 C ATOM 425 C4' DG A 14 6.177 -4.436 -6.610 1.00 0.20 C ATOM 426 O4' DG A 14 4.829 -4.397 -6.151 1.00 0.22 O ATOM 427 C3' DG A 14 6.848 -3.125 -6.184 1.00 0.19 C ATOM 428 O3' DG A 14 7.370 -2.434 -7.337 1.00 0.20 O ATOM 429 C2' DG A 14 5.734 -2.295 -5.544 1.00 0.20 C ATOM 430 C1' DG A 14 4.465 -3.041 -5.932 1.00 0.19 C ATOM 431 N9 DG A 14 3.443 -3.041 -4.892 1.00 0.20 N ATOM 432 C8 DG A 14 2.100 -2.851 -5.016 1.00 0.21 C ATOM 433 N7 DG A 14 1.457 -2.948 -3.893 1.00 0.21 N ATOM 434 C5 DG A 14 2.442 -3.219 -2.960 1.00 0.18 C ATOM 435 C6 DG A 14 2.329 -3.427 -1.564 1.00 0.18 C ATOM 436 O6 DG A 14 1.302 -3.429 -0.890 1.00 0.19 O ATOM 437 N1 DG A 14 3.578 -3.671 -0.986 1.00 0.18 N ATOM 438 C2 DG A 14 4.775 -3.708 -1.693 1.00 0.18 C ATOM 439 N2 DG A 14 5.890 -3.944 -1.009 1.00 0.22 N ATOM 440 N3 DG A 14 4.862 -3.513 -3.000 1.00 0.17 N ATOM 441 C4 DG A 14 3.663 -3.276 -3.564 1.00 0.17 C ATOM 0 H5' DG A 14 7.891 -5.718 -6.413 1.00 0.27 H new ATOM 0 H5'' DG A 14 6.874 -5.662 -4.988 1.00 0.27 H new ATOM 0 H4' DG A 14 6.249 -4.503 -7.696 1.00 0.20 H new ATOM 0 H3' DG A 14 7.680 -3.298 -5.502 1.00 0.19 H new ATOM 0 H2' DG A 14 5.849 -2.236 -4.462 1.00 0.20 H new ATOM 0 H2'' DG A 14 5.729 -1.272 -5.921 1.00 0.20 H new ATOM 0 H1' DG A 14 4.047 -2.542 -6.807 1.00 0.19 H new ATOM 0 H8 DG A 14 1.617 -2.640 -5.958 1.00 0.21 H new ATOM 0 H1 DG A 14 3.614 -3.833 0.020 1.00 0.18 H new ATOM 0 H21 DG A 14 6.787 -3.979 -1.493 1.00 0.22 H new ATOM 0 H22 DG A 14 5.848 -4.090 -0.000 1.00 0.22 H new ATOM 453 P DG A 15 6.550 -2.322 -8.730 1.00 0.21 P ATOM 454 OP1 DG A 15 5.948 -3.632 -9.043 1.00 0.25 O ATOM 455 OP2 DG A 15 7.431 -1.675 -9.729 1.00 0.28 O ATOM 456 O5' DG A 15 5.362 -1.301 -8.375 1.00 0.21 O ATOM 457 C5' DG A 15 4.291 -1.089 -9.296 1.00 0.27 C ATOM 458 C4' DG A 15 3.375 0.032 -8.828 1.00 0.25 C ATOM 459 O4' DG A 15 2.821 -0.308 -7.553 1.00 0.26 O ATOM 460 C3' DG A 15 4.083 1.384 -8.677 1.00 0.24 C ATOM 461 O3' DG A 15 3.381 2.359 -9.459 1.00 0.34 O ATOM 462 C2' DG A 15 3.951 1.711 -7.176 1.00 0.29 C ATOM 463 C1' DG A 15 2.754 0.873 -6.768 1.00 0.22 C ATOM 464 N9 DG A 15 2.746 0.479 -5.350 1.00 0.17 N ATOM 465 C8 DG A 15 3.806 0.147 -4.556 1.00 0.16 C ATOM 466 N7 DG A 15 3.485 -0.140 -3.339 1.00 0.15 N ATOM 467 C5 DG A 15 2.116 0.009 -3.313 1.00 0.14 C ATOM 468 C6 DG A 15 1.234 -0.174 -2.240 1.00 0.15 C ATOM 469 O6 DG A 15 1.518 -0.513 -1.105 1.00 0.18 O ATOM 470 N1 DG A 15 -0.078 0.074 -2.606 1.00 0.16 N ATOM 471 C2 DG A 15 -0.479 0.455 -3.869 1.00 0.17 C ATOM 472 N2 DG A 15 -1.779 0.653 -4.048 1.00 0.21 N ATOM 473 N3 DG A 15 0.365 0.628 -4.893 1.00 0.17 N ATOM 474 C4 DG A 15 1.645 0.387 -4.537 1.00 0.15 C ATOM 0 H5' DG A 15 3.717 -2.009 -9.407 1.00 0.27 H new ATOM 0 H5'' DG A 15 4.696 -0.845 -10.278 1.00 0.27 H new ATOM 0 H4' DG A 15 2.611 0.137 -9.598 1.00 0.25 H new ATOM 0 H3' DG A 15 5.122 1.373 -9.007 1.00 0.24 H new ATOM 0 H2' DG A 15 4.848 1.438 -6.620 1.00 0.29 H new ATOM 0 H2'' DG A 15 3.781 2.774 -7.005 1.00 0.29 H new ATOM 0 H1' DG A 15 1.853 1.467 -6.922 1.00 0.22 H new ATOM 0 H8 DG A 15 4.824 0.126 -4.915 1.00 0.16 H new ATOM 0 H1 DG A 15 -0.798 -0.033 -1.892 1.00 0.16 H new ATOM 0 H21 DG A 15 -2.131 0.936 -4.963 1.00 0.21 H new ATOM 0 H22 DG A 15 -2.427 0.522 -3.271 1.00 0.21 H new ATOM 486 P DG A 16 3.922 3.871 -9.602 1.00 0.43 P ATOM 487 OP1 DG A 16 4.810 3.943 -10.784 1.00 0.60 O ATOM 488 OP2 DG A 16 4.408 4.327 -8.282 1.00 0.51 O ATOM 489 O5' DG A 16 2.571 4.683 -9.936 1.00 0.42 O ATOM 490 C5' DG A 16 1.386 4.474 -9.158 1.00 0.41 C ATOM 491 C4' DG A 16 0.427 5.636 -9.264 1.00 0.33 C ATOM 492 O4' DG A 16 -0.893 5.176 -8.972 1.00 0.29 O ATOM 493 C3' DG A 16 0.757 6.798 -8.323 1.00 0.33 C ATOM 494 O3' DG A 16 1.314 7.882 -9.082 1.00 0.39 O ATOM 495 C2' DG A 16 -0.587 7.217 -7.731 1.00 0.28 C ATOM 496 C1' DG A 16 -1.509 6.029 -8.009 1.00 0.23 C ATOM 497 N9 DG A 16 -1.781 5.245 -6.802 1.00 0.18 N ATOM 498 C8 DG A 16 -2.967 5.088 -6.140 1.00 0.19 C ATOM 499 N7 DG A 16 -2.851 4.537 -4.985 1.00 0.17 N ATOM 500 C5 DG A 16 -1.511 4.297 -4.857 1.00 0.14 C ATOM 501 C6 DG A 16 -0.837 3.717 -3.784 1.00 0.13 C ATOM 502 O6 DG A 16 -1.343 3.369 -2.717 1.00 0.16 O ATOM 503 N1 DG A 16 0.540 3.631 -4.036 1.00 0.12 N ATOM 504 C2 DG A 16 1.147 4.071 -5.202 1.00 0.14 C ATOM 505 N2 DG A 16 2.447 3.878 -5.312 1.00 0.18 N ATOM 506 N3 DG A 16 0.491 4.631 -6.210 1.00 0.17 N ATOM 507 C4 DG A 16 -0.834 4.711 -5.967 1.00 0.16 C ATOM 0 H5' DG A 16 1.660 4.324 -8.114 1.00 0.41 H new ATOM 0 H5'' DG A 16 0.890 3.563 -9.491 1.00 0.41 H new ATOM 0 H4' DG A 16 0.512 6.017 -10.282 1.00 0.33 H new ATOM 0 H3' DG A 16 1.478 6.522 -7.553 1.00 0.33 H new ATOM 0 H2' DG A 16 -0.506 7.416 -6.662 1.00 0.28 H new ATOM 0 H2'' DG A 16 -0.961 8.128 -8.198 1.00 0.28 H new ATOM 0 H1' DG A 16 -2.455 6.426 -8.377 1.00 0.23 H new ATOM 0 H8 DG A 16 -3.916 5.399 -6.551 1.00 0.19 H new ATOM 0 H1 DG A 16 1.132 3.218 -3.315 1.00 0.12 H new ATOM 0 H21 DG A 16 2.939 4.184 -6.151 1.00 0.18 H new ATOM 0 H22 DG A 16 2.961 3.422 -4.558 1.00 0.18 H new ATOM 519 P DA A 17 2.073 9.112 -8.357 1.00 0.42 P ATOM 520 OP1 DA A 17 1.293 9.509 -7.160 1.00 0.47 O ATOM 521 OP2 DA A 17 2.402 10.124 -9.386 1.00 0.53 O ATOM 522 O5' DA A 17 3.450 8.442 -7.858 1.00 0.37 O ATOM 523 C5' DA A 17 3.570 7.894 -6.541 1.00 0.35 C ATOM 524 C4' DA A 17 5.022 7.756 -6.130 1.00 0.30 C ATOM 525 O4' DA A 17 5.131 7.811 -4.708 1.00 0.32 O ATOM 526 C3' DA A 17 5.638 6.447 -6.564 1.00 0.28 C ATOM 527 O3' DA A 17 7.046 6.614 -6.730 1.00 0.29 O ATOM 528 C2' DA A 17 5.347 5.529 -5.390 1.00 0.33 C ATOM 529 C1' DA A 17 5.247 6.479 -4.198 1.00 0.29 C ATOM 530 N9 DA A 17 4.077 6.230 -3.338 1.00 0.26 N ATOM 531 C8 DA A 17 2.751 6.249 -3.677 1.00 0.27 C ATOM 532 N7 DA A 17 1.949 5.982 -2.688 1.00 0.25 N ATOM 533 C5 DA A 17 2.805 5.771 -1.614 1.00 0.23 C ATOM 534 C6 DA A 17 2.573 5.450 -0.267 1.00 0.22 C ATOM 535 N6 DA A 17 1.356 5.275 0.241 1.00 0.24 N ATOM 536 N1 DA A 17 3.646 5.314 0.526 1.00 0.23 N ATOM 537 C2 DA A 17 4.857 5.488 0.013 1.00 0.24 C ATOM 538 N3 DA A 17 5.203 5.791 -1.229 1.00 0.25 N ATOM 539 C4 DA A 17 4.105 5.920 -2.000 1.00 0.24 C ATOM 0 H5' DA A 17 3.086 6.918 -6.506 1.00 0.35 H new ATOM 0 H5'' DA A 17 3.048 8.534 -5.830 1.00 0.35 H new ATOM 0 H4' DA A 17 5.549 8.576 -6.617 1.00 0.30 H new ATOM 0 H3' DA A 17 5.251 6.067 -7.510 1.00 0.28 H new ATOM 0 H2' DA A 17 4.421 4.973 -5.537 1.00 0.33 H new ATOM 0 H2'' DA A 17 6.140 4.795 -5.250 1.00 0.33 H new ATOM 0 H1' DA A 17 6.138 6.325 -3.589 1.00 0.29 H new ATOM 0 H8 DA A 17 2.402 6.466 -4.676 1.00 0.27 H new ATOM 0 H61 DA A 17 1.244 5.043 1.228 1.00 0.24 H new ATOM 0 H62 DA A 17 0.535 5.373 -0.356 1.00 0.24 H new ATOM 0 H2 DA A 17 5.676 5.365 0.706 1.00 0.24 H new ATOM 551 P DG A 18 7.971 5.386 -7.206 1.00 0.31 P ATOM 552 OP1 DG A 18 9.043 5.938 -8.061 1.00 0.40 O ATOM 553 OP2 DG A 18 7.105 4.302 -7.724 1.00 0.39 O ATOM 554 O5' DG A 18 8.634 4.890 -5.811 1.00 0.34 O ATOM 555 C5' DG A 18 9.083 3.532 -5.624 1.00 0.26 C ATOM 556 C4' DG A 18 9.528 3.276 -4.174 1.00 0.20 C ATOM 557 O4' DG A 18 8.454 3.599 -3.283 1.00 0.21 O ATOM 558 C3' DG A 18 9.909 1.827 -3.861 1.00 0.18 C ATOM 559 O3' DG A 18 10.799 1.809 -2.726 1.00 0.21 O ATOM 560 C2' DG A 18 8.566 1.228 -3.477 1.00 0.19 C ATOM 561 C1' DG A 18 7.941 2.383 -2.711 1.00 0.18 C ATOM 562 N9 DG A 18 6.483 2.459 -2.800 1.00 0.15 N ATOM 563 C8 DG A 18 5.711 2.759 -3.888 1.00 0.15 C ATOM 564 N7 DG A 18 4.459 2.879 -3.625 1.00 0.14 N ATOM 565 C5 DG A 18 4.379 2.638 -2.268 1.00 0.14 C ATOM 566 C6 DG A 18 3.248 2.642 -1.444 1.00 0.15 C ATOM 567 O6 DG A 18 2.106 2.910 -1.782 1.00 0.18 O ATOM 568 N1 DG A 18 3.573 2.339 -0.117 1.00 0.15 N ATOM 569 C2 DG A 18 4.853 2.075 0.329 1.00 0.15 C ATOM 570 N2 DG A 18 4.991 1.764 1.614 1.00 0.17 N ATOM 571 N3 DG A 18 5.924 2.083 -0.466 1.00 0.15 N ATOM 572 C4 DG A 18 5.608 2.371 -1.749 1.00 0.14 C ATOM 0 H5' DG A 18 9.912 3.326 -6.301 1.00 0.26 H new ATOM 0 H5'' DG A 18 8.279 2.843 -5.885 1.00 0.26 H new ATOM 0 H4' DG A 18 10.414 3.898 -4.044 1.00 0.20 H new ATOM 0 H3' DG A 18 10.411 1.301 -4.674 1.00 0.18 H new ATOM 0 H2' DG A 18 7.977 0.945 -4.349 1.00 0.19 H new ATOM 0 H2'' DG A 18 8.674 0.335 -2.861 1.00 0.19 H new ATOM 0 H1' DG A 18 8.191 2.233 -1.661 1.00 0.18 H new ATOM 0 H8 DG A 18 6.118 2.884 -4.881 1.00 0.15 H new ATOM 0 H1 DG A 18 2.815 2.311 0.565 1.00 0.15 H new ATOM 0 H21 DG A 18 5.916 1.560 1.993 1.00 0.17 H new ATOM 0 H22 DG A 18 4.172 1.729 2.221 1.00 0.17 H new ATOM 584 P DG A 19 11.426 0.440 -2.132 1.00 0.22 P ATOM 585 OP1 DG A 19 12.879 0.446 -2.410 1.00 0.27 O ATOM 586 OP2 DG A 19 10.600 -0.702 -2.581 1.00 0.27 O ATOM 587 O5' DG A 19 11.217 0.621 -0.543 1.00 0.29 O ATOM 588 C5' DG A 19 9.949 0.370 0.081 1.00 0.29 C ATOM 589 C4' DG A 19 10.119 -0.417 1.371 1.00 0.22 C ATOM 590 O4' DG A 19 8.944 -0.274 2.175 1.00 0.21 O ATOM 591 C3' DG A 19 10.347 -1.909 1.157 1.00 0.22 C ATOM 592 O3' DG A 19 11.253 -2.387 2.159 1.00 0.28 O ATOM 593 C2' DG A 19 8.960 -2.501 1.361 1.00 0.19 C ATOM 594 C1' DG A 19 8.372 -1.562 2.403 1.00 0.18 C ATOM 595 N9 DG A 19 6.907 -1.407 2.346 1.00 0.16 N ATOM 596 C8 DG A 19 6.016 -1.437 3.376 1.00 0.18 C ATOM 597 N7 DG A 19 4.786 -1.256 3.017 1.00 0.18 N ATOM 598 C5 DG A 19 4.856 -1.088 1.647 1.00 0.14 C ATOM 599 C6 DG A 19 3.815 -0.851 0.717 1.00 0.13 C ATOM 600 O6 DG A 19 2.618 -0.748 0.956 1.00 0.17 O ATOM 601 N1 DG A 19 4.306 -0.735 -0.583 1.00 0.13 N ATOM 602 C2 DG A 19 5.649 -0.842 -0.917 1.00 0.13 C ATOM 603 N2 DG A 19 5.970 -0.720 -2.193 1.00 0.17 N ATOM 604 N3 DG A 19 6.617 -1.066 -0.035 1.00 0.12 N ATOM 605 C4 DG A 19 6.152 -1.177 1.222 1.00 0.13 C ATOM 0 H5' DG A 19 9.306 -0.183 -0.604 1.00 0.29 H new ATOM 0 H5'' DG A 19 9.450 1.316 0.292 1.00 0.29 H new ATOM 0 H4' DG A 19 11.006 -0.008 1.854 1.00 0.22 H new ATOM 0 H3' DG A 19 10.774 -2.164 0.187 1.00 0.22 H new ATOM 0 H2' DG A 19 8.378 -2.506 0.440 1.00 0.19 H new ATOM 0 H2'' DG A 19 9.003 -3.531 1.716 1.00 0.19 H new ATOM 0 H1' DG A 19 8.600 -1.992 3.378 1.00 0.18 H new ATOM 0 H8 DG A 19 6.310 -1.598 4.403 1.00 0.18 H new ATOM 0 H1 DG A 19 3.638 -0.561 -1.334 1.00 0.13 H new ATOM 0 H21 DG A 19 6.945 -0.792 -2.483 1.00 0.17 H new ATOM 0 H22 DG A 19 5.242 -0.554 -2.888 1.00 0.17 H new ATOM 617 P DG A 20 11.701 -3.932 2.216 1.00 0.36 P ATOM 618 OP1 DG A 20 12.955 -4.024 2.997 1.00 0.47 O ATOM 619 OP2 DG A 20 11.644 -4.489 0.846 1.00 0.42 O ATOM 620 O5' DG A 20 10.515 -4.602 3.082 1.00 0.33 O ATOM 621 C5' DG A 20 10.356 -4.286 4.471 1.00 0.38 C ATOM 622 C4' DG A 20 9.065 -4.868 5.039 1.00 0.35 C ATOM 623 O4' DG A 20 7.940 -4.235 4.438 1.00 0.31 O ATOM 624 C3' DG A 20 8.899 -6.373 4.802 1.00 0.38 C ATOM 625 O3' DG A 20 9.190 -7.121 5.989 1.00 0.55 O ATOM 626 C2' DG A 20 7.431 -6.533 4.384 1.00 0.33 C ATOM 627 C1' DG A 20 6.849 -5.134 4.558 1.00 0.27 C ATOM 628 N9 DG A 20 5.839 -4.766 3.547 1.00 0.21 N ATOM 629 C8 DG A 20 6.011 -4.510 2.211 1.00 0.19 C ATOM 630 N7 DG A 20 4.919 -4.223 1.587 1.00 0.18 N ATOM 631 C5 DG A 20 3.948 -4.288 2.556 1.00 0.18 C ATOM 632 C6 DG A 20 2.569 -4.067 2.428 1.00 0.18 C ATOM 633 O6 DG A 20 1.963 -3.767 1.409 1.00 0.19 O ATOM 634 N1 DG A 20 1.914 -4.228 3.643 1.00 0.20 N ATOM 635 C2 DG A 20 2.537 -4.562 4.830 1.00 0.23 C ATOM 636 N2 DG A 20 1.762 -4.666 5.896 1.00 0.27 N ATOM 637 N3 DG A 20 3.851 -4.773 4.945 1.00 0.24 N ATOM 638 C4 DG A 20 4.490 -4.619 3.768 1.00 0.20 C ATOM 0 H5' DG A 20 10.355 -3.204 4.600 1.00 0.38 H new ATOM 0 H5'' DG A 20 11.207 -4.673 5.032 1.00 0.38 H new ATOM 0 H4' DG A 20 9.124 -4.691 6.113 1.00 0.35 H new ATOM 0 H3' DG A 20 9.586 -6.752 4.045 1.00 0.38 H new ATOM 0 H2' DG A 20 7.344 -6.877 3.354 1.00 0.33 H new ATOM 0 H2'' DG A 20 6.914 -7.262 5.008 1.00 0.33 H new ATOM 0 HO3' DG A 20 9.074 -8.077 5.810 1.00 0.55 H new ATOM 0 H1' DG A 20 6.341 -5.097 5.522 1.00 0.27 H new ATOM 0 H8 DG A 20 6.975 -4.545 1.725 1.00 0.19 H new ATOM 0 H1 DG A 20 0.904 -4.090 3.660 1.00 0.20 H new ATOM 0 H21 DG A 20 2.168 -4.910 6.800 1.00 0.27 H new ATOM 0 H22 DG A 20 0.759 -4.502 5.815 1.00 0.27 H new TER 650 DG A 20