USER MOD reduce.3.24.130724 H: found=0, std=0, add=274, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 274 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 Single : A 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot 11:sc= 1.22 USER MOD Single : A 2 DT C7 :methyl -30:sc= -4.25! (180deg=-5.21!) USER MOD Single : A 7 DT C7 :methyl 150:sc= -3.92! (180deg=-3.92!) USER MOD Single : A 8 DT C7 :methyl -30:sc= -0.254 (180deg=-1.6!) USER MOD Single : A 13 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 20 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 24 DG O3' : rot -29:sc= -1.12 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 9.310 11.520 3.498 1.00 0.80 O ATOM 2 C5' DT A 1 9.023 10.576 2.450 1.00 0.69 C ATOM 3 C4' DT A 1 7.672 9.887 2.687 1.00 0.59 C ATOM 4 O4' DT A 1 7.256 9.029 1.626 1.00 0.59 O ATOM 5 C3' DT A 1 7.812 8.951 3.884 1.00 0.57 C ATOM 6 O3' DT A 1 6.701 8.974 4.799 1.00 0.60 O ATOM 7 C2' DT A 1 7.904 7.556 3.263 1.00 0.49 C ATOM 8 C1' DT A 1 8.038 7.838 1.744 1.00 0.53 C ATOM 9 N1 DT A 1 9.376 7.802 1.066 1.00 0.66 N ATOM 10 C2 DT A 1 9.633 8.657 -0.007 1.00 0.77 C ATOM 11 O2 DT A 1 8.841 9.479 -0.455 1.00 0.81 O ATOM 12 N3 DT A 1 10.875 8.546 -0.590 1.00 0.94 N ATOM 13 C4 DT A 1 11.882 7.685 -0.224 1.00 1.01 C ATOM 14 O4 DT A 1 12.949 7.691 -0.831 1.00 1.18 O ATOM 15 C5 DT A 1 11.538 6.837 0.891 1.00 0.91 C ATOM 16 C7 DT A 1 12.527 5.807 1.441 1.00 1.04 C ATOM 17 C6 DT A 1 10.340 6.921 1.478 1.00 0.74 C ATOM 0 H5' DT A 1 9.814 9.827 2.403 1.00 0.69 H new ATOM 0 H5'' DT A 1 9.011 11.088 1.488 1.00 0.69 H new ATOM 0 H4' DT A 1 6.953 10.697 2.807 1.00 0.59 H new ATOM 0 H3' DT A 1 8.674 9.254 4.479 1.00 0.57 H new ATOM 0 H2' DT A 1 8.762 7.003 3.645 1.00 0.49 H new ATOM 0 H2'' DT A 1 7.018 6.960 3.483 1.00 0.49 H new ATOM 0 HO5' DT A 1 8.670 11.400 4.231 1.00 0.80 H new ATOM 0 H1' DT A 1 7.691 6.995 1.146 1.00 0.53 H new ATOM 0 H3 DT A 1 11.068 9.167 -1.375 1.00 0.94 H new ATOM 0 H71 DT A 1 12.350 5.666 2.507 1.00 1.04 H new ATOM 0 H72 DT A 1 12.391 4.858 0.922 1.00 1.04 H new ATOM 0 H73 DT A 1 13.546 6.162 1.286 1.00 1.04 H new ATOM 0 H6 DT A 1 10.124 6.268 2.311 1.00 0.74 H new ATOM 31 P DT A 2 6.515 10.190 5.841 1.00 0.68 P ATOM 32 OP1 DT A 2 7.530 11.209 5.477 1.00 0.81 O ATOM 33 OP2 DT A 2 6.487 9.629 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H new ATOM 0 H3' DT A 2 4.648 7.878 6.314 1.00 0.50 H new ATOM 0 H2' DT A 2 4.948 7.817 3.835 1.00 0.48 H new ATOM 0 H2'' DT A 2 3.993 6.366 4.068 1.00 0.48 H new ATOM 0 H1' DT A 2 1.863 7.630 3.805 1.00 0.51 H new ATOM 0 H3 DT A 2 0.873 7.805 -0.481 1.00 0.56 H new ATOM 0 H71 DT A 2 5.506 7.636 -1.417 1.00 0.48 H new ATOM 0 H72 DT A 2 5.733 9.255 -0.714 1.00 0.48 H new ATOM 0 H73 DT A 2 6.211 7.810 0.208 1.00 0.48 H new ATOM 0 H6 DT A 2 4.912 8.327 1.998 1.00 0.46 H new ATOM 63 P DG A 3 2.493 6.752 7.763 1.00 0.81 P ATOM 64 OP1 DG A 3 3.506 7.475 8.566 1.00 0.84 O ATOM 65 OP2 DG A 3 2.146 5.352 8.096 1.00 1.19 O ATOM 66 O5' DG A 3 1.154 7.651 7.761 1.00 0.99 O ATOM 67 C5' DG A 3 0.154 7.511 6.745 1.00 0.92 C ATOM 68 C4' DG A 3 -1.159 6.984 7.289 1.00 0.86 C ATOM 69 O4' DG A 3 -2.055 6.833 6.185 1.00 0.79 O ATOM 70 C3' DG A 3 -1.096 5.597 7.941 1.00 0.81 C ATOM 71 O3' DG A 3 -2.237 5.429 8.797 1.00 0.98 O ATOM 72 C2' DG A 3 -1.142 4.734 6.705 1.00 0.63 C ATOM 73 C1' DG A 3 -2.270 5.435 6.007 1.00 0.63 C ATOM 74 N9 DG A 3 -2.315 5.103 4.586 1.00 0.50 N ATOM 75 C8 DG A 3 -3.440 4.864 3.889 1.00 0.49 C ATOM 76 N7 DG A 3 -3.238 4.602 2.641 1.00 0.50 N ATOM 77 C5 DG A 3 -1.872 4.672 2.489 1.00 0.45 C ATOM 78 C6 DG A 3 -1.094 4.475 1.332 1.00 0.48 C ATOM 79 O6 DG A 3 -1.483 4.196 0.202 1.00 0.60 O ATOM 80 N1 DG A 3 0.237 4.634 1.601 1.00 0.44 N ATOM 81 C2 DG A 3 0.761 4.943 2.830 1.00 0.48 C ATOM 82 N2 DG A 3 2.071 5.053 2.905 1.00 0.55 N ATOM 83 N3 DG A 3 0.042 5.132 3.932 1.00 0.52 N ATOM 84 C4 DG A 3 -1.277 4.980 3.683 1.00 0.46 C ATOM 0 H5' DG A 3 0.520 6.836 5.971 1.00 0.92 H new ATOM 0 H5'' DG A 3 -0.015 8.478 6.271 1.00 0.92 H new ATOM 0 H4' DG A 3 -1.463 7.700 8.053 1.00 0.86 H new ATOM 0 H3' DG A 3 -0.240 5.385 8.582 1.00 0.81 H new ATOM 0 H2' DG A 3 -0.212 4.754 6.137 1.00 0.63 H new ATOM 0 H2'' DG A 3 -1.360 3.689 6.923 1.00 0.63 H new ATOM 0 H1' DG A 3 -3.226 5.121 6.427 1.00 0.63 H new ATOM 0 H8 DG A 3 -4.424 4.889 4.333 1.00 0.49 H new ATOM 0 H1 DG A 3 0.891 4.513 0.828 1.00 0.44 H new ATOM 0 H21 DG A 3 2.513 5.281 3.795 1.00 0.55 H new ATOM 0 H22 DG A 3 2.643 4.910 2.073 1.00 0.55 H new ATOM 96 P DG A 4 -2.444 4.134 9.735 1.00 1.13 P ATOM 97 OP1 DG A 4 -3.293 4.529 10.882 1.00 1.45 O ATOM 98 OP2 DG A 4 -1.124 3.507 9.973 1.00 1.26 O ATOM 99 O5' DG A 4 -3.297 3.173 8.772 1.00 0.92 O ATOM 100 C5' DG A 4 -4.666 3.468 8.459 1.00 0.84 C ATOM 101 C4' DG A 4 -5.152 2.609 7.307 1.00 0.56 C ATOM 102 O4' DG A 4 -4.394 2.812 6.091 1.00 0.40 O ATOM 103 C3' DG A 4 -5.053 1.119 7.632 1.00 0.57 C ATOM 104 O3' DG A 4 -6.239 0.488 7.133 1.00 0.62 O ATOM 105 C2' DG A 4 -3.823 0.737 6.833 1.00 0.47 C ATOM 106 C1' DG A 4 -4.142 1.511 5.560 1.00 0.31 C ATOM 107 N9 DG A 4 -3.044 1.437 4.570 1.00 0.27 N ATOM 108 C8 DG A 4 -1.676 1.465 4.729 1.00 0.30 C ATOM 109 N7 DG A 4 -1.011 1.378 3.606 1.00 0.32 N ATOM 110 C5 DG A 4 -2.010 1.284 2.643 1.00 0.31 C ATOM 111 C6 DG A 4 -1.917 1.164 1.235 1.00 0.38 C ATOM 112 O6 DG A 4 -0.921 1.119 0.529 1.00 0.46 O ATOM 113 N1 DG A 4 -3.152 1.096 0.649 1.00 0.41 N ATOM 114 C2 DG A 4 -4.344 1.139 1.323 1.00 0.37 C ATOM 115 N2 DG A 4 -5.458 1.061 0.633 1.00 0.44 N ATOM 116 N3 DG A 4 -4.452 1.252 2.636 1.00 0.30 N ATOM 117 C4 DG A 4 -3.244 1.319 3.230 1.00 0.26 C ATOM 0 H5' DG A 4 -4.766 4.522 8.200 1.00 0.84 H new ATOM 0 H5'' DG A 4 -5.290 3.295 9.336 1.00 0.84 H new ATOM 0 H4' DG A 4 -6.187 2.915 7.157 1.00 0.56 H new ATOM 0 H3' DG A 4 -4.975 0.846 8.684 1.00 0.57 H new ATOM 0 H2' DG A 4 -2.894 1.059 7.304 1.00 0.47 H new ATOM 0 H2'' DG A 4 -3.741 -0.337 6.667 1.00 0.47 H new ATOM 0 H1' DG A 4 -4.980 1.129 4.977 1.00 0.31 H new ATOM 0 H8 DG A 4 -1.196 1.551 5.693 1.00 0.30 H new ATOM 0 H1 DG A 4 -3.188 1.007 -0.366 1.00 0.41 H new ATOM 0 H21 DG A 4 -6.358 1.091 1.112 1.00 0.44 H new ATOM 0 H22 DG A 4 -5.424 0.971 -0.382 1.00 0.44 H new ATOM 129 P DG A 5 -7.295 -0.196 8.138 1.00 0.62 P ATOM 130 OP1 DG A 5 -8.618 0.428 7.902 1.00 0.95 O ATOM 131 OP2 DG A 5 -6.718 -0.212 9.502 1.00 0.85 O ATOM 132 O5' DG A 5 -7.327 -1.710 7.612 1.00 0.63 O ATOM 133 C5' DG A 5 -8.502 -2.220 6.974 1.00 0.72 C ATOM 134 C4' DG A 5 -8.167 -3.346 6.034 1.00 0.67 C ATOM 135 O4' DG A 5 -7.280 -2.934 4.989 1.00 0.77 O ATOM 136 C3' DG A 5 -7.542 -4.564 6.693 1.00 0.57 C ATOM 137 O3' DG A 5 -8.147 -5.657 5.987 1.00 0.81 O ATOM 138 C2' DG A 5 -6.138 -4.483 6.252 1.00 0.60 C ATOM 139 C1' DG A 5 -6.315 -3.967 4.829 1.00 0.71 C ATOM 140 N9 DG A 5 -5.105 -3.327 4.305 1.00 0.67 N ATOM 141 C8 DG A 5 -4.043 -2.783 4.975 1.00 0.70 C ATOM 142 N7 DG A 5 -3.134 -2.275 4.197 1.00 0.70 N ATOM 143 C5 DG A 5 -3.635 -2.500 2.925 1.00 0.67 C ATOM 144 C6 DG A 5 -3.091 -2.171 1.673 1.00 0.69 C ATOM 145 O6 DG A 5 -2.031 -1.616 1.424 1.00 0.75 O ATOM 146 N1 DG A 5 -3.906 -2.570 0.655 1.00 0.70 N ATOM 147 C2 DG A 5 -5.103 -3.212 0.801 1.00 0.68 C ATOM 148 N2 DG A 5 -5.755 -3.518 -0.299 1.00 0.70 N ATOM 149 N3 DG A 5 -5.634 -3.534 1.968 1.00 0.66 N ATOM 150 C4 DG A 5 -4.840 -3.144 2.986 1.00 0.65 C ATOM 0 H5' DG A 5 -8.997 -1.419 6.424 1.00 0.72 H new ATOM 0 H5'' DG A 5 -9.206 -2.571 7.729 1.00 0.72 H new ATOM 0 H4' DG A 5 -9.142 -3.629 5.638 1.00 0.67 H new ATOM 0 H3' DG A 5 -7.648 -4.648 7.775 1.00 0.57 H new ATOM 0 H2' DG A 5 -5.550 -3.803 6.868 1.00 0.60 H new ATOM 0 H2'' DG A 5 -5.639 -5.452 6.281 1.00 0.60 H new ATOM 0 H1' DG A 5 -6.575 -4.779 4.150 1.00 0.71 H new ATOM 0 H8 DG A 5 -3.967 -2.776 6.052 1.00 0.70 H new ATOM 0 H1 DG A 5 -3.595 -2.372 -0.296 1.00 0.70 H new ATOM 0 H21 DG A 5 -6.653 -3.998 -0.243 1.00 0.70 H new ATOM 0 H22 DG A 5 -5.362 -3.276 -1.209 1.00 0.70 H new ATOM 162 P DG A 6 -8.483 -7.177 6.375 1.00 0.68 P ATOM 163 OP1 DG A 6 -8.722 -7.851 5.080 1.00 1.20 O ATOM 164 OP2 DG A 6 -9.544 -7.176 7.406 1.00 1.36 O ATOM 165 O5' DG A 6 -7.155 -7.813 7.016 1.00 0.63 O ATOM 166 C5' DG A 6 -6.399 -8.883 6.422 1.00 0.49 C ATOM 167 C4' DG A 6 -4.983 -8.735 6.913 1.00 0.55 C ATOM 168 O4' DG A 6 -4.355 -7.690 6.164 1.00 0.56 O ATOM 169 C3' DG A 6 -4.019 -9.857 6.584 1.00 0.61 C ATOM 170 O3' DG A 6 -4.034 -10.216 5.198 1.00 0.60 O ATOM 171 C2' DG A 6 -2.718 -9.209 6.889 1.00 0.79 C ATOM 172 C1' DG A 6 -2.985 -7.741 6.565 1.00 0.57 C ATOM 173 N9 DG A 6 -2.954 -6.794 7.705 1.00 0.96 N ATOM 174 C8 DG A 6 -3.138 -5.432 7.695 1.00 1.20 C ATOM 175 N7 DG A 6 -3.080 -4.874 8.865 1.00 1.63 N ATOM 176 C5 DG A 6 -2.841 -5.941 9.721 1.00 1.69 C ATOM 177 C6 DG A 6 -2.681 -5.959 11.127 1.00 2.14 C ATOM 178 O6 DG A 6 -2.717 -5.033 11.928 1.00 2.55 O ATOM 179 N1 DG A 6 -2.462 -7.232 11.593 1.00 2.19 N ATOM 180 C2 DG A 6 -2.399 -8.354 10.814 1.00 1.90 C ATOM 181 N2 DG A 6 -2.174 -9.500 11.429 1.00 2.16 N ATOM 182 N3 DG A 6 -2.543 -8.360 9.501 1.00 1.47 N ATOM 183 C4 DG A 6 -2.763 -7.115 9.021 1.00 1.33 C ATOM 0 H5' DG A 6 -6.439 -8.828 5.334 1.00 0.49 H new ATOM 0 H5'' DG A 6 -6.809 -9.852 6.708 1.00 0.49 H new ATOM 0 H4' DG A 6 -5.119 -8.626 7.989 1.00 0.55 H new ATOM 0 H3' DG A 6 -4.247 -10.775 7.125 1.00 0.61 H new ATOM 0 H2' DG A 6 -2.432 -9.347 7.932 1.00 0.79 H new ATOM 0 H2'' DG A 6 -1.911 -9.617 6.281 1.00 0.79 H new ATOM 0 H1' DG A 6 -2.211 -7.450 5.855 1.00 0.57 H new ATOM 0 H8 DG A 6 -3.316 -4.873 6.788 1.00 1.20 H new ATOM 0 H1 DG A 6 -2.337 -7.350 12.598 1.00 2.19 H new ATOM 0 H21 DG A 6 -2.118 -10.365 10.891 1.00 2.16 H new ATOM 0 H22 DG A 6 -2.056 -9.521 12.442 1.00 2.16 H new ATOM 195 P DT A 7 -3.524 -11.661 4.737 1.00 0.72 P ATOM 196 OP1 DT A 7 -3.448 -11.666 3.258 1.00 0.85 O ATOM 197 OP2 DT A 7 -4.335 -12.678 5.442 1.00 1.07 O ATOM 198 O5' DT A 7 -2.018 -11.719 5.340 1.00 0.76 O ATOM 199 C5' DT A 7 -0.804 -11.636 4.575 1.00 0.68 C ATOM 200 C4' DT A 7 -0.719 -10.361 3.725 1.00 0.43 C ATOM 201 O4' DT A 7 -0.771 -9.124 4.439 1.00 0.39 O ATOM 202 C3' DT A 7 0.595 -10.280 2.914 1.00 0.42 C ATOM 203 O3' DT A 7 0.535 -9.305 1.834 1.00 0.38 O ATOM 204 C2' DT A 7 1.459 -9.722 4.059 1.00 0.44 C ATOM 205 C1' DT A 7 0.557 -8.599 4.535 1.00 0.43 C ATOM 206 N1 DT A 7 0.595 -7.973 5.858 1.00 0.64 N ATOM 207 C2 DT A 7 0.605 -6.583 5.858 1.00 0.82 C ATOM 208 O2 DT A 7 0.646 -5.905 4.834 1.00 0.82 O ATOM 209 N3 DT A 7 0.573 -5.970 7.071 1.00 1.07 N ATOM 210 C4 DT A 7 0.529 -6.601 8.281 1.00 1.19 C ATOM 211 O4 DT A 7 0.497 -5.939 9.310 1.00 1.43 O ATOM 212 C5 DT A 7 0.521 -8.042 8.193 1.00 1.07 C ATOM 213 C7 DT A 7 0.428 -8.867 9.440 1.00 1.33 C ATOM 214 C6 DT A 7 0.561 -8.682 7.022 1.00 0.81 C ATOM 0 H5' DT A 7 -0.731 -12.507 3.923 1.00 0.68 H new ATOM 0 H5'' DT A 7 0.049 -11.673 5.252 1.00 0.68 H new ATOM 0 H4' DT A 7 -1.609 -10.463 3.104 1.00 0.43 H new ATOM 0 H3' DT A 7 0.905 -11.200 2.419 1.00 0.42 H new ATOM 0 H2' DT A 7 1.652 -10.462 4.836 1.00 0.44 H new ATOM 0 H2'' DT A 7 2.428 -9.362 3.714 1.00 0.44 H new ATOM 0 H1' DT A 7 0.925 -7.786 3.909 1.00 0.43 H new ATOM 0 H3 DT A 7 0.583 -4.950 7.078 1.00 1.07 H new ATOM 0 H71 DT A 7 -0.081 -9.805 9.219 1.00 1.33 H new ATOM 0 H72 DT A 7 1.430 -9.077 9.813 1.00 1.33 H new ATOM 0 H73 DT A 7 -0.133 -8.320 10.197 1.00 1.33 H new ATOM 0 H6 DT A 7 0.566 -9.762 6.997 1.00 0.81 H new ATOM 227 P DT A 8 1.798 -8.467 1.207 1.00 0.43 P ATOM 228 OP1 DT A 8 3.056 -9.014 1.768 1.00 0.50 O ATOM 229 OP2 DT A 8 1.486 -7.030 1.373 1.00 0.50 O ATOM 230 O5' DT A 8 1.787 -8.780 -0.383 1.00 0.53 O ATOM 231 C5' DT A 8 2.258 -9.977 -1.025 1.00 0.58 C ATOM 232 C4' DT A 8 1.537 -10.196 -2.356 1.00 0.59 C ATOM 233 O4' DT A 8 0.116 -10.287 -2.117 1.00 0.56 O ATOM 234 C3' DT A 8 1.740 -9.069 -3.407 1.00 0.60 C ATOM 235 O3' DT A 8 1.710 -9.473 -4.788 1.00 0.60 O ATOM 236 C2' DT A 8 0.524 -8.151 -3.127 1.00 0.58 C ATOM 237 C1' DT A 8 -0.584 -9.220 -2.786 1.00 0.56 C ATOM 238 N1 DT A 8 -1.594 -8.571 -1.907 1.00 0.56 N ATOM 239 C2 DT A 8 -2.816 -8.243 -2.472 1.00 0.76 C ATOM 240 O2 DT A 8 -3.104 -8.475 -3.640 1.00 0.89 O ATOM 241 N3 DT A 8 -3.728 -7.634 -1.650 1.00 0.84 N ATOM 242 C4 DT A 8 -3.550 -7.320 -0.328 1.00 0.70 C ATOM 243 O4 DT A 8 -4.454 -6.767 0.294 1.00 0.84 O ATOM 244 C5 DT A 8 -2.258 -7.692 0.197 1.00 0.50 C ATOM 245 C7 DT A 8 -1.951 -7.393 1.663 1.00 0.45 C ATOM 246 C6 DT A 8 -1.339 -8.293 -0.591 1.00 0.47 C ATOM 0 H5' DT A 8 2.095 -10.834 -0.372 1.00 0.58 H new ATOM 0 H5'' DT A 8 3.332 -9.906 -1.195 1.00 0.58 H new ATOM 0 H4' DT A 8 1.970 -11.109 -2.764 1.00 0.59 H new ATOM 0 H3' DT A 8 2.732 -8.631 -3.298 1.00 0.60 H new ATOM 0 H2' DT A 8 0.706 -7.466 -2.299 1.00 0.58 H new ATOM 0 H2'' DT A 8 0.258 -7.542 -3.991 1.00 0.58 H new ATOM 0 H1' DT A 8 -1.113 -9.608 -3.657 1.00 0.56 H new ATOM 0 H3 DT A 8 -4.628 -7.390 -2.063 1.00 0.84 H new ATOM 0 H71 DT A 8 -2.501 -6.506 1.976 1.00 0.45 H new ATOM 0 H72 DT A 8 -2.251 -8.242 2.278 1.00 0.45 H new ATOM 0 H73 DT A 8 -0.882 -7.218 1.782 1.00 0.45 H new ATOM 0 H6 DT A 8 -0.380 -8.560 -0.172 1.00 0.47 H new ATOM 259 P DG A 9 2.663 -8.733 -5.888 1.00 0.54 P ATOM 260 OP1 DG A 9 2.909 -9.696 -6.984 1.00 0.64 O ATOM 261 OP2 DG A 9 3.810 -8.160 -5.140 1.00 0.65 O ATOM 262 O5' DG A 9 1.831 -7.484 -6.492 1.00 0.55 O ATOM 263 C5' DG A 9 0.527 -7.603 -7.089 1.00 0.49 C ATOM 264 C4' DG A 9 -0.311 -6.349 -6.800 1.00 0.35 C ATOM 265 O4' DG A 9 -0.175 -6.043 -5.404 1.00 0.31 O ATOM 266 C3' DG A 9 0.079 -5.090 -7.558 1.00 0.33 C ATOM 267 O3' DG A 9 -1.063 -4.250 -7.718 1.00 0.40 O ATOM 268 C2' DG A 9 1.121 -4.437 -6.666 1.00 0.30 C ATOM 269 C1' DG A 9 0.516 -4.795 -5.284 1.00 0.24 C ATOM 270 N9 DG A 9 1.406 -4.710 -4.103 1.00 0.23 N ATOM 271 C8 DG A 9 2.760 -4.723 -4.067 1.00 0.24 C ATOM 272 N7 DG A 9 3.286 -4.617 -2.883 1.00 0.25 N ATOM 273 C5 DG A 9 2.177 -4.523 -2.051 1.00 0.25 C ATOM 274 C6 DG A 9 2.102 -4.385 -0.637 1.00 0.31 C ATOM 275 O6 DG A 9 2.994 -4.287 0.196 1.00 0.36 O ATOM 276 N1 DG A 9 0.807 -4.329 -0.207 1.00 0.36 N ATOM 277 C2 DG A 9 -0.289 -4.392 -1.018 1.00 0.37 C ATOM 278 N2 DG A 9 -1.451 -4.302 -0.412 1.00 0.47 N ATOM 279 N3 DG A 9 -0.254 -4.519 -2.341 1.00 0.32 N ATOM 280 C4 DG A 9 1.020 -4.580 -2.790 1.00 0.25 C ATOM 0 H5' DG A 9 0.020 -8.485 -6.698 1.00 0.49 H new ATOM 0 H5'' DG A 9 0.624 -7.743 -8.166 1.00 0.49 H new ATOM 0 H4' DG A 9 -1.321 -6.602 -7.122 1.00 0.35 H new ATOM 0 H3' DG A 9 0.461 -5.286 -8.560 1.00 0.33 H new ATOM 0 H2' DG A 9 2.118 -4.853 -6.810 1.00 0.30 H new ATOM 0 H2'' DG A 9 1.198 -3.362 -6.826 1.00 0.30 H new ATOM 0 H1' DG A 9 -0.182 -3.994 -5.040 1.00 0.24 H new ATOM 0 H8 DG A 9 3.361 -4.815 -4.960 1.00 0.24 H new ATOM 0 H1 DG A 9 0.647 -4.233 0.796 1.00 0.36 H new ATOM 0 H21 DG A 9 -2.314 -4.341 -0.955 1.00 0.47 H new ATOM 0 H22 DG A 9 -1.491 -4.193 0.601 1.00 0.47 H new ATOM 292 P DG A 10 -1.097 -3.100 -8.847 1.00 0.37 P ATOM 293 OP1 DG A 10 -0.661 -3.678 -10.141 1.00 0.47 O ATOM 294 OP2 DG A 10 -0.397 -1.913 -8.304 1.00 0.59 O ATOM 295 O5' DG A 10 -2.657 -2.755 -8.935 1.00 0.45 O ATOM 296 C5' DG A 10 -3.614 -3.720 -9.386 1.00 0.49 C ATOM 297 C4' DG A 10 -4.938 -3.549 -8.651 1.00 0.56 C ATOM 298 O4' DG A 10 -4.841 -3.763 -7.239 1.00 0.52 O ATOM 299 C3' DG A 10 -5.568 -2.164 -8.847 1.00 0.62 C ATOM 300 O3' DG A 10 -6.912 -2.426 -9.261 1.00 0.79 O ATOM 301 C2' DG A 10 -5.505 -1.549 -7.417 1.00 0.54 C ATOM 302 C1' DG A 10 -5.678 -2.814 -6.580 1.00 0.53 C ATOM 303 N9 DG A 10 -5.131 -2.642 -5.222 1.00 0.47 N ATOM 304 C8 DG A 10 -5.788 -2.791 -4.038 1.00 0.52 C ATOM 305 N7 DG A 10 -5.031 -2.604 -2.990 1.00 0.53 N ATOM 306 C5 DG A 10 -3.781 -2.308 -3.525 1.00 0.44 C ATOM 307 C6 DG A 10 -2.551 -2.010 -2.880 1.00 0.44 C ATOM 308 O6 DG A 10 -2.310 -1.941 -1.683 1.00 0.52 O ATOM 309 N1 DG A 10 -1.545 -1.773 -3.774 1.00 0.41 N ATOM 310 C2 DG A 10 -1.685 -1.810 -5.128 1.00 0.43 C ATOM 311 N2 DG A 10 -0.612 -1.542 -5.833 1.00 0.50 N ATOM 312 N3 DG A 10 -2.819 -2.087 -5.756 1.00 0.43 N ATOM 313 C4 DG A 10 -3.831 -2.327 -4.891 1.00 0.42 C ATOM 0 H5' DG A 10 -3.228 -4.726 -9.222 1.00 0.49 H new ATOM 0 H5'' DG A 10 -3.771 -3.610 -10.459 1.00 0.49 H new ATOM 0 H4' DG A 10 -5.567 -4.316 -9.102 1.00 0.56 H new ATOM 0 H3' DG A 10 -5.099 -1.500 -9.573 1.00 0.62 H new ATOM 0 H2' DG A 10 -4.559 -1.045 -7.221 1.00 0.54 H new ATOM 0 H2'' DG A 10 -6.296 -0.821 -7.241 1.00 0.54 H new ATOM 0 H1' DG A 10 -6.729 -3.089 -6.493 1.00 0.53 H new ATOM 0 H8 DG A 10 -6.837 -3.040 -3.972 1.00 0.52 H new ATOM 0 H1 DG A 10 -0.622 -1.552 -3.400 1.00 0.41 H new ATOM 0 H21 DG A 10 -0.655 -1.554 -6.852 1.00 0.50 H new ATOM 0 H22 DG A 10 0.266 -1.321 -5.362 1.00 0.50 H new ATOM 325 P DG A 11 -7.807 -1.386 -10.109 1.00 0.88 P ATOM 326 OP1 DG A 11 -8.500 -2.141 -11.177 1.00 1.17 O ATOM 327 OP2 DG A 11 -6.972 -0.213 -10.457 1.00 1.13 O ATOM 328 O5' DG A 11 -8.909 -0.911 -9.046 1.00 1.00 O ATOM 329 C5' DG A 11 -9.316 -1.730 -7.945 1.00 0.86 C ATOM 330 C4' DG A 11 -9.084 -0.914 -6.710 1.00 0.63 C ATOM 331 O4' DG A 11 -8.247 -1.277 -5.619 1.00 0.60 O ATOM 332 C3' DG A 11 -9.862 0.378 -6.425 1.00 0.57 C ATOM 333 O3' DG A 11 -10.835 0.176 -5.383 1.00 0.51 O ATOM 334 C2' DG A 11 -8.720 1.084 -5.728 1.00 0.54 C ATOM 335 C1' DG A 11 -8.270 -0.071 -4.850 1.00 0.48 C ATOM 336 N9 DG A 11 -7.089 0.162 -4.022 1.00 0.42 N ATOM 337 C8 DG A 11 -7.064 0.044 -2.677 1.00 0.41 C ATOM 338 N7 DG A 11 -5.917 0.281 -2.135 1.00 0.38 N ATOM 339 C5 DG A 11 -5.109 0.586 -3.213 1.00 0.34 C ATOM 340 C6 DG A 11 -3.748 0.930 -3.230 1.00 0.31 C ATOM 341 O6 DG A 11 -2.991 1.029 -2.274 1.00 0.35 O ATOM 342 N1 DG A 11 -3.294 1.160 -4.494 1.00 0.33 N ATOM 343 C2 DG A 11 -4.061 1.074 -5.625 1.00 0.39 C ATOM 344 N2 DG A 11 -3.448 1.321 -6.763 1.00 0.46 N ATOM 345 N3 DG A 11 -5.353 0.753 -5.636 1.00 0.42 N ATOM 346 C4 DG A 11 -5.812 0.519 -4.387 1.00 0.38 C ATOM 0 H5' DG A 11 -8.741 -2.655 -7.914 1.00 0.86 H new ATOM 0 H5'' DG A 11 -10.365 -2.010 -8.035 1.00 0.86 H new ATOM 0 H4' DG A 11 -8.565 -1.211 -7.621 1.00 0.63 H new ATOM 0 H3' DG A 11 -10.366 0.821 -7.284 1.00 0.57 H new ATOM 0 H2' DG A 11 -7.946 1.424 -6.416 1.00 0.54 H new ATOM 0 H2'' DG A 11 -9.042 1.954 -5.156 1.00 0.54 H new ATOM 0 H1' DG A 11 -9.022 -0.180 -4.069 1.00 0.48 H new ATOM 0 H8 DG A 11 -7.936 -0.227 -2.100 1.00 0.41 H new ATOM 0 H1 DG A 11 -2.313 1.414 -4.606 1.00 0.33 H new ATOM 0 H21 DG A 11 -3.964 1.273 -7.641 1.00 0.46 H new ATOM 0 H22 DG A 11 -2.456 1.560 -6.767 1.00 0.46 H new ATOM 358 P DG A 12 -12.280 0.892 -5.343 1.00 0.51 P ATOM 359 OP1 DG A 12 -13.242 -0.044 -4.722 1.00 0.73 O ATOM 360 OP2 DG A 12 -12.563 1.463 -6.682 1.00 0.65 O ATOM 361 O5' DG A 12 -12.031 2.092 -4.304 1.00 0.49 O ATOM 362 C5' DG A 12 -11.787 3.453 -4.668 1.00 0.52 C ATOM 363 C4' DG A 12 -10.821 4.065 -3.671 1.00 0.47 C ATOM 364 O4' DG A 12 -9.523 3.463 -3.719 1.00 0.42 O ATOM 365 C3' DG A 12 -10.604 5.556 -3.897 1.00 0.59 C ATOM 366 O3' DG A 12 -10.974 6.265 -2.716 1.00 0.68 O ATOM 367 C2' DG A 12 -9.111 5.669 -4.027 1.00 0.56 C ATOM 368 C1' DG A 12 -8.696 4.496 -3.209 1.00 0.43 C ATOM 369 N9 DG A 12 -7.265 4.280 -3.403 1.00 0.42 N ATOM 370 C8 DG A 12 -6.595 4.117 -4.574 1.00 0.51 C ATOM 371 N7 DG A 12 -5.314 3.987 -4.424 1.00 0.51 N ATOM 372 C5 DG A 12 -5.119 4.069 -3.061 1.00 0.42 C ATOM 373 C6 DG A 12 -3.923 3.996 -2.311 1.00 0.44 C ATOM 374 O6 DG A 12 -2.774 3.857 -2.711 1.00 0.48 O ATOM 375 N1 DG A 12 -4.171 4.118 -0.974 1.00 0.51 N ATOM 376 C2 DG A 12 -5.421 4.292 -0.431 1.00 0.57 C ATOM 377 N2 DG A 12 -5.510 4.380 0.866 1.00 0.75 N ATOM 378 N3 DG A 12 -6.551 4.366 -1.111 1.00 0.50 N ATOM 379 C4 DG A 12 -6.318 4.244 -2.426 1.00 0.41 C ATOM 0 H5' DG A 12 -12.722 4.013 -4.679 1.00 0.52 H new ATOM 0 H5'' DG A 12 -11.372 3.505 -5.675 1.00 0.52 H new ATOM 0 H4' DG A 12 -11.295 3.887 -2.706 1.00 0.47 H new ATOM 0 H3' DG A 12 -11.168 5.943 -4.745 1.00 0.59 H new ATOM 0 H2' DG A 12 -8.775 5.597 -5.061 1.00 0.56 H new ATOM 0 H2'' DG A 12 -8.727 6.610 -3.633 1.00 0.56 H new ATOM 0 H1' DG A 12 -8.818 4.588 -2.130 1.00 0.43 H new ATOM 0 H8 DG A 12 -7.083 4.098 -5.537 1.00 0.51 H new ATOM 0 H1 DG A 12 -3.376 4.077 -0.336 1.00 0.51 H new ATOM 0 H21 DG A 12 -6.421 4.510 1.307 1.00 0.75 H new ATOM 0 H22 DG A 12 -4.669 4.319 1.440 1.00 0.75 H new ATOM 391 P DT A 13 -11.623 7.718 -2.862 1.00 1.16 P ATOM 392 OP1 DT A 13 -13.039 7.627 -2.450 1.00 1.80 O ATOM 393 OP2 DT A 13 -11.267 8.277 -4.186 1.00 1.76 O ATOM 394 O5' DT A 13 -10.846 8.566 -1.760 1.00 1.30 O ATOM 395 C5' DT A 13 -11.216 9.941 -1.609 1.00 1.39 C ATOM 396 C4' DT A 13 -10.059 10.756 -1.077 1.00 1.25 C ATOM 397 O4' DT A 13 -9.581 10.208 0.157 1.00 1.16 O ATOM 398 C3' DT A 13 -8.853 10.828 -2.042 1.00 1.17 C ATOM 399 O3' DT A 13 -8.103 12.011 -1.722 1.00 1.23 O ATOM 400 C2' DT A 13 -8.135 9.554 -1.572 1.00 0.98 C ATOM 401 C1' DT A 13 -8.231 9.793 -0.039 1.00 1.04 C ATOM 402 N1 DT A 13 -7.979 8.547 0.708 1.00 1.04 N ATOM 403 C2 DT A 13 -6.852 8.459 1.500 1.00 1.19 C ATOM 404 O2 DT A 13 -6.031 9.363 1.616 1.00 1.31 O ATOM 405 N3 DT A 13 -6.684 7.277 2.173 1.00 1.30 N ATOM 406 C4 DT A 13 -7.524 6.189 2.131 1.00 1.24 C ATOM 407 O4 DT A 13 -7.247 5.187 2.784 1.00 1.40 O ATOM 408 C5 DT A 13 -8.680 6.365 1.279 1.00 1.07 C ATOM 409 C7 DT A 13 -9.715 5.245 1.131 1.00 1.06 C ATOM 410 C6 DT A 13 -8.859 7.516 0.612 1.00 1.00 C ATOM 0 H5' DT A 13 -12.065 10.021 -0.930 1.00 1.39 H new ATOM 0 H5'' DT A 13 -11.538 10.343 -2.570 1.00 1.39 H new ATOM 0 H4' DT A 13 -10.459 11.761 -0.946 1.00 1.25 H new ATOM 0 H3' DT A 13 -9.048 10.877 -3.113 1.00 1.17 H new ATOM 0 H2' DT A 13 -8.639 8.641 -1.891 1.00 0.98 H new ATOM 0 H2'' DT A 13 -7.107 9.491 -1.928 1.00 0.98 H new ATOM 0 H1' DT A 13 -7.498 10.519 0.312 1.00 1.04 H new ATOM 0 H3 DT A 13 -5.855 7.196 2.762 1.00 1.30 H new ATOM 0 H71 DT A 13 -10.696 5.679 0.936 1.00 1.06 H new ATOM 0 H72 DT A 13 -9.433 4.597 0.301 1.00 1.06 H new ATOM 0 H73 DT A 13 -9.753 4.661 2.051 1.00 1.06 H new ATOM 0 H6 DT A 13 -9.728 7.626 -0.020 1.00 1.00 H new ATOM 423 P DT A 14 -8.639 13.514 -2.026 1.00 1.35 P ATOM 424 OP1 DT A 14 -8.410 14.341 -0.818 1.00 1.36 O ATOM 425 OP2 DT A 14 -9.993 13.429 -2.618 1.00 1.59 O ATOM 426 O5' DT A 14 -7.612 13.986 -3.168 1.00 1.32 O ATOM 427 C5' DT A 14 -6.212 13.881 -2.894 1.00 1.20 C ATOM 428 C4' DT A 14 -5.450 13.387 -4.050 1.00 1.17 C ATOM 429 O4' DT A 14 -4.151 13.124 -3.541 1.00 1.10 O ATOM 430 C3' DT A 14 -5.989 12.115 -4.701 1.00 1.14 C ATOM 431 O3' DT A 14 -5.839 12.280 -6.118 1.00 1.37 O ATOM 432 C2' DT A 14 -4.978 11.099 -4.209 1.00 0.85 C ATOM 433 C1' DT A 14 -3.735 11.980 -4.230 1.00 0.91 C ATOM 434 N1 DT A 14 -2.490 11.514 -3.595 1.00 0.79 N ATOM 435 C2 DT A 14 -1.295 11.622 -4.279 1.00 0.89 C ATOM 436 O2 DT A 14 -1.203 12.081 -5.413 1.00 1.06 O ATOM 437 N3 DT A 14 -0.183 11.181 -3.602 1.00 0.83 N ATOM 438 C4 DT A 14 -0.155 10.650 -2.330 1.00 0.70 C ATOM 439 O4 DT A 14 0.912 10.290 -1.841 1.00 0.73 O ATOM 440 C5 DT A 14 -1.452 10.576 -1.698 1.00 0.61 C ATOM 441 C7 DT A 14 -1.629 10.008 -0.290 1.00 0.57 C ATOM 442 C6 DT A 14 -2.537 11.004 -2.345 1.00 0.67 C ATOM 0 H5' DT A 14 -6.059 13.210 -2.048 1.00 1.20 H new ATOM 0 H5'' DT A 14 -5.828 14.858 -2.600 1.00 1.20 H new ATOM 0 H4' DT A 14 -5.498 14.137 -4.840 1.00 1.17 H new ATOM 0 H3' DT A 14 -7.026 11.859 -4.483 1.00 1.14 H new ATOM 0 H2' DT A 14 -5.210 10.720 -3.214 1.00 0.85 H new ATOM 0 H2'' DT A 14 -4.894 10.234 -4.867 1.00 0.85 H new ATOM 0 H1' DT A 14 -3.436 12.065 -5.275 1.00 0.91 H new ATOM 0 H3 DT A 14 0.710 11.254 -4.089 1.00 0.83 H new ATOM 0 H71 DT A 14 -2.477 10.493 0.194 1.00 0.57 H new ATOM 0 H72 DT A 14 -1.810 8.935 -0.351 1.00 0.57 H new ATOM 0 H73 DT A 14 -0.726 10.191 0.292 1.00 0.57 H new ATOM 0 H6 DT A 14 -3.494 10.940 -1.848 1.00 0.67 H new ATOM 455 P DG A 15 -6.998 11.881 -7.156 1.00 1.53 P ATOM 456 OP1 DG A 15 -6.513 12.185 -8.522 1.00 1.76 O ATOM 457 OP2 DG A 15 -8.279 12.449 -6.681 1.00 2.11 O ATOM 458 O5' DG A 15 -7.062 10.284 -6.978 1.00 1.01 O ATOM 459 C5' DG A 15 -6.403 9.357 -7.847 1.00 0.61 C ATOM 460 C4' DG A 15 -4.911 9.642 -8.040 1.00 0.44 C ATOM 461 O4' DG A 15 -4.160 9.705 -6.821 1.00 0.40 O ATOM 462 C3' DG A 15 -4.291 8.521 -8.863 1.00 0.42 C ATOM 463 O3' DG A 15 -3.254 9.114 -9.652 1.00 0.78 O ATOM 464 C2' DG A 15 -3.748 7.676 -7.738 1.00 0.43 C ATOM 465 C1' DG A 15 -3.080 8.790 -6.973 1.00 0.39 C ATOM 466 N9 DG A 15 -2.676 8.281 -5.671 1.00 0.31 N ATOM 467 C8 DG A 15 -3.482 7.771 -4.707 1.00 0.32 C ATOM 468 N7 DG A 15 -2.859 7.429 -3.616 1.00 0.40 N ATOM 469 C5 DG A 15 -1.531 7.736 -3.905 1.00 0.37 C ATOM 470 C6 DG A 15 -0.366 7.592 -3.121 1.00 0.46 C ATOM 471 O6 DG A 15 -0.236 7.182 -1.972 1.00 0.55 O ATOM 472 N1 DG A 15 0.745 8.022 -3.806 1.00 0.50 N ATOM 473 C2 DG A 15 0.769 8.529 -5.072 1.00 0.54 C ATOM 474 N2 DG A 15 1.949 8.874 -5.555 1.00 0.70 N ATOM 475 N3 DG A 15 -0.310 8.676 -5.818 1.00 0.49 N ATOM 476 C4 DG A 15 -1.420 8.257 -5.168 1.00 0.36 C ATOM 0 H5' DG A 15 -6.895 9.373 -8.820 1.00 0.61 H new ATOM 0 H5'' DG A 15 -6.522 8.350 -7.446 1.00 0.61 H new ATOM 0 H4' DG A 15 -4.863 10.617 -8.524 1.00 0.44 H new ATOM 0 H3' DG A 15 -4.927 7.967 -9.553 1.00 0.42 H new ATOM 0 H2' DG A 15 -4.527 7.170 -7.167 1.00 0.43 H new ATOM 0 H2'' DG A 15 -3.051 6.909 -8.075 1.00 0.43 H new ATOM 0 H1' DG A 15 -2.196 9.217 -7.446 1.00 0.39 H new ATOM 0 H8 DG A 15 -4.549 7.658 -4.833 1.00 0.32 H new ATOM 0 H1 DG A 15 1.639 7.956 -3.320 1.00 0.50 H new ATOM 0 H21 DG A 15 2.022 9.258 -6.497 1.00 0.70 H new ATOM 0 H22 DG A 15 2.787 8.756 -4.986 1.00 0.70 H new ATOM 488 P DG A 16 -3.257 9.055 -11.251 1.00 0.66 P ATOM 489 OP1 DG A 16 -2.550 10.252 -11.766 1.00 0.89 O ATOM 490 OP2 DG A 16 -4.625 8.741 -11.721 1.00 0.68 O ATOM 491 O5' DG A 16 -2.340 7.758 -11.470 1.00 1.13 O ATOM 492 C5' DG A 16 -0.915 7.871 -11.499 1.00 1.30 C ATOM 493 C4' DG A 16 -0.227 6.547 -11.233 1.00 1.04 C ATOM 494 O4' DG A 16 0.024 6.462 -9.857 1.00 0.90 O ATOM 495 C3' DG A 16 -1.000 5.303 -11.640 1.00 0.99 C ATOM 496 O3' DG A 16 -0.307 4.795 -12.778 1.00 1.13 O ATOM 497 C2' DG A 16 -0.771 4.455 -10.407 1.00 0.77 C ATOM 498 C1' DG A 16 0.418 5.122 -9.783 1.00 0.75 C ATOM 499 N9 DG A 16 0.704 4.955 -8.382 1.00 0.60 N ATOM 500 C8 DG A 16 1.919 4.902 -7.811 1.00 0.55 C ATOM 501 N7 DG A 16 1.889 4.812 -6.501 1.00 0.47 N ATOM 502 C5 DG A 16 0.515 4.802 -6.228 1.00 0.47 C ATOM 503 C6 DG A 16 -0.192 4.721 -5.004 1.00 0.45 C ATOM 504 O6 DG A 16 0.245 4.646 -3.867 1.00 0.47 O ATOM 505 N1 DG A 16 -1.547 4.740 -5.201 1.00 0.46 N ATOM 506 C2 DG A 16 -2.158 4.830 -6.422 1.00 0.51 C ATOM 507 N2 DG A 16 -3.463 4.835 -6.469 1.00 0.53 N ATOM 508 N3 DG A 16 -1.529 4.908 -7.569 1.00 0.57 N ATOM 509 C4 DG A 16 -0.198 4.890 -7.388 1.00 0.54 C ATOM 0 H5' DG A 16 -0.595 8.600 -10.754 1.00 1.30 H new ATOM 0 H5'' DG A 16 -0.603 8.251 -12.472 1.00 1.30 H new ATOM 0 H4' DG A 16 0.671 6.553 -11.851 1.00 1.04 H new ATOM 0 H3' DG A 16 -2.054 5.393 -11.901 1.00 0.99 H new ATOM 0 H2' DG A 16 -1.636 4.459 -9.743 1.00 0.77 H new ATOM 0 H2'' DG A 16 -0.568 3.414 -10.660 1.00 0.77 H new ATOM 0 H1' DG A 16 1.297 4.723 -10.289 1.00 0.75 H new ATOM 0 H8 DG A 16 2.838 4.931 -8.378 1.00 0.55 H new ATOM 0 H1 DG A 16 -2.145 4.683 -4.377 1.00 0.46 H new ATOM 0 H21 DG A 16 -3.941 4.901 -7.368 1.00 0.53 H new ATOM 0 H22 DG A 16 -4.005 4.773 -5.607 1.00 0.53 H new ATOM 521 P DG A 17 -0.345 3.332 -13.427 1.00 1.17 P ATOM 522 OP1 DG A 17 -0.525 3.460 -14.890 1.00 1.38 O ATOM 523 OP2 DG A 17 -1.240 2.455 -12.635 1.00 1.09 O ATOM 524 O5' DG A 17 1.188 2.953 -13.140 1.00 1.20 O ATOM 525 C5' DG A 17 1.615 1.827 -12.386 1.00 1.05 C ATOM 526 C4' DG A 17 2.498 2.195 -11.201 1.00 0.84 C ATOM 527 O4' DG A 17 1.733 2.673 -10.082 1.00 0.83 O ATOM 528 C3' DG A 17 3.142 0.897 -10.706 1.00 0.77 C ATOM 529 O3' DG A 17 4.567 0.765 -10.862 1.00 0.81 O ATOM 530 C2' DG A 17 2.550 0.752 -9.356 1.00 0.57 C ATOM 531 C1' DG A 17 2.338 2.122 -8.910 1.00 0.58 C ATOM 532 N9 DG A 17 1.423 1.986 -7.774 1.00 0.47 N ATOM 533 C8 DG A 17 0.089 1.878 -7.875 1.00 0.49 C ATOM 534 N7 DG A 17 -0.541 1.734 -6.742 1.00 0.41 N ATOM 535 C5 DG A 17 0.494 1.748 -5.810 1.00 0.33 C ATOM 536 C6 DG A 17 0.450 1.631 -4.400 1.00 0.27 C ATOM 537 O6 DG A 17 -0.530 1.487 -3.682 1.00 0.28 O ATOM 538 N1 DG A 17 1.701 1.695 -3.842 1.00 0.27 N ATOM 539 C2 DG A 17 2.869 1.855 -4.546 1.00 0.30 C ATOM 540 N2 DG A 17 3.991 1.898 -3.847 1.00 0.34 N ATOM 541 N3 DG A 17 2.929 1.966 -5.871 1.00 0.34 N ATOM 542 C4 DG A 17 1.704 1.904 -6.435 1.00 0.36 C ATOM 0 H5' DG A 17 2.161 1.147 -13.040 1.00 1.05 H new ATOM 0 H5'' DG A 17 0.740 1.288 -12.024 1.00 1.05 H new ATOM 0 H4' DG A 17 3.199 2.962 -11.529 1.00 0.84 H new ATOM 0 H3' DG A 17 2.920 0.035 -11.335 1.00 0.77 H new ATOM 0 H2' DG A 17 1.614 0.195 -9.389 1.00 0.57 H new ATOM 0 H2'' DG A 17 3.218 0.213 -8.684 1.00 0.57 H new ATOM 0 H1' DG A 17 3.182 2.728 -8.582 1.00 0.58 H new ATOM 0 H8 DG A 17 -0.425 1.908 -8.824 1.00 0.49 H new ATOM 0 H1 DG A 17 1.769 1.618 -2.827 1.00 0.27 H new ATOM 0 H21 DG A 17 4.885 2.015 -4.324 1.00 0.34 H new ATOM 0 H22 DG A 17 3.962 1.814 -2.831 1.00 0.34 H new ATOM 554 P DG A 18 5.726 1.876 -10.676 1.00 0.85 P ATOM 555 OP1 DG A 18 5.115 3.096 -10.099 1.00 1.01 O ATOM 556 OP2 DG A 18 6.443 1.966 -11.963 1.00 1.19 O ATOM 557 O5' DG A 18 6.678 1.193 -9.559 1.00 0.50 O ATOM 558 C5' DG A 18 6.229 1.154 -8.202 1.00 0.40 C ATOM 559 C4' DG A 18 6.451 -0.165 -7.483 1.00 0.35 C ATOM 560 O4' DG A 18 5.554 -0.024 -6.416 1.00 0.39 O ATOM 561 C3' DG A 18 6.043 -1.480 -8.134 1.00 0.35 C ATOM 562 O3' DG A 18 7.214 -2.185 -8.561 1.00 0.42 O ATOM 563 C2' DG A 18 5.576 -2.289 -6.907 1.00 0.35 C ATOM 564 C1' DG A 18 5.621 -1.270 -5.763 1.00 0.33 C ATOM 565 N9 DG A 18 4.345 -1.274 -5.049 1.00 0.33 N ATOM 566 C8 DG A 18 3.174 -1.081 -5.659 1.00 0.37 C ATOM 567 N7 DG A 18 2.125 -1.084 -4.901 1.00 0.35 N ATOM 568 C5 DG A 18 2.680 -1.308 -3.651 1.00 0.31 C ATOM 569 C6 DG A 18 2.046 -1.420 -2.400 1.00 0.32 C ATOM 570 O6 DG A 18 0.851 -1.343 -2.146 1.00 0.35 O ATOM 571 N1 DG A 18 2.954 -1.642 -1.402 1.00 0.35 N ATOM 572 C2 DG A 18 4.313 -1.745 -1.593 1.00 0.36 C ATOM 573 N2 DG A 18 5.075 -1.965 -0.554 1.00 0.45 N ATOM 574 N3 DG A 18 4.929 -1.644 -2.758 1.00 0.33 N ATOM 575 C4 DG A 18 4.045 -1.426 -3.739 1.00 0.31 C ATOM 0 H5' DG A 18 5.164 1.385 -8.182 1.00 0.40 H new ATOM 0 H5'' DG A 18 6.737 1.942 -7.646 1.00 0.40 H new ATOM 0 H4' DG A 18 7.526 -0.273 -7.341 1.00 0.35 H new ATOM 0 H3' DG A 18 5.344 -1.343 -8.959 1.00 0.35 H new ATOM 0 H2' DG A 18 4.572 -2.688 -7.049 1.00 0.35 H new ATOM 0 H2'' DG A 18 6.232 -3.138 -6.713 1.00 0.35 H new ATOM 0 H1' DG A 18 6.475 -1.465 -5.114 1.00 0.33 H new ATOM 0 H8 DG A 18 3.105 -0.931 -6.726 1.00 0.37 H new ATOM 0 H1 DG A 18 2.600 -1.738 -0.450 1.00 0.35 H new ATOM 0 H21 DG A 18 6.085 -2.045 -0.670 1.00 0.45 H new ATOM 0 H22 DG A 18 4.659 -2.056 0.373 1.00 0.45 H new ATOM 587 P DT A 19 7.659 -2.302 -10.105 1.00 0.72 P ATOM 588 OP1 DT A 19 6.439 -2.282 -10.945 1.00 0.89 O ATOM 589 OP2 DT A 19 8.608 -3.433 -10.227 1.00 0.91 O ATOM 590 O5' DT A 19 8.466 -0.942 -10.397 1.00 0.84 O ATOM 591 C5' DT A 19 9.724 -0.615 -9.786 1.00 0.68 C ATOM 592 C4' DT A 19 10.498 0.393 -10.644 1.00 0.55 C ATOM 593 O4' DT A 19 10.780 -0.137 -11.952 1.00 0.59 O ATOM 594 C3' DT A 19 9.748 1.716 -10.856 1.00 0.70 C ATOM 595 O3' DT A 19 10.608 2.829 -11.126 1.00 0.75 O ATOM 596 C2' DT A 19 9.003 1.353 -12.117 1.00 0.80 C ATOM 597 C1' DT A 19 10.108 0.665 -12.927 1.00 0.68 C ATOM 598 N1 DT A 19 9.480 -0.189 -13.961 1.00 0.86 N ATOM 599 C2 DT A 19 9.712 0.100 -15.295 1.00 0.97 C ATOM 600 O2 DT A 19 10.418 1.027 -15.678 1.00 0.97 O ATOM 601 N3 DT A 19 9.098 -0.722 -16.208 1.00 1.17 N ATOM 602 C4 DT A 19 8.284 -1.792 -15.922 1.00 1.35 C ATOM 603 O4 DT A 19 7.797 -2.447 -16.838 1.00 1.57 O ATOM 604 C5 DT A 19 8.094 -2.027 -14.508 1.00 1.28 C ATOM 605 C7 DT A 19 7.211 -3.177 -14.038 1.00 1.56 C ATOM 606 C6 DT A 19 8.683 -1.239 -13.594 1.00 1.03 C ATOM 0 H5' DT A 19 10.317 -1.520 -9.656 1.00 0.68 H new ATOM 0 H5'' DT A 19 9.554 -0.200 -8.793 1.00 0.68 H new ATOM 0 H4' DT A 19 11.414 0.581 -10.084 1.00 0.55 H new ATOM 0 H3' DT A 19 9.167 2.034 -9.990 1.00 0.70 H new ATOM 0 H2' DT A 19 8.162 0.688 -11.921 1.00 0.80 H new ATOM 0 H2'' DT A 19 8.604 2.230 -12.627 1.00 0.80 H new ATOM 0 H1' DT A 19 10.782 1.353 -13.438 1.00 0.68 H new ATOM 0 H3 DT A 19 9.262 -0.519 -17.194 1.00 1.17 H new ATOM 0 H71 DT A 19 7.571 -3.543 -13.076 1.00 1.56 H new ATOM 0 H72 DT A 19 6.184 -2.827 -13.932 1.00 1.56 H new ATOM 0 H73 DT A 19 7.245 -3.985 -14.769 1.00 1.56 H new ATOM 0 H6 DT A 19 8.524 -1.439 -12.545 1.00 1.03 H new ATOM 619 P DT A 20 11.417 3.624 -9.980 1.00 0.79 P ATOM 620 OP1 DT A 20 12.047 4.805 -10.611 1.00 0.95 O ATOM 621 OP2 DT A 20 12.251 2.650 -9.239 1.00 0.82 O ATOM 622 O5' DT A 20 10.259 4.133 -8.975 1.00 0.79 O ATOM 623 C5' DT A 20 9.093 4.840 -9.429 1.00 0.81 C ATOM 624 C4' DT A 20 8.093 5.107 -8.298 1.00 0.77 C ATOM 625 O4' DT A 20 7.685 3.912 -7.608 1.00 0.72 O ATOM 626 C3' DT A 20 8.613 6.038 -7.204 1.00 0.72 C ATOM 627 O3' DT A 20 7.489 6.662 -6.569 1.00 0.73 O ATOM 628 C2' DT A 20 9.282 5.005 -6.310 1.00 0.62 C ATOM 629 C1' DT A 20 8.121 4.002 -6.246 1.00 0.62 C ATOM 630 N1 DT A 20 8.491 2.652 -5.762 1.00 0.56 N ATOM 631 C2 DT A 20 7.594 1.986 -4.940 1.00 0.57 C ATOM 632 O2 DT A 20 6.513 2.449 -4.587 1.00 0.62 O ATOM 633 N3 DT A 20 7.972 0.735 -4.524 1.00 0.59 N ATOM 634 C4 DT A 20 9.142 0.088 -4.843 1.00 0.60 C ATOM 635 O4 DT A 20 9.353 -1.037 -4.402 1.00 0.66 O ATOM 636 C5 DT A 20 10.025 0.846 -5.706 1.00 0.58 C ATOM 637 C7 DT A 20 11.366 0.251 -6.151 1.00 0.66 C ATOM 638 C6 DT A 20 9.677 2.075 -6.126 1.00 0.57 C ATOM 0 H5' DT A 20 8.604 4.263 -10.214 1.00 0.81 H new ATOM 0 H5'' DT A 20 9.396 5.788 -9.873 1.00 0.81 H new ATOM 0 H4' DT A 20 7.264 5.569 -8.833 1.00 0.77 H new ATOM 0 H3' DT A 20 9.268 6.855 -7.505 1.00 0.72 H new ATOM 0 H2' DT A 20 10.186 4.583 -6.749 1.00 0.62 H new ATOM 0 H2'' DT A 20 9.557 5.401 -5.333 1.00 0.62 H new ATOM 0 H1' DT A 20 7.370 4.346 -5.534 1.00 0.62 H new ATOM 0 H3 DT A 20 7.321 0.236 -3.918 1.00 0.59 H new ATOM 0 H71 DT A 20 11.631 0.645 -7.132 1.00 0.66 H new ATOM 0 H72 DT A 20 12.140 0.519 -5.431 1.00 0.66 H new ATOM 0 H73 DT A 20 11.282 -0.834 -6.206 1.00 0.66 H new ATOM 0 H6 DT A 20 10.352 2.621 -6.768 1.00 0.57 H new ATOM 651 P DG A 21 7.661 7.747 -5.399 1.00 0.66 P ATOM 652 OP1 DG A 21 6.302 8.152 -4.967 1.00 0.74 O ATOM 653 OP2 DG A 21 8.630 8.773 -5.847 1.00 0.79 O ATOM 654 O5' DG A 21 8.351 6.875 -4.233 1.00 0.61 O ATOM 655 C5' DG A 21 7.687 6.656 -2.989 1.00 0.59 C ATOM 656 C4' DG A 21 8.615 6.026 -1.962 1.00 0.60 C ATOM 657 O4' DG A 21 7.978 5.998 -0.685 1.00 0.59 O ATOM 658 C3' DG A 21 9.036 4.575 -2.224 1.00 0.57 C ATOM 659 O3' DG A 21 10.236 4.304 -1.481 1.00 0.66 O ATOM 660 C2' DG A 21 7.827 3.843 -1.668 1.00 0.50 C ATOM 661 C1' DG A 21 7.433 4.693 -0.501 1.00 0.45 C ATOM 662 N9 DG A 21 5.990 4.741 -0.318 1.00 0.36 N ATOM 663 C8 DG A 21 5.329 4.740 0.869 1.00 0.32 C ATOM 664 N7 DG A 21 4.028 4.755 0.735 1.00 0.30 N ATOM 665 C5 DG A 21 3.840 4.770 -0.648 1.00 0.32 C ATOM 666 C6 DG A 21 2.654 4.791 -1.413 1.00 0.37 C ATOM 667 O6 DG A 21 1.495 4.792 -1.019 1.00 0.41 O ATOM 668 N1 DG A 21 2.918 4.798 -2.762 1.00 0.42 N ATOM 669 C2 DG A 21 4.154 4.791 -3.336 1.00 0.43 C ATOM 670 N2 DG A 21 4.191 4.812 -4.659 1.00 0.50 N ATOM 671 N3 DG A 21 5.276 4.771 -2.635 1.00 0.42 N ATOM 672 C4 DG A 21 5.039 4.762 -1.299 1.00 0.36 C ATOM 0 H5' DG A 21 6.824 6.009 -3.146 1.00 0.59 H new ATOM 0 H5'' DG A 21 7.309 7.604 -2.606 1.00 0.59 H new ATOM 0 H4' DG A 21 9.505 6.654 -2.017 1.00 0.60 H new ATOM 0 H3' DG A 21 9.266 4.305 -3.255 1.00 0.57 H new ATOM 0 H2' DG A 21 7.026 3.769 -2.403 1.00 0.50 H new ATOM 0 H2'' DG A 21 8.075 2.826 -1.363 1.00 0.50 H new ATOM 0 H1' DG A 21 7.836 4.251 0.410 1.00 0.45 H new ATOM 0 H8 DG A 21 5.828 4.728 1.827 1.00 0.32 H new ATOM 0 H1 DG A 21 2.115 4.809 -3.391 1.00 0.42 H new ATOM 0 H21 DG A 21 5.088 4.808 -5.144 1.00 0.50 H new ATOM 0 H22 DG A 21 3.322 4.832 -5.193 1.00 0.50 H new ATOM 684 P DG A 22 10.957 2.858 -1.381 1.00 0.76 P ATOM 685 OP1 DG A 22 12.351 3.079 -0.931 1.00 0.95 O ATOM 686 OP2 DG A 22 10.690 2.102 -2.626 1.00 0.85 O ATOM 687 O5' DG A 22 10.137 2.149 -0.189 1.00 0.71 O ATOM 688 C5' DG A 22 10.192 2.697 1.133 1.00 0.68 C ATOM 689 C4' DG A 22 9.049 2.203 2.003 1.00 0.61 C ATOM 690 O4' DG A 22 7.744 2.483 1.478 1.00 0.51 O ATOM 691 C3' DG A 22 9.104 0.689 2.286 1.00 0.63 C ATOM 692 O3' DG A 22 8.994 0.246 3.654 1.00 0.69 O ATOM 693 C2' DG A 22 7.939 0.223 1.464 1.00 0.53 C ATOM 694 C1' DG A 22 6.943 1.336 1.758 1.00 0.43 C ATOM 695 N9 DG A 22 5.775 1.306 0.859 1.00 0.37 N ATOM 696 C8 DG A 22 5.791 1.268 -0.503 1.00 0.38 C ATOM 697 N7 DG A 22 4.618 1.275 -1.058 1.00 0.36 N ATOM 698 C5 DG A 22 3.754 1.319 0.025 1.00 0.31 C ATOM 699 C6 DG A 22 2.348 1.344 0.037 1.00 0.32 C ATOM 700 O6 DG A 22 1.592 1.345 -0.927 1.00 0.34 O ATOM 701 N1 DG A 22 1.851 1.384 1.311 1.00 0.32 N ATOM 702 C2 DG A 22 2.605 1.399 2.453 1.00 0.32 C ATOM 703 N2 DG A 22 1.934 1.422 3.591 1.00 0.36 N ATOM 704 N3 DG A 22 3.940 1.378 2.467 1.00 0.32 N ATOM 705 C4 DG A 22 4.446 1.338 1.209 1.00 0.32 C ATOM 0 H5' DG A 22 10.160 3.785 1.076 1.00 0.68 H new ATOM 0 H5'' DG A 22 11.142 2.430 1.597 1.00 0.68 H new ATOM 0 H4' DG A 22 9.197 2.766 2.924 1.00 0.61 H new ATOM 0 H3' DG A 22 10.088 0.286 2.046 1.00 0.63 H new ATOM 0 H2' DG A 22 8.180 0.150 0.404 1.00 0.53 H new ATOM 0 H2'' DG A 22 7.574 -0.756 1.776 1.00 0.53 H new ATOM 0 H1' DG A 22 6.518 1.283 2.760 1.00 0.43 H new ATOM 0 H8 DG A 22 6.707 1.235 -1.075 1.00 0.38 H new ATOM 0 H1 DG A 22 0.837 1.404 1.418 1.00 0.32 H new ATOM 0 H21 DG A 22 2.436 1.434 4.479 1.00 0.36 H new ATOM 0 H22 DG A 22 0.914 1.428 3.582 1.00 0.36 H new ATOM 717 P DG A 23 8.916 1.132 5.007 1.00 0.69 P ATOM 718 OP1 DG A 23 8.934 2.578 4.690 1.00 0.95 O ATOM 719 OP2 DG A 23 9.908 0.576 5.961 1.00 1.10 O ATOM 720 O5' DG A 23 7.432 0.756 5.509 1.00 0.62 O ATOM 721 C5' DG A 23 7.304 0.216 6.820 1.00 0.93 C ATOM 722 C4' DG A 23 6.065 -0.629 7.098 1.00 0.77 C ATOM 723 O4' DG A 23 5.036 -0.504 6.096 1.00 0.73 O ATOM 724 C3' DG A 23 6.369 -2.131 7.201 1.00 0.72 C ATOM 725 O3' DG A 23 5.475 -2.739 8.146 1.00 0.73 O ATOM 726 C2' DG A 23 6.039 -2.566 5.791 1.00 0.64 C ATOM 727 C1' DG A 23 4.738 -1.830 5.656 1.00 0.63 C ATOM 728 N9 DG A 23 4.126 -1.836 4.322 1.00 0.59 N ATOM 729 C8 DG A 23 4.731 -1.905 3.105 1.00 0.58 C ATOM 730 N7 DG A 23 3.910 -1.889 2.106 1.00 0.58 N ATOM 731 C5 DG A 23 2.670 -1.805 2.692 1.00 0.57 C ATOM 732 C6 DG A 23 1.402 -1.753 2.084 1.00 0.59 C ATOM 733 O6 DG A 23 1.133 -1.764 0.888 1.00 0.62 O ATOM 734 N1 DG A 23 0.413 -1.674 3.019 1.00 0.60 N ATOM 735 C2 DG A 23 0.611 -1.648 4.374 1.00 0.59 C ATOM 736 N2 DG A 23 -0.462 -1.576 5.132 1.00 0.63 N ATOM 737 N3 DG A 23 1.795 -1.694 4.969 1.00 0.59 N ATOM 738 C4 DG A 23 2.784 -1.773 4.055 1.00 0.57 C ATOM 0 H5' DG A 23 7.318 1.042 7.531 1.00 0.93 H new ATOM 0 H5'' DG A 23 8.184 -0.394 7.023 1.00 0.93 H new ATOM 0 H4' DG A 23 5.716 -0.232 8.051 1.00 0.77 H new ATOM 0 H3' DG A 23 7.375 -2.389 7.532 1.00 0.72 H new ATOM 0 H2' DG A 23 6.785 -2.252 5.061 1.00 0.64 H new ATOM 0 H2'' DG A 23 5.931 -3.646 5.691 1.00 0.64 H new ATOM 0 H1' DG A 23 3.974 -2.333 6.249 1.00 0.63 H new ATOM 0 H8 DG A 23 5.802 -1.968 2.984 1.00 0.58 H new ATOM 0 H1 DG A 23 -0.549 -1.631 2.683 1.00 0.60 H new ATOM 0 H21 DG A 23 -0.369 -1.554 6.147 1.00 0.63 H new ATOM 0 H22 DG A 23 -1.387 -1.542 4.704 1.00 0.63 H new ATOM 750 P DG A 24 5.526 -4.310 8.490 1.00 0.77 P ATOM 751 OP1 DG A 24 4.428 -4.593 9.442 1.00 0.89 O ATOM 752 OP2 DG A 24 6.917 -4.667 8.847 1.00 1.01 O ATOM 753 O5' DG A 24 5.174 -5.014 7.077 1.00 0.63 O ATOM 754 C5' DG A 24 3.831 -5.209 6.614 1.00 0.51 C ATOM 755 C4' DG A 24 3.811 -5.805 5.207 1.00 0.39 C ATOM 756 O4' DG A 24 4.377 -4.992 4.172 1.00 0.42 O ATOM 757 C3' DG A 24 4.559 -7.144 5.139 1.00 0.44 C ATOM 758 O3' DG A 24 3.613 -8.209 5.170 1.00 0.54 O ATOM 759 C2' DG A 24 5.264 -7.032 3.762 1.00 0.51 C ATOM 760 C1' DG A 24 4.528 -5.913 3.085 1.00 0.44 C ATOM 761 N9 DG A 24 5.415 -5.387 2.052 1.00 0.47 N ATOM 762 C8 DG A 24 6.412 -4.496 2.211 1.00 0.53 C ATOM 763 N7 DG A 24 7.051 -4.184 1.119 1.00 0.60 N ATOM 764 C5 DG A 24 6.402 -4.954 0.154 1.00 0.57 C ATOM 765 C6 DG A 24 6.632 -5.062 -1.242 1.00 0.65 C ATOM 766 O6 DG A 24 7.470 -4.490 -1.935 1.00 0.76 O ATOM 767 N1 DG A 24 5.752 -5.949 -1.828 1.00 0.64 N ATOM 768 C2 DG A 24 4.775 -6.644 -1.160 1.00 0.60 C ATOM 769 N2 DG A 24 4.012 -7.448 -1.868 1.00 0.66 N ATOM 770 N3 DG A 24 4.547 -6.557 0.141 1.00 0.53 N ATOM 771 C4 DG A 24 5.400 -5.692 0.728 1.00 0.50 C ATOM 0 H5' DG A 24 3.301 -4.256 6.615 1.00 0.51 H new ATOM 0 H5'' DG A 24 3.300 -5.870 7.299 1.00 0.51 H new ATOM 0 H4' DG A 24 2.741 -5.907 5.023 1.00 0.39 H new ATOM 0 H3' DG A 24 5.252 -7.340 5.957 1.00 0.44 H new ATOM 0 H2' DG A 24 6.325 -6.807 3.871 1.00 0.51 H new ATOM 0 H2'' DG A 24 5.191 -7.961 3.196 1.00 0.51 H new ATOM 0 HO3' DG A 24 2.821 -7.928 5.674 1.00 0.54 H new ATOM 0 H1' DG A 24 3.580 -6.159 2.606 1.00 0.44 H new ATOM 0 H8 DG A 24 6.663 -4.072 3.172 1.00 0.53 H new ATOM 0 H1 DG A 24 5.834 -6.099 -2.834 1.00 0.64 H new ATOM 0 H21 DG A 24 3.274 -7.984 -1.412 1.00 0.66 H new ATOM 0 H22 DG A 24 4.159 -7.536 -2.874 1.00 0.66 H new TER 784 DG A 24