USER MOD reduce.3.24.130724 H: found=0, std=0, add=235, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 235 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 DC O5' : rot 180:sc= 0 USER MOD Single : A 12 DT C7 :methyl 150:sc= -3.3! (180deg=-3.3!) USER MOD Single : A 21 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 21 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 11.975 9.317 -2.135 1.00 1.19 O ATOM 2 C5' DC A 1 11.599 9.444 -0.770 1.00 1.05 C ATOM 3 C4' DC A 1 10.766 8.262 -0.323 1.00 0.79 C ATOM 4 O4' DC A 1 9.510 8.266 -1.049 1.00 0.73 O ATOM 5 C3' DC A 1 11.406 6.885 -0.583 1.00 0.73 C ATOM 6 O3' DC A 1 11.358 6.081 0.602 1.00 0.67 O ATOM 7 C2' DC A 1 10.542 6.272 -1.680 1.00 0.72 C ATOM 8 C1' DC A 1 9.200 6.955 -1.466 1.00 0.60 C ATOM 9 N1 DC A 1 8.329 7.035 -2.660 1.00 0.61 N ATOM 10 C2 DC A 1 6.939 6.837 -2.501 1.00 0.60 C ATOM 11 O2 DC A 1 6.491 6.613 -1.365 1.00 0.67 O ATOM 12 N3 DC A 1 6.125 6.902 -3.594 1.00 0.62 N ATOM 13 C4 DC A 1 6.650 7.151 -4.806 1.00 0.69 C ATOM 14 N4 DC A 1 5.826 7.206 -5.852 1.00 0.78 N ATOM 15 C5 DC A 1 8.054 7.358 -4.995 1.00 0.78 C ATOM 16 C6 DC A 1 8.848 7.293 -3.909 1.00 0.72 C ATOM 0 H5' DC A 1 11.034 10.365 -0.629 1.00 1.05 H new ATOM 0 H5'' DC A 1 12.492 9.520 -0.149 1.00 1.05 H new ATOM 0 H4' DC A 1 10.654 8.385 0.754 1.00 0.79 H new ATOM 0 H3' DC A 1 12.455 6.957 -0.869 1.00 0.73 H new ATOM 0 H2' DC A 1 10.945 6.472 -2.673 1.00 0.72 H new ATOM 0 H2'' DC A 1 10.466 5.189 -1.579 1.00 0.72 H new ATOM 0 HO5' DC A 1 12.511 10.093 -2.400 1.00 1.19 H new ATOM 0 H1' DC A 1 8.633 6.365 -0.746 1.00 0.60 H new ATOM 0 H41 DC A 1 6.196 7.393 -6.784 1.00 0.78 H new ATOM 0 H42 DC A 1 4.825 7.061 -5.721 1.00 0.78 H new ATOM 0 H5 DC A 1 8.462 7.559 -5.974 1.00 0.78 H new ATOM 0 H6 DC A 1 9.911 7.446 -4.020 1.00 0.72 H new ATOM 29 P DG A 2 12.539 5.034 0.890 1.00 0.89 P ATOM 30 OP1 DG A 2 13.740 5.775 1.358 1.00 1.19 O ATOM 31 OP2 DG A 2 12.696 4.154 -0.295 1.00 1.08 O ATOM 32 O5' DG A 2 11.958 4.172 2.101 1.00 0.78 O ATOM 33 C5' DG A 2 11.965 4.667 3.439 1.00 0.73 C ATOM 34 C4' DG A 2 10.728 4.223 4.196 1.00 0.60 C ATOM 35 O4' DG A 2 9.541 4.558 3.423 1.00 0.52 O ATOM 36 C3' DG A 2 10.627 2.713 4.462 1.00 0.60 C ATOM 37 O3' DG A 2 9.974 2.487 5.720 1.00 0.60 O ATOM 38 C2' DG A 2 9.768 2.235 3.304 1.00 0.57 C ATOM 39 C1' DG A 2 8.792 3.383 3.155 1.00 0.49 C ATOM 40 N9 DG A 2 8.190 3.505 1.821 1.00 0.48 N ATOM 41 C8 DG A 2 8.841 3.619 0.616 1.00 0.54 C ATOM 42 N7 DG A 2 8.025 3.707 -0.401 1.00 0.51 N ATOM 43 C5 DG A 2 6.760 3.646 0.167 1.00 0.45 C ATOM 44 C6 DG A 2 5.468 3.691 -0.439 1.00 0.42 C ATOM 45 O6 DG A 2 5.195 3.794 -1.639 1.00 0.44 O ATOM 46 N1 DG A 2 4.443 3.598 0.514 1.00 0.40 N ATOM 47 C2 DG A 2 4.651 3.476 1.878 1.00 0.40 C ATOM 48 N2 DG A 2 3.565 3.399 2.660 1.00 0.41 N ATOM 49 N3 DG A 2 5.851 3.432 2.444 1.00 0.41 N ATOM 50 C4 DG A 2 6.851 3.522 1.540 1.00 0.44 C ATOM 0 H5' DG A 2 12.015 5.756 3.426 1.00 0.73 H new ATOM 0 H5'' DG A 2 12.857 4.313 3.956 1.00 0.73 H new ATOM 0 H4' DG A 2 10.801 4.737 5.154 1.00 0.60 H new ATOM 0 H3' DG A 2 11.587 2.200 4.521 1.00 0.60 H new ATOM 0 H2' DG A 2 10.353 2.075 2.399 1.00 0.57 H new ATOM 0 H2'' DG A 2 9.264 1.295 3.528 1.00 0.57 H new ATOM 0 H1' DG A 2 7.957 3.215 3.835 1.00 0.49 H new ATOM 0 H8 DG A 2 9.917 3.634 0.519 1.00 0.54 H new ATOM 0 H1 DG A 2 3.480 3.622 0.180 1.00 0.40 H new ATOM 0 H21 DG A 2 3.670 3.308 3.671 1.00 0.41 H new ATOM 0 H22 DG A 2 2.634 3.431 2.244 1.00 0.41 H new ATOM 62 P DG A 3 9.727 0.991 6.247 1.00 0.67 P ATOM 63 OP1 DG A 3 10.038 0.934 7.699 1.00 0.83 O ATOM 64 OP2 DG A 3 10.439 0.038 5.359 1.00 0.79 O ATOM 65 O5' DG A 3 8.152 0.815 6.048 1.00 0.56 O ATOM 66 C5' DG A 3 7.220 1.539 6.849 1.00 0.53 C ATOM 67 C4' DG A 3 5.841 0.915 6.791 1.00 0.42 C ATOM 68 O4' DG A 3 5.240 1.195 5.498 1.00 0.45 O ATOM 69 C3' DG A 3 5.810 -0.616 6.947 1.00 0.40 C ATOM 70 O3' DG A 3 4.734 -1.001 7.810 1.00 0.43 O ATOM 71 C2' DG A 3 5.568 -1.113 5.529 1.00 0.41 C ATOM 72 C1' DG A 3 4.725 0.001 4.943 1.00 0.38 C ATOM 73 N9 DG A 3 4.785 0.099 3.478 1.00 0.36 N ATOM 74 C8 DG A 3 5.914 0.190 2.700 1.00 0.39 C ATOM 75 N7 DG A 3 5.655 0.247 1.422 1.00 0.40 N ATOM 76 C5 DG A 3 4.274 0.193 1.346 1.00 0.36 C ATOM 77 C6 DG A 3 3.416 0.217 0.209 1.00 0.37 C ATOM 78 O6 DG A 3 3.738 0.291 -0.981 1.00 0.40 O ATOM 79 N1 DG A 3 2.067 0.141 0.572 1.00 0.38 N ATOM 80 C2 DG A 3 1.608 0.056 1.877 1.00 0.38 C ATOM 81 N2 DG A 3 0.279 -0.002 2.035 1.00 0.43 N ATOM 82 N3 DG A 3 2.405 0.034 2.947 1.00 0.37 N ATOM 83 C4 DG A 3 3.718 0.104 2.610 1.00 0.35 C ATOM 0 H5' DG A 3 7.168 2.572 6.506 1.00 0.53 H new ATOM 0 H5'' DG A 3 7.567 1.563 7.882 1.00 0.53 H new ATOM 0 H4' DG A 3 5.306 1.353 7.633 1.00 0.42 H new ATOM 0 H3' DG A 3 6.720 -1.024 7.387 1.00 0.40 H new ATOM 0 H2' DG A 3 6.500 -1.251 4.981 1.00 0.41 H new ATOM 0 H2'' DG A 3 5.046 -2.070 5.516 1.00 0.41 H new ATOM 0 H1' DG A 3 3.678 -0.190 5.180 1.00 0.38 H new ATOM 0 H8 DG A 3 6.915 0.212 3.105 1.00 0.39 H new ATOM 0 H1 DG A 3 1.373 0.149 -0.176 1.00 0.38 H new ATOM 0 H21 DG A 3 -0.121 -0.066 2.971 1.00 0.43 H new ATOM 0 H22 DG A 3 -0.333 0.017 1.219 1.00 0.43 H new ATOM 95 P DG A 4 4.648 -2.508 8.356 1.00 0.43 P ATOM 96 OP1 DG A 4 4.579 -2.480 9.840 1.00 0.55 O ATOM 97 OP2 DG A 4 5.733 -3.312 7.736 1.00 0.51 O ATOM 98 O5' DG A 4 3.243 -2.999 7.782 1.00 0.41 O ATOM 99 C5' DG A 4 2.021 -2.463 8.278 1.00 0.48 C ATOM 100 C4' DG A 4 0.833 -2.961 7.483 1.00 0.43 C ATOM 101 O4' DG A 4 0.986 -2.577 6.089 1.00 0.38 O ATOM 102 C3' DG A 4 0.638 -4.491 7.475 1.00 0.43 C ATOM 103 O3' DG A 4 -0.750 -4.827 7.591 1.00 0.51 O ATOM 104 C2' DG A 4 1.157 -4.898 6.103 1.00 0.39 C ATOM 105 C1' DG A 4 0.770 -3.700 5.259 1.00 0.36 C ATOM 106 N9 DG A 4 1.558 -3.529 4.030 1.00 0.36 N ATOM 107 C8 DG A 4 2.923 -3.410 3.935 1.00 0.38 C ATOM 108 N7 DG A 4 3.342 -3.269 2.707 1.00 0.43 N ATOM 109 C5 DG A 4 2.188 -3.293 1.942 1.00 0.39 C ATOM 110 C6 DG A 4 2.020 -3.183 0.531 1.00 0.41 C ATOM 111 O6 DG A 4 2.894 -3.043 -0.330 1.00 0.47 O ATOM 112 N1 DG A 4 0.675 -3.257 0.158 1.00 0.39 N ATOM 113 C2 DG A 4 -0.379 -3.420 1.038 1.00 0.40 C ATOM 114 N2 DG A 4 -1.609 -3.471 0.495 1.00 0.45 N ATOM 115 N3 DG A 4 -0.232 -3.524 2.362 1.00 0.40 N ATOM 116 C4 DG A 4 1.073 -3.454 2.743 1.00 0.36 C ATOM 0 H5' DG A 4 2.057 -1.374 8.237 1.00 0.48 H new ATOM 0 H5'' DG A 4 1.900 -2.739 9.326 1.00 0.48 H new ATOM 0 H4' DG A 4 -0.028 -2.511 7.978 1.00 0.43 H new ATOM 0 H3' DG A 4 1.146 -4.988 8.301 1.00 0.43 H new ATOM 0 H2' DG A 4 2.234 -5.065 6.106 1.00 0.39 H new ATOM 0 H2'' DG A 4 0.693 -5.817 5.746 1.00 0.39 H new ATOM 0 H1' DG A 4 -0.259 -3.831 4.923 1.00 0.36 H new ATOM 0 H8 DG A 4 3.583 -3.431 4.790 1.00 0.38 H new ATOM 0 H1 DG A 4 0.455 -3.186 -0.835 1.00 0.39 H new ATOM 0 H21 DG A 4 -2.426 -3.590 1.094 1.00 0.45 H new ATOM 0 H22 DG A 4 -1.724 -3.391 -0.515 1.00 0.45 H new ATOM 128 P DC A 5 -1.524 -4.596 8.977 1.00 0.61 P ATOM 129 OP1 DC A 5 -0.540 -4.598 10.090 1.00 0.71 O ATOM 130 OP2 DC A 5 -2.653 -5.556 9.057 1.00 0.81 O ATOM 131 O5' DC A 5 -2.108 -3.116 8.806 1.00 0.62 O ATOM 132 C5' DC A 5 -3.188 -2.832 7.918 1.00 0.72 C ATOM 133 C4' DC A 5 -2.680 -2.605 6.512 1.00 0.77 C ATOM 134 O4' DC A 5 -3.273 -3.594 5.631 1.00 0.83 O ATOM 135 C3' DC A 5 -3.025 -1.236 5.904 1.00 0.77 C ATOM 136 O3' DC A 5 -1.905 -0.724 5.166 1.00 0.81 O ATOM 137 C2' DC A 5 -4.183 -1.548 4.968 1.00 0.79 C ATOM 138 C1' DC A 5 -3.859 -2.956 4.512 1.00 0.75 C ATOM 139 N1 DC A 5 -5.029 -3.739 4.085 1.00 0.79 N ATOM 140 C2 DC A 5 -5.063 -4.248 2.776 1.00 0.90 C ATOM 141 O2 DC A 5 -4.097 -4.030 2.028 1.00 1.06 O ATOM 142 N3 DC A 5 -6.148 -4.962 2.364 1.00 1.01 N ATOM 143 C4 DC A 5 -7.170 -5.173 3.210 1.00 1.10 C ATOM 144 N4 DC A 5 -8.230 -5.848 2.761 1.00 1.31 N ATOM 145 C5 DC A 5 -7.156 -4.672 4.551 1.00 1.14 C ATOM 146 C6 DC A 5 -6.078 -3.967 4.943 1.00 0.96 C ATOM 0 H5' DC A 5 -3.726 -1.949 8.263 1.00 0.72 H new ATOM 0 H5'' DC A 5 -3.897 -3.660 7.924 1.00 0.72 H new ATOM 0 H4' DC A 5 -1.595 -2.671 6.593 1.00 0.77 H new ATOM 0 H3' DC A 5 -3.273 -0.483 6.652 1.00 0.77 H new ATOM 0 H2' DC A 5 -5.144 -1.497 5.479 1.00 0.79 H new ATOM 0 H2'' DC A 5 -4.229 -0.850 4.132 1.00 0.79 H new ATOM 0 H1' DC A 5 -3.210 -2.897 3.638 1.00 0.75 H new ATOM 0 H41 DC A 5 -9.022 -6.024 3.379 1.00 1.31 H new ATOM 0 H42 DC A 5 -8.248 -6.188 1.799 1.00 1.31 H new ATOM 0 H5 DC A 5 -7.981 -4.853 5.224 1.00 1.14 H new ATOM 0 H6 DC A 5 -6.037 -3.574 5.948 1.00 0.96 H new ATOM 158 P DG A 6 -0.891 0.305 5.864 1.00 0.91 P ATOM 159 OP1 DG A 6 0.465 0.102 5.298 1.00 1.17 O ATOM 160 OP2 DG A 6 -1.041 0.210 7.339 1.00 1.14 O ATOM 161 O5' DG A 6 -1.438 1.719 5.369 1.00 0.77 O ATOM 162 C5' DG A 6 -2.419 2.451 6.104 1.00 0.72 C ATOM 163 C4' DG A 6 -3.431 3.092 5.173 1.00 0.60 C ATOM 164 O4' DG A 6 -2.739 3.913 4.196 1.00 0.55 O ATOM 165 C3' DG A 6 -4.258 2.106 4.346 1.00 0.56 C ATOM 166 O3' DG A 6 -5.530 2.675 4.021 1.00 0.62 O ATOM 167 C2' DG A 6 -3.405 1.940 3.101 1.00 0.49 C ATOM 168 C1' DG A 6 -2.871 3.348 2.893 1.00 0.48 C ATOM 169 N9 DG A 6 -1.564 3.410 2.221 1.00 0.45 N ATOM 170 C8 DG A 6 -0.326 3.486 2.814 1.00 0.45 C ATOM 171 N7 DG A 6 0.652 3.535 1.954 1.00 0.45 N ATOM 172 C5 DG A 6 0.031 3.487 0.720 1.00 0.43 C ATOM 173 C6 DG A 6 0.590 3.508 -0.589 1.00 0.43 C ATOM 174 O6 DG A 6 1.783 3.573 -0.903 1.00 0.43 O ATOM 175 N1 DG A 6 -0.399 3.442 -1.577 1.00 0.42 N ATOM 176 C2 DG A 6 -1.756 3.360 -1.324 1.00 0.43 C ATOM 177 N2 DG A 6 -2.561 3.298 -2.391 1.00 0.44 N ATOM 178 N3 DG A 6 -2.286 3.341 -0.103 1.00 0.44 N ATOM 179 C4 DG A 6 -1.341 3.406 0.867 1.00 0.43 C ATOM 0 H5' DG A 6 -1.931 3.221 6.702 1.00 0.72 H new ATOM 0 H5'' DG A 6 -2.930 1.784 6.799 1.00 0.72 H new ATOM 0 H4' DG A 6 -4.097 3.646 5.835 1.00 0.60 H new ATOM 0 H3' DG A 6 -4.473 1.167 4.856 1.00 0.56 H new ATOM 0 H2' DG A 6 -2.603 1.217 3.250 1.00 0.49 H new ATOM 0 H2'' DG A 6 -3.990 1.596 2.248 1.00 0.49 H new ATOM 0 H1' DG A 6 -3.562 3.883 2.242 1.00 0.48 H new ATOM 0 H8 DG A 6 -0.179 3.503 3.884 1.00 0.45 H new ATOM 0 H1 DG A 6 -0.098 3.455 -2.551 1.00 0.42 H new ATOM 0 H21 DG A 6 -3.571 3.236 -2.265 1.00 0.44 H new ATOM 0 H22 DG A 6 -2.164 3.312 -3.331 1.00 0.44 H new ATOM 191 P DG A 7 -6.692 1.736 3.439 1.00 0.65 P ATOM 192 OP1 DG A 7 -7.959 2.511 3.386 1.00 0.78 O ATOM 193 OP2 DG A 7 -6.703 0.461 4.199 1.00 0.75 O ATOM 194 O5' DG A 7 -6.193 1.451 1.950 1.00 0.53 O ATOM 195 C5' DG A 7 -6.424 2.379 0.892 1.00 0.48 C ATOM 196 C4' DG A 7 -6.538 1.662 -0.435 1.00 0.39 C ATOM 197 O4' DG A 7 -5.242 1.642 -1.089 1.00 0.40 O ATOM 198 C3' DG A 7 -6.984 0.198 -0.343 1.00 0.44 C ATOM 199 O3' DG A 7 -7.906 -0.094 -1.392 1.00 0.48 O ATOM 200 C2' DG A 7 -5.688 -0.582 -0.521 1.00 0.43 C ATOM 201 C1' DG A 7 -4.898 0.316 -1.454 1.00 0.39 C ATOM 202 N9 DG A 7 -3.439 0.175 -1.352 1.00 0.38 N ATOM 203 C8 DG A 7 -2.702 0.079 -0.199 1.00 0.40 C ATOM 204 N7 DG A 7 -1.420 -0.005 -0.415 1.00 0.40 N ATOM 205 C5 DG A 7 -1.296 0.033 -1.793 1.00 0.39 C ATOM 206 C6 DG A 7 -0.132 -0.020 -2.613 1.00 0.39 C ATOM 207 O6 DG A 7 1.049 -0.103 -2.251 1.00 0.41 O ATOM 208 N1 DG A 7 -0.452 0.044 -3.978 1.00 0.41 N ATOM 209 C2 DG A 7 -1.738 0.148 -4.478 1.00 0.42 C ATOM 210 N2 DG A 7 -1.871 0.188 -5.815 1.00 0.47 N ATOM 211 N3 DG A 7 -2.830 0.202 -3.714 1.00 0.40 N ATOM 212 C4 DG A 7 -2.538 0.141 -2.391 1.00 0.38 C ATOM 0 H5' DG A 7 -5.609 3.102 0.851 1.00 0.48 H new ATOM 0 H5'' DG A 7 -7.338 2.940 1.087 1.00 0.48 H new ATOM 0 H4' DG A 7 -7.299 2.218 -0.982 1.00 0.39 H new ATOM 0 H3' DG A 7 -7.491 -0.046 0.590 1.00 0.44 H new ATOM 0 H2' DG A 7 -5.173 -0.737 0.427 1.00 0.43 H new ATOM 0 H2'' DG A 7 -5.862 -1.567 -0.954 1.00 0.43 H new ATOM 0 H1' DG A 7 -5.148 0.047 -2.480 1.00 0.39 H new ATOM 0 H8 DG A 7 -3.140 0.074 0.788 1.00 0.40 H new ATOM 0 H1 DG A 7 0.317 0.012 -4.648 1.00 0.41 H new ATOM 0 H21 DG A 7 -2.798 0.264 -6.233 1.00 0.47 H new ATOM 0 H22 DG A 7 -1.045 0.142 -6.411 1.00 0.47 H new ATOM 224 P DG A 8 -8.746 -1.452 -1.351 1.00 0.61 P ATOM 225 OP1 DG A 8 -10.152 -1.162 -1.730 1.00 0.80 O ATOM 226 OP2 DG A 8 -8.511 -2.128 -0.050 1.00 0.78 O ATOM 227 O5' DG A 8 -8.061 -2.305 -2.507 1.00 0.64 O ATOM 228 C5' DG A 8 -8.151 -1.903 -3.869 1.00 0.70 C ATOM 229 C4' DG A 8 -7.237 -2.739 -4.735 1.00 0.58 C ATOM 230 O4' DG A 8 -5.883 -2.288 -4.602 1.00 0.70 O ATOM 231 C3' DG A 8 -7.152 -4.207 -4.356 1.00 0.56 C ATOM 232 O3' DG A 8 -8.227 -4.935 -4.961 1.00 0.63 O ATOM 233 C2' DG A 8 -5.803 -4.633 -4.940 1.00 0.71 C ATOM 234 C1' DG A 8 -5.010 -3.318 -5.037 1.00 0.59 C ATOM 235 N9 DG A 8 -3.787 -3.273 -4.215 1.00 0.47 N ATOM 236 C8 DG A 8 -3.699 -3.269 -2.839 1.00 0.44 C ATOM 237 N7 DG A 8 -2.467 -3.233 -2.403 1.00 0.41 N ATOM 238 C5 DG A 8 -1.695 -3.210 -3.553 1.00 0.39 C ATOM 239 C6 DG A 8 -0.277 -3.167 -3.711 1.00 0.38 C ATOM 240 O6 DG A 8 0.583 -3.143 -2.827 1.00 0.41 O ATOM 241 N1 DG A 8 0.098 -3.156 -5.059 1.00 0.39 N ATOM 242 C2 DG A 8 -0.788 -3.182 -6.120 1.00 0.45 C ATOM 243 N2 DG A 8 -0.256 -3.162 -7.352 1.00 0.49 N ATOM 244 N3 DG A 8 -2.113 -3.223 -5.982 1.00 0.49 N ATOM 245 C4 DG A 8 -2.495 -3.234 -4.681 1.00 0.44 C ATOM 0 H5' DG A 8 -7.884 -0.850 -3.961 1.00 0.70 H new ATOM 0 H5'' DG A 8 -9.180 -2.003 -4.215 1.00 0.70 H new ATOM 0 H4' DG A 8 -7.668 -2.631 -5.731 1.00 0.58 H new ATOM 0 H3' DG A 8 -7.228 -4.390 -3.284 1.00 0.56 H new ATOM 0 H2' DG A 8 -5.300 -5.356 -4.298 1.00 0.71 H new ATOM 0 H2'' DG A 8 -5.921 -5.102 -5.917 1.00 0.71 H new ATOM 0 H1' DG A 8 -4.675 -3.209 -6.068 1.00 0.59 H new ATOM 0 H8 DG A 8 -4.560 -3.293 -2.188 1.00 0.44 H new ATOM 0 H1 DG A 8 1.095 -3.127 -5.274 1.00 0.39 H new ATOM 0 H21 DG A 8 -0.864 -3.180 -8.171 1.00 0.49 H new ATOM 0 H22 DG A 8 0.757 -3.129 -7.470 1.00 0.49 H new ATOM 257 P DC A 9 -9.009 -6.052 -4.116 1.00 0.82 P ATOM 258 OP1 DC A 9 -8.032 -6.804 -3.286 1.00 1.17 O ATOM 259 OP2 DC A 9 -9.863 -6.835 -5.044 1.00 1.18 O ATOM 260 O5' DC A 9 -9.948 -5.177 -3.162 1.00 0.65 O ATOM 261 C5' DC A 9 -9.865 -5.264 -1.740 1.00 0.70 C ATOM 262 C4' DC A 9 -11.240 -5.191 -1.116 1.00 0.62 C ATOM 263 O4' DC A 9 -11.115 -5.416 0.311 1.00 0.67 O ATOM 264 C3' DC A 9 -11.958 -3.834 -1.271 1.00 0.63 C ATOM 265 O3' DC A 9 -13.291 -4.028 -1.759 1.00 0.72 O ATOM 266 C2' DC A 9 -11.980 -3.261 0.147 1.00 0.64 C ATOM 267 C1' DC A 9 -11.946 -4.514 1.002 1.00 0.68 C ATOM 268 N1 DC A 9 -11.417 -4.341 2.374 1.00 0.69 N ATOM 269 C2 DC A 9 -12.006 -5.080 3.416 1.00 0.82 C ATOM 270 O2 DC A 9 -12.940 -5.855 3.150 1.00 0.99 O ATOM 271 N3 DC A 9 -11.541 -4.933 4.686 1.00 0.83 N ATOM 272 C4 DC A 9 -10.531 -4.086 4.940 1.00 0.73 C ATOM 273 N4 DC A 9 -10.122 -3.964 6.204 1.00 0.79 N ATOM 274 C5 DC A 9 -9.907 -3.321 3.902 1.00 0.67 C ATOM 275 C6 DC A 9 -10.375 -3.477 2.644 1.00 0.63 C ATOM 0 H5' DC A 9 -9.244 -4.454 -1.357 1.00 0.70 H new ATOM 0 H5'' DC A 9 -9.381 -6.199 -1.456 1.00 0.70 H new ATOM 0 H4' DC A 9 -11.830 -5.943 -1.640 1.00 0.62 H new ATOM 0 H3' DC A 9 -11.462 -3.172 -1.981 1.00 0.63 H new ATOM 0 H2' DC A 9 -11.123 -2.615 0.338 1.00 0.64 H new ATOM 0 H2'' DC A 9 -12.875 -2.667 0.332 1.00 0.64 H new ATOM 0 H1' DC A 9 -12.973 -4.849 1.144 1.00 0.68 H new ATOM 0 H41 DC A 9 -9.357 -3.330 6.434 1.00 0.79 H new ATOM 0 H42 DC A 9 -10.574 -4.505 6.941 1.00 0.79 H new ATOM 0 H5 DC A 9 -9.093 -2.645 4.117 1.00 0.67 H new ATOM 0 H6 DC A 9 -9.927 -2.917 1.837 1.00 0.63 H new ATOM 287 P DG A 10 -14.189 -2.748 -2.132 1.00 0.98 P ATOM 288 OP1 DG A 10 -13.327 -1.536 -2.151 1.00 1.42 O ATOM 289 OP2 DG A 10 -15.376 -2.729 -1.241 1.00 1.66 O ATOM 290 O5' DG A 10 -14.665 -3.071 -3.622 1.00 0.79 O ATOM 291 C5' DG A 10 -13.878 -2.724 -4.760 1.00 0.89 C ATOM 292 C4' DG A 10 -14.432 -1.493 -5.449 1.00 0.78 C ATOM 293 O4' DG A 10 -14.040 -0.305 -4.705 1.00 0.73 O ATOM 294 C3' DG A 10 -13.893 -1.251 -6.857 1.00 0.77 C ATOM 295 O3' DG A 10 -14.801 -0.421 -7.599 1.00 0.85 O ATOM 296 C2' DG A 10 -12.607 -0.512 -6.551 1.00 0.69 C ATOM 297 C1' DG A 10 -13.057 0.422 -5.438 1.00 0.67 C ATOM 298 N9 DG A 10 -11.998 0.850 -4.506 1.00 0.65 N ATOM 299 C8 DG A 10 -10.648 0.602 -4.603 1.00 0.70 C ATOM 300 N7 DG A 10 -9.956 1.123 -3.625 1.00 0.74 N ATOM 301 C5 DG A 10 -10.904 1.752 -2.828 1.00 0.72 C ATOM 302 C6 DG A 10 -10.752 2.493 -1.613 1.00 0.81 C ATOM 303 O6 DG A 10 -9.716 2.740 -0.987 1.00 0.89 O ATOM 304 N1 DG A 10 -11.978 2.961 -1.133 1.00 0.91 N ATOM 305 C2 DG A 10 -13.197 2.745 -1.744 1.00 0.95 C ATOM 306 N2 DG A 10 -14.266 3.276 -1.134 1.00 1.16 N ATOM 307 N3 DG A 10 -13.351 2.058 -2.875 1.00 0.84 N ATOM 308 C4 DG A 10 -12.171 1.592 -3.360 1.00 0.71 C ATOM 0 H5' DG A 10 -13.857 -3.559 -5.461 1.00 0.89 H new ATOM 0 H5'' DG A 10 -12.849 -2.541 -4.452 1.00 0.89 H new ATOM 0 H4' DG A 10 -15.507 -1.670 -5.496 1.00 0.78 H new ATOM 0 H3' DG A 10 -13.758 -2.150 -7.459 1.00 0.77 H new ATOM 0 H2' DG A 10 -11.813 -1.185 -6.227 1.00 0.69 H new ATOM 0 H2'' DG A 10 -12.230 0.032 -7.417 1.00 0.69 H new ATOM 0 H1' DG A 10 -13.416 1.344 -5.896 1.00 0.67 H new ATOM 0 H8 DG A 10 -10.205 0.033 -5.407 1.00 0.70 H new ATOM 0 H1 DG A 10 -11.972 3.502 -0.268 1.00 0.91 H new ATOM 0 H21 DG A 10 -15.196 3.152 -1.535 1.00 1.16 H new ATOM 0 H22 DG A 10 -14.150 3.804 -0.269 1.00 1.16 H new ATOM 320 P DC A 11 -14.636 -0.249 -9.187 1.00 0.77 P ATOM 321 OP1 DC A 11 -15.847 -0.791 -9.854 1.00 0.94 O ATOM 322 OP2 DC A 11 -13.323 -0.802 -9.604 1.00 0.77 O ATOM 323 O5' DC A 11 -14.627 1.345 -9.358 1.00 0.80 O ATOM 324 C5' DC A 11 -13.509 2.054 -9.898 1.00 0.73 C ATOM 325 C4' DC A 11 -12.481 2.336 -8.824 1.00 0.63 C ATOM 326 O4' DC A 11 -11.583 1.230 -8.723 1.00 0.73 O ATOM 327 C3' DC A 11 -11.550 3.513 -9.082 1.00 0.58 C ATOM 328 O3' DC A 11 -12.154 4.732 -8.630 1.00 0.58 O ATOM 329 C2' DC A 11 -10.323 3.164 -8.234 1.00 0.60 C ATOM 330 C1' DC A 11 -10.406 1.642 -8.059 1.00 0.65 C ATOM 331 N1 DC A 11 -9.265 0.826 -8.583 1.00 0.75 N ATOM 332 C2 DC A 11 -8.401 1.338 -9.596 1.00 0.78 C ATOM 333 O2 DC A 11 -8.604 2.465 -10.075 1.00 0.78 O ATOM 334 N3 DC A 11 -7.371 0.565 -10.045 1.00 0.96 N ATOM 335 C4 DC A 11 -7.173 -0.663 -9.542 1.00 1.11 C ATOM 336 N4 DC A 11 -6.151 -1.383 -10.011 1.00 1.30 N ATOM 337 C5 DC A 11 -8.021 -1.208 -8.530 1.00 1.13 C ATOM 338 C6 DC A 11 -9.039 -0.446 -8.086 1.00 0.94 C ATOM 0 H5' DC A 11 -13.846 2.992 -10.340 1.00 0.73 H new ATOM 0 H5'' DC A 11 -13.054 1.470 -10.698 1.00 0.73 H new ATOM 0 H4' DC A 11 -13.091 2.540 -7.944 1.00 0.63 H new ATOM 0 H3' DC A 11 -11.315 3.666 -10.135 1.00 0.58 H new ATOM 0 H2' DC A 11 -9.399 3.458 -8.731 1.00 0.60 H new ATOM 0 H2'' DC A 11 -10.345 3.677 -7.273 1.00 0.60 H new ATOM 0 H1' DC A 11 -10.386 1.463 -6.984 1.00 0.65 H new ATOM 0 H41 DC A 11 -5.977 -2.320 -9.646 1.00 1.30 H new ATOM 0 H42 DC A 11 -5.544 -0.996 -10.734 1.00 1.30 H new ATOM 0 H5 DC A 11 -7.851 -2.198 -8.134 1.00 1.13 H new ATOM 0 H6 DC A 11 -9.696 -0.837 -7.323 1.00 0.94 H new ATOM 350 P DT A 12 -11.381 6.131 -8.812 1.00 0.79 P ATOM 351 OP1 DT A 12 -12.306 7.112 -9.437 1.00 1.21 O ATOM 352 OP2 DT A 12 -10.085 5.885 -9.494 1.00 1.09 O ATOM 353 O5' DT A 12 -11.104 6.579 -7.301 1.00 0.72 O ATOM 354 C5' DT A 12 -9.920 7.291 -6.937 1.00 0.60 C ATOM 355 C4' DT A 12 -9.718 7.290 -5.433 1.00 0.58 C ATOM 356 O4' DT A 12 -9.769 5.929 -4.941 1.00 0.58 O ATOM 357 C3' DT A 12 -8.358 7.803 -4.964 1.00 0.58 C ATOM 358 O3' DT A 12 -8.360 9.228 -4.786 1.00 0.68 O ATOM 359 C2' DT A 12 -8.197 7.110 -3.620 1.00 0.60 C ATOM 360 C1' DT A 12 -8.864 5.756 -3.849 1.00 0.58 C ATOM 361 N1 DT A 12 -7.931 4.654 -4.169 1.00 0.54 N ATOM 362 C2 DT A 12 -7.304 4.016 -3.110 1.00 0.61 C ATOM 363 O2 DT A 12 -7.483 4.334 -1.945 1.00 0.71 O ATOM 364 N3 DT A 12 -6.454 2.994 -3.466 1.00 0.60 N ATOM 365 C4 DT A 12 -6.173 2.553 -4.750 1.00 0.53 C ATOM 366 O4 DT A 12 -5.388 1.623 -4.920 1.00 0.57 O ATOM 367 C5 DT A 12 -6.860 3.263 -5.814 1.00 0.48 C ATOM 368 C7 DT A 12 -6.615 2.855 -7.231 1.00 0.48 C ATOM 369 C6 DT A 12 -7.698 4.267 -5.482 1.00 0.48 C ATOM 0 H5' DT A 12 -9.985 8.318 -7.297 1.00 0.60 H new ATOM 0 H5'' DT A 12 -9.056 6.837 -7.423 1.00 0.60 H new ATOM 0 H4' DT A 12 -10.504 7.946 -5.058 1.00 0.58 H new ATOM 0 H3' DT A 12 -7.559 7.599 -5.677 1.00 0.58 H new ATOM 0 H2' DT A 12 -7.148 7.002 -3.345 1.00 0.60 H new ATOM 0 H2'' DT A 12 -8.681 7.668 -2.818 1.00 0.60 H new ATOM 0 H1' DT A 12 -9.350 5.462 -2.919 1.00 0.58 H new ATOM 0 H3 DT A 12 -5.980 2.509 -2.704 1.00 0.60 H new ATOM 0 H71 DT A 12 -7.506 3.053 -7.826 1.00 0.48 H new ATOM 0 H72 DT A 12 -5.776 3.423 -7.633 1.00 0.48 H new ATOM 0 H73 DT A 12 -6.383 1.791 -7.268 1.00 0.48 H new ATOM 0 H6 DT A 12 -8.211 4.793 -6.273 1.00 0.48 H new ATOM 382 P DA A 13 -7.251 10.140 -5.519 1.00 0.73 P ATOM 383 OP1 DA A 13 -7.616 11.569 -5.340 1.00 0.85 O ATOM 384 OP2 DA A 13 -7.090 9.653 -6.912 1.00 0.68 O ATOM 385 O5' DA A 13 -5.901 9.851 -4.689 1.00 0.81 O ATOM 386 C5' DA A 13 -5.265 8.573 -4.707 1.00 0.71 C ATOM 387 C4' DA A 13 -4.465 8.370 -5.969 1.00 0.70 C ATOM 388 O4' DA A 13 -3.065 8.661 -5.691 1.00 0.68 O ATOM 389 C3' DA A 13 -4.485 6.926 -6.488 1.00 0.64 C ATOM 390 O3' DA A 13 -4.489 6.928 -7.920 1.00 0.71 O ATOM 391 C2' DA A 13 -3.190 6.342 -5.965 1.00 0.64 C ATOM 392 C1' DA A 13 -2.263 7.534 -6.016 1.00 0.67 C ATOM 393 N9 DA A 13 -1.142 7.461 -5.066 1.00 0.65 N ATOM 394 C8 DA A 13 -1.191 7.508 -3.694 1.00 0.64 C ATOM 395 N7 DA A 13 -0.013 7.404 -3.118 1.00 0.64 N ATOM 396 C5 DA A 13 0.872 7.279 -4.185 1.00 0.65 C ATOM 397 C6 DA A 13 2.284 7.131 -4.257 1.00 0.66 C ATOM 398 N6 DA A 13 3.092 7.094 -3.190 1.00 0.67 N ATOM 399 N1 DA A 13 2.846 7.033 -5.489 1.00 0.67 N ATOM 400 C2 DA A 13 2.046 7.083 -6.569 1.00 0.70 C ATOM 401 N3 DA A 13 0.717 7.218 -6.631 1.00 0.68 N ATOM 402 C4 DA A 13 0.184 7.314 -5.392 1.00 0.66 C ATOM 0 H5' DA A 13 -6.018 7.790 -4.623 1.00 0.71 H new ATOM 0 H5'' DA A 13 -4.610 8.480 -3.841 1.00 0.71 H new ATOM 0 H4' DA A 13 -4.916 9.025 -6.714 1.00 0.70 H new ATOM 0 H3' DA A 13 -5.361 6.363 -6.168 1.00 0.64 H new ATOM 0 H2' DA A 13 -3.298 5.952 -4.953 1.00 0.64 H new ATOM 0 H2'' DA A 13 -2.833 5.521 -6.586 1.00 0.64 H new ATOM 0 H1' DA A 13 -1.810 7.583 -7.006 1.00 0.67 H new ATOM 0 H8 DA A 13 -2.111 7.620 -3.140 1.00 0.64 H new ATOM 0 H61 DA A 13 4.098 6.985 -3.316 1.00 0.67 H new ATOM 0 H62 DA A 13 2.701 7.175 -2.251 1.00 0.67 H new ATOM 0 H2 DA A 13 2.548 7.003 -7.522 1.00 0.70 H new ATOM 414 P DG A 14 -5.733 6.325 -8.731 1.00 0.63 P ATOM 415 OP1 DG A 14 -6.057 7.233 -9.862 1.00 0.77 O ATOM 416 OP2 DG A 14 -6.825 6.001 -7.785 1.00 0.68 O ATOM 417 O5' DG A 14 -5.126 4.971 -9.313 1.00 0.55 O ATOM 418 C5' DG A 14 -4.380 4.966 -10.525 1.00 0.61 C ATOM 419 C4' DG A 14 -3.280 3.926 -10.500 1.00 0.55 C ATOM 420 O4' DG A 14 -2.374 4.169 -9.381 1.00 0.51 O ATOM 421 C3' DG A 14 -3.745 2.458 -10.318 1.00 0.53 C ATOM 422 O3' DG A 14 -2.936 1.608 -11.123 1.00 0.70 O ATOM 423 C2' DG A 14 -3.417 2.191 -8.861 1.00 0.47 C ATOM 424 C1' DG A 14 -2.116 2.930 -8.767 1.00 0.44 C ATOM 425 N9 DG A 14 -1.578 3.156 -7.423 1.00 0.38 N ATOM 426 C8 DG A 14 -2.256 3.217 -6.228 1.00 0.38 C ATOM 427 N7 DG A 14 -1.461 3.393 -5.202 1.00 0.38 N ATOM 428 C5 DG A 14 -0.190 3.452 -5.757 1.00 0.36 C ATOM 429 C6 DG A 14 1.089 3.623 -5.143 1.00 0.39 C ATOM 430 O6 DG A 14 1.347 3.757 -3.944 1.00 0.41 O ATOM 431 N1 DG A 14 2.125 3.619 -6.089 1.00 0.40 N ATOM 432 C2 DG A 14 1.939 3.472 -7.452 1.00 0.39 C ATOM 433 N2 DG A 14 3.033 3.487 -8.226 1.00 0.42 N ATOM 434 N3 DG A 14 0.755 3.315 -8.023 1.00 0.38 N ATOM 435 C4 DG A 14 -0.256 3.312 -7.127 1.00 0.36 C ATOM 0 H5' DG A 14 -3.945 5.952 -10.689 1.00 0.61 H new ATOM 0 H5'' DG A 14 -5.048 4.769 -11.363 1.00 0.61 H new ATOM 0 H4' DG A 14 -2.820 4.032 -11.483 1.00 0.55 H new ATOM 0 H3' DG A 14 -4.789 2.291 -10.585 1.00 0.53 H new ATOM 0 H2' DG A 14 -4.173 2.584 -8.182 1.00 0.47 H new ATOM 0 H2'' DG A 14 -3.313 1.128 -8.642 1.00 0.47 H new ATOM 0 H1' DG A 14 -1.346 2.319 -9.238 1.00 0.44 H new ATOM 0 H8 DG A 14 -3.329 3.129 -6.144 1.00 0.38 H new ATOM 0 H1 DG A 14 3.080 3.732 -5.749 1.00 0.40 H new ATOM 0 H21 DG A 14 2.944 3.382 -9.237 1.00 0.42 H new ATOM 0 H22 DG A 14 3.954 3.603 -7.804 1.00 0.42 H new ATOM 447 P DG A 15 -3.515 0.881 -12.413 1.00 0.53 P ATOM 448 OP1 DG A 15 -4.225 1.859 -13.275 1.00 0.97 O ATOM 449 OP2 DG A 15 -4.257 -0.328 -11.993 1.00 1.16 O ATOM 450 O5' DG A 15 -2.170 0.430 -13.137 1.00 0.51 O ATOM 451 C5' DG A 15 -1.323 1.382 -13.769 1.00 0.55 C ATOM 452 C4' DG A 15 0.128 1.157 -13.403 1.00 0.44 C ATOM 453 O4' DG A 15 0.317 1.354 -11.973 1.00 0.42 O ATOM 454 C3' DG A 15 0.671 -0.253 -13.705 1.00 0.42 C ATOM 455 O3' DG A 15 1.902 -0.138 -14.441 1.00 0.45 O ATOM 456 C2' DG A 15 0.923 -0.844 -12.308 1.00 0.41 C ATOM 457 C1' DG A 15 1.271 0.428 -11.510 1.00 0.37 C ATOM 458 N9 DG A 15 1.154 0.301 -10.040 1.00 0.38 N ATOM 459 C8 DG A 15 0.007 0.141 -9.293 1.00 0.42 C ATOM 460 N7 DG A 15 0.237 0.062 -8.008 1.00 0.44 N ATOM 461 C5 DG A 15 1.611 0.173 -7.894 1.00 0.41 C ATOM 462 C6 DG A 15 2.443 0.154 -6.736 1.00 0.43 C ATOM 463 O6 DG A 15 2.099 0.041 -5.556 1.00 0.46 O ATOM 464 N1 DG A 15 3.796 0.295 -7.065 1.00 0.42 N ATOM 465 C2 DG A 15 4.275 0.440 -8.358 1.00 0.39 C ATOM 466 N2 DG A 15 5.597 0.556 -8.501 1.00 0.42 N ATOM 467 N3 DG A 15 3.502 0.461 -9.441 1.00 0.37 N ATOM 468 C4 DG A 15 2.192 0.322 -9.141 1.00 0.38 C ATOM 0 H5' DG A 15 -1.622 2.389 -13.476 1.00 0.55 H new ATOM 0 H5'' DG A 15 -1.442 1.316 -14.850 1.00 0.55 H new ATOM 0 H4' DG A 15 0.669 1.873 -14.021 1.00 0.44 H new ATOM 0 H3' DG A 15 -0.001 -0.869 -14.303 1.00 0.42 H new ATOM 0 H2' DG A 15 0.045 -1.353 -11.911 1.00 0.41 H new ATOM 0 H2'' DG A 15 1.738 -1.568 -12.307 1.00 0.41 H new ATOM 0 H1' DG A 15 2.316 0.697 -11.666 1.00 0.37 H new ATOM 0 H8 DG A 15 -0.981 0.086 -9.725 1.00 0.42 H new ATOM 0 H1 DG A 15 4.474 0.291 -6.303 1.00 0.42 H new ATOM 0 H21 DG A 15 6.002 0.665 -9.431 1.00 0.42 H new ATOM 0 H22 DG A 15 6.202 0.536 -7.680 1.00 0.42 H new ATOM 480 P DG A 16 2.590 -1.439 -15.093 1.00 0.52 P ATOM 481 OP1 DG A 16 3.357 -1.025 -16.295 1.00 0.68 O ATOM 482 OP2 DG A 16 1.561 -2.495 -15.262 1.00 0.64 O ATOM 483 O5' DG A 16 3.613 -1.883 -13.956 1.00 0.48 O ATOM 484 C5' DG A 16 4.542 -0.956 -13.403 1.00 0.41 C ATOM 485 C4' DG A 16 5.528 -1.654 -12.496 1.00 0.41 C ATOM 486 O4' DG A 16 5.056 -1.588 -11.138 1.00 0.46 O ATOM 487 C3' DG A 16 5.774 -3.146 -12.783 1.00 0.47 C ATOM 488 O3' DG A 16 7.187 -3.438 -12.791 1.00 0.60 O ATOM 489 C2' DG A 16 5.115 -3.826 -11.599 1.00 0.45 C ATOM 490 C1' DG A 16 5.350 -2.799 -10.509 1.00 0.40 C ATOM 491 N9 DG A 16 4.512 -2.919 -9.310 1.00 0.39 N ATOM 492 C8 DG A 16 3.137 -2.972 -9.241 1.00 0.40 C ATOM 493 N7 DG A 16 2.690 -3.040 -8.011 1.00 0.42 N ATOM 494 C5 DG A 16 3.838 -3.027 -7.227 1.00 0.41 C ATOM 495 C6 DG A 16 3.993 -3.072 -5.807 1.00 0.44 C ATOM 496 O6 DG A 16 3.109 -3.136 -4.946 1.00 0.47 O ATOM 497 N1 DG A 16 5.345 -3.033 -5.429 1.00 0.46 N ATOM 498 C2 DG A 16 6.407 -2.959 -6.317 1.00 0.46 C ATOM 499 N2 DG A 16 7.640 -2.921 -5.793 1.00 0.51 N ATOM 500 N3 DG A 16 6.264 -2.917 -7.637 1.00 0.44 N ATOM 501 C4 DG A 16 4.966 -2.953 -8.020 1.00 0.40 C ATOM 0 H5' DG A 16 4.007 -0.189 -12.843 1.00 0.41 H new ATOM 0 H5'' DG A 16 5.077 -0.449 -14.206 1.00 0.41 H new ATOM 0 H4' DG A 16 6.465 -1.127 -12.675 1.00 0.41 H new ATOM 0 H3' DG A 16 5.387 -3.466 -13.750 1.00 0.47 H new ATOM 0 H2' DG A 16 4.055 -4.013 -11.768 1.00 0.45 H new ATOM 0 H2'' DG A 16 5.575 -4.787 -11.367 1.00 0.45 H new ATOM 0 H1' DG A 16 6.364 -2.916 -10.127 1.00 0.40 H new ATOM 0 H8 DG A 16 2.495 -2.959 -10.109 1.00 0.40 H new ATOM 0 H1 DG A 16 5.560 -3.061 -4.432 1.00 0.46 H new ATOM 0 H21 DG A 16 8.453 -2.866 -6.406 1.00 0.51 H new ATOM 0 H22 DG A 16 7.765 -2.947 -4.781 1.00 0.51 H new ATOM 513 P DA A 17 8.136 -2.918 -13.986 1.00 0.70 P ATOM 514 OP1 DA A 17 7.451 -3.151 -15.283 1.00 0.76 O ATOM 515 OP2 DA A 17 9.486 -3.505 -13.803 1.00 1.02 O ATOM 516 O5' DA A 17 8.204 -1.346 -13.712 1.00 0.83 O ATOM 517 C5' DA A 17 9.440 -0.648 -13.558 1.00 0.78 C ATOM 518 C4' DA A 17 9.304 0.776 -14.060 1.00 0.63 C ATOM 519 O4' DA A 17 9.480 0.793 -15.503 1.00 0.73 O ATOM 520 C3' DA A 17 7.929 1.416 -13.802 1.00 0.62 C ATOM 521 O3' DA A 17 8.078 2.784 -13.374 1.00 0.88 O ATOM 522 C2' DA A 17 7.255 1.346 -15.161 1.00 0.67 C ATOM 523 C1' DA A 17 8.430 1.533 -16.094 1.00 0.90 C ATOM 524 N9 DA A 17 8.206 1.059 -17.479 1.00 1.30 N ATOM 525 C8 DA A 17 8.102 -0.241 -17.955 1.00 1.55 C ATOM 526 N7 DA A 17 7.885 -0.314 -19.243 1.00 2.00 N ATOM 527 C5 DA A 17 7.843 1.010 -19.651 1.00 2.16 C ATOM 528 C6 DA A 17 7.642 1.603 -20.918 1.00 2.76 C ATOM 529 N6 DA A 17 7.438 0.900 -22.033 1.00 3.18 N ATOM 530 N1 DA A 17 7.658 2.958 -20.995 1.00 3.04 N ATOM 531 C2 DA A 17 7.860 3.662 -19.865 1.00 2.77 C ATOM 532 N3 DA A 17 8.061 3.217 -18.615 1.00 2.16 N ATOM 533 C4 DA A 17 8.039 1.865 -18.577 1.00 1.82 C ATOM 0 H5' DA A 17 10.227 -1.162 -14.109 1.00 0.78 H new ATOM 0 H5'' DA A 17 9.736 -0.645 -12.509 1.00 0.78 H new ATOM 0 H4' DA A 17 10.059 1.342 -13.514 1.00 0.63 H new ATOM 0 H3' DA A 17 7.362 0.916 -13.017 1.00 0.62 H new ATOM 0 H2' DA A 17 6.753 0.392 -15.321 1.00 0.67 H new ATOM 0 H2'' DA A 17 6.504 2.126 -15.286 1.00 0.67 H new ATOM 0 H1' DA A 17 8.635 2.598 -16.204 1.00 0.90 H new ATOM 0 H8 DA A 17 8.192 -1.111 -17.321 1.00 1.55 H new ATOM 0 H61 DA A 17 7.299 1.382 -22.921 1.00 3.18 H new ATOM 0 H62 DA A 17 7.421 -0.119 -21.997 1.00 3.18 H new ATOM 0 H2 DA A 17 7.860 4.736 -19.981 1.00 2.77 H new ATOM 545 P DG A 18 6.953 3.454 -12.433 1.00 0.84 P ATOM 546 OP1 DG A 18 6.254 2.379 -11.681 1.00 1.13 O ATOM 547 OP2 DG A 18 6.123 4.370 -13.253 1.00 1.18 O ATOM 548 O5' DG A 18 7.808 4.313 -11.392 1.00 0.73 O ATOM 549 C5' DG A 18 9.093 4.857 -11.699 1.00 0.56 C ATOM 550 C4' DG A 18 10.109 4.482 -10.627 1.00 0.44 C ATOM 551 O4' DG A 18 9.538 4.756 -9.315 1.00 0.45 O ATOM 552 C3' DG A 18 10.540 3.004 -10.590 1.00 0.39 C ATOM 553 O3' DG A 18 11.924 2.897 -10.201 1.00 0.40 O ATOM 554 C2' DG A 18 9.639 2.402 -9.518 1.00 0.37 C ATOM 555 C1' DG A 18 9.443 3.562 -8.544 1.00 0.39 C ATOM 556 N9 DG A 18 8.135 3.556 -7.842 1.00 0.41 N ATOM 557 C8 DG A 18 6.881 3.516 -8.416 1.00 0.43 C ATOM 558 N7 DG A 18 5.916 3.565 -7.547 1.00 0.44 N ATOM 559 C5 DG A 18 6.545 3.635 -6.326 1.00 0.42 C ATOM 560 C6 DG A 18 5.986 3.703 -5.019 1.00 0.44 C ATOM 561 O6 DG A 18 4.790 3.725 -4.707 1.00 0.48 O ATOM 562 N1 DG A 18 6.977 3.752 -4.037 1.00 0.44 N ATOM 563 C2 DG A 18 8.335 3.734 -4.292 1.00 0.44 C ATOM 564 N2 DG A 18 9.132 3.751 -3.219 1.00 0.48 N ATOM 565 N3 DG A 18 8.869 3.677 -5.513 1.00 0.42 N ATOM 566 C4 DG A 18 7.922 3.627 -6.480 1.00 0.41 C ATOM 0 H5' DG A 18 9.024 5.942 -11.778 1.00 0.56 H new ATOM 0 H5'' DG A 18 9.427 4.488 -12.668 1.00 0.56 H new ATOM 0 H4' DG A 18 10.988 5.076 -10.877 1.00 0.44 H new ATOM 0 H3' DG A 18 10.449 2.505 -11.555 1.00 0.39 H new ATOM 0 H2' DG A 18 8.691 2.059 -9.933 1.00 0.37 H new ATOM 0 H2'' DG A 18 10.105 1.543 -9.035 1.00 0.37 H new ATOM 0 H1' DG A 18 10.200 3.480 -7.765 1.00 0.39 H new ATOM 0 H8 DG A 18 6.718 3.450 -9.482 1.00 0.43 H new ATOM 0 H1 DG A 18 6.678 3.805 -3.063 1.00 0.44 H new ATOM 0 H21 DG A 18 10.145 3.739 -3.336 1.00 0.48 H new ATOM 0 H22 DG A 18 8.727 3.776 -2.283 1.00 0.48 H new ATOM 578 P DG A 19 12.627 1.448 -10.066 1.00 0.46 P ATOM 579 OP1 DG A 19 14.084 1.594 -10.308 1.00 0.58 O ATOM 580 OP2 DG A 19 11.887 0.469 -10.902 1.00 0.52 O ATOM 581 O5' DG A 19 12.391 1.098 -8.527 1.00 0.47 O ATOM 582 C5' DG A 19 12.904 1.945 -7.506 1.00 0.58 C ATOM 583 C4' DG A 19 12.617 1.390 -6.126 1.00 0.56 C ATOM 584 O4' DG A 19 11.220 1.596 -5.792 1.00 0.48 O ATOM 585 C3' DG A 19 12.869 -0.118 -5.950 1.00 0.59 C ATOM 586 O3' DG A 19 13.721 -0.323 -4.810 1.00 0.80 O ATOM 587 C2' DG A 19 11.467 -0.693 -5.713 1.00 0.52 C ATOM 588 C1' DG A 19 10.748 0.474 -5.080 1.00 0.41 C ATOM 589 N9 DG A 19 9.282 0.416 -5.174 1.00 0.34 N ATOM 590 C8 DG A 19 8.525 0.372 -6.318 1.00 0.36 C ATOM 591 N7 DG A 19 7.245 0.339 -6.084 1.00 0.35 N ATOM 592 C5 DG A 19 7.141 0.357 -4.708 1.00 0.32 C ATOM 593 C6 DG A 19 5.985 0.334 -3.877 1.00 0.34 C ATOM 594 O6 DG A 19 4.797 0.297 -4.230 1.00 0.38 O ATOM 595 N1 DG A 19 6.323 0.362 -2.515 1.00 0.32 N ATOM 596 C2 DG A 19 7.626 0.406 -2.033 1.00 0.30 C ATOM 597 N2 DG A 19 7.786 0.416 -0.702 1.00 0.32 N ATOM 598 N3 DG A 19 8.706 0.429 -2.811 1.00 0.30 N ATOM 599 C4 DG A 19 8.394 0.403 -4.126 1.00 0.31 C ATOM 0 H5' DG A 19 12.462 2.937 -7.599 1.00 0.58 H new ATOM 0 H5'' DG A 19 13.980 2.062 -7.636 1.00 0.58 H new ATOM 0 H4' DG A 19 13.312 1.927 -5.480 1.00 0.56 H new ATOM 0 H3' DG A 19 13.364 -0.589 -6.799 1.00 0.59 H new ATOM 0 H2' DG A 19 10.993 -1.008 -6.643 1.00 0.52 H new ATOM 0 H2'' DG A 19 11.489 -1.563 -5.056 1.00 0.52 H new ATOM 0 H1' DG A 19 10.950 0.492 -4.009 1.00 0.41 H new ATOM 0 H8 DG A 19 8.948 0.365 -7.312 1.00 0.36 H new ATOM 0 H1 DG A 19 5.563 0.349 -1.835 1.00 0.32 H new ATOM 0 H21 DG A 19 8.723 0.448 -0.301 1.00 0.32 H new ATOM 0 H22 DG A 19 6.970 0.392 -0.090 1.00 0.32 H new ATOM 611 P DG A 20 14.148 -1.802 -4.338 1.00 0.96 P ATOM 612 OP1 DG A 20 15.609 -1.819 -4.068 1.00 1.27 O ATOM 613 OP2 DG A 20 13.619 -2.794 -5.308 1.00 0.97 O ATOM 614 O5' DG A 20 13.364 -1.948 -2.959 1.00 0.96 O ATOM 615 C5' DG A 20 13.562 -1.016 -1.897 1.00 1.09 C ATOM 616 C4' DG A 20 13.019 -1.555 -0.591 1.00 1.01 C ATOM 617 O4' DG A 20 11.569 -1.425 -0.580 1.00 0.85 O ATOM 618 C3' DG A 20 13.303 -3.038 -0.339 1.00 1.02 C ATOM 619 O3' DG A 20 13.528 -3.272 1.063 1.00 1.15 O ATOM 620 C2' DG A 20 12.024 -3.706 -0.801 1.00 0.84 C ATOM 621 C1' DG A 20 10.971 -2.695 -0.375 1.00 0.71 C ATOM 622 N9 DG A 20 9.722 -2.766 -1.148 1.00 0.55 N ATOM 623 C8 DG A 20 9.596 -2.774 -2.518 1.00 0.54 C ATOM 624 N7 DG A 20 8.357 -2.873 -2.914 1.00 0.48 N ATOM 625 C5 DG A 20 7.619 -2.932 -1.747 1.00 0.44 C ATOM 626 C6 DG A 20 6.211 -3.043 -1.555 1.00 0.44 C ATOM 627 O6 DG A 20 5.330 -3.115 -2.421 1.00 0.48 O ATOM 628 N1 DG A 20 5.871 -3.067 -0.197 1.00 0.44 N ATOM 629 C2 DG A 20 6.786 -2.993 0.841 1.00 0.44 C ATOM 630 N2 DG A 20 6.287 -3.031 2.085 1.00 0.47 N ATOM 631 N3 DG A 20 8.103 -2.889 0.668 1.00 0.48 N ATOM 632 C4 DG A 20 8.448 -2.864 -0.643 1.00 0.47 C ATOM 0 H5' DG A 20 13.069 -0.074 -2.139 1.00 1.09 H new ATOM 0 H5'' DG A 20 14.625 -0.801 -1.791 1.00 1.09 H new ATOM 0 H4' DG A 20 13.523 -0.971 0.179 1.00 1.01 H new ATOM 0 H3' DG A 20 14.190 -3.409 -0.852 1.00 1.02 H new ATOM 0 H2' DG A 20 12.017 -3.874 -1.878 1.00 0.84 H new ATOM 0 H2'' DG A 20 11.875 -4.676 -0.326 1.00 0.84 H new ATOM 0 H1' DG A 20 10.683 -2.893 0.658 1.00 0.71 H new ATOM 0 H8 DG A 20 10.435 -2.705 -3.195 1.00 0.54 H new ATOM 0 H1 DG A 20 4.883 -3.144 0.045 1.00 0.44 H new ATOM 0 H21 DG A 20 6.914 -2.980 2.888 1.00 0.47 H new ATOM 0 H22 DG A 20 5.280 -3.111 2.228 1.00 0.47 H new ATOM 644 P DT A 21 14.237 -4.630 1.560 1.00 1.33 P ATOM 645 OP1 DT A 21 14.820 -4.401 2.907 1.00 1.58 O ATOM 646 OP2 DT A 21 15.144 -5.120 0.490 1.00 1.58 O ATOM 647 O5' DT A 21 13.000 -5.631 1.698 1.00 1.11 O ATOM 648 C5' DT A 21 12.265 -5.738 2.917 1.00 1.07 C ATOM 649 C4' DT A 21 11.134 -6.742 2.797 1.00 0.94 C ATOM 650 O4' DT A 21 10.116 -6.227 1.905 1.00 0.87 O ATOM 651 C3' DT A 21 11.520 -8.086 2.199 1.00 1.03 C ATOM 652 O3' DT A 21 12.026 -8.968 3.209 1.00 1.21 O ATOM 653 C2' DT A 21 10.197 -8.588 1.640 1.00 1.00 C ATOM 654 C1' DT A 21 9.483 -7.297 1.211 1.00 0.92 C ATOM 655 N1 DT A 21 9.531 -7.002 -0.237 1.00 1.03 N ATOM 656 C2 DT A 21 8.382 -6.496 -0.834 1.00 1.26 C ATOM 657 O2 DT A 21 7.340 -6.306 -0.223 1.00 1.40 O ATOM 658 N3 DT A 21 8.503 -6.211 -2.177 1.00 1.50 N ATOM 659 C4 DT A 21 9.628 -6.376 -2.965 1.00 1.60 C ATOM 660 O4 DT A 21 9.589 -6.076 -4.156 1.00 1.90 O ATOM 661 C5 DT A 21 10.793 -6.910 -2.280 1.00 1.48 C ATOM 662 C7 DT A 21 12.049 -7.119 -3.059 1.00 1.82 C ATOM 663 C6 DT A 21 10.696 -7.197 -0.967 1.00 1.19 C ATOM 0 H5' DT A 21 11.860 -4.762 3.186 1.00 1.07 H new ATOM 0 H5'' DT A 21 12.935 -6.038 3.722 1.00 1.07 H new ATOM 0 H4' DT A 21 10.806 -6.890 3.826 1.00 0.94 H new ATOM 0 H3' DT A 21 12.310 -8.023 1.450 1.00 1.03 H new ATOM 0 H2' DT A 21 10.346 -9.264 0.798 1.00 1.00 H new ATOM 0 H2'' DT A 21 9.625 -9.134 2.390 1.00 1.00 H new ATOM 0 HO3' DT A 21 12.266 -9.827 2.803 1.00 1.21 H new ATOM 0 H1' DT A 21 8.427 -7.421 1.450 1.00 0.92 H new ATOM 0 H3 DT A 21 7.674 -5.838 -2.640 1.00 1.50 H new ATOM 0 H71 DT A 21 12.910 -6.997 -2.401 1.00 1.82 H new ATOM 0 H72 DT A 21 12.053 -8.125 -3.480 1.00 1.82 H new ATOM 0 H73 DT A 21 12.103 -6.388 -3.866 1.00 1.82 H new ATOM 0 H6 DT A 21 11.562 -7.596 -0.460 1.00 1.19 H new TER 677 DT A 21