USER MOD reduce.3.24.130724 H: found=0, std=0, add=250, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 250 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 25:sc= 0.00712 USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 15 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 22 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 22 DT O3' : rot 165:sc= 1.5 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 3.547 -4.422 2.095 1.00 0.56 O ATOM 2 C5' DT A 1 4.263 -3.280 1.683 1.00 0.28 C ATOM 3 C4' DT A 1 3.541 -2.002 2.062 1.00 0.20 C ATOM 4 O4' DT A 1 2.216 -1.985 1.490 1.00 0.20 O ATOM 5 C3' DT A 1 3.323 -1.814 3.570 1.00 0.33 C ATOM 6 O3' DT A 1 4.312 -0.917 4.092 1.00 0.21 O ATOM 7 C2' DT A 1 1.901 -1.198 3.706 1.00 0.39 C ATOM 8 C1' DT A 1 1.391 -1.111 2.239 1.00 0.26 C ATOM 9 N1 DT A 1 -0.013 -1.535 2.085 1.00 0.36 N ATOM 10 C2 DT A 1 -0.940 -0.585 1.676 1.00 0.36 C ATOM 11 O2 DT A 1 -0.643 0.573 1.432 1.00 0.33 O ATOM 12 N3 DT A 1 -2.234 -1.047 1.568 1.00 0.49 N ATOM 13 C4 DT A 1 -2.683 -2.335 1.823 1.00 0.62 C ATOM 14 O4 DT A 1 -3.876 -2.602 1.695 1.00 0.76 O ATOM 15 C5 DT A 1 -1.659 -3.280 2.242 1.00 0.63 C ATOM 16 C7 DT A 1 -2.054 -4.692 2.530 1.00 0.83 C ATOM 17 C6 DT A 1 -0.387 -2.845 2.351 1.00 0.51 C ATOM 0 H5' DT A 1 4.407 -3.310 0.603 1.00 0.28 H new ATOM 0 H5'' DT A 1 5.254 -3.287 2.137 1.00 0.28 H new ATOM 0 H4' DT A 1 4.192 -1.212 1.687 1.00 0.20 H new ATOM 0 H3' DT A 1 3.409 -2.750 4.122 1.00 0.33 H new ATOM 0 H2' DT A 1 1.251 -1.823 4.319 1.00 0.39 H new ATOM 0 H2'' DT A 1 1.934 -0.215 4.177 1.00 0.39 H new ATOM 0 HO5' DT A 1 2.595 -4.201 2.172 1.00 0.56 H new ATOM 0 H1' DT A 1 1.436 -0.074 1.905 1.00 0.26 H new ATOM 0 H3 DT A 1 -2.936 -0.370 1.269 1.00 0.49 H new ATOM 0 H71 DT A 1 -1.219 -5.356 2.307 1.00 0.83 H new ATOM 0 H72 DT A 1 -2.323 -4.787 3.582 1.00 0.83 H new ATOM 0 H73 DT A 1 -2.909 -4.964 1.911 1.00 0.83 H new ATOM 0 H6 DT A 1 0.374 -3.547 2.659 1.00 0.51 H new ATOM 31 P DA A 2 5.592 -1.505 4.865 1.00 0.43 P ATOM 32 OP1 DA A 2 5.608 -2.986 4.741 1.00 0.68 O ATOM 33 OP2 DA A 2 5.618 -0.935 6.236 1.00 0.59 O ATOM 34 O5' DA A 2 6.819 -0.908 4.037 1.00 0.29 O ATOM 35 C5' DA A 2 7.032 -1.212 2.656 1.00 0.17 C ATOM 36 C4' DA A 2 6.963 0.067 1.825 1.00 0.91 C ATOM 37 O4' DA A 2 5.611 0.559 1.832 1.00 0.84 O ATOM 38 C3' DA A 2 7.818 1.214 2.348 1.00 0.99 C ATOM 39 O3' DA A 2 9.006 1.343 1.562 1.00 0.21 O ATOM 40 C2' DA A 2 6.954 2.475 2.177 1.00 0.91 C ATOM 41 C1' DA A 2 5.603 1.963 1.676 1.00 0.84 C ATOM 42 N9 DA A 2 4.469 2.506 2.438 1.00 0.00 N ATOM 43 C8 DA A 2 4.058 2.125 3.683 1.00 0.99 C ATOM 44 N7 DA A 2 3.015 2.780 4.130 1.00 0.26 N ATOM 45 C5 DA A 2 2.715 3.663 3.104 1.00 0.52 C ATOM 46 C6 DA A 2 1.707 4.648 2.955 1.00 0.99 C ATOM 47 N6 DA A 2 0.783 4.911 3.882 1.00 0.21 N ATOM 48 N1 DA A 2 1.688 5.362 1.802 1.00 0.26 N ATOM 49 C2 DA A 2 2.620 5.099 0.868 1.00 0.08 C ATOM 50 N3 DA A 2 3.614 4.199 0.890 1.00 0.65 N ATOM 51 C4 DA A 2 3.607 3.506 2.048 1.00 0.38 C ATOM 0 H5' DA A 2 6.280 -1.921 2.311 1.00 0.17 H new ATOM 0 H5'' DA A 2 8.003 -1.689 2.525 1.00 0.17 H new ATOM 0 H4' DA A 2 7.331 -0.217 0.839 1.00 0.91 H new ATOM 0 H3' DA A 2 8.119 1.052 3.383 1.00 0.99 H new ATOM 0 H2' DA A 2 6.848 3.012 3.120 1.00 0.91 H new ATOM 0 H2'' DA A 2 7.403 3.167 1.465 1.00 0.91 H new ATOM 0 H1' DA A 2 5.475 2.277 0.640 1.00 0.84 H new ATOM 0 H8 DA A 2 4.551 1.350 4.251 1.00 0.99 H new ATOM 0 H61 DA A 2 0.083 5.634 3.714 1.00 0.21 H new ATOM 0 H62 DA A 2 0.777 4.389 4.758 1.00 0.21 H new ATOM 0 H2 DA A 2 2.559 5.699 -0.028 1.00 0.08 H new ATOM 63 P DG A 3 10.435 1.561 2.262 1.00 0.39 P ATOM 64 OP1 DG A 3 10.338 1.213 3.703 1.00 0.70 O ATOM 65 OP2 DG A 3 10.936 2.915 1.915 1.00 0.56 O ATOM 66 O5' DG A 3 11.344 0.467 1.531 1.00 0.14 O ATOM 67 C5' DG A 3 11.608 0.517 0.127 1.00 0.93 C ATOM 68 C4' DG A 3 10.815 -0.550 -0.607 1.00 0.75 C ATOM 69 O4' DG A 3 9.395 -0.279 -0.481 1.00 0.66 O ATOM 70 C3' DG A 3 11.083 -0.671 -2.120 1.00 0.65 C ATOM 71 O3' DG A 3 11.360 -2.037 -2.430 1.00 0.68 O ATOM 72 C2' DG A 3 9.776 -0.217 -2.777 1.00 0.56 C ATOM 73 C1' DG A 3 8.744 -0.528 -1.705 1.00 0.54 C ATOM 74 N9 DG A 3 7.503 0.284 -1.747 1.00 0.47 N ATOM 75 C8 DG A 3 7.386 1.661 -1.834 1.00 0.49 C ATOM 76 N7 DG A 3 6.150 2.068 -1.860 1.00 0.45 N ATOM 77 C5 DG A 3 5.398 0.915 -1.777 1.00 0.38 C ATOM 78 C6 DG A 3 3.984 0.748 -1.753 1.00 0.34 C ATOM 79 O6 DG A 3 3.114 1.622 -1.816 1.00 0.39 O ATOM 80 N1 DG A 3 3.621 -0.596 -1.649 1.00 0.32 N ATOM 81 C2 DG A 3 4.514 -1.649 -1.581 1.00 0.35 C ATOM 82 N2 DG A 3 3.992 -2.881 -1.481 1.00 0.39 N ATOM 83 N3 DG A 3 5.841 -1.500 -1.608 1.00 0.39 N ATOM 84 C4 DG A 3 6.212 -0.200 -1.705 1.00 0.40 C ATOM 0 H5' DG A 3 12.673 0.374 -0.053 1.00 0.93 H new ATOM 0 H5'' DG A 3 11.349 1.502 -0.262 1.00 0.93 H new ATOM 0 H4' DG A 3 11.138 -1.478 -0.136 1.00 0.75 H new ATOM 0 H3' DG A 3 11.932 -0.078 -2.462 1.00 0.65 H new ATOM 0 H2' DG A 3 9.795 0.844 -3.027 1.00 0.56 H new ATOM 0 H2'' DG A 3 9.577 -0.759 -3.702 1.00 0.56 H new ATOM 0 H1' DG A 3 8.408 -1.554 -1.855 1.00 0.54 H new ATOM 0 H8 DG A 3 8.234 2.329 -1.876 1.00 0.49 H new ATOM 0 H1 DG A 3 2.626 -0.817 -1.621 1.00 0.32 H new ATOM 0 H21 DG A 3 4.607 -3.693 -1.428 1.00 0.39 H new ATOM 0 H22 DG A 3 2.980 -3.006 -1.458 1.00 0.39 H new ATOM 96 P DG A 4 11.942 -2.446 -3.864 1.00 0.62 P ATOM 97 OP1 DG A 4 13.354 -2.882 -3.705 1.00 0.77 O ATOM 98 OP2 DG A 4 11.662 -1.362 -4.838 1.00 0.68 O ATOM 99 O5' DG A 4 11.046 -3.714 -4.220 1.00 0.74 O ATOM 100 C5' DG A 4 10.542 -4.564 -3.193 1.00 0.66 C ATOM 101 C4' DG A 4 9.396 -5.411 -3.703 1.00 0.58 C ATOM 102 O4' DG A 4 8.150 -4.661 -3.582 1.00 0.60 O ATOM 103 C3' DG A 4 9.494 -5.811 -5.181 1.00 0.53 C ATOM 104 O3' DG A 4 8.997 -7.139 -5.366 1.00 0.59 O ATOM 105 C2' DG A 4 8.609 -4.790 -5.842 1.00 0.44 C ATOM 106 C1' DG A 4 7.490 -4.660 -4.831 1.00 0.49 C ATOM 107 N9 DG A 4 6.709 -3.426 -4.952 1.00 0.43 N ATOM 108 C8 DG A 4 7.208 -2.166 -5.136 1.00 0.42 C ATOM 109 N7 DG A 4 6.283 -1.249 -5.205 1.00 0.41 N ATOM 110 C5 DG A 4 5.097 -1.946 -5.065 1.00 0.40 C ATOM 111 C6 DG A 4 3.753 -1.477 -5.065 1.00 0.39 C ATOM 112 O6 DG A 4 3.355 -0.314 -5.189 1.00 0.42 O ATOM 113 N1 DG A 4 2.837 -2.522 -4.899 1.00 0.41 N ATOM 114 C2 DG A 4 3.185 -3.854 -4.752 1.00 0.46 C ATOM 115 N2 DG A 4 2.173 -4.723 -4.619 1.00 0.51 N ATOM 116 N3 DG A 4 4.441 -4.300 -4.747 1.00 0.47 N ATOM 117 C4 DG A 4 5.341 -3.299 -4.908 1.00 0.42 C ATOM 0 H5' DG A 4 10.206 -3.961 -2.349 1.00 0.66 H new ATOM 0 H5'' DG A 4 11.340 -5.209 -2.826 1.00 0.66 H new ATOM 0 H4' DG A 4 9.433 -6.317 -3.098 1.00 0.58 H new ATOM 0 H3' DG A 4 10.508 -5.822 -5.581 1.00 0.53 H new ATOM 0 H2' DG A 4 9.126 -3.844 -6.006 1.00 0.44 H new ATOM 0 H2'' DG A 4 8.247 -5.128 -6.813 1.00 0.44 H new ATOM 0 H1' DG A 4 6.771 -5.467 -4.974 1.00 0.49 H new ATOM 0 H8 DG A 4 8.263 -1.952 -5.216 1.00 0.42 H new ATOM 0 H1 DG A 4 1.845 -2.286 -4.885 1.00 0.41 H new ATOM 0 H21 DG A 4 2.367 -5.718 -4.507 1.00 0.51 H new ATOM 0 H22 DG A 4 1.209 -4.389 -4.630 1.00 0.51 H new ATOM 129 P DG A 5 9.037 -7.819 -6.817 1.00 0.57 P ATOM 130 OP1 DG A 5 9.564 -9.203 -6.685 1.00 0.68 O ATOM 131 OP2 DG A 5 9.730 -6.910 -7.764 1.00 0.56 O ATOM 132 O5' DG A 5 7.489 -7.888 -7.192 1.00 0.58 O ATOM 133 C5' DG A 5 6.561 -8.542 -6.333 1.00 0.57 C ATOM 134 C4' DG A 5 5.257 -8.855 -7.053 1.00 0.57 C ATOM 135 O4' DG A 5 4.377 -7.696 -7.022 1.00 0.52 O ATOM 136 C3' DG A 5 5.385 -9.221 -8.500 1.00 0.62 C ATOM 137 O3' DG A 5 4.312 -10.080 -8.908 1.00 0.71 O ATOM 138 C2' DG A 5 5.279 -7.877 -9.177 1.00 0.58 C ATOM 139 C1' DG A 5 4.151 -7.242 -8.349 1.00 0.51 C ATOM 140 N9 DG A 5 4.088 -5.761 -8.335 1.00 0.45 N ATOM 141 C8 DG A 5 5.123 -4.843 -8.261 1.00 0.44 C ATOM 142 N7 DG A 5 4.705 -3.603 -8.260 1.00 0.41 N ATOM 143 C5 DG A 5 3.327 -3.701 -8.335 1.00 0.40 C ATOM 144 C6 DG A 5 2.330 -2.680 -8.367 1.00 0.41 C ATOM 145 O6 DG A 5 2.495 -1.456 -8.338 1.00 0.42 O ATOM 146 N1 DG A 5 1.039 -3.216 -8.443 1.00 0.43 N ATOM 147 C2 DG A 5 0.755 -4.571 -8.486 1.00 0.45 C ATOM 148 N2 DG A 5 -0.534 -4.921 -8.560 1.00 0.49 N ATOM 149 N3 DG A 5 1.680 -5.523 -8.460 1.00 0.45 N ATOM 150 C4 DG A 5 2.934 -5.024 -8.383 1.00 0.42 C ATOM 0 H5' DG A 5 6.357 -7.911 -5.468 1.00 0.57 H new ATOM 0 H5'' DG A 5 7.001 -9.466 -5.957 1.00 0.57 H new ATOM 0 H4' DG A 5 4.871 -9.720 -6.514 1.00 0.57 H new ATOM 0 H3' DG A 5 6.300 -9.764 -8.736 1.00 0.62 H new ATOM 0 H2' DG A 5 6.207 -7.308 -9.120 1.00 0.58 H new ATOM 0 H2'' DG A 5 5.022 -7.963 -10.233 1.00 0.58 H new ATOM 0 H1' DG A 5 3.204 -7.538 -8.800 1.00 0.51 H new ATOM 0 H8 DG A 5 6.165 -5.122 -8.210 1.00 0.44 H new ATOM 0 H1 DG A 5 0.254 -2.565 -8.468 1.00 0.43 H new ATOM 0 H21 DG A 5 -0.794 -5.907 -8.594 1.00 0.49 H new ATOM 0 H22 DG A 5 -1.257 -4.202 -8.582 1.00 0.49 H new ATOM 162 P DT A 6 4.367 -11.646 -8.562 1.00 0.82 P ATOM 163 OP1 DT A 6 5.761 -12.019 -8.211 1.00 0.08 O ATOM 164 OP2 DT A 6 3.714 -12.399 -9.664 1.00 0.97 O ATOM 165 O5' DT A 6 3.459 -11.740 -7.250 1.00 0.87 O ATOM 166 C5' DT A 6 2.208 -12.422 -7.249 1.00 0.75 C ATOM 167 C4' DT A 6 1.265 -11.812 -6.235 1.00 0.77 C ATOM 168 O4' DT A 6 -0.055 -12.422 -6.386 1.00 0.84 O ATOM 169 C3' DT A 6 1.656 -12.038 -4.769 1.00 0.92 C ATOM 170 O3' DT A 6 1.163 -10.963 -3.953 1.00 0.25 O ATOM 171 C2' DT A 6 0.885 -13.337 -4.462 1.00 0.04 C ATOM 172 C1' DT A 6 -0.438 -13.034 -5.166 1.00 0.03 C ATOM 173 N1 DT A 6 -1.297 -14.208 -5.447 1.00 0.20 N ATOM 174 C2 DT A 6 -2.531 -14.272 -4.813 1.00 0.59 C ATOM 175 O2 DT A 6 -2.927 -13.412 -4.042 1.00 0.85 O ATOM 176 N3 DT A 6 -3.285 -15.388 -5.116 1.00 0.80 N ATOM 177 C4 DT A 6 -2.935 -16.424 -5.969 1.00 0.76 C ATOM 178 O4 DT A 6 -3.714 -17.359 -6.145 1.00 0.07 O ATOM 179 C5 DT A 6 -1.626 -16.294 -6.598 1.00 0.52 C ATOM 180 C7 DT A 6 -1.149 -17.363 -7.531 1.00 0.81 C ATOM 181 C6 DT A 6 -0.883 -15.210 -6.314 1.00 0.22 C ATOM 0 H5' DT A 6 2.363 -13.476 -7.020 1.00 0.75 H new ATOM 0 H5'' DT A 6 1.762 -12.374 -8.242 1.00 0.75 H new ATOM 0 H4' DT A 6 1.292 -10.741 -6.437 1.00 0.77 H new ATOM 0 H3' DT A 6 2.729 -12.090 -4.585 1.00 0.92 H new ATOM 0 H2' DT A 6 1.379 -14.220 -4.866 1.00 0.04 H new ATOM 0 H2'' DT A 6 0.759 -13.504 -3.392 1.00 0.04 H new ATOM 0 H1' DT A 6 -1.053 -12.415 -4.513 1.00 0.03 H new ATOM 0 H3 DT A 6 -4.197 -15.458 -4.664 1.00 0.80 H new ATOM 0 H71 DT A 6 -0.490 -16.924 -8.281 1.00 0.81 H new ATOM 0 H72 DT A 6 -0.604 -18.121 -6.968 1.00 0.81 H new ATOM 0 H73 DT A 6 -2.005 -17.823 -8.025 1.00 0.81 H new ATOM 0 H6 DT A 6 0.085 -15.114 -6.784 1.00 0.22 H new ATOM 194 P DG A 7 2.099 -10.354 -2.800 1.00 0.49 P ATOM 195 OP1 DG A 7 3.123 -9.473 -3.418 1.00 0.22 O ATOM 196 OP2 DG A 7 2.581 -11.470 -1.946 1.00 0.89 O ATOM 197 O5' DG A 7 1.083 -9.454 -1.958 1.00 0.05 O ATOM 198 C5' DG A 7 0.570 -9.886 -0.700 1.00 0.84 C ATOM 199 C4' DG A 7 -0.683 -9.114 -0.321 1.00 0.60 C ATOM 200 O4' DG A 7 -0.344 -7.732 0.005 1.00 0.47 O ATOM 201 C3' DG A 7 -1.744 -9.021 -1.414 1.00 0.69 C ATOM 202 O3' DG A 7 -3.056 -9.115 -0.850 1.00 0.74 O ATOM 203 C2' DG A 7 -1.510 -7.657 -1.998 1.00 0.62 C ATOM 204 C1' DG A 7 -1.158 -6.857 -0.762 1.00 0.48 C ATOM 205 N9 DG A 7 -0.415 -5.594 -0.992 1.00 0.40 N ATOM 206 C8 DG A 7 0.952 -5.430 -1.076 1.00 0.38 C ATOM 207 N7 DG A 7 1.315 -4.190 -1.256 1.00 0.36 N ATOM 208 C5 DG A 7 0.127 -3.483 -1.299 1.00 0.34 C ATOM 209 C6 DG A 7 -0.098 -2.087 -1.472 1.00 0.34 C ATOM 210 O6 DG A 7 0.743 -1.197 -1.615 1.00 0.37 O ATOM 211 N1 DG A 7 -1.457 -1.770 -1.457 1.00 0.35 N ATOM 212 C2 DG A 7 -2.477 -2.685 -1.296 1.00 0.40 C ATOM 213 N2 DG A 7 -3.726 -2.181 -1.299 1.00 0.45 N ATOM 214 N3 DG A 7 -2.281 -4.000 -1.134 1.00 0.43 N ATOM 215 C4 DG A 7 -0.959 -4.329 -1.144 1.00 0.38 C ATOM 0 H5' DG A 7 1.329 -9.752 0.070 1.00 0.84 H new ATOM 0 H5'' DG A 7 0.344 -10.952 -0.743 1.00 0.84 H new ATOM 0 H4' DG A 7 -1.091 -9.678 0.517 1.00 0.60 H new ATOM 0 H3' DG A 7 -1.677 -9.820 -2.152 1.00 0.69 H new ATOM 0 H2' DG A 7 -0.703 -7.657 -2.730 1.00 0.62 H new ATOM 0 H2'' DG A 7 -2.396 -7.268 -2.500 1.00 0.62 H new ATOM 0 H1' DG A 7 -2.084 -6.534 -0.287 1.00 0.48 H new ATOM 0 H8 DG A 7 1.653 -6.248 -1.000 1.00 0.38 H new ATOM 0 H1 DG A 7 -1.715 -0.790 -1.574 1.00 0.35 H new ATOM 0 H21 DG A 7 -4.527 -2.802 -1.185 1.00 0.45 H new ATOM 0 H22 DG A 7 -3.871 -1.178 -1.416 1.00 0.45 H new ATOM 227 P DG A 8 -4.288 -9.541 -1.784 1.00 0.03 P ATOM 228 OP1 DG A 8 -5.505 -9.677 -0.942 1.00 0.32 O ATOM 229 OP2 DG A 8 -3.885 -10.712 -2.603 1.00 0.36 O ATOM 230 O5' DG A 8 -4.454 -8.273 -2.737 1.00 0.81 O ATOM 231 C5' DG A 8 -5.540 -7.365 -2.583 1.00 0.71 C ATOM 232 C4' DG A 8 -5.544 -6.329 -3.690 1.00 0.55 C ATOM 233 O4' DG A 8 -4.420 -5.448 -3.552 1.00 0.50 O ATOM 234 C3' DG A 8 -5.433 -6.879 -5.117 1.00 0.49 C ATOM 235 O3' DG A 8 -6.704 -6.769 -5.766 1.00 0.59 O ATOM 236 C2' DG A 8 -4.389 -5.975 -5.794 1.00 0.50 C ATOM 237 C1' DG A 8 -4.224 -4.844 -4.796 1.00 0.47 C ATOM 238 N9 DG A 8 -2.917 -4.157 -4.791 1.00 0.42 N ATOM 239 C8 DG A 8 -1.662 -4.714 -4.661 1.00 0.42 C ATOM 240 N7 DG A 8 -0.703 -3.830 -4.674 1.00 0.41 N ATOM 241 C5 DG A 8 -1.353 -2.617 -4.824 1.00 0.40 C ATOM 242 C6 DG A 8 -0.827 -1.294 -4.903 1.00 0.42 C ATOM 243 O6 DG A 8 0.355 -0.939 -4.856 1.00 0.44 O ATOM 244 N1 DG A 8 -1.839 -0.340 -5.056 1.00 0.43 N ATOM 245 C2 DG A 8 -3.188 -0.634 -5.128 1.00 0.44 C ATOM 246 N2 DG A 8 -4.032 0.397 -5.279 1.00 0.47 N ATOM 247 N3 DG A 8 -3.685 -1.867 -5.054 1.00 0.43 N ATOM 248 C4 DG A 8 -2.719 -2.803 -4.902 1.00 0.41 C ATOM 0 H5' DG A 8 -5.469 -6.868 -1.615 1.00 0.71 H new ATOM 0 H5'' DG A 8 -6.482 -7.914 -2.591 1.00 0.71 H new ATOM 0 H4' DG A 8 -6.514 -5.846 -3.572 1.00 0.55 H new ATOM 0 H3' DG A 8 -5.144 -7.929 -5.155 1.00 0.49 H new ATOM 0 H2' DG A 8 -3.450 -6.501 -5.967 1.00 0.50 H new ATOM 0 H2'' DG A 8 -4.735 -5.613 -6.762 1.00 0.50 H new ATOM 0 H1' DG A 8 -4.929 -4.055 -5.058 1.00 0.47 H new ATOM 0 H8 DG A 8 -1.491 -5.775 -4.559 1.00 0.42 H new ATOM 0 H1 DG A 8 -1.562 0.640 -5.119 1.00 0.43 H new ATOM 0 H21 DG A 8 -5.036 0.230 -5.337 1.00 0.47 H new ATOM 0 H22 DG A 8 -3.669 1.349 -5.336 1.00 0.47 H new ATOM 260 P DG A 9 -6.950 -7.465 -7.189 1.00 0.61 P ATOM 261 OP1 DG A 9 -8.144 -8.343 -7.095 1.00 0.82 O ATOM 262 OP2 DG A 9 -5.682 -8.077 -7.660 1.00 0.81 O ATOM 263 O5' DG A 9 -7.302 -6.212 -8.111 1.00 0.65 O ATOM 264 C5' DG A 9 -8.352 -5.319 -7.751 1.00 0.60 C ATOM 265 C4' DG A 9 -8.247 -4.010 -8.502 1.00 0.54 C ATOM 266 O4' DG A 9 -7.011 -3.341 -8.143 1.00 0.53 O ATOM 267 C3' DG A 9 -8.230 -4.134 -10.036 1.00 0.51 C ATOM 268 O3' DG A 9 -9.199 -3.247 -10.603 1.00 0.61 O ATOM 269 C2' DG A 9 -6.814 -3.713 -10.430 1.00 0.55 C ATOM 270 C1' DG A 9 -6.436 -2.773 -9.298 1.00 0.52 C ATOM 271 N9 DG A 9 -4.991 -2.600 -9.061 1.00 0.48 N ATOM 272 C8 DG A 9 -4.051 -3.587 -8.856 1.00 0.47 C ATOM 273 N7 DG A 9 -2.850 -3.117 -8.672 1.00 0.47 N ATOM 274 C5 DG A 9 -2.992 -1.747 -8.758 1.00 0.45 C ATOM 275 C6 DG A 9 -2.015 -0.718 -8.639 1.00 0.45 C ATOM 276 O6 DG A 9 -0.802 -0.843 -8.438 1.00 0.46 O ATOM 277 N1 DG A 9 -2.581 0.553 -8.790 1.00 0.45 N ATOM 278 C2 DG A 9 -3.922 0.794 -9.025 1.00 0.47 C ATOM 279 N2 DG A 9 -4.293 2.078 -9.136 1.00 0.48 N ATOM 280 N3 DG A 9 -4.838 -0.163 -9.142 1.00 0.49 N ATOM 281 C4 DG A 9 -4.309 -1.405 -8.998 1.00 0.47 C ATOM 0 H5' DG A 9 -8.317 -5.128 -6.678 1.00 0.60 H new ATOM 0 H5'' DG A 9 -9.315 -5.784 -7.961 1.00 0.60 H new ATOM 0 H4' DG A 9 -9.145 -3.462 -8.216 1.00 0.54 H new ATOM 0 H3' DG A 9 -8.474 -5.136 -10.388 1.00 0.51 H new ATOM 0 H2' DG A 9 -6.138 -4.566 -10.495 1.00 0.55 H new ATOM 0 H2'' DG A 9 -6.792 -3.214 -11.399 1.00 0.55 H new ATOM 0 H1' DG A 9 -6.792 -1.776 -9.557 1.00 0.52 H new ATOM 0 H8 DG A 9 -4.286 -4.641 -8.849 1.00 0.47 H new ATOM 0 H1 DG A 9 -1.960 1.359 -8.722 1.00 0.45 H new ATOM 0 H21 DG A 9 -5.270 2.313 -9.310 1.00 0.48 H new ATOM 0 H22 DG A 9 -3.598 2.819 -9.047 1.00 0.48 H new ATOM 293 P DT A 10 -10.647 -3.807 -11.008 1.00 0.74 P ATOM 294 OP1 DT A 10 -10.478 -5.049 -11.809 1.00 0.82 O ATOM 295 OP2 DT A 10 -11.425 -2.698 -11.619 1.00 0.22 O ATOM 296 O5' DT A 10 -11.297 -4.183 -9.596 1.00 0.02 O ATOM 297 C5' DT A 10 -12.506 -4.938 -9.514 1.00 0.72 C ATOM 298 C4' DT A 10 -13.072 -4.913 -8.109 1.00 0.76 C ATOM 299 O4' DT A 10 -14.483 -5.237 -8.165 1.00 0.65 O ATOM 300 C3' DT A 10 -12.476 -5.942 -7.148 1.00 0.63 C ATOM 301 O3' DT A 10 -12.635 -5.499 -5.796 1.00 0.39 O ATOM 302 C2' DT A 10 -13.334 -7.167 -7.420 1.00 0.32 C ATOM 303 C1' DT A 10 -14.712 -6.551 -7.657 1.00 0.74 C ATOM 304 N1 DT A 10 -15.559 -7.278 -8.620 1.00 3.67 N ATOM 305 C2 DT A 10 -16.827 -7.669 -8.212 1.00 4.25 C ATOM 306 O2 DT A 10 -17.265 -7.438 -7.095 1.00 4.15 O ATOM 307 N3 DT A 10 -17.564 -8.341 -9.167 1.00 5.15 N ATOM 308 C4 DT A 10 -17.162 -8.651 -10.460 1.00 5.63 C ATOM 309 O4 DT A 10 -17.924 -9.256 -11.212 1.00 6.53 O ATOM 310 C5 DT A 10 -15.821 -8.210 -10.815 1.00 5.12 C ATOM 311 C7 DT A 10 -15.295 -8.503 -12.180 1.00 5.84 C ATOM 312 C6 DT A 10 -15.093 -7.555 -9.897 1.00 4.13 C ATOM 0 H5' DT A 10 -12.316 -5.968 -9.814 1.00 0.72 H new ATOM 0 H5'' DT A 10 -13.239 -4.533 -10.212 1.00 0.72 H new ATOM 0 H4' DT A 10 -12.842 -3.914 -7.740 1.00 0.76 H new ATOM 0 H3' DT A 10 -11.409 -6.119 -7.285 1.00 0.63 H new ATOM 0 H2' DT A 10 -12.983 -7.725 -8.288 1.00 0.32 H new ATOM 0 H2'' DT A 10 -13.336 -7.858 -6.577 1.00 0.32 H new ATOM 0 H1' DT A 10 -15.252 -6.578 -6.711 1.00 0.74 H new ATOM 0 H3 DT A 10 -18.500 -8.641 -8.895 1.00 5.15 H new ATOM 0 H71 DT A 10 -14.594 -7.722 -12.475 1.00 5.84 H new ATOM 0 H72 DT A 10 -14.784 -9.466 -12.174 1.00 5.84 H new ATOM 0 H73 DT A 10 -16.122 -8.536 -12.889 1.00 5.84 H new ATOM 0 H6 DT A 10 -14.099 -7.229 -10.165 1.00 4.13 H new ATOM 325 P DT A 11 -11.851 -6.244 -4.611 1.00 0.39 P ATOM 326 OP1 DT A 11 -10.980 -7.299 -5.189 1.00 0.89 O ATOM 327 OP2 DT A 11 -12.831 -6.654 -3.576 1.00 0.82 O ATOM 328 O5' DT A 11 -10.927 -5.086 -4.022 1.00 0.99 O ATOM 329 C5' DT A 11 -11.224 -3.709 -4.233 1.00 0.76 C ATOM 330 C4' DT A 11 -10.000 -2.872 -4.014 1.00 0.66 C ATOM 331 O4' DT A 11 -9.411 -2.555 -5.293 1.00 0.57 O ATOM 332 C3' DT A 11 -10.244 -1.530 -3.310 1.00 0.60 C ATOM 333 O3' DT A 11 -9.347 -1.398 -2.200 1.00 0.70 O ATOM 334 C2' DT A 11 -9.924 -0.483 -4.374 1.00 0.51 C ATOM 335 C1' DT A 11 -8.958 -1.225 -5.272 1.00 0.50 C ATOM 336 N1 DT A 11 -8.884 -0.714 -6.645 1.00 0.43 N ATOM 337 C2 DT A 11 -7.650 -0.310 -7.117 1.00 0.49 C ATOM 338 O2 DT A 11 -6.638 -0.339 -6.439 1.00 0.57 O ATOM 339 N3 DT A 11 -7.652 0.149 -8.416 1.00 0.51 N ATOM 340 C4 DT A 11 -8.748 0.252 -9.262 1.00 0.48 C ATOM 341 O4 DT A 11 -8.604 0.685 -10.401 1.00 0.57 O ATOM 342 C5 DT A 11 -10.010 -0.187 -8.685 1.00 0.41 C ATOM 343 C7 DT A 11 -11.258 -0.116 -9.490 1.00 0.45 C ATOM 344 C6 DT A 11 -10.018 -0.644 -7.433 1.00 0.39 C ATOM 0 H5' DT A 11 -12.015 -3.393 -3.553 1.00 0.76 H new ATOM 0 H5'' DT A 11 -11.597 -3.562 -5.247 1.00 0.76 H new ATOM 0 H4' DT A 11 -9.361 -3.475 -3.368 1.00 0.66 H new ATOM 0 H3' DT A 11 -11.258 -1.432 -2.922 1.00 0.60 H new ATOM 0 H2' DT A 11 -10.816 -0.163 -4.912 1.00 0.51 H new ATOM 0 H2'' DT A 11 -9.474 0.411 -3.943 1.00 0.51 H new ATOM 0 H1' DT A 11 -7.950 -1.106 -4.876 1.00 0.50 H new ATOM 0 H3 DT A 11 -6.753 0.444 -8.797 1.00 0.51 H new ATOM 0 H71 DT A 11 -11.938 -0.908 -9.177 1.00 0.45 H new ATOM 0 H72 DT A 11 -11.735 0.852 -9.338 1.00 0.45 H new ATOM 0 H73 DT A 11 -11.017 -0.240 -10.546 1.00 0.45 H new ATOM 0 H6 DT A 11 -10.956 -0.976 -7.013 1.00 0.39 H new ATOM 357 P DG A 12 -9.773 -0.540 -0.914 1.00 0.73 P ATOM 358 OP1 DG A 12 -8.906 -0.924 0.231 1.00 0.84 O ATOM 359 OP2 DG A 12 -11.241 -0.651 -0.725 1.00 0.86 O ATOM 360 O5' DG A 12 -9.414 0.957 -1.343 1.00 0.70 O ATOM 361 C5' DG A 12 -9.744 2.050 -0.491 1.00 0.76 C ATOM 362 C4' DG A 12 -9.028 3.323 -0.902 1.00 0.72 C ATOM 363 O4' DG A 12 -7.630 3.227 -0.540 1.00 0.67 O ATOM 364 C3' DG A 12 -9.071 3.662 -2.378 1.00 0.70 C ATOM 365 O3' DG A 12 -9.318 5.056 -2.571 1.00 0.78 O ATOM 366 C2' DG A 12 -7.710 3.265 -2.890 1.00 0.59 C ATOM 367 C1' DG A 12 -6.820 3.496 -1.666 1.00 0.58 C ATOM 368 N9 DG A 12 -5.630 2.634 -1.600 1.00 0.52 N ATOM 369 C8 DG A 12 -5.579 1.272 -1.384 1.00 0.50 C ATOM 370 N7 DG A 12 -4.356 0.795 -1.393 1.00 0.47 N ATOM 371 C5 DG A 12 -3.560 1.914 -1.625 1.00 0.45 C ATOM 372 C6 DG A 12 -2.141 2.042 -1.738 1.00 0.44 C ATOM 373 O6 DG A 12 -1.289 1.154 -1.663 1.00 0.44 O ATOM 374 N1 DG A 12 -1.752 3.370 -1.968 1.00 0.45 N ATOM 375 C2 DG A 12 -2.626 4.438 -2.076 1.00 0.50 C ATOM 376 N2 DG A 12 -2.098 5.657 -2.276 1.00 0.54 N ATOM 377 N3 DG A 12 -3.944 4.323 -1.977 1.00 0.53 N ATOM 378 C4 DG A 12 -4.339 3.049 -1.752 1.00 0.49 C ATOM 0 H5' DG A 12 -9.481 1.801 0.537 1.00 0.76 H new ATOM 0 H5'' DG A 12 -10.821 2.216 -0.513 1.00 0.76 H new ATOM 0 H4' DG A 12 -9.567 4.112 -0.377 1.00 0.72 H new ATOM 0 H3' DG A 12 -9.873 3.146 -2.906 1.00 0.70 H new ATOM 0 H2' DG A 12 -7.687 2.226 -3.219 1.00 0.59 H new ATOM 0 H2'' DG A 12 -7.401 3.875 -3.738 1.00 0.59 H new ATOM 0 H1' DG A 12 -6.440 4.516 -1.713 1.00 0.58 H new ATOM 0 H8 DG A 12 -6.455 0.661 -1.224 1.00 0.50 H new ATOM 0 H1 DG A 12 -0.755 3.562 -2.062 1.00 0.45 H new ATOM 0 H21 DG A 12 -2.709 6.470 -2.361 1.00 0.54 H new ATOM 0 H22 DG A 12 -1.086 5.770 -2.343 1.00 0.54 H new ATOM 390 P DG A 13 -9.898 5.569 -3.976 1.00 0.80 P ATOM 391 OP1 DG A 13 -10.914 6.623 -3.724 1.00 0.01 O ATOM 392 OP2 DG A 13 -10.312 4.396 -4.789 1.00 0.86 O ATOM 393 O5' DG A 13 -8.616 6.234 -4.645 1.00 0.66 O ATOM 394 C5' DG A 13 -8.004 7.383 -4.074 1.00 0.68 C ATOM 395 C4' DG A 13 -6.775 7.780 -4.858 1.00 0.60 C ATOM 396 O4' DG A 13 -5.677 6.924 -4.492 1.00 0.54 O ATOM 397 C3' DG A 13 -6.912 7.649 -6.385 1.00 0.57 C ATOM 398 O3' DG A 13 -6.884 8.944 -6.990 1.00 0.64 O ATOM 399 C2' DG A 13 -5.699 6.818 -6.820 1.00 0.52 C ATOM 400 C1' DG A 13 -4.803 6.814 -5.588 1.00 0.51 C ATOM 401 N9 DG A 13 -4.052 5.570 -5.458 1.00 0.46 N ATOM 402 C8 DG A 13 -4.586 4.318 -5.319 1.00 0.45 C ATOM 403 N7 DG A 13 -3.681 3.378 -5.249 1.00 0.42 N ATOM 404 C5 DG A 13 -2.474 4.056 -5.348 1.00 0.42 C ATOM 405 C6 DG A 13 -1.136 3.564 -5.337 1.00 0.41 C ATOM 406 O6 DG A 13 -0.760 2.395 -5.232 1.00 0.42 O ATOM 407 N1 DG A 13 -0.200 4.596 -5.465 1.00 0.42 N ATOM 408 C2 DG A 13 -0.522 5.936 -5.587 1.00 0.43 C ATOM 409 N2 DG A 13 0.501 6.794 -5.700 1.00 0.46 N ATOM 410 N3 DG A 13 -1.770 6.404 -5.598 1.00 0.45 N ATOM 411 C4 DG A 13 -2.688 5.416 -5.476 1.00 0.44 C ATOM 0 H5' DG A 13 -7.731 7.179 -3.039 1.00 0.68 H new ATOM 0 H5'' DG A 13 -8.714 8.210 -4.059 1.00 0.68 H new ATOM 0 H4' DG A 13 -6.619 8.831 -4.614 1.00 0.60 H new ATOM 0 H3' DG A 13 -7.850 7.181 -6.683 1.00 0.57 H new ATOM 0 H2' DG A 13 -5.989 5.807 -7.108 1.00 0.52 H new ATOM 0 H2'' DG A 13 -5.196 7.262 -7.679 1.00 0.52 H new ATOM 0 H1' DG A 13 -4.075 7.623 -5.651 1.00 0.51 H new ATOM 0 H8 DG A 13 -5.648 4.126 -5.272 1.00 0.45 H new ATOM 0 H1 DG A 13 0.788 4.343 -5.469 1.00 0.42 H new ATOM 0 H21 DG A 13 0.320 7.794 -5.793 1.00 0.46 H new ATOM 0 H22 DG A 13 1.460 6.447 -5.693 1.00 0.46 H new ATOM 423 P DG A 14 -7.037 9.082 -8.582 1.00 0.68 P ATOM 424 OP1 DG A 14 -7.738 10.355 -8.890 1.00 0.87 O ATOM 425 OP2 DG A 14 -7.620 7.829 -9.123 1.00 0.72 O ATOM 426 O5' DG A 14 -5.518 9.200 -9.050 1.00 0.57 O ATOM 427 C5' DG A 14 -4.682 10.225 -8.524 1.00 0.66 C ATOM 428 C4' DG A 14 -3.213 9.908 -8.682 1.00 0.53 C ATOM 429 O4' DG A 14 -2.934 8.527 -8.329 1.00 0.44 O ATOM 430 C3' DG A 14 -2.660 10.088 -10.113 1.00 0.63 C ATOM 431 O3' DG A 14 -1.486 10.920 -10.072 1.00 0.77 O ATOM 432 C2' DG A 14 -2.253 8.641 -10.515 1.00 0.55 C ATOM 433 C1' DG A 14 -1.906 8.070 -9.167 1.00 0.41 C ATOM 434 N9 DG A 14 -1.830 6.606 -9.079 1.00 0.36 N ATOM 435 C8 DG A 14 -2.870 5.709 -9.053 1.00 0.38 C ATOM 436 N7 DG A 14 -2.472 4.467 -8.953 1.00 0.39 N ATOM 437 C5 DG A 14 -1.087 4.549 -8.915 1.00 0.36 C ATOM 438 C6 DG A 14 -0.099 3.521 -8.810 1.00 0.36 C ATOM 439 O6 DG A 14 -0.274 2.306 -8.732 1.00 0.42 O ATOM 440 N1 DG A 14 1.199 4.043 -8.802 1.00 0.34 N ATOM 441 C2 DG A 14 1.504 5.389 -8.888 1.00 0.34 C ATOM 442 N2 DG A 14 2.805 5.721 -8.863 1.00 0.37 N ATOM 443 N3 DG A 14 0.589 6.352 -8.988 1.00 0.35 N ATOM 444 C4 DG A 14 -0.677 5.864 -8.995 1.00 0.34 C ATOM 0 H5' DG A 14 -4.908 10.368 -7.467 1.00 0.66 H new ATOM 0 H5'' DG A 14 -4.904 11.166 -9.028 1.00 0.66 H new ATOM 0 H4' DG A 14 -2.729 10.624 -8.018 1.00 0.53 H new ATOM 0 H3' DG A 14 -3.369 10.550 -10.800 1.00 0.63 H new ATOM 0 H2' DG A 14 -3.067 8.100 -10.997 1.00 0.55 H new ATOM 0 H2'' DG A 14 -1.408 8.624 -11.203 1.00 0.55 H new ATOM 0 H1' DG A 14 -0.899 8.392 -8.903 1.00 0.41 H new ATOM 0 H8 DG A 14 -3.909 5.999 -9.109 1.00 0.38 H new ATOM 0 H1 DG A 14 1.975 3.385 -8.728 1.00 0.34 H new ATOM 0 H21 DG A 14 3.083 6.701 -8.924 1.00 0.37 H new ATOM 0 H22 DG A 14 3.516 4.993 -8.783 1.00 0.37 H new ATOM 456 P DT A 15 -1.558 12.467 -10.502 1.00 0.94 P ATOM 457 OP1 DT A 15 -2.968 12.833 -10.785 1.00 0.09 O ATOM 458 OP2 DT A 15 -0.559 12.708 -11.574 1.00 0.08 O ATOM 459 O5' DT A 15 -1.083 13.224 -9.175 1.00 0.27 O ATOM 460 C5' DT A 15 -1.723 12.977 -7.929 1.00 0.42 C ATOM 461 C4' DT A 15 -1.191 13.865 -6.829 1.00 0.10 C ATOM 462 O4' DT A 15 -1.568 15.231 -7.100 1.00 0.13 O ATOM 463 C3' DT A 15 -1.754 13.524 -5.442 1.00 0.14 C ATOM 464 O3' DT A 15 -0.691 13.194 -4.543 1.00 0.27 O ATOM 465 C2' DT A 15 -2.483 14.785 -4.969 1.00 0.00 C ATOM 466 C1' DT A 15 -2.026 15.870 -5.921 1.00 0.97 C ATOM 467 N1 DT A 15 -3.088 16.825 -6.291 1.00 0.30 N ATOM 468 C2 DT A 15 -3.098 18.071 -5.678 1.00 0.55 C ATOM 469 O2 DT A 15 -2.267 18.415 -4.852 1.00 0.60 O ATOM 470 N3 DT A 15 -4.128 18.903 -6.073 1.00 0.00 N ATOM 471 C4 DT A 15 -5.123 18.615 -6.999 1.00 0.28 C ATOM 472 O4 DT A 15 -5.981 19.457 -7.254 1.00 0.76 O ATOM 473 C5 DT A 15 -5.047 17.290 -7.601 1.00 0.15 C ATOM 474 C7 DT A 15 -6.074 16.887 -8.612 1.00 0.69 C ATOM 475 C6 DT A 15 -4.051 16.469 -7.225 1.00 0.68 C ATOM 0 H5' DT A 15 -1.582 11.933 -7.651 1.00 0.42 H new ATOM 0 H5'' DT A 15 -2.796 13.137 -8.036 1.00 0.42 H new ATOM 0 H4' DT A 15 -0.112 13.714 -6.815 1.00 0.10 H new ATOM 0 H3' DT A 15 -2.423 12.664 -5.478 1.00 0.14 H new ATOM 0 H2' DT A 15 -3.565 14.655 -5.006 1.00 0.00 H new ATOM 0 H2'' DT A 15 -2.226 15.028 -3.938 1.00 0.00 H new ATOM 0 H1' DT A 15 -1.251 16.447 -5.417 1.00 0.97 H new ATOM 0 H3 DT A 15 -4.161 19.826 -5.639 1.00 0.00 H new ATOM 0 H71 DT A 15 -5.633 16.184 -9.318 1.00 0.69 H new ATOM 0 H72 DT A 15 -6.916 16.414 -8.107 1.00 0.69 H new ATOM 0 H73 DT A 15 -6.422 17.770 -9.149 1.00 0.69 H new ATOM 0 H6 DT A 15 -3.998 15.487 -7.671 1.00 0.68 H new ATOM 488 P DG A 16 -1.025 12.375 -3.205 1.00 0.80 P ATOM 489 OP1 DG A 16 -1.945 11.257 -3.538 1.00 0.10 O ATOM 490 OP2 DG A 16 -1.457 13.332 -2.156 1.00 0.67 O ATOM 491 O5' DG A 16 0.393 11.773 -2.805 1.00 0.49 O ATOM 492 C5' DG A 16 1.285 12.487 -1.958 1.00 0.10 C ATOM 493 C4' DG A 16 2.670 11.884 -1.999 1.00 0.87 C ATOM 494 O4' DG A 16 2.606 10.514 -1.518 1.00 0.72 O ATOM 495 C3' DG A 16 3.299 11.806 -3.397 1.00 0.72 C ATOM 496 O3' DG A 16 4.717 11.991 -3.313 1.00 0.76 O ATOM 497 C2' DG A 16 2.975 10.375 -3.824 1.00 0.69 C ATOM 498 C1' DG A 16 3.096 9.627 -2.508 1.00 0.66 C ATOM 499 N9 DG A 16 2.319 8.383 -2.442 1.00 0.58 N ATOM 500 C8 DG A 16 0.950 8.256 -2.424 1.00 0.60 C ATOM 501 N7 DG A 16 0.550 7.011 -2.358 1.00 0.56 N ATOM 502 C5 DG A 16 1.726 6.276 -2.333 1.00 0.50 C ATOM 503 C6 DG A 16 1.933 4.866 -2.262 1.00 0.46 C ATOM 504 O6 DG A 16 1.082 3.975 -2.207 1.00 0.48 O ATOM 505 N1 DG A 16 3.293 4.540 -2.254 1.00 0.43 N ATOM 506 C2 DG A 16 4.320 5.464 -2.311 1.00 0.45 C ATOM 507 N2 DG A 16 5.567 4.984 -2.281 1.00 0.48 N ATOM 508 N3 DG A 16 4.135 6.779 -2.380 1.00 0.50 N ATOM 509 C4 DG A 16 2.825 7.112 -2.385 1.00 0.52 C ATOM 0 H5' DG A 16 0.909 12.474 -0.935 1.00 0.10 H new ATOM 0 H5'' DG A 16 1.330 13.531 -2.268 1.00 0.10 H new ATOM 0 H4' DG A 16 3.282 12.545 -1.385 1.00 0.87 H new ATOM 0 H3' DG A 16 2.930 12.564 -4.088 1.00 0.72 H new ATOM 0 H2' DG A 16 1.976 10.292 -4.252 1.00 0.69 H new ATOM 0 H2'' DG A 16 3.675 10.003 -4.572 1.00 0.69 H new ATOM 0 H1' DG A 16 4.137 9.331 -2.374 1.00 0.66 H new ATOM 0 H8 DG A 16 0.274 9.097 -2.461 1.00 0.60 H new ATOM 0 H1 DG A 16 3.545 3.553 -2.203 1.00 0.43 H new ATOM 0 H21 DG A 16 6.361 5.623 -2.320 1.00 0.48 H new ATOM 0 H22 DG A 16 5.725 3.978 -2.219 1.00 0.48 H new ATOM 521 P DG A 17 5.572 12.175 -4.660 1.00 0.79 P ATOM 522 OP1 DG A 17 6.666 13.150 -4.406 1.00 0.01 O ATOM 523 OP2 DG A 17 4.646 12.463 -5.784 1.00 0.84 O ATOM 524 O5' DG A 17 6.211 10.726 -4.867 1.00 0.75 O ATOM 525 C5' DG A 17 7.278 10.276 -4.039 1.00 0.80 C ATOM 526 C4' DG A 17 7.792 8.920 -4.477 1.00 0.69 C ATOM 527 O4' DG A 17 6.748 7.928 -4.323 1.00 0.62 O ATOM 528 C3' DG A 17 8.243 8.822 -5.951 1.00 0.66 C ATOM 529 O3' DG A 17 9.588 8.331 -6.008 1.00 0.74 O ATOM 530 C2' DG A 17 7.269 7.818 -6.573 1.00 0.53 C ATOM 531 C1' DG A 17 6.852 6.996 -5.372 1.00 0.51 C ATOM 532 N9 DG A 17 5.570 6.281 -5.499 1.00 0.45 N ATOM 533 C8 DG A 17 4.316 6.822 -5.663 1.00 0.44 C ATOM 534 N7 DG A 17 3.372 5.925 -5.708 1.00 0.43 N ATOM 535 C5 DG A 17 4.032 4.718 -5.575 1.00 0.41 C ATOM 536 C6 DG A 17 3.519 3.390 -5.553 1.00 0.42 C ATOM 537 O6 DG A 17 2.338 3.031 -5.635 1.00 0.44 O ATOM 538 N1 DG A 17 4.539 2.440 -5.403 1.00 0.42 N ATOM 539 C2 DG A 17 5.886 2.747 -5.291 1.00 0.44 C ATOM 540 N2 DG A 17 6.740 1.718 -5.176 1.00 0.47 N ATOM 541 N3 DG A 17 6.368 3.989 -5.306 1.00 0.45 N ATOM 542 C4 DG A 17 5.393 4.919 -5.450 1.00 0.43 C ATOM 0 H5' DG A 17 6.938 10.220 -3.005 1.00 0.80 H new ATOM 0 H5'' DG A 17 8.092 11.001 -4.068 1.00 0.80 H new ATOM 0 H4' DG A 17 8.663 8.754 -3.843 1.00 0.69 H new ATOM 0 H3' DG A 17 8.232 9.780 -6.472 1.00 0.66 H new ATOM 0 H2' DG A 17 6.419 8.312 -7.044 1.00 0.53 H new ATOM 0 H2'' DG A 17 7.747 7.207 -7.339 1.00 0.53 H new ATOM 0 H1' DG A 17 7.587 6.205 -5.225 1.00 0.51 H new ATOM 0 H8 DG A 17 4.132 7.883 -5.746 1.00 0.44 H new ATOM 0 H1 DG A 17 4.272 1.456 -5.374 1.00 0.42 H new ATOM 0 H21 DG A 17 7.741 1.893 -5.091 1.00 0.47 H new ATOM 0 H22 DG A 17 6.388 0.761 -5.174 1.00 0.47 H new ATOM 554 P DG A 18 10.307 8.125 -7.426 1.00 0.78 P ATOM 555 OP1 DG A 18 11.774 8.281 -7.250 1.00 0.00 O ATOM 556 OP2 DG A 18 9.643 8.989 -8.435 1.00 0.87 O ATOM 557 O5' DG A 18 9.984 6.594 -7.756 1.00 0.64 O ATOM 558 C5' DG A 18 10.626 5.527 -7.059 1.00 0.61 C ATOM 559 C4' DG A 18 10.736 4.279 -7.971 1.00 0.49 C ATOM 560 O4' DG A 18 9.491 3.525 -7.871 1.00 0.47 O ATOM 561 C3' DG A 18 10.896 4.597 -9.446 1.00 0.51 C ATOM 562 O3' DG A 18 11.642 3.567 -10.104 1.00 0.61 O ATOM 563 C2' DG A 18 9.453 4.615 -9.928 1.00 0.46 C ATOM 564 C1' DG A 18 8.884 3.435 -9.146 1.00 0.41 C ATOM 565 N9 DG A 18 7.405 3.365 -8.965 1.00 0.37 N ATOM 566 C8 DG A 18 6.471 4.393 -8.896 1.00 0.35 C ATOM 567 N7 DG A 18 5.247 3.965 -8.753 1.00 0.34 N ATOM 568 C5 DG A 18 5.359 2.590 -8.713 1.00 0.34 C ATOM 569 C6 DG A 18 4.349 1.595 -8.569 1.00 0.35 C ATOM 570 O6 DG A 18 3.130 1.763 -8.463 1.00 0.35 O ATOM 571 N1 DG A 18 4.888 0.304 -8.568 1.00 0.37 N ATOM 572 C2 DG A 18 6.235 0.016 -8.695 1.00 0.40 C ATOM 573 N2 DG A 18 6.579 -1.280 -8.658 1.00 0.43 N ATOM 574 N3 DG A 18 7.183 0.941 -8.837 1.00 0.39 N ATOM 575 C4 DG A 18 6.680 2.200 -8.837 1.00 0.36 C ATOM 0 H5' DG A 18 10.062 5.280 -6.159 1.00 0.61 H new ATOM 0 H5'' DG A 18 11.619 5.839 -6.737 1.00 0.61 H new ATOM 0 H4' DG A 18 11.621 3.741 -7.631 1.00 0.49 H new ATOM 0 H3' DG A 18 11.435 5.524 -9.644 1.00 0.51 H new ATOM 0 H2' DG A 18 8.948 5.552 -9.691 1.00 0.46 H new ATOM 0 H2'' DG A 18 9.374 4.475 -11.006 1.00 0.46 H new ATOM 0 H1' DG A 18 9.099 2.537 -9.725 1.00 0.41 H new ATOM 0 H8 DG A 18 6.732 5.439 -8.955 1.00 0.35 H new ATOM 0 H1 DG A 18 4.243 -0.479 -8.467 1.00 0.37 H new ATOM 0 H21 DG A 18 7.558 -1.550 -8.747 1.00 0.43 H new ATOM 0 H22 DG A 18 5.861 -1.995 -8.541 1.00 0.43 H new ATOM 587 P DG A 19 12.152 3.797 -11.609 1.00 0.80 P ATOM 588 OP1 DG A 19 13.360 2.964 -11.841 1.00 0.06 O ATOM 589 OP2 DG A 19 12.264 5.256 -11.864 1.00 0.94 O ATOM 590 O5' DG A 19 10.946 3.209 -12.474 1.00 0.73 O ATOM 591 C5' DG A 19 10.520 1.859 -12.313 1.00 0.73 C ATOM 592 C4' DG A 19 9.128 1.641 -12.858 1.00 0.74 C ATOM 593 O4' DG A 19 8.236 2.695 -12.395 1.00 0.65 O ATOM 594 C3' DG A 19 9.028 1.637 -14.378 1.00 0.86 C ATOM 595 O3' DG A 19 8.100 0.637 -14.811 1.00 0.98 O ATOM 596 C2' DG A 19 8.483 3.040 -14.687 1.00 0.81 C ATOM 597 C1' DG A 19 7.532 3.232 -13.496 1.00 0.65 C ATOM 598 N9 DG A 19 7.115 4.618 -13.153 1.00 0.59 N ATOM 599 C8 DG A 19 7.841 5.805 -13.213 1.00 0.67 C ATOM 600 N7 DG A 19 7.164 6.839 -12.792 1.00 0.70 N ATOM 601 C5 DG A 19 5.925 6.328 -12.439 1.00 0.60 C ATOM 602 C6 DG A 19 4.769 6.985 -11.909 1.00 0.64 C ATOM 603 O6 DG A 19 4.617 8.184 -11.643 1.00 0.78 O ATOM 604 N1 DG A 19 3.720 6.089 -11.689 1.00 0.59 N ATOM 605 C2 DG A 19 3.772 4.737 -11.953 1.00 0.53 C ATOM 606 N2 DG A 19 2.659 4.046 -11.679 1.00 0.60 N ATOM 607 N3 DG A 19 4.841 4.114 -12.444 1.00 0.51 N ATOM 608 C4 DG A 19 5.877 4.963 -12.661 1.00 0.52 C ATOM 0 H5' DG A 19 10.542 1.595 -11.256 1.00 0.73 H new ATOM 0 H5'' DG A 19 11.218 1.194 -12.822 1.00 0.73 H new ATOM 0 H4' DG A 19 8.850 0.652 -12.493 1.00 0.74 H new ATOM 0 H3' DG A 19 9.973 1.418 -14.876 1.00 0.86 H new ATOM 0 H2' DG A 19 9.269 3.794 -14.717 1.00 0.81 H new ATOM 0 H2'' DG A 19 7.964 3.083 -15.645 1.00 0.81 H new ATOM 0 H1' DG A 19 6.590 2.752 -13.760 1.00 0.65 H new ATOM 0 H8 DG A 19 8.858 5.864 -13.571 1.00 0.67 H new ATOM 0 H1 DG A 19 2.852 6.463 -11.305 1.00 0.59 H new ATOM 0 H21 DG A 19 2.628 3.041 -11.850 1.00 0.60 H new ATOM 0 H22 DG A 19 1.842 4.524 -11.299 1.00 0.60 H new ATOM 620 P DA A 20 8.247 0.013 -16.281 1.00 0.12 P ATOM 621 OP1 DA A 20 8.538 -1.440 -16.161 1.00 0.43 O ATOM 622 OP2 DA A 20 9.198 0.841 -17.064 1.00 0.26 O ATOM 623 O5' DA A 20 6.782 0.200 -16.880 1.00 0.03 O ATOM 624 C5' DA A 20 5.795 -0.814 -16.734 1.00 0.05 C ATOM 625 C4' DA A 20 4.408 -0.277 -17.007 1.00 0.92 C ATOM 626 O4' DA A 20 4.176 0.918 -16.225 1.00 0.76 O ATOM 627 C3' DA A 20 4.141 0.125 -18.473 1.00 0.95 C ATOM 628 O3' DA A 20 3.035 -0.631 -18.979 1.00 0.06 O ATOM 629 C2' DA A 20 3.758 1.627 -18.384 1.00 0.84 C ATOM 630 C1' DA A 20 3.281 1.728 -16.931 1.00 0.69 C ATOM 631 N9 DA A 20 3.281 3.078 -16.321 1.00 0.58 N ATOM 632 C8 DA A 20 4.292 4.024 -16.287 1.00 0.67 C ATOM 633 N7 DA A 20 3.962 5.128 -15.659 1.00 0.70 N ATOM 634 C5 DA A 20 2.656 4.905 -15.244 1.00 0.58 C ATOM 635 C6 DA A 20 1.734 5.701 -14.519 1.00 0.65 C ATOM 636 N6 DA A 20 2.000 6.935 -14.083 1.00 0.83 N ATOM 637 N1 DA A 20 0.505 5.179 -14.266 1.00 0.67 N ATOM 638 C2 DA A 20 0.230 3.942 -14.718 1.00 0.67 C ATOM 639 N3 DA A 20 1.009 3.100 -15.411 1.00 0.61 N ATOM 640 C4 DA A 20 2.225 3.647 -15.644 1.00 0.53 C ATOM 0 H5' DA A 20 5.837 -1.222 -15.724 1.00 0.05 H new ATOM 0 H5'' DA A 20 6.010 -1.635 -17.418 1.00 0.05 H new ATOM 0 H4' DA A 20 3.747 -1.104 -16.748 1.00 0.92 H new ATOM 0 H3' DA A 20 4.992 -0.055 -19.130 1.00 0.95 H new ATOM 0 H2' DA A 20 4.607 2.281 -18.585 1.00 0.84 H new ATOM 0 H2'' DA A 20 2.975 1.895 -19.094 1.00 0.84 H new ATOM 0 H1' DA A 20 2.232 1.434 -16.896 1.00 0.69 H new ATOM 0 H8 DA A 20 5.262 3.868 -16.736 1.00 0.67 H new ATOM 0 H61 DA A 20 1.292 7.457 -13.566 1.00 0.83 H new ATOM 0 H62 DA A 20 2.911 7.356 -14.267 1.00 0.83 H new ATOM 0 H2 DA A 20 -0.760 3.575 -14.490 1.00 0.67 H new ATOM 652 P DA A 21 3.111 -1.288 -20.440 1.00 0.26 P ATOM 653 OP1 DA A 21 4.406 -2.003 -20.583 1.00 0.56 O ATOM 654 OP2 DA A 21 2.784 -0.250 -21.448 1.00 0.42 O ATOM 655 O5' DA A 21 1.932 -2.367 -20.398 1.00 0.27 O ATOM 656 C5' DA A 21 0.587 -1.993 -20.117 1.00 0.16 C ATOM 657 C4' DA A 21 0.332 -1.985 -18.631 1.00 0.09 C ATOM 658 O4' DA A 21 -0.976 -1.416 -18.392 1.00 0.03 O ATOM 659 C3' DA A 21 0.319 -3.379 -17.966 1.00 0.23 C ATOM 660 O3' DA A 21 1.206 -3.401 -16.834 1.00 0.18 O ATOM 661 C2' DA A 21 -1.149 -3.533 -17.496 1.00 0.26 C ATOM 662 C1' DA A 21 -1.563 -2.073 -17.303 1.00 0.09 C ATOM 663 N9 DA A 21 -3.019 -1.795 -17.313 1.00 0.19 N ATOM 664 C8 DA A 21 -4.078 -2.674 -17.182 1.00 0.38 C ATOM 665 N7 DA A 21 -5.254 -2.095 -17.228 1.00 0.49 N ATOM 666 C5 DA A 21 -4.962 -0.749 -17.395 1.00 0.38 C ATOM 667 C6 DA A 21 -5.780 0.402 -17.516 1.00 0.49 C ATOM 668 N6 DA A 21 -7.116 0.372 -17.489 1.00 0.72 N ATOM 669 N1 DA A 21 -5.163 1.604 -17.673 1.00 0.42 N ATOM 670 C2 DA A 21 -3.818 1.633 -17.705 1.00 0.22 C ATOM 671 N3 DA A 21 -2.948 0.626 -17.603 1.00 0.09 N ATOM 672 C4 DA A 21 -3.588 -0.552 -17.448 1.00 0.19 C ATOM 0 H5' DA A 21 -0.097 -2.687 -20.604 1.00 0.16 H new ATOM 0 H5'' DA A 21 0.386 -1.005 -20.530 1.00 0.16 H new ATOM 0 H4' DA A 21 1.155 -1.416 -18.200 1.00 0.09 H new ATOM 0 H3' DA A 21 0.645 -4.176 -18.634 1.00 0.23 H new ATOM 0 H2' DA A 21 -1.766 -4.040 -18.238 1.00 0.26 H new ATOM 0 H2'' DA A 21 -1.226 -4.107 -16.572 1.00 0.26 H new ATOM 0 H1' DA A 21 -1.245 -1.749 -16.312 1.00 0.09 H new ATOM 0 H8 DA A 21 -3.949 -3.739 -17.054 1.00 0.38 H new ATOM 0 H61 DA A 21 -7.648 1.238 -17.581 1.00 0.72 H new ATOM 0 H62 DA A 21 -7.604 -0.517 -17.376 1.00 0.72 H new ATOM 0 H2 DA A 21 -3.380 2.612 -17.831 1.00 0.22 H new ATOM 684 P DT A 22 2.549 -4.289 -16.879 1.00 0.31 P ATOM 685 OP1 DT A 22 3.727 -3.389 -16.839 1.00 0.56 O ATOM 686 OP2 DT A 22 2.464 -5.240 -18.015 1.00 0.63 O ATOM 687 O5' DT A 22 2.502 -5.121 -15.513 1.00 0.51 O ATOM 688 C5' DT A 22 1.605 -4.809 -14.449 1.00 0.30 C ATOM 689 C4' DT A 22 2.143 -3.685 -13.590 1.00 0.05 C ATOM 690 O4' DT A 22 1.535 -2.444 -13.978 1.00 0.93 O ATOM 691 C3' DT A 22 1.810 -3.803 -12.109 1.00 0.87 C ATOM 692 O3' DT A 22 2.794 -4.588 -11.430 1.00 0.91 O ATOM 693 C2' DT A 22 1.853 -2.335 -11.618 1.00 0.71 C ATOM 694 C1' DT A 22 1.685 -1.505 -12.929 1.00 0.73 C ATOM 695 N1 DT A 22 0.510 -0.613 -12.924 1.00 0.63 N ATOM 696 C2 DT A 22 0.727 0.758 -12.866 1.00 0.60 C ATOM 697 O2 DT A 22 1.838 1.257 -12.801 1.00 0.68 O ATOM 698 N3 DT A 22 -0.418 1.527 -12.876 1.00 0.63 N ATOM 699 C4 DT A 22 -1.728 1.073 -12.926 1.00 0.69 C ATOM 700 O4 DT A 22 -2.653 1.880 -12.919 1.00 0.80 O ATOM 701 C5 DT A 22 -1.882 -0.374 -12.983 1.00 0.73 C ATOM 702 C7 DT A 22 -3.258 -0.959 -13.045 1.00 0.91 C ATOM 703 C6 DT A 22 -0.774 -1.138 -12.978 1.00 0.70 C ATOM 0 H5' DT A 22 1.444 -5.695 -13.834 1.00 0.30 H new ATOM 0 H5'' DT A 22 0.636 -4.525 -14.859 1.00 0.30 H new ATOM 0 H4' DT A 22 3.222 -3.733 -13.736 1.00 0.05 H new ATOM 0 H3' DT A 22 0.853 -4.291 -11.924 1.00 0.87 H new ATOM 0 H2' DT A 22 1.054 -2.127 -10.906 1.00 0.71 H new ATOM 0 H2'' DT A 22 2.794 -2.107 -11.117 1.00 0.71 H new ATOM 0 HO3' DT A 22 2.710 -4.453 -10.463 1.00 0.91 H new ATOM 0 H1' DT A 22 2.555 -0.858 -13.041 1.00 0.73 H new ATOM 0 H3 DT A 22 -0.288 2.538 -12.843 1.00 0.63 H new ATOM 0 H71 DT A 22 -3.229 -1.901 -13.593 1.00 0.91 H new ATOM 0 H72 DT A 22 -3.623 -1.138 -12.034 1.00 0.91 H new ATOM 0 H73 DT A 22 -3.926 -0.264 -13.554 1.00 0.91 H new ATOM 0 H6 DT A 22 -0.889 -2.211 -13.018 1.00 0.70 H new TER 717 DT A 22