USER MOD reduce.3.24.130724 H: found=0, std=0, add=221, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 221 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 DA O5' : rot 180:sc= 0 USER MOD Single : A 12 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 20 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 4.504 15.640 -4.389 1.00 0.32 O ATOM 2 C5' DA A 1 4.126 14.628 -3.454 1.00 0.23 C ATOM 3 C4' DA A 1 2.901 13.854 -3.936 1.00 0.19 C ATOM 4 O4' DA A 1 2.544 12.871 -2.976 1.00 0.26 O ATOM 5 C3' DA A 1 1.662 14.715 -4.133 1.00 0.18 C ATOM 6 O3' DA A 1 1.618 15.174 -5.489 1.00 0.29 O ATOM 7 C2' DA A 1 0.496 13.763 -3.861 1.00 0.24 C ATOM 8 C1' DA A 1 1.148 12.588 -3.110 1.00 0.29 C ATOM 9 N9 DA A 1 0.614 12.377 -1.752 1.00 0.33 N ATOM 10 C8 DA A 1 -0.690 12.379 -1.328 1.00 0.45 C ATOM 11 N7 DA A 1 -0.829 12.160 -0.049 1.00 0.49 N ATOM 12 C5 DA A 1 0.476 12.001 0.405 1.00 0.38 C ATOM 13 C6 DA A 1 1.015 11.742 1.676 1.00 0.36 C ATOM 14 N6 DA A 1 0.267 11.593 2.770 1.00 0.46 N ATOM 15 N1 DA A 1 2.352 11.644 1.771 1.00 0.27 N ATOM 16 C2 DA A 1 3.090 11.794 0.678 1.00 0.22 C ATOM 17 N3 DA A 1 2.705 12.038 -0.564 1.00 0.22 N ATOM 18 C4 DA A 1 1.361 12.131 -0.627 1.00 0.29 C ATOM 0 H5' DA A 1 3.913 15.085 -2.488 1.00 0.23 H new ATOM 0 H5'' DA A 1 4.958 13.940 -3.305 1.00 0.23 H new ATOM 0 H4' DA A 1 3.195 13.430 -4.896 1.00 0.19 H new ATOM 0 H3' DA A 1 1.640 15.592 -3.486 1.00 0.18 H new ATOM 0 H2' DA A 1 -0.279 14.241 -3.261 1.00 0.24 H new ATOM 0 H2'' DA A 1 0.024 13.434 -4.787 1.00 0.24 H new ATOM 0 HO5' DA A 1 5.290 16.119 -4.052 1.00 0.32 H new ATOM 0 H1' DA A 1 0.939 11.689 -3.689 1.00 0.29 H new ATOM 0 H8 DA A 1 -1.525 12.546 -1.992 1.00 0.45 H new ATOM 0 H61 DA A 1 0.710 11.406 3.669 1.00 0.46 H new ATOM 0 H62 DA A 1 -0.748 11.666 2.707 1.00 0.46 H new ATOM 0 H2 DA A 1 4.156 11.704 0.823 1.00 0.22 H new ATOM 31 P DI A 2 0.336 15.971 -6.050 1.00 0.31 P ATOM 32 OP1 DI A 2 0.800 16.933 -7.075 1.00 0.39 O ATOM 33 OP2 DI A 2 -0.456 16.448 -4.894 1.00 0.35 O ATOM 34 O5' DI A 2 -0.500 14.811 -6.790 1.00 0.31 O ATOM 35 C5' DI A 2 0.169 13.869 -7.632 1.00 0.31 C ATOM 36 C4' DI A 2 -0.782 12.784 -8.130 1.00 0.31 C ATOM 37 O4' DI A 2 -1.592 12.333 -7.045 1.00 0.29 O ATOM 38 C3' DI A 2 -1.728 13.245 -9.245 1.00 0.33 C ATOM 39 O3' DI A 2 -1.482 12.473 -10.426 1.00 0.33 O ATOM 40 C2' DI A 2 -3.138 12.954 -8.727 1.00 0.34 C ATOM 41 C1' DI A 2 -2.890 12.027 -7.545 1.00 0.31 C ATOM 42 N9 DI A 2 -3.848 12.200 -6.438 1.00 0.32 N ATOM 43 C8 DI A 2 -3.742 12.999 -5.329 1.00 0.33 C ATOM 44 N7 DI A 2 -4.768 12.930 -4.527 1.00 0.36 N ATOM 45 C5 DI A 2 -5.617 12.020 -5.148 1.00 0.38 C ATOM 46 C6 DI A 2 -6.893 11.544 -4.741 1.00 0.45 C ATOM 47 O6 DI A 2 -7.533 11.836 -3.734 1.00 0.47 O ATOM 48 N1 DI A 2 -7.404 10.637 -5.655 1.00 0.51 N ATOM 49 C2 DI A 2 -6.766 10.244 -6.810 1.00 0.50 C ATOM 50 N3 DI A 2 -5.580 10.677 -7.204 1.00 0.43 N ATOM 51 C4 DI A 2 -5.062 11.567 -6.321 1.00 0.36 C ATOM 0 H5'' DI A 2 0.607 14.389 -8.484 1.00 0.31 H new ATOM 0 H2'' DI A 2 -3.651 13.866 -8.423 1.00 0.34 H new ATOM 0 H8 DI A 2 -2.878 13.635 -5.135 1.00 0.33 H new ATOM 0 H5' DI A 2 0.991 13.409 -7.083 1.00 0.31 H new ATOM 0 H4' DI A 2 -0.147 11.997 -8.537 1.00 0.31 H new ATOM 0 H3' DI A 2 -1.592 14.298 -9.492 1.00 0.33 H new ATOM 0 H2' DI A 2 -3.757 12.479 -9.488 1.00 0.34 H new ATOM 0 H2 DI A 2 -7.276 9.522 -7.447 1.00 0.50 H new ATOM 0 H1' DI A 2 -2.997 11.002 -7.900 1.00 0.31 H new ATOM 0 H1 DI A 2 -8.319 10.231 -5.458 1.00 0.51 H new ATOM 62 P DG A 3 -1.481 10.865 -10.364 1.00 0.32 P ATOM 63 OP1 DG A 3 -2.851 10.385 -10.659 1.00 0.37 O ATOM 64 OP2 DG A 3 -0.813 10.456 -9.114 1.00 0.29 O ATOM 65 O5' DG A 3 -0.529 10.461 -11.595 1.00 0.35 O ATOM 66 C5' DG A 3 0.852 10.833 -11.601 1.00 0.33 C ATOM 67 C4' DG A 3 1.712 9.864 -10.791 1.00 0.30 C ATOM 68 O4' DG A 3 1.400 9.977 -9.399 1.00 0.27 O ATOM 69 C3' DG A 3 1.520 8.394 -11.181 1.00 0.30 C ATOM 70 O3' DG A 3 2.779 7.839 -11.578 1.00 0.33 O ATOM 71 C2' DG A 3 1.031 7.707 -9.904 1.00 0.28 C ATOM 72 C1' DG A 3 1.478 8.676 -8.822 1.00 0.25 C ATOM 73 N9 DG A 3 0.636 8.662 -7.610 1.00 0.20 N ATOM 74 C8 DG A 3 -0.729 8.569 -7.514 1.00 0.21 C ATOM 75 N7 DG A 3 -1.175 8.566 -6.289 1.00 0.19 N ATOM 76 C5 DG A 3 -0.024 8.664 -5.514 1.00 0.17 C ATOM 77 C6 DG A 3 0.118 8.707 -4.101 1.00 0.16 C ATOM 78 O6 DG A 3 -0.764 8.663 -3.243 1.00 0.19 O ATOM 79 N1 DG A 3 1.451 8.809 -3.726 1.00 0.18 N ATOM 80 C2 DG A 3 2.517 8.863 -4.601 1.00 0.19 C ATOM 81 N2 DG A 3 3.727 8.959 -4.051 1.00 0.22 N ATOM 82 N3 DG A 3 2.384 8.824 -5.931 1.00 0.19 N ATOM 83 C4 DG A 3 1.090 8.724 -6.313 1.00 0.18 C ATOM 0 H5' DG A 3 0.958 11.838 -11.194 1.00 0.33 H new ATOM 0 H5'' DG A 3 1.214 10.866 -12.629 1.00 0.33 H new ATOM 0 H4' DG A 3 2.743 10.144 -11.005 1.00 0.30 H new ATOM 0 H3' DG A 3 0.822 8.269 -12.009 1.00 0.30 H new ATOM 0 H2' DG A 3 -0.050 7.569 -9.905 1.00 0.28 H new ATOM 0 H2'' DG A 3 1.478 6.721 -9.776 1.00 0.28 H new ATOM 0 H1' DG A 3 2.479 8.387 -8.500 1.00 0.25 H new ATOM 0 H8 DG A 3 -1.376 8.504 -8.376 1.00 0.21 H new ATOM 0 H1 DG A 3 1.658 8.847 -2.728 1.00 0.18 H new ATOM 0 H21 DG A 3 4.555 9.003 -4.645 1.00 0.22 H new ATOM 0 H22 DG A 3 3.825 8.989 -3.036 1.00 0.22 H new ATOM 95 P DG A 4 2.890 6.291 -12.011 1.00 0.35 P ATOM 96 OP1 DG A 4 3.665 6.215 -13.269 1.00 0.48 O ATOM 97 OP2 DG A 4 1.539 5.692 -11.939 1.00 0.43 O ATOM 98 O5' DG A 4 3.783 5.658 -10.830 1.00 0.29 O ATOM 99 C5' DG A 4 5.160 6.019 -10.689 1.00 0.33 C ATOM 100 C4' DG A 4 5.799 5.332 -9.487 1.00 0.34 C ATOM 101 O4' DG A 4 5.058 5.650 -8.304 1.00 0.35 O ATOM 102 C3' DG A 4 5.844 3.804 -9.595 1.00 0.34 C ATOM 103 O3' DG A 4 7.117 3.334 -9.143 1.00 0.34 O ATOM 104 C2' DG A 4 4.755 3.337 -8.645 1.00 0.34 C ATOM 105 C1' DG A 4 4.785 4.438 -7.601 1.00 0.35 C ATOM 106 N9 DG A 4 3.514 4.607 -6.876 1.00 0.35 N ATOM 107 C8 DG A 4 2.261 4.821 -7.386 1.00 0.35 C ATOM 108 N7 DG A 4 1.330 4.898 -6.479 1.00 0.35 N ATOM 109 C5 DG A 4 2.011 4.724 -5.281 1.00 0.37 C ATOM 110 C6 DG A 4 1.519 4.710 -3.951 1.00 0.38 C ATOM 111 O6 DG A 4 0.358 4.845 -3.567 1.00 0.40 O ATOM 112 N1 DG A 4 2.541 4.506 -3.033 1.00 0.40 N ATOM 113 C2 DG A 4 3.872 4.336 -3.354 1.00 0.40 C ATOM 114 N2 DG A 4 4.708 4.154 -2.332 1.00 0.43 N ATOM 115 N3 DG A 4 4.336 4.349 -4.607 1.00 0.39 N ATOM 116 C4 DG A 4 3.352 4.546 -5.515 1.00 0.37 C ATOM 0 H5' DG A 4 5.244 7.100 -10.578 1.00 0.33 H new ATOM 0 H5'' DG A 4 5.703 5.748 -11.595 1.00 0.33 H new ATOM 0 H4' DG A 4 6.825 5.699 -9.450 1.00 0.34 H new ATOM 0 H3' DG A 4 5.700 3.441 -10.613 1.00 0.34 H new ATOM 0 H2' DG A 4 3.785 3.261 -9.136 1.00 0.34 H new ATOM 0 H2'' DG A 4 4.973 2.358 -8.218 1.00 0.34 H new ATOM 0 H1' DG A 4 5.535 4.179 -6.854 1.00 0.35 H new ATOM 0 H8 DG A 4 2.063 4.917 -8.443 1.00 0.35 H new ATOM 0 H1 DG A 4 2.288 4.480 -2.045 1.00 0.40 H new ATOM 0 H21 DG A 4 5.705 4.023 -2.505 1.00 0.43 H new ATOM 0 H22 DG A 4 4.351 4.146 -1.376 1.00 0.43 H new ATOM 128 P DG A 5 7.497 1.773 -9.245 1.00 0.33 P ATOM 129 OP1 DG A 5 8.544 1.615 -10.279 1.00 0.43 O ATOM 130 OP2 DG A 5 6.241 0.996 -9.340 1.00 0.39 O ATOM 131 O5' DG A 5 8.161 1.488 -7.808 1.00 0.22 O ATOM 132 C5' DG A 5 9.197 2.339 -7.316 1.00 0.23 C ATOM 133 C4' DG A 5 9.309 2.270 -5.797 1.00 0.20 C ATOM 134 O4' DG A 5 8.015 2.466 -5.214 1.00 0.20 O ATOM 135 C3' DG A 5 9.844 0.938 -5.272 1.00 0.22 C ATOM 136 O3' DG A 5 10.735 1.179 -4.174 1.00 0.21 O ATOM 137 C2' DG A 5 8.598 0.214 -4.780 1.00 0.23 C ATOM 138 C1' DG A 5 7.739 1.380 -4.325 1.00 0.20 C ATOM 139 N9 DG A 5 6.288 1.123 -4.379 1.00 0.21 N ATOM 140 C8 DG A 5 5.464 1.100 -5.473 1.00 0.23 C ATOM 141 N7 DG A 5 4.212 0.875 -5.186 1.00 0.25 N ATOM 142 C5 DG A 5 4.204 0.737 -3.801 1.00 0.23 C ATOM 143 C6 DG A 5 3.120 0.480 -2.916 1.00 0.25 C ATOM 144 O6 DG A 5 1.932 0.324 -3.190 1.00 0.28 O ATOM 145 N1 DG A 5 3.546 0.416 -1.595 1.00 0.25 N ATOM 146 C2 DG A 5 4.849 0.578 -1.175 1.00 0.24 C ATOM 147 N2 DG A 5 5.062 0.478 0.137 1.00 0.27 N ATOM 148 N3 DG A 5 5.869 0.821 -2.005 1.00 0.22 N ATOM 149 C4 DG A 5 5.473 0.886 -3.298 1.00 0.22 C ATOM 0 H5' DG A 5 8.999 3.367 -7.620 1.00 0.23 H new ATOM 0 H5'' DG A 5 10.148 2.052 -7.765 1.00 0.23 H new ATOM 0 H4' DG A 5 10.018 3.050 -5.519 1.00 0.20 H new ATOM 0 H3' DG A 5 10.395 0.370 -6.022 1.00 0.22 H new ATOM 0 H2' DG A 5 8.120 -0.365 -5.570 1.00 0.23 H new ATOM 0 H2'' DG A 5 8.818 -0.477 -3.966 1.00 0.23 H new ATOM 0 H1' DG A 5 7.984 1.579 -3.282 1.00 0.20 H new ATOM 0 H8 DG A 5 5.819 1.254 -6.481 1.00 0.23 H new ATOM 0 H1 DG A 5 2.840 0.235 -0.881 1.00 0.25 H new ATOM 0 H21 DG A 5 6.005 0.588 0.510 1.00 0.27 H new ATOM 0 H22 DG A 5 4.282 0.291 0.767 1.00 0.27 H new ATOM 161 P DA A 6 12.258 1.642 -4.438 1.00 0.25 P ATOM 162 OP1 DA A 6 12.391 1.993 -5.869 1.00 0.32 O ATOM 163 OP2 DA A 6 13.159 0.629 -3.842 1.00 0.34 O ATOM 164 O5' DA A 6 12.381 2.997 -3.572 1.00 0.22 O ATOM 165 C5' DA A 6 11.640 4.161 -3.944 1.00 0.20 C ATOM 166 C4' DA A 6 12.189 5.425 -3.295 1.00 0.28 C ATOM 167 O4' DA A 6 13.535 5.645 -3.731 1.00 0.38 O ATOM 168 C3' DA A 6 11.385 6.679 -3.646 1.00 0.23 C ATOM 169 O3' DA A 6 11.193 7.472 -2.471 1.00 0.33 O ATOM 170 C2' DA A 6 12.269 7.423 -4.634 1.00 0.25 C ATOM 171 C1' DA A 6 13.655 6.993 -4.186 1.00 0.38 C ATOM 172 N9 DA A 6 14.669 7.019 -5.257 1.00 0.45 N ATOM 173 C8 DA A 6 14.553 6.606 -6.559 1.00 0.47 C ATOM 174 N7 DA A 6 15.643 6.756 -7.260 1.00 0.60 N ATOM 175 C5 DA A 6 16.546 7.307 -6.356 1.00 0.65 C ATOM 176 C6 DA A 6 17.887 7.705 -6.478 1.00 0.78 C ATOM 177 N6 DA A 6 18.579 7.601 -7.612 1.00 0.88 N ATOM 178 N1 DA A 6 18.481 8.213 -5.384 1.00 0.84 N ATOM 179 C2 DA A 6 17.786 8.313 -4.258 1.00 0.78 C ATOM 180 N3 DA A 6 16.529 7.976 -4.019 1.00 0.67 N ATOM 181 C4 DA A 6 15.960 7.471 -5.133 1.00 0.58 C ATOM 0 H5' DA A 6 10.596 4.032 -3.658 1.00 0.20 H new ATOM 0 H5'' DA A 6 11.662 4.272 -5.028 1.00 0.20 H new ATOM 0 H4' DA A 6 12.128 5.264 -2.219 1.00 0.28 H new ATOM 0 H3' DA A 6 10.399 6.452 -4.052 1.00 0.23 H new ATOM 0 H2' DA A 6 12.064 7.135 -5.665 1.00 0.25 H new ATOM 0 H2'' DA A 6 12.135 8.503 -4.572 1.00 0.25 H new ATOM 0 H1' DA A 6 13.992 7.693 -3.422 1.00 0.38 H new ATOM 0 H8 DA A 6 13.642 6.194 -6.967 1.00 0.47 H new ATOM 0 H61 DA A 6 19.552 7.906 -7.646 1.00 0.88 H new ATOM 0 H62 DA A 6 18.136 7.217 -8.446 1.00 0.88 H new ATOM 0 H2 DA A 6 18.322 8.728 -3.418 1.00 0.78 H new ATOM 193 P DG A 7 10.306 8.815 -2.530 1.00 0.28 P ATOM 194 OP1 DG A 7 9.400 8.723 -3.697 1.00 0.29 O ATOM 195 OP2 DG A 7 11.214 9.975 -2.391 1.00 0.32 O ATOM 196 O5' DG A 7 9.417 8.707 -1.192 1.00 0.34 O ATOM 197 C5' DG A 7 10.010 8.938 0.088 1.00 0.34 C ATOM 198 C4' DG A 7 9.178 8.330 1.211 1.00 0.24 C ATOM 199 O4' DG A 7 7.851 8.847 1.146 1.00 0.25 O ATOM 200 C3' DG A 7 9.091 6.806 1.150 1.00 0.21 C ATOM 201 O3' DG A 7 9.532 6.252 2.394 1.00 0.22 O ATOM 202 C2' DG A 7 7.612 6.493 0.936 1.00 0.23 C ATOM 203 C1' DG A 7 6.923 7.786 1.349 1.00 0.20 C ATOM 204 N9 DG A 7 5.731 8.098 0.542 1.00 0.21 N ATOM 205 C8 DG A 7 5.673 8.441 -0.780 1.00 0.24 C ATOM 206 N7 DG A 7 4.463 8.646 -1.221 1.00 0.24 N ATOM 207 C5 DG A 7 3.659 8.424 -0.105 1.00 0.22 C ATOM 208 C6 DG A 7 2.244 8.500 0.028 1.00 0.22 C ATOM 209 O6 DG A 7 1.411 8.777 -0.831 1.00 0.24 O ATOM 210 N1 DG A 7 1.839 8.202 1.323 1.00 0.22 N ATOM 211 C2 DG A 7 2.686 7.873 2.361 1.00 0.23 C ATOM 212 N2 DG A 7 2.111 7.619 3.536 1.00 0.27 N ATOM 213 N3 DG A 7 4.015 7.800 2.237 1.00 0.22 N ATOM 214 C4 DG A 7 4.428 8.088 0.980 1.00 0.20 C ATOM 0 H5' DG A 7 10.115 10.010 0.252 1.00 0.34 H new ATOM 0 H5'' DG A 7 11.013 8.513 0.107 1.00 0.34 H new ATOM 0 H4' DG A 7 9.678 8.597 2.142 1.00 0.24 H new ATOM 0 H3' DG A 7 9.713 6.388 0.358 1.00 0.21 H new ATOM 0 H2' DG A 7 7.400 6.237 -0.102 1.00 0.23 H new ATOM 0 H2'' DG A 7 7.286 5.650 1.545 1.00 0.23 H new ATOM 0 H1' DG A 7 6.605 7.670 2.385 1.00 0.20 H new ATOM 0 H8 DG A 7 6.550 8.534 -1.403 1.00 0.24 H new ATOM 0 H1 DG A 7 0.839 8.228 1.522 1.00 0.22 H new ATOM 0 H21 DG A 7 2.685 7.370 4.342 1.00 0.27 H new ATOM 0 H22 DG A 7 1.097 7.674 3.630 1.00 0.27 H new ATOM 226 P DG A 8 9.697 4.660 2.562 1.00 0.25 P ATOM 227 OP1 DG A 8 10.786 4.404 3.532 1.00 0.34 O ATOM 228 OP2 DG A 8 9.755 4.056 1.212 1.00 0.31 O ATOM 229 O5' DG A 8 8.305 4.234 3.244 1.00 0.23 O ATOM 230 C5' DG A 8 8.051 4.532 4.619 1.00 0.23 C ATOM 231 C4' DG A 8 6.867 3.733 5.149 1.00 0.22 C ATOM 232 O4' DG A 8 5.674 4.114 4.449 1.00 0.24 O ATOM 233 C3' DG A 8 7.021 2.223 4.971 1.00 0.20 C ATOM 234 O3' DG A 8 6.422 1.549 6.087 1.00 0.21 O ATOM 235 C2' DG A 8 6.227 1.946 3.708 1.00 0.20 C ATOM 236 C1' DG A 8 5.094 2.941 3.876 1.00 0.22 C ATOM 237 N9 DG A 8 4.428 3.327 2.617 1.00 0.24 N ATOM 238 C8 DG A 8 4.990 3.669 1.415 1.00 0.26 C ATOM 239 N7 DG A 8 4.121 3.951 0.485 1.00 0.28 N ATOM 240 C5 DG A 8 2.891 3.785 1.116 1.00 0.27 C ATOM 241 C6 DG A 8 1.575 3.951 0.604 1.00 0.30 C ATOM 242 O6 DG A 8 1.232 4.283 -0.527 1.00 0.33 O ATOM 243 N1 DG A 8 0.616 3.683 1.571 1.00 0.29 N ATOM 244 C2 DG A 8 0.884 3.304 2.868 1.00 0.28 C ATOM 245 N2 DG A 8 -0.172 3.091 3.652 1.00 0.30 N ATOM 246 N3 DG A 8 2.121 3.147 3.352 1.00 0.26 N ATOM 247 C4 DG A 8 3.070 3.403 2.421 1.00 0.25 C ATOM 0 H5' DG A 8 7.853 5.598 4.732 1.00 0.23 H new ATOM 0 H5'' DG A 8 8.938 4.308 5.212 1.00 0.23 H new ATOM 0 H4' DG A 8 6.815 3.955 6.215 1.00 0.22 H new ATOM 0 H3' DG A 8 8.057 1.889 4.909 1.00 0.20 H new ATOM 0 H2' DG A 8 6.808 2.127 2.804 1.00 0.20 H new ATOM 0 H2'' DG A 8 5.872 0.917 3.658 1.00 0.20 H new ATOM 0 H1' DG A 8 4.326 2.474 4.492 1.00 0.22 H new ATOM 0 H8 DG A 8 6.057 3.702 1.253 1.00 0.26 H new ATOM 0 H1 DG A 8 -0.363 3.774 1.300 1.00 0.29 H new ATOM 0 H21 DG A 8 -0.038 2.808 4.623 1.00 0.30 H new ATOM 0 H22 DG A 8 -1.115 3.211 3.281 1.00 0.30 H new ATOM 259 P DG A 9 6.600 -0.040 6.285 1.00 0.24 P ATOM 260 OP1 DG A 9 6.215 -0.379 7.674 1.00 0.31 O ATOM 261 OP2 DG A 9 7.935 -0.424 5.777 1.00 0.33 O ATOM 262 O5' DG A 9 5.489 -0.652 5.293 1.00 0.23 O ATOM 263 C5' DG A 9 4.608 -1.690 5.734 1.00 0.29 C ATOM 264 C4' DG A 9 3.459 -1.138 6.575 1.00 0.26 C ATOM 265 O4' DG A 9 2.797 -0.096 5.863 1.00 0.19 O ATOM 266 C3' DG A 9 2.392 -2.166 6.902 1.00 0.34 C ATOM 267 O3' DG A 9 1.701 -1.786 8.099 1.00 0.40 O ATOM 268 C2' DG A 9 1.452 -2.081 5.708 1.00 0.30 C ATOM 269 C1' DG A 9 1.599 -0.621 5.268 1.00 0.21 C ATOM 270 N9 DG A 9 1.723 -0.444 3.807 1.00 0.21 N ATOM 271 C8 DG A 9 2.860 -0.422 3.044 1.00 0.22 C ATOM 272 N7 DG A 9 2.643 -0.231 1.774 1.00 0.24 N ATOM 273 C5 DG A 9 1.260 -0.120 1.685 1.00 0.24 C ATOM 274 C6 DG A 9 0.439 0.096 0.546 1.00 0.29 C ATOM 275 O6 DG A 9 0.784 0.234 -0.626 1.00 0.34 O ATOM 276 N1 DG A 9 -0.905 0.143 0.890 1.00 0.29 N ATOM 277 C2 DG A 9 -1.400 0.002 2.171 1.00 0.26 C ATOM 278 N2 DG A 9 -2.724 0.075 2.304 1.00 0.29 N ATOM 279 N3 DG A 9 -0.628 -0.200 3.244 1.00 0.23 N ATOM 280 C4 DG A 9 0.687 -0.249 2.926 1.00 0.22 C ATOM 0 H5' DG A 9 5.169 -2.419 6.319 1.00 0.29 H new ATOM 0 H5'' DG A 9 4.205 -2.217 4.869 1.00 0.29 H new ATOM 0 H4' DG A 9 3.920 -0.796 7.502 1.00 0.26 H new ATOM 0 H3' DG A 9 2.790 -3.167 7.067 1.00 0.34 H new ATOM 0 H2' DG A 9 1.739 -2.773 4.917 1.00 0.30 H new ATOM 0 H2'' DG A 9 0.425 -2.320 5.983 1.00 0.30 H new ATOM 0 H1' DG A 9 0.693 -0.105 5.586 1.00 0.21 H new ATOM 0 H8 DG A 9 3.849 -0.552 3.459 1.00 0.22 H new ATOM 0 H1 DG A 9 -1.578 0.293 0.139 1.00 0.29 H new ATOM 0 H21 DG A 9 -3.150 -0.022 3.226 1.00 0.29 H new ATOM 0 H22 DG A 9 -3.311 0.228 1.484 1.00 0.29 H new ATOM 292 P DI A 10 2.290 -2.187 9.545 1.00 0.45 P ATOM 293 OP1 DI A 10 3.046 -3.452 9.403 1.00 0.51 O ATOM 294 OP2 DI A 10 1.192 -2.093 10.533 1.00 0.53 O ATOM 295 O5' DI A 10 3.339 -1.004 9.846 1.00 0.44 O ATOM 296 C5' DI A 10 3.148 -0.130 10.964 1.00 0.46 C ATOM 297 C4' DI A 10 4.096 1.065 10.909 1.00 0.44 C ATOM 298 O4' DI A 10 3.884 1.783 9.691 1.00 0.41 O ATOM 299 C3' DI A 10 3.904 2.061 12.046 1.00 0.44 C ATOM 300 O3' DI A 10 5.151 2.691 12.351 1.00 0.47 O ATOM 301 C2' DI A 10 2.939 3.077 11.463 1.00 0.40 C ATOM 302 C1' DI A 10 3.346 3.078 9.992 1.00 0.36 C ATOM 303 N9 DI A 10 2.237 3.326 9.047 1.00 0.31 N ATOM 304 C8 DI A 10 0.919 2.948 9.137 1.00 0.29 C ATOM 305 N7 DI A 10 0.195 3.307 8.117 1.00 0.26 N ATOM 306 C5 DI A 10 1.090 3.972 7.287 1.00 0.26 C ATOM 307 C6 DI A 10 0.874 4.586 6.026 1.00 0.28 C ATOM 308 O6 DI A 10 -0.170 4.661 5.383 1.00 0.31 O ATOM 309 N1 DI A 10 2.041 5.141 5.532 1.00 0.34 N ATOM 310 C2 DI A 10 3.259 5.106 6.175 1.00 0.38 C ATOM 311 N3 DI A 10 3.478 4.539 7.349 1.00 0.36 N ATOM 312 C4 DI A 10 2.345 3.989 7.849 1.00 0.30 C ATOM 0 H5'' DI A 10 2.117 0.223 10.979 1.00 0.46 H new ATOM 0 H2'' DI A 10 1.899 2.780 11.600 1.00 0.40 H new ATOM 0 H8 DI A 10 0.516 2.397 9.987 1.00 0.29 H new ATOM 0 H5' DI A 10 3.310 -0.682 11.890 1.00 0.46 H new ATOM 0 H4' DI A 10 5.100 0.647 10.987 1.00 0.44 H new ATOM 0 H3' DI A 10 3.541 1.603 12.966 1.00 0.44 H new ATOM 0 H2' DI A 10 3.053 4.060 11.920 1.00 0.40 H new ATOM 0 H2 DI A 10 4.105 5.581 5.679 1.00 0.38 H new ATOM 0 H1' DI A 10 4.058 3.894 9.865 1.00 0.36 H new ATOM 0 H1 DI A 10 1.997 5.610 4.627 1.00 0.34 H new ATOM 323 P DC A 11 5.189 4.205 12.898 1.00 0.46 P ATOM 324 OP1 DC A 11 6.517 4.447 13.505 1.00 0.49 O ATOM 325 OP2 DC A 11 3.961 4.442 13.690 1.00 0.48 O ATOM 326 O5' DC A 11 5.089 5.068 11.543 1.00 0.42 O ATOM 327 C5' DC A 11 6.253 5.295 10.744 1.00 0.42 C ATOM 328 C4' DC A 11 7.064 6.480 11.260 1.00 0.37 C ATOM 329 O4' DC A 11 8.292 6.574 10.537 1.00 0.41 O ATOM 330 C3' DC A 11 6.346 7.828 11.118 1.00 0.26 C ATOM 331 O3' DC A 11 6.295 8.477 12.393 1.00 0.31 O ATOM 332 C2' DC A 11 7.220 8.637 10.161 1.00 0.23 C ATOM 333 C1' DC A 11 8.567 7.952 10.305 1.00 0.32 C ATOM 334 N1 DC A 11 9.427 8.044 9.109 1.00 0.36 N ATOM 335 C2 DC A 11 10.694 8.584 9.273 1.00 0.40 C ATOM 336 O2 DC A 11 11.059 8.969 10.381 1.00 0.49 O ATOM 337 N3 DC A 11 11.504 8.670 8.183 1.00 0.45 N ATOM 338 C4 DC A 11 11.090 8.247 6.981 1.00 0.54 C ATOM 339 N4 DC A 11 11.910 8.346 5.935 1.00 0.65 N ATOM 340 C5 DC A 11 9.784 7.690 6.808 1.00 0.61 C ATOM 341 C6 DC A 11 8.990 7.608 7.892 1.00 0.50 C ATOM 0 H5' DC A 11 5.956 5.478 9.711 1.00 0.42 H new ATOM 0 H5'' DC A 11 6.875 4.400 10.743 1.00 0.42 H new ATOM 0 H4' DC A 11 7.222 6.290 12.322 1.00 0.37 H new ATOM 0 H3' DC A 11 5.324 7.722 10.755 1.00 0.26 H new ATOM 0 H2' DC A 11 6.849 8.596 9.137 1.00 0.23 H new ATOM 0 H2'' DC A 11 7.266 9.689 10.441 1.00 0.23 H new ATOM 0 H1' DC A 11 9.108 8.446 11.112 1.00 0.32 H new ATOM 0 H41 DC A 11 11.605 8.027 5.016 1.00 0.65 H new ATOM 0 H42 DC A 11 12.843 8.741 6.054 1.00 0.65 H new ATOM 0 H5 DC A 11 9.447 7.347 5.841 1.00 0.61 H new ATOM 0 H6 DC A 11 7.997 7.193 7.798 1.00 0.50 H new ATOM 353 P DT A 12 5.538 9.888 12.561 1.00 0.32 P ATOM 354 OP1 DT A 12 6.123 10.847 11.597 1.00 0.31 O ATOM 355 OP2 DT A 12 5.499 10.224 14.002 1.00 0.44 O ATOM 356 O5' DT A 12 4.039 9.543 12.083 1.00 0.29 O ATOM 357 C5' DT A 12 2.919 9.859 12.914 1.00 0.20 C ATOM 358 C4' DT A 12 1.597 9.610 12.192 1.00 0.15 C ATOM 359 O4' DT A 12 1.553 10.388 10.988 1.00 0.18 O ATOM 360 C3' DT A 12 1.373 8.144 11.785 1.00 0.13 C ATOM 361 O3' DT A 12 0.056 7.728 12.176 1.00 0.14 O ATOM 362 C2' DT A 12 1.467 8.168 10.267 1.00 0.14 C ATOM 363 C1' DT A 12 0.973 9.571 9.982 1.00 0.15 C ATOM 364 N1 DT A 12 1.337 10.111 8.656 1.00 0.17 N ATOM 365 C2 DT A 12 0.314 10.625 7.881 1.00 0.23 C ATOM 366 O2 DT A 12 -0.851 10.655 8.273 1.00 0.33 O ATOM 367 N3 DT A 12 0.675 11.107 6.637 1.00 0.25 N ATOM 368 C4 DT A 12 1.953 11.116 6.108 1.00 0.24 C ATOM 369 O4 DT A 12 2.163 11.569 4.984 1.00 0.27 O ATOM 370 C5 DT A 12 2.956 10.560 6.987 1.00 0.25 C ATOM 371 C7 DT A 12 4.405 10.495 6.519 1.00 0.36 C ATOM 372 C6 DT A 12 2.627 10.086 8.207 1.00 0.22 C ATOM 0 H5' DT A 12 2.976 10.903 13.221 1.00 0.20 H new ATOM 0 H5'' DT A 12 2.957 9.257 13.822 1.00 0.20 H new ATOM 0 H4' DT A 12 0.820 9.889 12.903 1.00 0.15 H new ATOM 0 H3' DT A 12 2.086 7.462 12.248 1.00 0.13 H new ATOM 0 H2' DT A 12 2.485 8.007 9.912 1.00 0.14 H new ATOM 0 H2'' DT A 12 0.842 7.406 9.801 1.00 0.14 H new ATOM 0 H1' DT A 12 -0.117 9.555 9.983 1.00 0.15 H new ATOM 0 H3 DT A 12 -0.070 11.491 6.055 1.00 0.25 H new ATOM 0 H71 DT A 12 5.069 10.574 7.380 1.00 0.36 H new ATOM 0 H72 DT A 12 4.581 9.547 6.011 1.00 0.36 H new ATOM 0 H73 DT A 12 4.602 11.317 5.831 1.00 0.36 H new ATOM 0 H6 DT A 12 3.400 9.678 8.842 1.00 0.22 H new ATOM 385 P DG A 13 -0.422 6.204 11.948 1.00 0.18 P ATOM 386 OP1 DG A 13 -0.859 5.658 13.253 1.00 0.29 O ATOM 387 OP2 DG A 13 0.625 5.504 11.171 1.00 0.25 O ATOM 388 O5' DG A 13 -1.726 6.360 11.008 1.00 0.20 O ATOM 389 C5' DG A 13 -1.598 6.813 9.656 1.00 0.19 C ATOM 390 C4' DG A 13 -2.886 6.620 8.859 1.00 0.20 C ATOM 391 O4' DG A 13 -2.779 7.327 7.622 1.00 0.24 O ATOM 392 C3' DG A 13 -3.199 5.158 8.535 1.00 0.20 C ATOM 393 O3' DG A 13 -4.538 4.853 8.941 1.00 0.24 O ATOM 394 C2' DG A 13 -3.080 5.053 7.017 1.00 0.19 C ATOM 395 C1' DG A 13 -3.243 6.496 6.560 1.00 0.20 C ATOM 396 N9 DG A 13 -2.449 6.834 5.362 1.00 0.19 N ATOM 397 C8 DG A 13 -1.094 7.001 5.259 1.00 0.22 C ATOM 398 N7 DG A 13 -0.684 7.300 4.061 1.00 0.24 N ATOM 399 C5 DG A 13 -1.850 7.338 3.308 1.00 0.22 C ATOM 400 C6 DG A 13 -2.027 7.613 1.926 1.00 0.24 C ATOM 401 O6 DG A 13 -1.168 7.885 1.088 1.00 0.29 O ATOM 402 N1 DG A 13 -3.366 7.548 1.564 1.00 0.24 N ATOM 403 C2 DG A 13 -4.406 7.253 2.424 1.00 0.24 C ATOM 404 N2 DG A 13 -5.627 7.237 1.891 1.00 0.27 N ATOM 405 N3 DG A 13 -4.239 6.994 3.725 1.00 0.21 N ATOM 406 C4 DG A 13 -2.940 7.053 4.095 1.00 0.20 C ATOM 0 H5' DG A 13 -0.787 6.272 9.169 1.00 0.19 H new ATOM 0 H5'' DG A 13 -1.325 7.868 9.652 1.00 0.19 H new ATOM 0 H4' DG A 13 -3.693 6.998 9.487 1.00 0.20 H new ATOM 0 H3' DG A 13 -2.530 4.467 9.047 1.00 0.20 H new ATOM 0 H2' DG A 13 -2.117 4.640 6.715 1.00 0.19 H new ATOM 0 H2'' DG A 13 -3.850 4.407 6.596 1.00 0.19 H new ATOM 0 H1' DG A 13 -4.293 6.643 6.307 1.00 0.20 H new ATOM 0 H8 DG A 13 -0.424 6.894 6.099 1.00 0.22 H new ATOM 0 H1 DG A 13 -3.600 7.732 0.588 1.00 0.24 H new ATOM 0 H21 DG A 13 -6.436 7.026 2.475 1.00 0.27 H new ATOM 0 H22 DG A 13 -5.753 7.436 0.899 1.00 0.27 H new ATOM 418 P DG A 14 -5.051 3.327 8.967 1.00 0.25 P ATOM 419 OP1 DG A 14 -6.062 3.193 10.038 1.00 0.33 O ATOM 420 OP2 DG A 14 -3.866 2.440 8.958 1.00 0.22 O ATOM 421 O5' DG A 14 -5.797 3.181 7.549 1.00 0.23 O ATOM 422 C5' DG A 14 -7.065 3.805 7.333 1.00 0.25 C ATOM 423 C4' DG A 14 -7.573 3.568 5.913 1.00 0.22 C ATOM 424 O4' DG A 14 -6.617 4.064 4.979 1.00 0.23 O ATOM 425 C3' DG A 14 -7.811 2.092 5.581 1.00 0.19 C ATOM 426 O3' DG A 14 -9.208 1.880 5.351 1.00 0.22 O ATOM 427 C2' DG A 14 -7.027 1.834 4.292 1.00 0.17 C ATOM 428 C1' DG A 14 -6.638 3.230 3.825 1.00 0.19 C ATOM 429 N9 DG A 14 -5.302 3.301 3.204 1.00 0.18 N ATOM 430 C8 DG A 14 -4.072 3.184 3.799 1.00 0.17 C ATOM 431 N7 DG A 14 -3.072 3.303 2.971 1.00 0.21 N ATOM 432 C5 DG A 14 -3.680 3.512 1.738 1.00 0.23 C ATOM 433 C6 DG A 14 -3.096 3.709 0.457 1.00 0.28 C ATOM 434 O6 DG A 14 -1.905 3.740 0.159 1.00 0.33 O ATOM 435 N1 DG A 14 -4.065 3.882 -0.522 1.00 0.29 N ATOM 436 C2 DG A 14 -5.426 3.868 -0.301 1.00 0.26 C ATOM 437 N2 DG A 14 -6.201 4.051 -1.370 1.00 0.29 N ATOM 438 N3 DG A 14 -5.977 3.683 0.903 1.00 0.22 N ATOM 439 C4 DG A 14 -5.046 3.513 1.871 1.00 0.20 C ATOM 0 H5' DG A 14 -6.980 4.876 7.516 1.00 0.25 H new ATOM 0 H5'' DG A 14 -7.789 3.416 8.049 1.00 0.25 H new ATOM 0 H4' DG A 14 -8.529 4.087 5.847 1.00 0.22 H new ATOM 0 H3' DG A 14 -7.495 1.429 6.386 1.00 0.19 H new ATOM 0 H2' DG A 14 -6.150 1.213 4.474 1.00 0.17 H new ATOM 0 H2'' DG A 14 -7.635 1.318 3.549 1.00 0.17 H new ATOM 0 H1' DG A 14 -7.360 3.537 3.069 1.00 0.19 H new ATOM 0 H8 DG A 14 -3.943 3.009 4.857 1.00 0.17 H new ATOM 0 H1 DG A 14 -3.745 4.031 -1.479 1.00 0.29 H new ATOM 0 H21 DG A 14 -7.216 4.051 -1.270 1.00 0.29 H new ATOM 0 H22 DG A 14 -5.779 4.191 -2.288 1.00 0.29 H new ATOM 451 P DG A 15 -9.777 0.396 5.089 1.00 0.26 P ATOM 452 OP1 DG A 15 -11.174 0.341 5.576 1.00 0.33 O ATOM 453 OP2 DG A 15 -8.781 -0.576 5.593 1.00 0.28 O ATOM 454 O5' DG A 15 -9.800 0.308 3.483 1.00 0.30 O ATOM 455 C5' DG A 15 -10.742 1.074 2.727 1.00 0.31 C ATOM 456 C4' DG A 15 -10.582 0.827 1.231 1.00 0.31 C ATOM 457 O4' DG A 15 -9.255 1.178 0.837 1.00 0.30 O ATOM 458 C3' DG A 15 -10.812 -0.631 0.822 1.00 0.32 C ATOM 459 O3' DG A 15 -11.873 -0.708 -0.142 1.00 0.32 O ATOM 460 C2' DG A 15 -9.495 -1.084 0.190 1.00 0.35 C ATOM 461 C1' DG A 15 -8.806 0.234 -0.129 1.00 0.32 C ATOM 462 N9 DG A 15 -7.335 0.180 -0.051 1.00 0.32 N ATOM 463 C8 DG A 15 -6.539 -0.021 1.047 1.00 0.30 C ATOM 464 N7 DG A 15 -5.262 -0.003 0.785 1.00 0.30 N ATOM 465 C5 DG A 15 -5.205 0.226 -0.586 1.00 0.31 C ATOM 466 C6 DG A 15 -4.078 0.347 -1.444 1.00 0.32 C ATOM 467 O6 DG A 15 -2.886 0.275 -1.151 1.00 0.33 O ATOM 468 N1 DG A 15 -4.460 0.575 -2.759 1.00 0.34 N ATOM 469 C2 DG A 15 -5.765 0.674 -3.197 1.00 0.36 C ATOM 470 N2 DG A 15 -5.935 0.894 -4.500 1.00 0.39 N ATOM 471 N3 DG A 15 -6.825 0.562 -2.393 1.00 0.36 N ATOM 472 C4 DG A 15 -6.470 0.339 -1.105 1.00 0.33 C ATOM 0 H5' DG A 15 -10.606 2.134 2.939 1.00 0.31 H new ATOM 0 H5'' DG A 15 -11.755 0.815 3.034 1.00 0.31 H new ATOM 0 H4' DG A 15 -11.339 1.438 0.739 1.00 0.31 H new ATOM 0 H3' DG A 15 -11.094 -1.255 1.670 1.00 0.32 H new ATOM 0 H2' DG A 15 -8.906 -1.693 0.875 1.00 0.35 H new ATOM 0 H2'' DG A 15 -9.661 -1.682 -0.706 1.00 0.35 H new ATOM 0 H1' DG A 15 -9.057 0.496 -1.157 1.00 0.32 H new ATOM 0 H8 DG A 15 -6.934 -0.180 2.039 1.00 0.30 H new ATOM 0 H1 DG A 15 -3.720 0.677 -3.454 1.00 0.34 H new ATOM 0 H21 DG A 15 -6.876 0.977 -4.885 1.00 0.39 H new ATOM 0 H22 DG A 15 -5.124 0.980 -5.113 1.00 0.39 H new ATOM 484 P DA A 16 -11.920 0.264 -1.429 1.00 0.32 P ATOM 485 OP1 DA A 16 -12.963 -0.243 -2.349 1.00 0.34 O ATOM 486 OP2 DA A 16 -10.540 0.458 -1.922 1.00 0.34 O ATOM 487 O5' DA A 16 -12.438 1.657 -0.807 1.00 0.33 O ATOM 488 C5' DA A 16 -13.800 1.804 -0.395 1.00 0.35 C ATOM 489 C4' DA A 16 -14.255 3.260 -0.460 1.00 0.34 C ATOM 490 O4' DA A 16 -15.623 3.352 -0.052 1.00 0.37 O ATOM 491 C3' DA A 16 -13.447 4.205 0.437 1.00 0.35 C ATOM 492 O3' DA A 16 -12.947 5.295 -0.347 1.00 0.32 O ATOM 493 C2' DA A 16 -14.453 4.723 1.463 1.00 0.41 C ATOM 494 C1' DA A 16 -15.774 4.525 0.741 1.00 0.39 C ATOM 495 N9 DA A 16 -16.929 4.320 1.634 1.00 0.45 N ATOM 496 C8 DA A 16 -17.014 3.557 2.769 1.00 0.53 C ATOM 497 N7 DA A 16 -18.189 3.583 3.336 1.00 0.59 N ATOM 498 C5 DA A 16 -18.935 4.424 2.516 1.00 0.56 C ATOM 499 C6 DA A 16 -20.268 4.865 2.569 1.00 0.64 C ATOM 500 N6 DA A 16 -21.120 4.500 3.528 1.00 0.71 N ATOM 501 N1 DA A 16 -20.683 5.694 1.596 1.00 0.71 N ATOM 502 C2 DA A 16 -19.829 6.052 0.645 1.00 0.71 C ATOM 503 N3 DA A 16 -18.561 5.708 0.486 1.00 0.61 N ATOM 504 C4 DA A 16 -18.175 4.877 1.477 1.00 0.52 C ATOM 0 H5' DA A 16 -13.915 1.432 0.623 1.00 0.35 H new ATOM 0 H5'' DA A 16 -14.441 1.194 -1.031 1.00 0.35 H new ATOM 0 H4' DA A 16 -14.106 3.569 -1.495 1.00 0.34 H new ATOM 0 H3' DA A 16 -12.595 3.713 0.906 1.00 0.35 H new ATOM 0 H2' DA A 16 -14.410 4.161 2.396 1.00 0.41 H new ATOM 0 H2'' DA A 16 -14.278 5.769 1.713 1.00 0.41 H new ATOM 0 H1' DA A 16 -15.983 5.430 0.171 1.00 0.39 H new ATOM 0 H8 DA A 16 -16.184 2.986 3.159 1.00 0.53 H new ATOM 0 H61 DA A 16 -22.078 4.850 3.519 1.00 0.71 H new ATOM 0 H62 DA A 16 -20.813 3.871 4.270 1.00 0.71 H new ATOM 0 H2 DA A 16 -20.225 6.719 -0.106 1.00 0.71 H new ATOM 516 P DG A 17 -13.892 6.544 -0.727 1.00 0.29 P ATOM 517 OP1 DG A 17 -13.867 7.502 0.400 1.00 0.39 O ATOM 518 OP2 DG A 17 -15.184 6.017 -1.219 1.00 0.30 O ATOM 519 O5' DG A 17 -13.113 7.207 -1.970 1.00 0.22 O ATOM 520 C5' DG A 17 -11.839 7.827 -1.779 1.00 0.19 C ATOM 521 C4' DG A 17 -11.040 7.872 -3.077 1.00 0.12 C ATOM 522 O4' DG A 17 -9.741 8.410 -2.814 1.00 0.14 O ATOM 523 C3' DG A 17 -10.851 6.500 -3.727 1.00 0.19 C ATOM 524 O3' DG A 17 -11.229 6.567 -5.106 1.00 0.28 O ATOM 525 C2' DG A 17 -9.357 6.214 -3.611 1.00 0.21 C ATOM 526 C1' DG A 17 -8.768 7.610 -3.482 1.00 0.16 C ATOM 527 N9 DG A 17 -7.529 7.665 -2.684 1.00 0.16 N ATOM 528 C8 DG A 17 -7.376 7.488 -1.334 1.00 0.17 C ATOM 529 N7 DG A 17 -6.146 7.594 -0.921 1.00 0.19 N ATOM 530 C5 DG A 17 -5.425 7.860 -2.080 1.00 0.18 C ATOM 531 C6 DG A 17 -4.031 8.073 -2.254 1.00 0.20 C ATOM 532 O6 DG A 17 -3.147 8.065 -1.399 1.00 0.23 O ATOM 533 N1 DG A 17 -3.716 8.309 -3.585 1.00 0.20 N ATOM 534 C2 DG A 17 -4.626 8.338 -4.622 1.00 0.19 C ATOM 535 N2 DG A 17 -4.133 8.582 -5.836 1.00 0.21 N ATOM 536 N3 DG A 17 -5.938 8.138 -4.459 1.00 0.18 N ATOM 537 C4 DG A 17 -6.264 7.906 -3.167 1.00 0.17 C ATOM 0 H5' DG A 17 -11.276 7.280 -1.023 1.00 0.19 H new ATOM 0 H5'' DG A 17 -11.979 8.840 -1.401 1.00 0.19 H new ATOM 0 H4' DG A 17 -11.613 8.493 -3.766 1.00 0.12 H new ATOM 0 H3' DG A 17 -11.456 5.727 -3.254 1.00 0.19 H new ATOM 0 H2' DG A 17 -9.128 5.594 -2.744 1.00 0.21 H new ATOM 0 H2'' DG A 17 -8.974 5.691 -4.487 1.00 0.21 H new ATOM 0 H1' DG A 17 -8.519 7.957 -4.485 1.00 0.16 H new ATOM 0 H8 DG A 17 -8.203 7.279 -0.671 1.00 0.17 H new ATOM 0 H1 DG A 17 -2.736 8.474 -3.814 1.00 0.20 H new ATOM 0 H21 DG A 17 -4.757 8.616 -6.642 1.00 0.21 H new ATOM 0 H22 DG A 17 -3.132 8.735 -5.959 1.00 0.21 H new ATOM 549 P DG A 18 -11.493 5.217 -5.943 1.00 0.42 P ATOM 550 OP1 DG A 18 -12.558 5.485 -6.935 1.00 0.57 O ATOM 551 OP2 DG A 18 -11.646 4.100 -4.982 1.00 0.55 O ATOM 552 O5' DG A 18 -10.107 5.012 -6.734 1.00 0.40 O ATOM 553 C5' DG A 18 -9.845 5.738 -7.938 1.00 0.35 C ATOM 554 C4' DG A 18 -8.531 5.305 -8.578 1.00 0.26 C ATOM 555 O4' DG A 18 -7.451 5.564 -7.675 1.00 0.28 O ATOM 556 C3' DG A 18 -8.477 3.814 -8.934 1.00 0.24 C ATOM 557 O3' DG A 18 -7.997 3.659 -10.274 1.00 0.30 O ATOM 558 C2' DG A 18 -7.468 3.228 -7.954 1.00 0.22 C ATOM 559 C1' DG A 18 -6.589 4.431 -7.671 1.00 0.23 C ATOM 560 N9 DG A 18 -5.903 4.387 -6.366 1.00 0.26 N ATOM 561 C8 DG A 18 -6.439 4.214 -5.117 1.00 0.28 C ATOM 562 N7 DG A 18 -5.557 4.218 -4.157 1.00 0.33 N ATOM 563 C5 DG A 18 -4.347 4.410 -4.816 1.00 0.34 C ATOM 564 C6 DG A 18 -3.028 4.502 -4.292 1.00 0.40 C ATOM 565 O6 DG A 18 -2.666 4.429 -3.120 1.00 0.46 O ATOM 566 N1 DG A 18 -2.092 4.697 -5.300 1.00 0.43 N ATOM 567 C2 DG A 18 -2.388 4.790 -6.646 1.00 0.40 C ATOM 568 N2 DG A 18 -1.358 4.980 -7.468 1.00 0.44 N ATOM 569 N3 DG A 18 -3.626 4.704 -7.138 1.00 0.33 N ATOM 570 C4 DG A 18 -4.550 4.514 -6.170 1.00 0.30 C ATOM 0 H5' DG A 18 -9.810 6.805 -7.720 1.00 0.35 H new ATOM 0 H5'' DG A 18 -10.662 5.583 -8.642 1.00 0.35 H new ATOM 0 H4' DG A 18 -8.449 5.877 -9.502 1.00 0.26 H new ATOM 0 H3' DG A 18 -9.451 3.329 -8.873 1.00 0.24 H new ATOM 0 H2' DG A 18 -7.946 2.848 -7.051 1.00 0.22 H new ATOM 0 H2'' DG A 18 -6.905 2.402 -8.389 1.00 0.22 H new ATOM 0 H1' DG A 18 -5.805 4.461 -8.428 1.00 0.23 H new ATOM 0 H8 DG A 18 -7.497 4.086 -4.943 1.00 0.28 H new ATOM 0 H1 DG A 18 -1.113 4.778 -5.026 1.00 0.43 H new ATOM 0 H21 DG A 18 -1.515 5.056 -8.473 1.00 0.44 H new ATOM 0 H22 DG A 18 -0.412 5.049 -7.093 1.00 0.44 H new ATOM 582 P DG A 19 -7.686 2.194 -10.867 1.00 0.32 P ATOM 583 OP1 DG A 19 -8.017 2.198 -12.310 1.00 0.47 O ATOM 584 OP2 DG A 19 -8.305 1.193 -9.970 1.00 0.34 O ATOM 585 O5' DG A 19 -6.086 2.083 -10.718 1.00 0.28 O ATOM 586 C5' DG A 19 -5.226 2.888 -11.530 1.00 0.28 C ATOM 587 C4' DG A 19 -3.761 2.496 -11.360 1.00 0.27 C ATOM 588 O4' DG A 19 -3.383 2.625 -9.987 1.00 0.26 O ATOM 589 C3' DG A 19 -3.446 1.056 -11.784 1.00 0.30 C ATOM 590 O3' DG A 19 -2.349 1.059 -12.706 1.00 0.35 O ATOM 591 C2' DG A 19 -3.036 0.353 -10.494 1.00 0.31 C ATOM 592 C1' DG A 19 -2.557 1.516 -9.646 1.00 0.28 C ATOM 593 N9 DG A 19 -2.675 1.295 -8.192 1.00 0.31 N ATOM 594 C8 DG A 19 -3.809 1.160 -7.435 1.00 0.35 C ATOM 595 N7 DG A 19 -3.579 0.980 -6.166 1.00 0.39 N ATOM 596 C5 DG A 19 -2.191 0.996 -6.071 1.00 0.37 C ATOM 597 C6 DG A 19 -1.355 0.848 -4.932 1.00 0.40 C ATOM 598 O6 DG A 19 -1.685 0.671 -3.761 1.00 0.44 O ATOM 599 N1 DG A 19 -0.011 0.926 -5.273 1.00 0.37 N ATOM 600 C2 DG A 19 0.471 1.122 -6.550 1.00 0.33 C ATOM 601 N2 DG A 19 1.796 1.168 -6.681 1.00 0.33 N ATOM 602 N3 DG A 19 -0.314 1.262 -7.623 1.00 0.31 N ATOM 603 C4 DG A 19 -1.629 1.188 -7.309 1.00 0.32 C ATOM 0 H5' DG A 19 -5.355 3.938 -11.267 1.00 0.28 H new ATOM 0 H5'' DG A 19 -5.512 2.784 -12.577 1.00 0.28 H new ATOM 0 H4' DG A 19 -3.203 3.169 -12.011 1.00 0.27 H new ATOM 0 H3' DG A 19 -4.290 0.567 -12.271 1.00 0.30 H new ATOM 0 H2' DG A 19 -3.871 -0.173 -10.032 1.00 0.31 H new ATOM 0 H2'' DG A 19 -2.249 -0.382 -10.661 1.00 0.31 H new ATOM 0 H1' DG A 19 -1.497 1.666 -9.849 1.00 0.28 H new ATOM 0 H8 DG A 19 -4.804 1.199 -7.853 1.00 0.35 H new ATOM 0 H1 DG A 19 0.672 0.831 -4.521 1.00 0.37 H new ATOM 0 H21 DG A 19 2.213 1.311 -7.601 1.00 0.33 H new ATOM 0 H22 DG A 19 2.394 1.061 -5.861 1.00 0.33 H new ATOM 615 P DC A 20 -0.977 1.827 -12.354 1.00 0.36 P ATOM 616 OP1 DC A 20 -1.310 3.051 -11.593 1.00 0.34 O ATOM 617 OP2 DC A 20 -0.173 1.927 -13.592 1.00 0.43 O ATOM 618 O5' DC A 20 -0.236 0.801 -11.356 1.00 0.34 O ATOM 619 C5' DC A 20 0.653 -0.194 -11.871 1.00 0.42 C ATOM 620 C4' DC A 20 1.699 -0.606 -10.834 1.00 0.46 C ATOM 621 O4' DC A 20 1.064 -0.983 -9.608 1.00 0.37 O ATOM 622 C3' DC A 20 2.568 -1.788 -11.276 1.00 0.55 C ATOM 623 O3' DC A 20 3.943 -1.405 -11.391 1.00 0.75 O ATOM 624 C2' DC A 20 2.378 -2.844 -10.184 1.00 0.47 C ATOM 625 C1' DC A 20 1.837 -2.028 -9.024 1.00 0.43 C ATOM 626 N1 DC A 20 0.967 -2.790 -8.109 1.00 0.35 N ATOM 627 C2 DC A 20 1.562 -3.781 -7.344 1.00 0.44 C ATOM 628 O2 DC A 20 2.768 -3.994 -7.443 1.00 0.56 O ATOM 629 N3 DC A 20 0.777 -4.498 -6.493 1.00 0.44 N ATOM 630 C4 DC A 20 -0.536 -4.253 -6.397 1.00 0.39 C ATOM 631 N4 DC A 20 -1.276 -4.973 -5.555 1.00 0.47 N ATOM 632 C5 DC A 20 -1.153 -3.230 -7.186 1.00 0.34 C ATOM 633 C6 DC A 20 -0.366 -2.528 -8.023 1.00 0.29 C ATOM 0 H5' DC A 20 1.153 0.189 -12.760 1.00 0.42 H new ATOM 0 H5'' DC A 20 0.081 -1.069 -12.179 1.00 0.42 H new ATOM 0 H4' DC A 20 2.339 0.268 -10.709 1.00 0.46 H new ATOM 0 H3' DC A 20 2.281 -2.161 -12.259 1.00 0.55 H new ATOM 0 H2' DC A 20 1.681 -3.624 -10.491 1.00 0.47 H new ATOM 0 H2'' DC A 20 3.316 -3.337 -9.930 1.00 0.47 H new ATOM 0 HO3' DC A 20 4.475 -2.178 -11.673 1.00 0.75 H new ATOM 0 H1' DC A 20 2.678 -1.680 -8.424 1.00 0.43 H new ATOM 0 H41 DC A 20 -2.277 -4.794 -5.475 1.00 0.47 H new ATOM 0 H42 DC A 20 -0.842 -5.703 -4.991 1.00 0.47 H new ATOM 0 H5 DC A 20 -2.212 -3.029 -7.112 1.00 0.34 H new ATOM 0 H6 DC A 20 -0.797 -1.748 -8.633 1.00 0.29 H new TER 646 DC A 20