USER MOD reduce.3.24.130724 H: found=0, std=0, add=249, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 274 hydrogens (25 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 4 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT O5' : rot 17:sc= 0.567 USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 25 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 4 5.739 -10.395 -11.662 1.00 0.75 O ATOM 2 C5' DT A 4 6.077 -11.335 -10.636 1.00 0.65 C ATOM 3 C4' DT A 4 7.572 -11.408 -10.416 1.00 0.59 C ATOM 4 O4' DT A 4 7.830 -11.963 -9.101 1.00 0.66 O ATOM 5 C3' DT A 4 8.327 -12.302 -11.407 1.00 0.69 C ATOM 6 O3' DT A 4 9.590 -11.717 -11.746 1.00 0.69 O ATOM 7 C2' DT A 4 8.526 -13.595 -10.639 1.00 0.83 C ATOM 8 C1' DT A 4 8.660 -13.108 -9.208 1.00 0.77 C ATOM 9 N1 DT A 4 8.229 -14.083 -8.186 1.00 0.88 N ATOM 10 C2 DT A 4 6.888 -14.388 -8.101 1.00 1.03 C ATOM 11 O2 DT A 4 6.043 -13.893 -8.830 1.00 1.11 O ATOM 12 N3 DT A 4 6.570 -15.300 -7.128 1.00 1.16 N ATOM 13 C4 DT A 4 7.437 -15.922 -6.253 1.00 1.16 C ATOM 14 O4 DT A 4 7.003 -16.723 -5.428 1.00 1.30 O ATOM 15 C5 DT A 4 8.828 -15.555 -6.397 1.00 1.05 C ATOM 16 C7 DT A 4 9.841 -16.180 -5.488 1.00 1.17 C ATOM 17 C6 DT A 4 9.155 -14.665 -7.345 1.00 0.93 C ATOM 0 H5' DT A 4 5.700 -12.321 -10.907 1.00 0.65 H new ATOM 0 H5'' DT A 4 5.585 -11.051 -9.706 1.00 0.65 H new ATOM 0 H4' DT A 4 7.926 -10.385 -10.544 1.00 0.59 H new ATOM 0 H3' DT A 4 7.793 -12.445 -12.347 1.00 0.69 H new ATOM 0 H2' DT A 4 7.681 -14.273 -10.760 1.00 0.83 H new ATOM 0 H2'' DT A 4 9.415 -14.131 -10.970 1.00 0.83 H new ATOM 0 HO5' DT A 4 6.536 -10.191 -12.194 1.00 0.75 H new ATOM 0 H1' DT A 4 9.716 -12.918 -9.016 1.00 0.77 H new ATOM 0 H3 DT A 4 5.584 -15.546 -7.041 1.00 1.16 H new ATOM 0 H71 DT A 4 10.799 -16.251 -6.004 1.00 1.17 H new ATOM 0 H72 DT A 4 9.955 -15.567 -4.594 1.00 1.17 H new ATOM 0 H73 DT A 4 9.508 -17.178 -5.203 1.00 1.17 H new ATOM 0 H6 DT A 4 10.194 -14.390 -7.456 1.00 0.93 H new ATOM 31 P DG A 5 9.671 -10.612 -12.911 1.00 0.64 P ATOM 32 OP1 DG A 5 8.331 -9.981 -13.015 1.00 0.67 O ATOM 33 OP2 DG A 5 10.280 -11.242 -14.110 1.00 0.99 O ATOM 34 O5' DG A 5 10.690 -9.526 -12.343 1.00 0.58 O ATOM 35 C5' DG A 5 10.599 -8.156 -12.734 1.00 0.49 C ATOM 36 C4' DG A 5 11.948 -7.486 -12.605 1.00 0.50 C ATOM 37 O4' DG A 5 12.509 -7.797 -11.303 1.00 0.58 O ATOM 38 C3' DG A 5 12.992 -7.940 -13.628 1.00 0.45 C ATOM 39 O3' DG A 5 13.847 -6.849 -13.987 1.00 0.49 O ATOM 40 C2' DG A 5 13.770 -9.005 -12.880 1.00 0.49 C ATOM 41 C1' DG A 5 13.740 -8.488 -11.452 1.00 0.55 C ATOM 42 N9 DG A 5 13.799 -9.532 -10.431 1.00 0.62 N ATOM 43 C8 DG A 5 12.739 -10.156 -9.822 1.00 0.80 C ATOM 44 N7 DG A 5 13.101 -11.052 -8.945 1.00 0.85 N ATOM 45 C5 DG A 5 14.490 -11.017 -8.977 1.00 0.68 C ATOM 46 C6 DG A 5 15.443 -11.768 -8.241 1.00 0.69 C ATOM 47 O6 DG A 5 15.242 -12.640 -7.388 1.00 0.82 O ATOM 48 N1 DG A 5 16.750 -11.421 -8.579 1.00 0.60 N ATOM 49 C2 DG A 5 17.085 -10.466 -9.511 1.00 0.57 C ATOM 50 N2 DG A 5 18.397 -10.267 -9.705 1.00 0.68 N ATOM 51 N3 DG A 5 16.205 -9.761 -10.203 1.00 0.53 N ATOM 52 C4 DG A 5 14.936 -10.085 -9.888 1.00 0.57 C ATOM 0 H5' DG A 5 9.868 -7.640 -12.112 1.00 0.49 H new ATOM 0 H5'' DG A 5 10.247 -8.087 -13.763 1.00 0.49 H new ATOM 0 H4' DG A 5 11.752 -6.426 -12.764 1.00 0.50 H new ATOM 0 H3' DG A 5 12.555 -8.304 -14.558 1.00 0.45 H new ATOM 0 H2' DG A 5 13.303 -9.986 -12.967 1.00 0.49 H new ATOM 0 H2'' DG A 5 14.789 -9.103 -13.255 1.00 0.49 H new ATOM 0 H1' DG A 5 14.623 -7.867 -11.303 1.00 0.55 H new ATOM 0 H8 DG A 5 11.707 -9.928 -10.046 1.00 0.80 H new ATOM 0 H1 DG A 5 17.509 -11.908 -8.103 1.00 0.60 H new ATOM 0 H21 DG A 5 18.713 -9.573 -10.382 1.00 0.68 H new ATOM 0 H22 DG A 5 19.079 -10.810 -9.175 1.00 0.68 H new ATOM 64 P DA A 6 13.528 -5.976 -15.299 1.00 0.38 P ATOM 65 OP1 DA A 6 13.078 -6.913 -16.360 1.00 0.42 O ATOM 66 OP2 DA A 6 14.684 -5.080 -15.555 1.00 0.44 O ATOM 67 O5' DA A 6 12.283 -5.077 -14.872 1.00 0.44 O ATOM 68 C5' DA A 6 12.446 -3.967 -13.990 1.00 0.35 C ATOM 69 C4' DA A 6 11.123 -3.267 -13.784 1.00 0.30 C ATOM 70 O4' DA A 6 10.159 -4.208 -13.268 1.00 0.35 O ATOM 71 C3' DA A 6 11.145 -2.136 -12.765 1.00 0.31 C ATOM 72 O3' DA A 6 11.507 -0.902 -13.397 1.00 0.33 O ATOM 73 C2' DA A 6 9.707 -2.092 -12.277 1.00 0.32 C ATOM 74 C1' DA A 6 9.233 -3.538 -12.420 1.00 0.32 C ATOM 75 N9 DA A 6 9.165 -4.277 -11.157 1.00 0.28 N ATOM 76 C8 DA A 6 10.184 -4.522 -10.270 1.00 0.33 C ATOM 77 N7 DA A 6 9.815 -5.211 -9.218 1.00 0.33 N ATOM 78 C5 DA A 6 8.461 -5.435 -9.424 1.00 0.27 C ATOM 79 C6 DA A 6 7.487 -6.109 -8.666 1.00 0.31 C ATOM 80 N6 DA A 6 7.739 -6.704 -7.498 1.00 0.34 N ATOM 81 N1 DA A 6 6.228 -6.150 -9.155 1.00 0.40 N ATOM 82 C2 DA A 6 5.975 -5.551 -10.325 1.00 0.45 C ATOM 83 N3 DA A 6 6.804 -4.887 -11.128 1.00 0.39 N ATOM 84 C4 DA A 6 8.047 -4.865 -10.615 1.00 0.29 C ATOM 0 H5' DA A 6 13.175 -3.269 -14.402 1.00 0.35 H new ATOM 0 H5'' DA A 6 12.838 -4.309 -13.032 1.00 0.35 H new ATOM 0 H4' DA A 6 10.879 -2.857 -14.764 1.00 0.30 H new ATOM 0 H3' DA A 6 11.866 -2.286 -11.962 1.00 0.31 H new ATOM 0 H2' DA A 6 9.645 -1.750 -11.244 1.00 0.32 H new ATOM 0 H2'' DA A 6 9.102 -1.411 -12.875 1.00 0.32 H new ATOM 0 H1' DA A 6 8.219 -3.506 -12.819 1.00 0.32 H new ATOM 0 H8 DA A 6 11.196 -4.179 -10.425 1.00 0.33 H new ATOM 0 H61 DA A 6 6.989 -7.178 -6.995 1.00 0.34 H new ATOM 0 H62 DA A 6 8.682 -6.685 -7.109 1.00 0.34 H new ATOM 0 H2 DA A 6 4.952 -5.615 -10.666 1.00 0.45 H new ATOM 96 P DG A 7 11.362 0.483 -12.593 1.00 0.34 P ATOM 97 OP1 DG A 7 12.297 1.456 -13.214 1.00 0.52 O ATOM 98 OP2 DG A 7 11.464 0.194 -11.139 1.00 0.46 O ATOM 99 O5' DG A 7 9.873 0.956 -12.909 1.00 0.44 O ATOM 100 C5' DG A 7 9.184 1.853 -12.038 1.00 0.41 C ATOM 101 C4' DG A 7 7.691 1.656 -12.167 1.00 0.32 C ATOM 102 O4' DG A 7 7.345 0.333 -11.684 1.00 0.33 O ATOM 103 C3' DG A 7 6.840 2.632 -11.354 1.00 0.30 C ATOM 104 O3' DG A 7 5.621 2.926 -12.046 1.00 0.34 O ATOM 105 C2' DG A 7 6.559 1.865 -10.075 1.00 0.31 C ATOM 106 C1' DG A 7 6.474 0.430 -10.565 1.00 0.26 C ATOM 107 N9 DG A 7 6.893 -0.568 -9.582 1.00 0.23 N ATOM 108 C8 DG A 7 8.156 -0.754 -9.076 1.00 0.27 C ATOM 109 N7 DG A 7 8.227 -1.724 -8.207 1.00 0.29 N ATOM 110 C5 DG A 7 6.928 -2.210 -8.133 1.00 0.25 C ATOM 111 C6 DG A 7 6.388 -3.266 -7.355 1.00 0.30 C ATOM 112 O6 DG A 7 6.972 -3.999 -6.550 1.00 0.39 O ATOM 113 N1 DG A 7 5.023 -3.433 -7.581 1.00 0.29 N ATOM 114 C2 DG A 7 4.280 -2.670 -8.452 1.00 0.26 C ATOM 115 N2 DG A 7 2.976 -2.973 -8.542 1.00 0.32 N ATOM 116 N3 DG A 7 4.773 -1.682 -9.183 1.00 0.24 N ATOM 117 C4 DG A 7 6.093 -1.509 -8.975 1.00 0.22 C ATOM 0 H5' DG A 7 9.445 2.883 -12.282 1.00 0.41 H new ATOM 0 H5'' DG A 7 9.494 1.681 -11.007 1.00 0.41 H new ATOM 0 H4' DG A 7 7.477 1.816 -13.224 1.00 0.32 H new ATOM 0 H3' DG A 7 7.330 3.590 -11.178 1.00 0.30 H new ATOM 0 H2' DG A 7 7.353 1.997 -9.340 1.00 0.31 H new ATOM 0 H2'' DG A 7 5.631 2.188 -9.603 1.00 0.31 H new ATOM 0 H1' DG A 7 5.429 0.218 -10.792 1.00 0.26 H new ATOM 0 H8 DG A 7 9.006 -0.156 -9.369 1.00 0.27 H new ATOM 0 H1 DG A 7 4.542 -4.171 -7.066 1.00 0.29 H new ATOM 0 H21 DG A 7 2.372 -2.444 -9.170 1.00 0.32 H new ATOM 0 H22 DG A 7 2.589 -3.733 -7.982 1.00 0.32 H new ATOM 129 P DG A 8 4.707 4.162 -11.573 1.00 0.38 P ATOM 130 OP1 DG A 8 4.129 4.780 -12.794 1.00 0.65 O ATOM 131 OP2 DG A 8 5.496 4.997 -10.632 1.00 0.65 O ATOM 132 O5' DG A 8 3.522 3.474 -10.759 1.00 0.39 O ATOM 133 C5' DG A 8 2.482 4.258 -10.174 1.00 0.48 C ATOM 134 C4' DG A 8 1.403 3.359 -9.615 1.00 0.48 C ATOM 135 O4' DG A 8 2.009 2.127 -9.144 1.00 0.39 O ATOM 136 C3' DG A 8 0.635 3.941 -8.422 1.00 0.59 C ATOM 137 O3' DG A 8 -0.767 3.679 -8.559 1.00 0.66 O ATOM 138 C2' DG A 8 1.204 3.197 -7.225 1.00 0.56 C ATOM 139 C1' DG A 8 1.578 1.856 -7.822 1.00 0.45 C ATOM 140 N9 DG A 8 2.660 1.164 -7.124 1.00 0.41 N ATOM 141 C8 DG A 8 4.003 1.442 -7.194 1.00 0.46 C ATOM 142 N7 DG A 8 4.732 0.658 -6.449 1.00 0.48 N ATOM 143 C5 DG A 8 3.814 -0.193 -5.849 1.00 0.40 C ATOM 144 C6 DG A 8 4.014 -1.257 -4.934 1.00 0.39 C ATOM 145 O6 DG A 8 5.079 -1.665 -4.456 1.00 0.46 O ATOM 146 N1 DG A 8 2.814 -1.865 -4.572 1.00 0.34 N ATOM 147 C2 DG A 8 1.577 -1.484 -5.041 1.00 0.36 C ATOM 148 N2 DG A 8 0.529 -2.187 -4.586 1.00 0.41 N ATOM 149 N3 DG A 8 1.379 -0.492 -5.895 1.00 0.38 N ATOM 150 C4 DG A 8 2.532 0.105 -6.254 1.00 0.37 C ATOM 0 H5' DG A 8 2.057 4.927 -10.922 1.00 0.48 H new ATOM 0 H5'' DG A 8 2.891 4.884 -9.381 1.00 0.48 H new ATOM 0 H4' DG A 8 0.698 3.219 -10.434 1.00 0.48 H new ATOM 0 H3' DG A 8 0.741 5.022 -8.334 1.00 0.59 H new ATOM 0 H2' DG A 8 2.069 3.709 -6.802 1.00 0.56 H new ATOM 0 H2'' DG A 8 0.471 3.095 -6.424 1.00 0.56 H new ATOM 0 H1' DG A 8 0.710 1.200 -7.755 1.00 0.45 H new ATOM 0 H8 DG A 8 4.415 2.231 -7.805 1.00 0.46 H new ATOM 0 H1 DG A 8 2.855 -2.645 -3.916 1.00 0.34 H new ATOM 0 H21 DG A 8 -0.415 -1.954 -4.896 1.00 0.41 H new ATOM 0 H22 DG A 8 0.676 -2.954 -3.930 1.00 0.41 H new ATOM 162 P DG A 9 -1.816 4.389 -7.568 1.00 0.84 P ATOM 163 OP1 DG A 9 -3.076 4.592 -8.327 1.00 1.14 O ATOM 164 OP2 DG A 9 -1.148 5.554 -6.933 1.00 1.17 O ATOM 165 O5' DG A 9 -2.086 3.293 -6.444 1.00 0.50 O ATOM 166 C5' DG A 9 -2.661 2.029 -6.775 1.00 0.38 C ATOM 167 C4' DG A 9 -3.170 1.342 -5.529 1.00 0.35 C ATOM 168 O4' DG A 9 -2.071 0.638 -4.894 1.00 0.43 O ATOM 169 C3' DG A 9 -3.746 2.282 -4.462 1.00 0.47 C ATOM 170 O3' DG A 9 -4.933 1.718 -3.892 1.00 0.71 O ATOM 171 C2' DG A 9 -2.642 2.364 -3.421 1.00 0.55 C ATOM 172 C1' DG A 9 -2.000 0.995 -3.525 1.00 0.49 C ATOM 173 N9 DG A 9 -0.597 0.948 -3.115 1.00 0.43 N ATOM 174 C8 DG A 9 0.434 1.723 -3.588 1.00 0.42 C ATOM 175 N7 DG A 9 1.582 1.452 -3.029 1.00 0.39 N ATOM 176 C5 DG A 9 1.291 0.433 -2.132 1.00 0.37 C ATOM 177 C6 DG A 9 2.138 -0.270 -1.238 1.00 0.36 C ATOM 178 O6 DG A 9 3.352 -0.124 -1.061 1.00 0.39 O ATOM 179 N1 DG A 9 1.441 -1.229 -0.505 1.00 0.36 N ATOM 180 C2 DG A 9 0.092 -1.470 -0.627 1.00 0.37 C ATOM 181 N2 DG A 9 -0.413 -2.432 0.161 1.00 0.39 N ATOM 182 N3 DG A 9 -0.708 -0.819 -1.456 1.00 0.40 N ATOM 183 C4 DG A 9 -0.047 0.111 -2.172 1.00 0.39 C ATOM 0 H5' DG A 9 -1.918 1.401 -7.267 1.00 0.38 H new ATOM 0 H5'' DG A 9 -3.479 2.168 -7.482 1.00 0.38 H new ATOM 0 H4' DG A 9 -3.973 0.691 -5.874 1.00 0.35 H new ATOM 0 H3' DG A 9 -4.026 3.258 -4.859 1.00 0.47 H new ATOM 0 H2' DG A 9 -1.934 3.163 -3.641 1.00 0.55 H new ATOM 0 H2'' DG A 9 -3.037 2.553 -2.423 1.00 0.55 H new ATOM 0 H1' DG A 9 -2.529 0.320 -2.852 1.00 0.49 H new ATOM 0 H8 DG A 9 0.307 2.481 -4.347 1.00 0.42 H new ATOM 0 H1 DG A 9 1.966 -1.789 0.166 1.00 0.36 H new ATOM 0 H21 DG A 9 -1.407 -2.658 0.117 1.00 0.39 H new ATOM 0 H22 DG A 9 0.197 -2.937 0.804 1.00 0.39 H new ATOM 195 P DT A 10 -6.364 2.398 -4.172 1.00 0.46 P ATOM 196 OP1 DT A 10 -6.168 3.444 -5.209 1.00 0.48 O ATOM 197 OP2 DT A 10 -6.969 2.764 -2.866 1.00 0.56 O ATOM 198 O5' DT A 10 -7.229 1.223 -4.812 1.00 0.59 O ATOM 199 C5' DT A 10 -6.894 0.672 -6.086 1.00 0.51 C ATOM 200 C4' DT A 10 -6.464 -0.770 -5.934 1.00 0.55 C ATOM 201 O4' DT A 10 -7.641 -1.617 -5.915 1.00 0.96 O ATOM 202 C3' DT A 10 -5.591 -1.303 -7.070 1.00 0.90 C ATOM 203 O3' DT A 10 -4.674 -2.286 -6.574 1.00 0.91 O ATOM 204 C2' DT A 10 -6.600 -1.937 -8.007 1.00 1.26 C ATOM 205 C1' DT A 10 -7.646 -2.479 -7.045 1.00 1.20 C ATOM 206 N1 DT A 10 -9.017 -2.509 -7.591 1.00 1.74 N ATOM 207 C2 DT A 10 -9.420 -3.634 -8.276 1.00 2.12 C ATOM 208 O2 DT A 10 -8.698 -4.602 -8.453 1.00 2.05 O ATOM 209 N3 DT A 10 -10.705 -3.584 -8.752 1.00 2.65 N ATOM 210 C4 DT A 10 -11.606 -2.548 -8.613 1.00 2.85 C ATOM 211 O4 DT A 10 -12.731 -2.647 -9.096 1.00 3.37 O ATOM 212 C5 DT A 10 -11.118 -1.399 -7.883 1.00 2.44 C ATOM 213 C7 DT A 10 -12.029 -0.227 -7.685 1.00 2.69 C ATOM 214 C6 DT A 10 -9.863 -1.433 -7.412 1.00 1.91 C ATOM 0 H5' DT A 10 -6.092 1.252 -6.542 1.00 0.51 H new ATOM 0 H5'' DT A 10 -7.752 0.735 -6.755 1.00 0.51 H new ATOM 0 H4' DT A 10 -5.882 -0.793 -5.013 1.00 0.55 H new ATOM 0 H3' DT A 10 -4.984 -0.535 -7.549 1.00 0.90 H new ATOM 0 H2' DT A 10 -7.024 -1.210 -8.700 1.00 1.26 H new ATOM 0 H2'' DT A 10 -6.154 -2.728 -8.609 1.00 1.26 H new ATOM 0 H1' DT A 10 -7.385 -3.513 -6.818 1.00 1.20 H new ATOM 0 H3 DT A 10 -11.031 -4.403 -9.265 1.00 2.65 H new ATOM 0 H71 DT A 10 -11.779 0.275 -6.750 1.00 2.69 H new ATOM 0 H72 DT A 10 -11.910 0.470 -8.514 1.00 2.69 H new ATOM 0 H73 DT A 10 -13.062 -0.572 -7.646 1.00 2.69 H new ATOM 0 H6 DT A 10 -9.496 -0.577 -6.866 1.00 1.91 H new ATOM 227 P DG A 11 -3.177 -2.355 -7.160 1.00 0.87 P ATOM 228 OP1 DG A 11 -2.264 -1.834 -6.111 1.00 1.12 O ATOM 229 OP2 DG A 11 -3.173 -1.735 -8.510 1.00 0.96 O ATOM 230 O5' DG A 11 -2.897 -3.915 -7.325 1.00 0.73 O ATOM 231 C5' DG A 11 -3.783 -4.748 -8.073 1.00 0.50 C ATOM 232 C4' DG A 11 -3.741 -6.162 -7.542 1.00 0.33 C ATOM 233 O4' DG A 11 -2.407 -6.698 -7.722 1.00 0.38 O ATOM 234 C3' DG A 11 -4.042 -6.298 -6.050 1.00 0.31 C ATOM 235 O3' DG A 11 -4.688 -7.548 -5.785 1.00 0.43 O ATOM 236 C2' DG A 11 -2.665 -6.259 -5.415 1.00 0.32 C ATOM 237 C1' DG A 11 -1.795 -6.940 -6.460 1.00 0.34 C ATOM 238 N9 DG A 11 -0.424 -6.437 -6.524 1.00 0.35 N ATOM 239 C8 DG A 11 0.030 -5.361 -7.247 1.00 0.36 C ATOM 240 N7 DG A 11 1.310 -5.151 -7.111 1.00 0.38 N ATOM 241 C5 DG A 11 1.729 -6.151 -6.244 1.00 0.37 C ATOM 242 C6 DG A 11 3.019 -6.433 -5.728 1.00 0.40 C ATOM 243 O6 DG A 11 4.077 -5.833 -5.944 1.00 0.43 O ATOM 244 N1 DG A 11 3.010 -7.539 -4.879 1.00 0.41 N ATOM 245 C2 DG A 11 1.887 -8.275 -4.574 1.00 0.40 C ATOM 246 N2 DG A 11 2.067 -9.307 -3.735 1.00 0.44 N ATOM 247 N3 DG A 11 0.678 -8.021 -5.050 1.00 0.37 N ATOM 248 C4 DG A 11 0.673 -6.953 -5.873 1.00 0.36 C ATOM 0 H5' DG A 11 -3.501 -4.738 -9.126 1.00 0.50 H new ATOM 0 H5'' DG A 11 -4.799 -4.358 -8.012 1.00 0.50 H new ATOM 0 H4' DG A 11 -4.514 -6.692 -8.098 1.00 0.33 H new ATOM 0 H3' DG A 11 -4.709 -5.524 -5.670 1.00 0.31 H new ATOM 0 H2' DG A 11 -2.338 -5.238 -5.219 1.00 0.32 H new ATOM 0 H2'' DG A 11 -2.643 -6.789 -4.463 1.00 0.32 H new ATOM 0 H1' DG A 11 -1.725 -7.995 -6.193 1.00 0.34 H new ATOM 0 H8 DG A 11 -0.609 -4.750 -7.867 1.00 0.36 H new ATOM 0 H1 DG A 11 3.894 -7.822 -4.456 1.00 0.41 H new ATOM 0 H21 DG A 11 1.275 -9.892 -3.469 1.00 0.44 H new ATOM 0 H22 DG A 11 2.996 -9.506 -3.364 1.00 0.44 H new ATOM 260 P DG A 12 -5.547 -7.738 -4.439 1.00 0.53 P ATOM 261 OP1 DG A 12 -6.447 -8.901 -4.647 1.00 1.12 O ATOM 262 OP2 DG A 12 -6.125 -6.423 -4.061 1.00 0.77 O ATOM 263 O5' DG A 12 -4.462 -8.143 -3.344 1.00 0.50 O ATOM 264 C5' DG A 12 -4.374 -7.447 -2.101 1.00 0.29 C ATOM 265 C4' DG A 12 -3.296 -8.061 -1.239 1.00 0.40 C ATOM 266 O4' DG A 12 -2.002 -7.743 -1.808 1.00 0.46 O ATOM 267 C3' DG A 12 -3.266 -7.559 0.211 1.00 0.50 C ATOM 268 O3' DG A 12 -3.145 -8.664 1.114 1.00 0.66 O ATOM 269 C2' DG A 12 -2.028 -6.679 0.276 1.00 0.49 C ATOM 270 C1' DG A 12 -1.135 -7.275 -0.794 1.00 0.47 C ATOM 271 N9 DG A 12 -0.200 -6.329 -1.398 1.00 0.38 N ATOM 272 C8 DG A 12 -0.488 -5.353 -2.321 1.00 0.31 C ATOM 273 N7 DG A 12 0.556 -4.653 -2.674 1.00 0.27 N ATOM 274 C5 DG A 12 1.598 -5.203 -1.938 1.00 0.31 C ATOM 275 C6 DG A 12 2.974 -4.860 -1.899 1.00 0.32 C ATOM 276 O6 DG A 12 3.560 -3.973 -2.529 1.00 0.34 O ATOM 277 N1 DG A 12 3.688 -5.670 -1.016 1.00 0.39 N ATOM 278 C2 DG A 12 3.131 -6.684 -0.270 1.00 0.46 C ATOM 279 N2 DG A 12 3.970 -7.367 0.524 1.00 0.55 N ATOM 280 N3 DG A 12 1.850 -7.012 -0.299 1.00 0.47 N ATOM 281 C4 DG A 12 1.148 -6.236 -1.148 1.00 0.38 C ATOM 0 H5' DG A 12 -5.332 -7.488 -1.583 1.00 0.29 H new ATOM 0 H5'' DG A 12 -4.153 -6.395 -2.279 1.00 0.29 H new ATOM 0 H4' DG A 12 -3.519 -9.128 -1.218 1.00 0.40 H new ATOM 0 H3' DG A 12 -4.173 -7.023 0.491 1.00 0.50 H new ATOM 0 H2' DG A 12 -2.263 -5.635 0.071 1.00 0.49 H new ATOM 0 H2'' DG A 12 -1.559 -6.713 1.259 1.00 0.49 H new ATOM 0 H1' DG A 12 -0.522 -8.048 -0.331 1.00 0.47 H new ATOM 0 H8 DG A 12 -1.479 -5.182 -2.715 1.00 0.31 H new ATOM 0 H1 DG A 12 4.689 -5.500 -0.917 1.00 0.39 H new ATOM 0 H21 DG A 12 3.618 -8.130 1.102 1.00 0.55 H new ATOM 0 H22 DG A 12 4.960 -7.123 0.550 1.00 0.55 H new ATOM 293 P DG A 13 -3.727 -8.547 2.609 1.00 0.82 P ATOM 294 OP1 DG A 13 -3.582 -9.880 3.246 1.00 0.94 O ATOM 295 OP2 DG A 13 -5.067 -7.909 2.541 1.00 0.92 O ATOM 296 O5' DG A 13 -2.728 -7.539 3.335 1.00 1.11 O ATOM 297 C5' DG A 13 -2.617 -7.511 4.759 1.00 1.19 C ATOM 298 C4' DG A 13 -1.286 -8.084 5.189 1.00 0.87 C ATOM 299 O4' DG A 13 -0.281 -7.745 4.201 1.00 0.68 O ATOM 300 C3' DG A 13 -0.757 -7.551 6.522 1.00 0.61 C ATOM 301 O3' DG A 13 -0.041 -8.576 7.220 1.00 0.52 O ATOM 302 C2' DG A 13 0.180 -6.434 6.103 1.00 0.51 C ATOM 303 C1' DG A 13 0.737 -6.945 4.786 1.00 0.55 C ATOM 304 N9 DG A 13 1.086 -5.894 3.832 1.00 0.50 N ATOM 305 C8 DG A 13 0.235 -5.229 2.983 1.00 0.51 C ATOM 306 N7 DG A 13 0.834 -4.336 2.246 1.00 0.47 N ATOM 307 C5 DG A 13 2.165 -4.414 2.630 1.00 0.42 C ATOM 308 C6 DG A 13 3.292 -3.685 2.176 1.00 0.41 C ATOM 309 O6 DG A 13 3.333 -2.797 1.318 1.00 0.42 O ATOM 310 N1 DG A 13 4.461 -4.075 2.827 1.00 0.43 N ATOM 311 C2 DG A 13 4.523 -5.050 3.797 1.00 0.45 C ATOM 312 N2 DG A 13 5.737 -5.293 4.316 1.00 0.51 N ATOM 313 N3 DG A 13 3.477 -5.737 4.229 1.00 0.46 N ATOM 314 C4 DG A 13 2.339 -5.370 3.607 1.00 0.45 C ATOM 0 H5' DG A 13 -3.429 -8.084 5.206 1.00 1.19 H new ATOM 0 H5'' DG A 13 -2.714 -6.487 5.119 1.00 1.19 H new ATOM 0 H4' DG A 13 -1.463 -9.154 5.295 1.00 0.87 H new ATOM 0 H3' DG A 13 -1.545 -7.216 7.196 1.00 0.61 H new ATOM 0 H2' DG A 13 -0.347 -5.488 5.980 1.00 0.51 H new ATOM 0 H2'' DG A 13 0.967 -6.268 6.839 1.00 0.51 H new ATOM 0 H1' DG A 13 1.660 -7.483 5.001 1.00 0.55 H new ATOM 0 H8 DG A 13 -0.826 -5.427 2.931 1.00 0.51 H new ATOM 0 H1 DG A 13 5.329 -3.607 2.567 1.00 0.43 H new ATOM 0 H21 DG A 13 5.850 -6.004 5.039 1.00 0.51 H new ATOM 0 H22 DG A 13 6.547 -4.767 3.987 1.00 0.51 H new ATOM 326 P DT A 14 -0.740 -9.344 8.447 1.00 0.89 P ATOM 327 OP1 DT A 14 -2.032 -9.885 7.955 1.00 1.25 O ATOM 328 OP2 DT A 14 -0.723 -8.446 9.630 1.00 1.41 O ATOM 329 O5' DT A 14 0.232 -10.574 8.737 1.00 0.81 O ATOM 330 C5' DT A 14 1.563 -10.365 9.212 1.00 0.82 C ATOM 331 C4' DT A 14 2.563 -10.849 8.188 1.00 0.74 C ATOM 332 O4' DT A 14 3.891 -10.806 8.760 1.00 0.76 O ATOM 333 C3' DT A 14 2.370 -12.291 7.733 1.00 0.69 C ATOM 334 O3' DT A 14 1.502 -12.345 6.596 1.00 0.71 O ATOM 335 C2' DT A 14 3.777 -12.714 7.357 1.00 0.75 C ATOM 336 C1' DT A 14 4.639 -11.948 8.353 1.00 0.75 C ATOM 337 N1 DT A 14 4.996 -12.714 9.564 1.00 0.84 N ATOM 338 C2 DT A 14 6.098 -13.539 9.509 1.00 1.11 C ATOM 339 O2 DT A 14 6.789 -13.664 8.511 1.00 1.39 O ATOM 340 N3 DT A 14 6.363 -14.216 10.672 1.00 1.23 N ATOM 341 C4 DT A 14 5.654 -14.153 11.854 1.00 1.18 C ATOM 342 O4 DT A 14 6.013 -14.823 12.819 1.00 1.36 O ATOM 343 C5 DT A 14 4.510 -13.269 11.841 1.00 1.11 C ATOM 344 C7 DT A 14 3.681 -13.138 13.081 1.00 1.47 C ATOM 345 C6 DT A 14 4.238 -12.599 10.711 1.00 0.94 C ATOM 0 H5' DT A 14 1.709 -10.896 10.153 1.00 0.82 H new ATOM 0 H5'' DT A 14 1.723 -9.306 9.415 1.00 0.82 H new ATOM 0 H4' DT A 14 2.420 -10.190 7.332 1.00 0.74 H new ATOM 0 H3' DT A 14 1.915 -12.931 8.489 1.00 0.69 H new ATOM 0 H2' DT A 14 3.913 -13.791 7.449 1.00 0.75 H new ATOM 0 H2'' DT A 14 4.017 -12.449 6.327 1.00 0.75 H new ATOM 0 H1' DT A 14 5.577 -11.705 7.854 1.00 0.75 H new ATOM 0 H3 DT A 14 7.174 -14.835 10.662 1.00 1.23 H new ATOM 0 H71 DT A 14 3.245 -12.140 13.124 1.00 1.47 H new ATOM 0 H72 DT A 14 2.884 -13.882 13.066 1.00 1.47 H new ATOM 0 H73 DT A 14 4.309 -13.297 13.957 1.00 1.47 H new ATOM 0 H6 DT A 14 3.384 -11.938 10.699 1.00 0.94 H new ATOM 358 P DA A 15 0.756 -13.720 6.223 1.00 0.75 P ATOM 359 OP1 DA A 15 0.043 -14.183 7.441 1.00 0.99 O ATOM 360 OP2 DA A 15 1.735 -14.617 5.560 1.00 1.08 O ATOM 361 O5' DA A 15 -0.335 -13.284 5.146 1.00 0.64 O ATOM 362 C5' DA A 15 -0.960 -14.250 4.300 1.00 0.81 C ATOM 363 C4' DA A 15 -0.400 -14.155 2.899 1.00 0.68 C ATOM 364 O4' DA A 15 -1.101 -15.095 2.045 1.00 0.64 O ATOM 365 C3' DA A 15 -0.561 -12.787 2.233 1.00 0.67 C ATOM 366 O3' DA A 15 0.553 -12.514 1.374 1.00 0.60 O ATOM 367 C2' DA A 15 -1.833 -12.946 1.422 1.00 0.74 C ATOM 368 C1' DA A 15 -1.769 -14.404 0.999 1.00 0.66 C ATOM 369 N9 DA A 15 -3.076 -15.036 0.804 1.00 0.73 N ATOM 370 C8 DA A 15 -4.041 -15.282 1.750 1.00 0.92 C ATOM 371 N7 DA A 15 -5.112 -15.868 1.271 1.00 1.00 N ATOM 372 C5 DA A 15 -4.834 -16.020 -0.080 1.00 0.89 C ATOM 373 C6 DA A 15 -5.571 -16.574 -1.141 1.00 1.01 C ATOM 374 N6 DA A 15 -6.789 -17.102 -1.001 1.00 1.15 N ATOM 375 N1 DA A 15 -5.005 -16.569 -2.368 1.00 1.09 N ATOM 376 C2 DA A 15 -3.783 -16.041 -2.509 1.00 1.04 C ATOM 377 N3 DA A 15 -2.993 -15.491 -1.590 1.00 0.85 N ATOM 378 C4 DA A 15 -3.583 -15.512 -0.382 1.00 0.77 C ATOM 0 H5' DA A 15 -2.037 -14.085 4.281 1.00 0.81 H new ATOM 0 H5'' DA A 15 -0.798 -15.252 4.697 1.00 0.81 H new ATOM 0 H4' DA A 15 0.665 -14.359 3.007 1.00 0.68 H new ATOM 0 H3' DA A 15 -0.606 -11.963 2.945 1.00 0.67 H new ATOM 0 H2' DA A 15 -2.722 -12.734 2.015 1.00 0.74 H new ATOM 0 H2'' DA A 15 -1.854 -12.274 0.564 1.00 0.74 H new ATOM 0 H1' DA A 15 -1.262 -14.450 0.035 1.00 0.66 H new ATOM 0 H8 DA A 15 -3.928 -15.018 2.791 1.00 0.92 H new ATOM 0 H61 DA A 15 -7.273 -17.489 -1.811 1.00 1.15 H new ATOM 0 H62 DA A 15 -7.235 -17.118 -0.084 1.00 1.15 H new ATOM 0 H2 DA A 15 -3.381 -16.065 -3.511 1.00 1.04 H new ATOM 390 P DG A 16 1.914 -11.916 1.987 1.00 0.43 P ATOM 391 OP1 DG A 16 2.025 -12.397 3.388 1.00 0.79 O ATOM 392 OP2 DG A 16 1.952 -10.457 1.709 1.00 0.71 O ATOM 393 O5' DG A 16 3.060 -12.616 1.127 1.00 0.32 O ATOM 394 C5' DG A 16 3.693 -13.816 1.573 1.00 0.24 C ATOM 395 C4' DG A 16 5.186 -13.611 1.668 1.00 0.22 C ATOM 396 O4' DG A 16 5.680 -13.133 0.390 1.00 0.30 O ATOM 397 C3' DG A 16 5.627 -12.570 2.699 1.00 0.28 C ATOM 398 O3' DG A 16 6.881 -12.946 3.281 1.00 0.37 O ATOM 399 C2' DG A 16 5.776 -11.308 1.872 1.00 0.37 C ATOM 400 C1' DG A 16 6.268 -11.849 0.542 1.00 0.36 C ATOM 401 N9 DG A 16 5.894 -11.039 -0.615 1.00 0.40 N ATOM 402 C8 DG A 16 4.702 -11.066 -1.297 1.00 0.50 C ATOM 403 N7 DG A 16 4.659 -10.225 -2.295 1.00 0.51 N ATOM 404 C5 DG A 16 5.901 -9.603 -2.269 1.00 0.42 C ATOM 405 C6 DG A 16 6.440 -8.597 -3.109 1.00 0.42 C ATOM 406 O6 DG A 16 5.905 -8.036 -4.073 1.00 0.50 O ATOM 407 N1 DG A 16 7.737 -8.246 -2.737 1.00 0.38 N ATOM 408 C2 DG A 16 8.419 -8.806 -1.680 1.00 0.36 C ATOM 409 N2 DG A 16 9.659 -8.341 -1.461 1.00 0.41 N ATOM 410 N3 DG A 16 7.926 -9.745 -0.890 1.00 0.34 N ATOM 411 C4 DG A 16 6.673 -10.094 -1.239 1.00 0.37 C ATOM 0 H5' DG A 16 3.473 -14.630 0.883 1.00 0.24 H new ATOM 0 H5'' DG A 16 3.295 -14.106 2.545 1.00 0.24 H new ATOM 0 H4' DG A 16 5.585 -14.580 1.967 1.00 0.22 H new ATOM 0 H3' DG A 16 4.928 -12.457 3.528 1.00 0.28 H new ATOM 0 H2' DG A 16 4.831 -10.775 1.770 1.00 0.37 H new ATOM 0 H2'' DG A 16 6.488 -10.612 2.316 1.00 0.37 H new ATOM 0 H1' DG A 16 7.358 -11.857 0.567 1.00 0.36 H new ATOM 0 H8 DG A 16 3.882 -11.718 -1.034 1.00 0.50 H new ATOM 0 H1 DG A 16 8.212 -7.527 -3.284 1.00 0.38 H new ATOM 0 H21 DG A 16 10.216 -8.716 -0.693 1.00 0.41 H new ATOM 0 H22 DG A 16 10.044 -7.613 -2.063 1.00 0.41 H new ATOM 423 P DG A 17 7.465 -12.120 4.532 1.00 0.49 P ATOM 424 OP1 DG A 17 8.294 -13.056 5.334 1.00 0.70 O ATOM 425 OP2 DG A 17 6.343 -11.396 5.181 1.00 0.54 O ATOM 426 O5' DG A 17 8.435 -11.045 3.866 1.00 0.51 O ATOM 427 C5' DG A 17 9.630 -11.447 3.193 1.00 0.54 C ATOM 428 C4' DG A 17 10.653 -10.335 3.233 1.00 0.38 C ATOM 429 O4' DG A 17 10.381 -9.400 2.157 1.00 0.39 O ATOM 430 C3' DG A 17 10.653 -9.505 4.519 1.00 0.35 C ATOM 431 O3' DG A 17 11.988 -9.112 4.858 1.00 0.40 O ATOM 432 C2' DG A 17 9.814 -8.294 4.155 1.00 0.42 C ATOM 433 C1' DG A 17 10.136 -8.105 2.683 1.00 0.31 C ATOM 434 N9 DG A 17 9.060 -7.498 1.902 1.00 0.31 N ATOM 435 C8 DG A 17 7.752 -7.911 1.831 1.00 0.37 C ATOM 436 N7 DG A 17 7.019 -7.174 1.044 1.00 0.37 N ATOM 437 C5 DG A 17 7.897 -6.212 0.563 1.00 0.30 C ATOM 438 C6 DG A 17 7.675 -5.136 -0.333 1.00 0.30 C ATOM 439 O6 DG A 17 6.622 -4.815 -0.895 1.00 0.35 O ATOM 440 N1 DG A 17 8.835 -4.397 -0.557 1.00 0.29 N ATOM 441 C2 DG A 17 10.055 -4.672 0.019 1.00 0.30 C ATOM 442 N2 DG A 17 11.064 -3.850 -0.312 1.00 0.36 N ATOM 443 N3 DG A 17 10.274 -5.673 0.856 1.00 0.29 N ATOM 444 C4 DG A 17 9.160 -6.397 1.082 1.00 0.28 C ATOM 0 H5' DG A 17 9.404 -11.705 2.159 1.00 0.54 H new ATOM 0 H5'' DG A 17 10.037 -12.342 3.663 1.00 0.54 H new ATOM 0 H4' DG A 17 11.617 -10.838 3.152 1.00 0.38 H new ATOM 0 H3' DG A 17 10.265 -10.047 5.381 1.00 0.35 H new ATOM 0 H2' DG A 17 8.751 -8.472 4.319 1.00 0.42 H new ATOM 0 H2'' DG A 17 10.085 -7.419 4.746 1.00 0.42 H new ATOM 0 H1' DG A 17 10.985 -7.425 2.613 1.00 0.31 H new ATOM 0 H8 DG A 17 7.368 -8.762 2.374 1.00 0.37 H new ATOM 0 H1 DG A 17 8.776 -3.599 -1.190 1.00 0.29 H new ATOM 0 H21 DG A 17 11.993 -4.000 0.081 1.00 0.36 H new ATOM 0 H22 DG A 17 10.901 -3.076 -0.956 1.00 0.36 H new ATOM 456 P DG A 18 12.301 -8.501 6.312 1.00 0.35 P ATOM 457 OP1 DG A 18 13.705 -8.852 6.648 1.00 0.55 O ATOM 458 OP2 DG A 18 11.206 -8.901 7.234 1.00 0.70 O ATOM 459 O5' DG A 18 12.220 -6.924 6.093 1.00 0.52 O ATOM 460 C5' DG A 18 13.262 -6.059 6.547 1.00 0.63 C ATOM 461 C4' DG A 18 13.517 -4.970 5.530 1.00 0.52 C ATOM 462 O4' DG A 18 12.422 -4.939 4.580 1.00 0.59 O ATOM 463 C3' DG A 18 13.616 -3.550 6.113 1.00 0.41 C ATOM 464 O3' DG A 18 14.807 -2.907 5.644 1.00 0.49 O ATOM 465 C2' DG A 18 12.381 -2.837 5.577 1.00 0.41 C ATOM 466 C1' DG A 18 12.092 -3.596 4.299 1.00 0.46 C ATOM 467 N9 DG A 18 10.697 -3.543 3.861 1.00 0.45 N ATOM 468 C8 DG A 18 9.661 -4.339 4.286 1.00 0.48 C ATOM 469 N7 DG A 18 8.523 -4.053 3.715 1.00 0.49 N ATOM 470 C5 DG A 18 8.826 -3.002 2.859 1.00 0.45 C ATOM 471 C6 DG A 18 7.992 -2.272 1.975 1.00 0.47 C ATOM 472 O6 DG A 18 6.782 -2.416 1.772 1.00 0.50 O ATOM 473 N1 DG A 18 8.698 -1.286 1.288 1.00 0.50 N ATOM 474 C2 DG A 18 10.044 -1.044 1.443 1.00 0.54 C ATOM 475 N2 DG A 18 10.558 -0.053 0.696 1.00 0.64 N ATOM 476 N3 DG A 18 10.832 -1.719 2.265 1.00 0.51 N ATOM 477 C4 DG A 18 10.162 -2.676 2.936 1.00 0.45 C ATOM 0 H5' DG A 18 14.174 -6.632 6.713 1.00 0.63 H new ATOM 0 H5'' DG A 18 12.986 -5.616 7.504 1.00 0.63 H new ATOM 0 H4' DG A 18 14.480 -5.221 5.086 1.00 0.52 H new ATOM 0 H3' DG A 18 13.661 -3.544 7.202 1.00 0.41 H new ATOM 0 H2' DG A 18 11.547 -2.889 6.277 1.00 0.41 H new ATOM 0 H2'' DG A 18 12.573 -1.781 5.387 1.00 0.41 H new ATOM 0 H1' DG A 18 12.667 -3.145 3.490 1.00 0.46 H new ATOM 0 H8 DG A 18 9.777 -5.123 5.019 1.00 0.48 H new ATOM 0 H1 DG A 18 8.183 -0.705 0.626 1.00 0.50 H new ATOM 0 H21 DG A 18 11.550 0.176 0.765 1.00 0.64 H new ATOM 0 H22 DG A 18 9.957 0.471 0.060 1.00 0.64 H new ATOM 489 P DT A 19 15.361 -1.597 6.395 1.00 0.39 P ATOM 490 OP1 DT A 19 16.625 -1.976 7.077 1.00 0.75 O ATOM 491 OP2 DT A 19 14.251 -1.007 7.186 1.00 0.50 O ATOM 492 O5' DT A 19 15.716 -0.594 5.207 1.00 0.53 O ATOM 493 C5' DT A 19 17.017 -0.574 4.619 1.00 0.86 C ATOM 494 C4' DT A 19 16.939 -0.981 3.165 1.00 0.60 C ATOM 495 O4' DT A 19 18.163 -0.583 2.496 1.00 0.64 O ATOM 496 C3' DT A 19 16.795 -2.489 2.925 1.00 0.68 C ATOM 497 O3' DT A 19 15.878 -2.736 1.852 1.00 0.47 O ATOM 498 C2' DT A 19 18.199 -2.925 2.541 1.00 0.90 C ATOM 499 C1' DT A 19 18.736 -1.696 1.833 1.00 0.83 C ATOM 500 N1 DT A 19 20.206 -1.554 1.882 1.00 1.18 N ATOM 501 C2 DT A 19 20.914 -1.710 0.711 1.00 1.41 C ATOM 502 O2 DT A 19 20.386 -1.962 -0.361 1.00 1.36 O ATOM 503 N3 DT A 19 22.271 -1.562 0.839 1.00 1.74 N ATOM 504 C4 DT A 19 22.974 -1.280 1.993 1.00 1.87 C ATOM 505 O4 DT A 19 24.197 -1.176 1.953 1.00 2.18 O ATOM 506 C5 DT A 19 22.169 -1.128 3.184 1.00 1.65 C ATOM 507 C7 DT A 19 22.847 -0.821 4.483 1.00 1.82 C ATOM 508 C6 DT A 19 20.840 -1.270 3.075 1.00 1.32 C ATOM 0 H5' DT A 19 17.679 -1.252 5.159 1.00 0.86 H new ATOM 0 H5'' DT A 19 17.446 0.424 4.702 1.00 0.86 H new ATOM 0 H4' DT A 19 16.045 -0.490 2.781 1.00 0.60 H new ATOM 0 H3' DT A 19 16.408 -3.026 3.791 1.00 0.68 H new ATOM 0 H2' DT A 19 18.797 -3.185 3.414 1.00 0.90 H new ATOM 0 H2'' DT A 19 18.190 -3.798 1.889 1.00 0.90 H new ATOM 0 H1' DT A 19 18.478 -1.774 0.777 1.00 0.83 H new ATOM 0 H3 DT A 19 22.822 -1.672 -0.012 1.00 1.74 H new ATOM 0 H71 DT A 19 22.177 -0.238 5.114 1.00 1.82 H new ATOM 0 H72 DT A 19 23.103 -1.752 4.989 1.00 1.82 H new ATOM 0 H73 DT A 19 23.756 -0.249 4.293 1.00 1.82 H new ATOM 0 H6 DT A 19 20.236 -1.157 3.963 1.00 1.32 H new ATOM 521 P DG A 20 15.370 -4.233 1.556 1.00 0.46 P ATOM 522 OP1 DG A 20 14.023 -4.131 0.939 1.00 0.56 O ATOM 523 OP2 DG A 20 15.552 -5.042 2.789 1.00 0.54 O ATOM 524 O5' DG A 20 16.385 -4.771 0.450 1.00 0.40 O ATOM 525 C5' DG A 20 15.943 -5.629 -0.603 1.00 0.36 C ATOM 526 C4' DG A 20 16.223 -4.996 -1.947 1.00 0.33 C ATOM 527 O4' DG A 20 15.316 -5.554 -2.931 1.00 0.32 O ATOM 528 C3' DG A 20 16.012 -3.483 -2.004 1.00 0.36 C ATOM 529 O3' DG A 20 16.920 -2.886 -2.938 1.00 0.44 O ATOM 530 C2' DG A 20 14.582 -3.354 -2.492 1.00 0.30 C ATOM 531 C1' DG A 20 14.439 -4.548 -3.421 1.00 0.27 C ATOM 532 N9 DG A 20 13.091 -5.110 -3.471 1.00 0.22 N ATOM 533 C8 DG A 20 12.618 -6.192 -2.772 1.00 0.24 C ATOM 534 N7 DG A 20 11.367 -6.464 -3.025 1.00 0.25 N ATOM 535 C5 DG A 20 10.990 -5.500 -3.951 1.00 0.23 C ATOM 536 C6 DG A 20 9.746 -5.287 -4.596 1.00 0.29 C ATOM 537 O6 DG A 20 8.699 -5.931 -4.470 1.00 0.36 O ATOM 538 N1 DG A 20 9.790 -4.197 -5.464 1.00 0.29 N ATOM 539 C2 DG A 20 10.903 -3.416 -5.675 1.00 0.25 C ATOM 540 N2 DG A 20 10.758 -2.401 -6.540 1.00 0.30 N ATOM 541 N3 DG A 20 12.069 -3.606 -5.079 1.00 0.22 N ATOM 542 C4 DG A 20 12.041 -4.657 -4.236 1.00 0.20 C ATOM 0 H5' DG A 20 14.875 -5.823 -0.500 1.00 0.36 H new ATOM 0 H5'' DG A 20 16.450 -6.592 -0.534 1.00 0.36 H new ATOM 0 H4' DG A 20 17.276 -5.203 -2.139 1.00 0.33 H new ATOM 0 H3' DG A 20 16.187 -2.986 -1.050 1.00 0.36 H new ATOM 0 H2' DG A 20 13.868 -3.393 -1.669 1.00 0.30 H new ATOM 0 H2'' DG A 20 14.415 -2.412 -3.014 1.00 0.30 H new ATOM 0 H1' DG A 20 14.671 -4.212 -4.432 1.00 0.27 H new ATOM 0 H8 DG A 20 13.221 -6.762 -2.081 1.00 0.24 H new ATOM 0 H1 DG A 20 8.940 -3.963 -5.977 1.00 0.29 H new ATOM 0 H21 DG A 20 11.546 -1.785 -6.740 1.00 0.30 H new ATOM 0 H22 DG A 20 9.860 -2.245 -6.998 1.00 0.30 H new ATOM 554 P DG A 21 17.266 -1.318 -2.829 1.00 0.53 P ATOM 555 OP1 DG A 21 18.454 -1.067 -3.684 1.00 0.62 O ATOM 556 OP2 DG A 21 17.306 -0.946 -1.392 1.00 0.67 O ATOM 557 O5' DG A 21 16.010 -0.597 -3.498 1.00 0.47 O ATOM 558 C5' DG A 21 15.929 -0.422 -4.913 1.00 0.41 C ATOM 559 C4' DG A 21 14.944 0.675 -5.251 1.00 0.33 C ATOM 560 O4' DG A 21 13.598 0.135 -5.204 1.00 0.33 O ATOM 561 C3' DG A 21 14.954 1.871 -4.291 1.00 0.38 C ATOM 562 O3' DG A 21 14.791 3.093 -5.021 1.00 0.45 O ATOM 563 C2' DG A 21 13.752 1.618 -3.398 1.00 0.35 C ATOM 564 C1' DG A 21 12.792 0.924 -4.345 1.00 0.30 C ATOM 565 N9 DG A 21 11.825 0.043 -3.694 1.00 0.27 N ATOM 566 C8 DG A 21 12.055 -0.811 -2.643 1.00 0.27 C ATOM 567 N7 DG A 21 10.996 -1.478 -2.278 1.00 0.26 N ATOM 568 C5 DG A 21 10.001 -1.037 -3.139 1.00 0.26 C ATOM 569 C6 DG A 21 8.635 -1.403 -3.225 1.00 0.29 C ATOM 570 O6 DG A 21 8.017 -2.220 -2.532 1.00 0.33 O ATOM 571 N1 DG A 21 7.974 -0.716 -4.242 1.00 0.35 N ATOM 572 C2 DG A 21 8.570 0.209 -5.068 1.00 0.36 C ATOM 573 N2 DG A 21 7.778 0.777 -5.991 1.00 0.44 N ATOM 574 N3 DG A 21 9.845 0.558 -4.998 1.00 0.33 N ATOM 575 C4 DG A 21 10.496 -0.099 -4.019 1.00 0.28 C ATOM 0 H5' DG A 21 15.620 -1.355 -5.385 1.00 0.41 H new ATOM 0 H5'' DG A 21 16.912 -0.173 -5.312 1.00 0.41 H new ATOM 0 H4' DG A 21 15.246 1.030 -6.236 1.00 0.33 H new ATOM 0 H3' DG A 21 15.885 1.966 -3.732 1.00 0.38 H new ATOM 0 H2' DG A 21 14.005 0.992 -2.543 1.00 0.35 H new ATOM 0 H2'' DG A 21 13.336 2.545 -3.003 1.00 0.35 H new ATOM 0 H1' DG A 21 12.203 1.689 -4.851 1.00 0.30 H new ATOM 0 H8 DG A 21 13.018 -0.919 -2.166 1.00 0.27 H new ATOM 0 H1 DG A 21 6.983 -0.912 -4.383 1.00 0.35 H new ATOM 0 H21 DG A 21 8.160 1.471 -6.634 1.00 0.44 H new ATOM 0 H22 DG A 21 6.794 0.515 -6.050 1.00 0.44 H new ATOM 587 P DG A 22 15.032 4.506 -4.290 1.00 0.47 P ATOM 588 OP1 DG A 22 16.126 5.199 -5.017 1.00 0.96 O ATOM 589 OP2 DG A 22 15.160 4.264 -2.830 1.00 0.92 O ATOM 590 O5' DG A 22 13.679 5.309 -4.551 1.00 0.77 O ATOM 591 C5' DG A 22 12.747 5.550 -3.495 1.00 0.55 C ATOM 592 C4' DG A 22 11.348 5.666 -4.053 1.00 0.51 C ATOM 593 O4' DG A 22 10.788 4.346 -4.215 1.00 0.54 O ATOM 594 C3' DG A 22 10.358 6.403 -3.162 1.00 0.48 C ATOM 595 O3' DG A 22 10.387 7.807 -3.441 1.00 0.50 O ATOM 596 C2' DG A 22 9.021 5.803 -3.567 1.00 0.54 C ATOM 597 C1' DG A 22 9.379 4.387 -4.014 1.00 0.53 C ATOM 598 N9 DG A 22 9.033 3.345 -3.048 1.00 0.52 N ATOM 599 C8 DG A 22 9.886 2.690 -2.193 1.00 0.56 C ATOM 600 N7 DG A 22 9.287 1.802 -1.448 1.00 0.57 N ATOM 601 C5 DG A 22 7.956 1.873 -1.834 1.00 0.53 C ATOM 602 C6 DG A 22 6.829 1.146 -1.375 1.00 0.54 C ATOM 603 O6 DG A 22 6.789 0.266 -0.508 1.00 0.59 O ATOM 604 N1 DG A 22 5.661 1.527 -2.032 1.00 0.49 N ATOM 605 C2 DG A 22 5.598 2.492 -3.011 1.00 0.46 C ATOM 606 N2 DG A 22 4.384 2.727 -3.535 1.00 0.46 N ATOM 607 N3 DG A 22 6.643 3.177 -3.448 1.00 0.47 N ATOM 608 C4 DG A 22 7.782 2.819 -2.820 1.00 0.49 C ATOM 0 H5' DG A 22 13.013 6.466 -2.967 1.00 0.55 H new ATOM 0 H5'' DG A 22 12.791 4.739 -2.769 1.00 0.55 H new ATOM 0 H4' DG A 22 11.472 6.225 -4.981 1.00 0.51 H new ATOM 0 H3' DG A 22 10.570 6.299 -2.098 1.00 0.48 H new ATOM 0 H2' DG A 22 8.318 5.794 -2.734 1.00 0.54 H new ATOM 0 H2'' DG A 22 8.555 6.371 -4.372 1.00 0.54 H new ATOM 0 H1' DG A 22 8.803 4.181 -4.916 1.00 0.53 H new ATOM 0 H8 DG A 22 10.946 2.890 -2.143 1.00 0.56 H new ATOM 0 H1 DG A 22 4.794 1.059 -1.770 1.00 0.49 H new ATOM 0 H21 DG A 22 4.271 3.431 -4.265 1.00 0.46 H new ATOM 0 H22 DG A 22 3.575 2.202 -3.203 1.00 0.46 H new ATOM 620 P DT A 23 10.051 8.862 -2.276 1.00 0.48 P ATOM 621 OP1 DT A 23 10.152 10.222 -2.865 1.00 0.64 O ATOM 622 OP2 DT A 23 10.866 8.518 -1.083 1.00 0.73 O ATOM 623 O5' DT A 23 8.520 8.584 -1.934 1.00 0.55 O ATOM 624 C5' DT A 23 7.828 9.372 -0.965 1.00 0.58 C ATOM 625 C4' DT A 23 6.345 9.368 -1.255 1.00 0.50 C ATOM 626 O4' DT A 23 5.876 7.996 -1.311 1.00 0.44 O ATOM 627 C3' DT A 23 5.482 10.066 -0.198 1.00 0.54 C ATOM 628 O3' DT A 23 4.401 10.767 -0.825 1.00 0.68 O ATOM 629 C2' DT A 23 4.960 8.915 0.642 1.00 0.43 C ATOM 630 C1' DT A 23 4.820 7.806 -0.383 1.00 0.41 C ATOM 631 N1 DT A 23 4.934 6.442 0.173 1.00 0.37 N ATOM 632 C2 DT A 23 3.775 5.734 0.402 1.00 0.43 C ATOM 633 O2 DT A 23 2.664 6.177 0.162 1.00 0.52 O ATOM 634 N3 DT A 23 3.965 4.480 0.924 1.00 0.48 N ATOM 635 C4 DT A 23 5.168 3.879 1.232 1.00 0.48 C ATOM 636 O4 DT A 23 5.177 2.745 1.700 1.00 0.58 O ATOM 637 C5 DT A 23 6.344 4.677 0.966 1.00 0.44 C ATOM 638 C7 DT A 23 7.694 4.104 1.269 1.00 0.56 C ATOM 639 C6 DT A 23 6.175 5.906 0.456 1.00 0.39 C ATOM 0 H5' DT A 23 8.206 10.394 -0.979 1.00 0.58 H new ATOM 0 H5'' DT A 23 8.012 8.978 0.034 1.00 0.58 H new ATOM 0 H4' DT A 23 6.239 9.911 -2.194 1.00 0.50 H new ATOM 0 H3' DT A 23 6.028 10.806 0.387 1.00 0.54 H new ATOM 0 H2' DT A 23 5.653 8.647 1.440 1.00 0.43 H new ATOM 0 H2'' DT A 23 4.007 9.155 1.114 1.00 0.43 H new ATOM 0 H1' DT A 23 3.822 7.869 -0.818 1.00 0.41 H new ATOM 0 H3 DT A 23 3.124 3.931 1.104 1.00 0.48 H new ATOM 0 H71 DT A 23 8.429 4.521 0.581 1.00 0.56 H new ATOM 0 H72 DT A 23 7.973 4.353 2.293 1.00 0.56 H new ATOM 0 H73 DT A 23 7.663 3.020 1.154 1.00 0.56 H new ATOM 0 H6 DT A 23 7.051 6.505 0.257 1.00 0.39 H new ATOM 652 P DA A 24 3.291 11.506 0.076 1.00 0.75 P ATOM 653 OP1 DA A 24 2.860 12.721 -0.660 1.00 1.11 O ATOM 654 OP2 DA A 24 3.818 11.635 1.458 1.00 0.72 O ATOM 655 O5' DA A 24 2.069 10.480 0.095 1.00 0.67 O ATOM 656 C5' DA A 24 1.392 10.155 1.311 1.00 0.65 C ATOM 657 C4' DA A 24 1.188 8.660 1.407 1.00 0.65 C ATOM 658 O4' DA A 24 2.333 8.067 2.072 1.00 0.62 O ATOM 659 C3' DA A 24 -0.034 8.224 2.218 1.00 0.59 C ATOM 660 O3' DA A 24 -0.607 7.040 1.653 1.00 0.77 O ATOM 661 C2' DA A 24 0.544 7.937 3.590 1.00 0.48 C ATOM 662 C1' DA A 24 1.920 7.392 3.251 1.00 0.51 C ATOM 663 N9 DA A 24 2.933 7.620 4.283 1.00 0.43 N ATOM 664 C8 DA A 24 3.807 8.675 4.386 1.00 0.47 C ATOM 665 N7 DA A 24 4.603 8.601 5.425 1.00 0.50 N ATOM 666 C5 DA A 24 4.229 7.419 6.049 1.00 0.46 C ATOM 667 C6 DA A 24 4.694 6.772 7.208 1.00 0.54 C ATOM 668 N6 DA A 24 5.678 7.245 7.977 1.00 0.66 N ATOM 669 N1 DA A 24 4.105 5.606 7.555 1.00 0.62 N ATOM 670 C2 DA A 24 3.119 5.131 6.784 1.00 0.63 C ATOM 671 N3 DA A 24 2.595 5.647 5.674 1.00 0.56 N ATOM 672 C4 DA A 24 3.202 6.804 5.356 1.00 0.44 C ATOM 0 H5' DA A 24 0.429 10.665 1.348 1.00 0.65 H new ATOM 0 H5'' DA A 24 1.972 10.507 2.165 1.00 0.65 H new ATOM 0 H4' DA A 24 1.048 8.331 0.377 1.00 0.65 H new ATOM 0 H3' DA A 24 -0.829 8.970 2.238 1.00 0.59 H new ATOM 0 H2' DA A 24 0.602 8.836 4.203 1.00 0.48 H new ATOM 0 H2'' DA A 24 -0.056 7.213 4.141 1.00 0.48 H new ATOM 0 H1' DA A 24 1.836 6.310 3.144 1.00 0.51 H new ATOM 0 H8 DA A 24 3.836 9.489 3.677 1.00 0.47 H new ATOM 0 H61 DA A 24 5.970 6.728 8.806 1.00 0.66 H new ATOM 0 H62 DA A 24 6.137 8.123 7.735 1.00 0.66 H new ATOM 0 H2 DA A 24 2.687 4.196 7.109 1.00 0.63 H new ATOM 684 P DA A 25 -2.140 6.665 1.958 1.00 0.96 P ATOM 685 OP1 DA A 25 -2.958 7.199 0.840 1.00 1.42 O ATOM 686 OP2 DA A 25 -2.452 7.066 3.353 1.00 1.13 O ATOM 687 O5' DA A 25 -2.168 5.073 1.877 1.00 0.90 O ATOM 688 C5' DA A 25 -3.339 4.379 1.448 1.00 0.68 C ATOM 689 C4' DA A 25 -3.283 2.935 1.889 1.00 0.66 C ATOM 690 O4' DA A 25 -2.158 2.286 1.265 1.00 0.67 O ATOM 691 C3' DA A 25 -3.064 2.723 3.379 1.00 0.68 C ATOM 692 O3' DA A 25 -4.308 2.740 4.085 1.00 0.94 O ATOM 693 C2' DA A 25 -2.427 1.343 3.434 1.00 0.73 C ATOM 694 C1' DA A 25 -1.718 1.210 2.085 1.00 0.68 C ATOM 695 N9 DA A 25 -0.256 1.271 2.164 1.00 0.62 N ATOM 696 C8 DA A 25 0.579 2.227 1.637 1.00 0.58 C ATOM 697 N7 DA A 25 1.850 2.003 1.868 1.00 0.58 N ATOM 698 C5 DA A 25 1.854 0.821 2.597 1.00 0.59 C ATOM 699 C6 DA A 25 2.894 0.051 3.149 1.00 0.63 C ATOM 700 N6 DA A 25 4.189 0.365 3.048 1.00 0.65 N ATOM 701 N1 DA A 25 2.555 -1.073 3.818 1.00 0.69 N ATOM 702 C2 DA A 25 1.260 -1.394 3.920 1.00 0.72 C ATOM 703 N3 DA A 25 0.194 -0.752 3.446 1.00 0.70 N ATOM 704 C4 DA A 25 0.564 0.360 2.787 1.00 0.63 C ATOM 0 H5' DA A 25 -3.424 4.432 0.363 1.00 0.68 H new ATOM 0 H5'' DA A 25 -4.226 4.859 1.861 1.00 0.68 H new ATOM 0 H4' DA A 25 -4.257 2.533 1.609 1.00 0.66 H new ATOM 0 H3' DA A 25 -2.454 3.499 3.841 1.00 0.68 H new ATOM 0 H2' DA A 25 -1.725 1.260 4.264 1.00 0.73 H new ATOM 0 H2'' DA A 25 -3.176 0.563 3.570 1.00 0.73 H new ATOM 0 HO3' DA A 25 -4.144 2.600 5.041 1.00 0.94 H new ATOM 0 H1' DA A 25 -1.968 0.227 1.686 1.00 0.68 H new ATOM 0 H8 DA A 25 0.221 3.083 1.084 1.00 0.58 H new ATOM 0 H61 DA A 25 4.894 -0.237 3.472 1.00 0.65 H new ATOM 0 H62 DA A 25 4.472 1.207 2.547 1.00 0.65 H new ATOM 0 H2 DA A 25 1.049 -2.303 4.464 1.00 0.72 H new TER 717 DA A 25 HETATM 718 C17 BO6 A 101 13.635 -7.969 -5.701 1.00 0.41 C HETATM 719 C18 BO6 A 101 14.633 -7.062 -6.045 1.00 0.41 C HETATM 720 N19 BO6 A 101 14.349 -6.007 -6.911 1.00 0.43 N HETATM 721 C31 BO6 A 101 15.410 -5.041 -7.279 1.00 0.46 C HETATM 722 C20 BO6 A 101 13.063 -5.863 -7.430 1.00 0.49 C HETATM 723 C21 BO6 A 101 12.066 -6.771 -7.085 1.00 0.51 C HETATM 724 C16 BO6 A 101 12.338 -7.832 -6.218 1.00 0.46 C HETATM 725 C15 BO6 A 101 11.366 -8.755 -5.849 1.00 0.51 C HETATM 726 C14 BO6 A 101 11.664 -10.227 -5.545 1.00 0.50 C HETATM 727 C7 BO6 A 101 10.796 -11.052 -4.834 1.00 0.53 C HETATM 728 C6 BO6 A 101 9.481 -11.168 -5.259 1.00 0.47 C HETATM 729 C8 BO6 A 101 11.194 -11.759 -3.722 1.00 0.66 C HETATM 730 C9 BO6 A 101 10.279 -12.561 -3.063 1.00 0.72 C HETATM 731 C2 BO6 A 101 9.017 -12.646 -3.505 1.00 0.66 C HETATM 732 N1 BO6 A 101 7.972 -13.335 -3.053 1.00 0.72 N HETATM 733 C3 BO6 A 101 8.620 -11.956 -4.594 1.00 0.53 C HETATM 734 C4 BO6 A 101 7.333 -12.227 -4.802 1.00 0.52 C HETATM 735 C10 BO6 A 101 6.476 -11.800 -5.744 1.00 0.44 C HETATM 736 C5 BO6 A 101 6.931 -13.085 -3.842 1.00 0.63 C HETATM 737 C13 BO6 A 101 5.668 -13.530 -3.808 1.00 0.65 C HETATM 738 C12 BO6 A 101 4.757 -13.112 -4.762 1.00 0.56 C HETATM 739 C11 BO6 A 101 5.158 -12.238 -5.743 1.00 0.46 C HETATM 740 C22 BO6 A 101 4.286 -11.787 -6.728 1.00 0.42 C HETATM 741 C23 BO6 A 101 4.180 -10.317 -7.154 1.00 0.36 C HETATM 742 C24 BO6 A 101 3.097 -9.794 -7.853 1.00 0.32 C HETATM 743 C25 BO6 A 101 1.809 -10.265 -7.557 1.00 0.34 C HETATM 744 C26 BO6 A 101 0.701 -9.766 -8.235 1.00 0.33 C HETATM 745 N27 BO6 A 101 0.864 -8.789 -9.216 1.00 0.31 N HETATM 746 C30 BO6 A 101 -0.315 -8.257 -9.938 1.00 0.36 C HETATM 747 C28 BO6 A 101 2.140 -8.314 -9.517 1.00 0.34 C HETATM 748 C29 BO6 A 101 3.248 -8.814 -8.839 1.00 0.34 C