USER MOD reduce.3.24.130724 H: found=0, std=0, add=203, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 203 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= 0.00141 USER MOD Single : A 2 DT C7 :methyl 150:sc= -0.723 (180deg=-0.723) USER MOD Single : A 18 DT C7 :methyl -30:sc= -0.123 (180deg=-0.165) USER MOD Single : A 18 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 6.987 3.840 6.060 1.00 0.57 O ATOM 2 C5' DT A 1 6.461 4.522 4.919 1.00 0.48 C ATOM 3 C4' DT A 1 4.941 4.400 4.850 1.00 0.37 C ATOM 4 O4' DT A 1 4.570 3.021 4.775 1.00 0.31 O ATOM 5 C3' DT A 1 4.214 5.002 6.057 1.00 0.42 C ATOM 6 O3' DT A 1 3.228 5.925 5.587 1.00 0.41 O ATOM 7 C2' DT A 1 3.551 3.806 6.737 1.00 0.44 C ATOM 8 C1' DT A 1 3.409 2.839 5.577 1.00 0.31 C ATOM 9 N1 DT A 1 3.345 1.419 5.970 1.00 0.31 N ATOM 10 C2 DT A 1 2.161 0.747 5.734 1.00 0.31 C ATOM 11 O2 DT A 1 1.189 1.295 5.220 1.00 0.37 O ATOM 12 N3 DT A 1 2.134 -0.583 6.112 1.00 0.31 N ATOM 13 C4 DT A 1 3.174 -1.287 6.695 1.00 0.36 C ATOM 14 O4 DT A 1 3.040 -2.472 6.991 1.00 0.40 O ATOM 15 C5 DT A 1 4.370 -0.502 6.903 1.00 0.41 C ATOM 16 C7 DT A 1 5.594 -1.152 7.537 1.00 0.55 C ATOM 17 C6 DT A 1 4.421 0.797 6.544 1.00 0.37 C ATOM 0 H5' DT A 1 6.902 4.110 4.011 1.00 0.48 H new ATOM 0 H5'' DT A 1 6.742 5.574 4.961 1.00 0.48 H new ATOM 0 H4' DT A 1 4.643 4.959 3.963 1.00 0.37 H new ATOM 0 H3' DT A 1 4.873 5.541 6.738 1.00 0.42 H new ATOM 0 H2' DT A 1 4.166 3.397 7.539 1.00 0.44 H new ATOM 0 H2'' DT A 1 2.587 4.066 7.175 1.00 0.44 H new ATOM 0 HO5' DT A 1 6.365 3.134 6.335 1.00 0.57 H new ATOM 0 H1' DT A 1 2.469 3.053 5.069 1.00 0.31 H new ATOM 0 H3 DT A 1 1.267 -1.093 5.946 1.00 0.31 H new ATOM 0 H71 DT A 1 6.497 -0.672 7.160 1.00 0.55 H new ATOM 0 H72 DT A 1 5.547 -1.037 8.620 1.00 0.55 H new ATOM 0 H73 DT A 1 5.614 -2.212 7.285 1.00 0.55 H new ATOM 0 H6 DT A 1 5.329 1.358 6.713 1.00 0.37 H new ATOM 31 P DT A 2 3.667 7.133 4.613 1.00 0.39 P ATOM 32 OP1 DT A 2 4.423 6.558 3.479 1.00 0.38 O ATOM 33 OP2 DT A 2 4.278 8.196 5.443 1.00 0.43 O ATOM 34 O5' DT A 2 2.262 7.679 4.053 1.00 0.38 O ATOM 35 C5' DT A 2 1.590 8.748 4.720 1.00 0.40 C ATOM 36 C4' DT A 2 0.274 9.103 4.029 1.00 0.42 C ATOM 37 O4' DT A 2 -0.597 7.966 4.038 1.00 0.45 O ATOM 38 C3' DT A 2 -0.494 10.234 4.700 1.00 0.45 C ATOM 39 O3' DT A 2 -1.312 10.895 3.727 1.00 0.46 O ATOM 40 C2' DT A 2 -1.372 9.495 5.690 1.00 0.50 C ATOM 41 C1' DT A 2 -1.721 8.251 4.885 1.00 0.49 C ATOM 42 N1 DT A 2 -1.978 7.049 5.699 1.00 0.50 N ATOM 43 C2 DT A 2 -3.277 6.832 6.118 1.00 0.56 C ATOM 44 O2 DT A 2 -4.190 7.609 5.849 1.00 0.59 O ATOM 45 N3 DT A 2 -3.491 5.686 6.862 1.00 0.60 N ATOM 46 C4 DT A 2 -2.531 4.755 7.217 1.00 0.58 C ATOM 47 O4 DT A 2 -2.832 3.767 7.883 1.00 0.63 O ATOM 48 C5 DT A 2 -1.203 5.066 6.735 1.00 0.53 C ATOM 49 C7 DT A 2 -0.049 4.126 7.061 1.00 0.54 C ATOM 50 C6 DT A 2 -0.970 6.176 6.007 1.00 0.50 C ATOM 0 H5' DT A 2 2.236 9.625 4.746 1.00 0.40 H new ATOM 0 H5'' DT A 2 1.394 8.466 5.755 1.00 0.40 H new ATOM 0 H4' DT A 2 0.555 9.420 3.025 1.00 0.42 H new ATOM 0 H3' DT A 2 0.142 10.991 5.159 1.00 0.45 H new ATOM 0 H2' DT A 2 -0.844 9.256 6.613 1.00 0.50 H new ATOM 0 H2'' DT A 2 -2.256 10.069 5.968 1.00 0.50 H new ATOM 0 H1' DT A 2 -2.643 8.467 4.345 1.00 0.49 H new ATOM 0 H3 DT A 2 -4.445 5.511 7.178 1.00 0.60 H new ATOM 0 H71 DT A 2 0.690 4.166 6.261 1.00 0.54 H new ATOM 0 H72 DT A 2 0.415 4.431 7.999 1.00 0.54 H new ATOM 0 H73 DT A 2 -0.425 3.107 7.157 1.00 0.54 H new ATOM 0 H6 DT A 2 0.032 6.381 5.660 1.00 0.50 H new ATOM 63 P DG A 3 -0.654 11.681 2.481 1.00 0.42 P ATOM 64 OP1 DG A 3 -0.087 12.952 2.980 1.00 0.45 O ATOM 65 OP2 DG A 3 -1.640 11.701 1.378 1.00 0.45 O ATOM 66 O5' DG A 3 0.565 10.722 2.047 1.00 0.35 O ATOM 67 C5' DG A 3 1.914 11.194 2.120 1.00 0.29 C ATOM 68 C4' DG A 3 2.878 10.274 1.376 1.00 0.23 C ATOM 69 O4' DG A 3 2.791 8.955 1.916 1.00 0.24 O ATOM 70 C3' DG A 3 2.605 10.173 -0.128 1.00 0.19 C ATOM 71 O3' DG A 3 3.817 10.417 -0.849 1.00 0.23 O ATOM 72 C2' DG A 3 2.157 8.731 -0.344 1.00 0.19 C ATOM 73 C1' DG A 3 2.791 8.023 0.839 1.00 0.19 C ATOM 74 N9 DG A 3 2.057 6.828 1.287 1.00 0.17 N ATOM 75 C8 DG A 3 0.724 6.703 1.571 1.00 0.17 C ATOM 76 N7 DG A 3 0.377 5.513 1.969 1.00 0.19 N ATOM 77 C5 DG A 3 1.567 4.793 1.947 1.00 0.18 C ATOM 78 C6 DG A 3 1.815 3.434 2.280 1.00 0.21 C ATOM 79 O6 DG A 3 1.015 2.586 2.669 1.00 0.25 O ATOM 80 N1 DG A 3 3.154 3.109 2.117 1.00 0.20 N ATOM 81 C2 DG A 3 4.134 3.979 1.689 1.00 0.18 C ATOM 82 N2 DG A 3 5.366 3.482 1.591 1.00 0.20 N ATOM 83 N3 DG A 3 3.903 5.257 1.376 1.00 0.17 N ATOM 84 C4 DG A 3 2.601 5.592 1.528 1.00 0.17 C ATOM 0 H5' DG A 3 2.217 11.269 3.164 1.00 0.29 H new ATOM 0 H5'' DG A 3 1.971 12.198 1.698 1.00 0.29 H new ATOM 0 H4' DG A 3 3.867 10.713 1.508 1.00 0.23 H new ATOM 0 H3' DG A 3 1.862 10.893 -0.470 1.00 0.19 H new ATOM 0 H2' DG A 3 1.071 8.636 -0.342 1.00 0.19 H new ATOM 0 H2'' DG A 3 2.510 8.332 -1.295 1.00 0.19 H new ATOM 0 H1' DG A 3 3.783 7.688 0.535 1.00 0.19 H new ATOM 0 H8 DG A 3 0.023 7.519 1.474 1.00 0.17 H new ATOM 0 H1 DG A 3 3.435 2.152 2.330 1.00 0.20 H new ATOM 0 H21 DG A 3 6.133 4.078 1.280 1.00 0.20 H new ATOM 0 H22 DG A 3 5.542 2.506 1.827 1.00 0.20 H new ATOM 96 P DG A 4 3.870 10.225 -2.447 1.00 0.25 P ATOM 97 OP1 DG A 4 4.825 11.210 -3.002 1.00 0.35 O ATOM 98 OP2 DG A 4 2.481 10.180 -2.954 1.00 0.31 O ATOM 99 O5' DG A 4 4.513 8.757 -2.606 1.00 0.28 O ATOM 100 C5' DG A 4 5.896 8.536 -2.318 1.00 0.33 C ATOM 101 C4' DG A 4 6.317 7.104 -2.644 1.00 0.32 C ATOM 102 O4' DG A 4 5.541 6.191 -1.868 1.00 0.30 O ATOM 103 C3' DG A 4 6.129 6.723 -4.117 1.00 0.33 C ATOM 104 O3' DG A 4 7.381 6.291 -4.660 1.00 0.41 O ATOM 105 C2' DG A 4 5.143 5.555 -4.099 1.00 0.32 C ATOM 106 C1' DG A 4 5.265 5.052 -2.671 1.00 0.28 C ATOM 107 N9 DG A 4 4.040 4.420 -2.148 1.00 0.23 N ATOM 108 C8 DG A 4 2.822 4.994 -1.896 1.00 0.24 C ATOM 109 N7 DG A 4 1.931 4.165 -1.430 1.00 0.24 N ATOM 110 C5 DG A 4 2.605 2.951 -1.365 1.00 0.21 C ATOM 111 C6 DG A 4 2.144 1.679 -0.932 1.00 0.21 C ATOM 112 O6 DG A 4 1.028 1.374 -0.515 1.00 0.24 O ATOM 113 N1 DG A 4 3.143 0.717 -1.027 1.00 0.20 N ATOM 114 C2 DG A 4 4.425 0.950 -1.482 1.00 0.20 C ATOM 115 N2 DG A 4 5.244 -0.101 -1.500 1.00 0.21 N ATOM 116 N3 DG A 4 4.859 2.147 -1.888 1.00 0.21 N ATOM 117 C4 DG A 4 3.899 3.096 -1.802 1.00 0.21 C ATOM 0 H5' DG A 4 6.086 8.741 -1.264 1.00 0.33 H new ATOM 0 H5'' DG A 4 6.504 9.234 -2.893 1.00 0.33 H new ATOM 0 H4' DG A 4 7.381 7.048 -2.414 1.00 0.32 H new ATOM 0 H3' DG A 4 5.770 7.556 -4.722 1.00 0.33 H new ATOM 0 H2' DG A 4 4.128 5.876 -4.332 1.00 0.32 H new ATOM 0 H2'' DG A 4 5.409 4.787 -4.825 1.00 0.32 H new ATOM 0 H1' DG A 4 6.042 4.288 -2.649 1.00 0.28 H new ATOM 0 H8 DG A 4 2.618 6.041 -2.068 1.00 0.24 H new ATOM 0 H1 DG A 4 2.911 -0.233 -0.738 1.00 0.20 H new ATOM 0 H21 DG A 4 6.205 0.007 -1.826 1.00 0.21 H new ATOM 0 H22 DG A 4 4.910 -1.013 -1.188 1.00 0.21 H new ATOM 129 P DG A 5 7.485 5.805 -6.192 1.00 0.46 P ATOM 130 OP1 DG A 5 8.825 6.166 -6.706 1.00 0.57 O ATOM 131 OP2 DG A 5 6.274 6.266 -6.905 1.00 0.49 O ATOM 132 O5' DG A 5 7.411 4.203 -6.061 1.00 0.38 O ATOM 133 C5' DG A 5 8.516 3.466 -5.525 1.00 0.35 C ATOM 134 C4' DG A 5 8.254 1.963 -5.557 1.00 0.26 C ATOM 135 O4' DG A 5 7.074 1.672 -4.812 1.00 0.33 O ATOM 136 C3' DG A 5 8.045 1.401 -6.968 1.00 0.23 C ATOM 137 O3' DG A 5 9.107 0.495 -7.296 1.00 0.19 O ATOM 138 C2' DG A 5 6.717 0.642 -6.908 1.00 0.25 C ATOM 139 C1' DG A 5 6.437 0.554 -5.415 1.00 0.27 C ATOM 140 N9 DG A 5 5.007 0.617 -5.067 1.00 0.32 N ATOM 141 C8 DG A 5 4.161 1.693 -5.129 1.00 0.38 C ATOM 142 N7 DG A 5 2.944 1.433 -4.744 1.00 0.41 N ATOM 143 C5 DG A 5 2.981 0.087 -4.402 1.00 0.38 C ATOM 144 C6 DG A 5 1.946 -0.753 -3.914 1.00 0.40 C ATOM 145 O6 DG A 5 0.774 -0.460 -3.683 1.00 0.45 O ATOM 146 N1 DG A 5 2.402 -2.047 -3.696 1.00 0.36 N ATOM 147 C2 DG A 5 3.695 -2.479 -3.921 1.00 0.32 C ATOM 148 N2 DG A 5 3.947 -3.760 -3.654 1.00 0.30 N ATOM 149 N3 DG A 5 4.669 -1.687 -4.379 1.00 0.30 N ATOM 150 C4 DG A 5 4.241 -0.423 -4.598 1.00 0.33 C ATOM 0 H5' DG A 5 8.702 3.782 -4.499 1.00 0.35 H new ATOM 0 H5'' DG A 5 9.417 3.692 -6.096 1.00 0.35 H new ATOM 0 H4' DG A 5 9.144 1.498 -5.134 1.00 0.26 H new ATOM 0 H3' DG A 5 8.035 2.187 -7.723 1.00 0.23 H new ATOM 0 H2' DG A 5 5.925 1.173 -7.436 1.00 0.25 H new ATOM 0 H2'' DG A 5 6.796 -0.346 -7.362 1.00 0.25 H new ATOM 0 H1' DG A 5 6.805 -0.411 -5.066 1.00 0.27 H new ATOM 0 H8 DG A 5 4.475 2.670 -5.467 1.00 0.38 H new ATOM 0 H1 DG A 5 1.732 -2.730 -3.343 1.00 0.36 H new ATOM 0 H21 DG A 5 4.883 -4.137 -3.800 1.00 0.30 H new ATOM 0 H22 DG A 5 3.203 -4.364 -3.303 1.00 0.30 H new ATOM 162 P DG A 6 9.541 -0.693 -6.296 1.00 0.18 P ATOM 163 OP1 DG A 6 10.250 -1.725 -7.084 1.00 0.21 O ATOM 164 OP2 DG A 6 8.365 -1.068 -5.480 1.00 0.26 O ATOM 165 O5' DG A 6 10.612 0.031 -5.336 1.00 0.23 O ATOM 166 C5' DG A 6 11.752 0.689 -5.896 1.00 0.18 C ATOM 167 C4' DG A 6 13.046 0.273 -5.202 1.00 0.23 C ATOM 168 O4' DG A 6 14.159 0.905 -5.847 1.00 0.26 O ATOM 169 C3' DG A 6 13.110 0.653 -3.720 1.00 0.28 C ATOM 170 O3' DG A 6 13.693 -0.424 -2.978 1.00 0.42 O ATOM 171 C2' DG A 6 14.041 1.855 -3.695 1.00 0.22 C ATOM 172 C1' DG A 6 14.969 1.523 -4.849 1.00 0.20 C ATOM 173 N9 DG A 6 15.630 2.693 -5.461 1.00 0.17 N ATOM 174 C8 DG A 6 15.519 4.019 -5.129 1.00 0.21 C ATOM 175 N7 DG A 6 16.243 4.812 -5.868 1.00 0.30 N ATOM 176 C5 DG A 6 16.881 3.953 -6.756 1.00 0.30 C ATOM 177 C6 DG A 6 17.799 4.243 -7.802 1.00 0.40 C ATOM 178 O6 DG A 6 18.234 5.337 -8.153 1.00 0.50 O ATOM 179 N1 DG A 6 18.204 3.088 -8.458 1.00 0.43 N ATOM 180 C2 DG A 6 17.781 1.813 -8.150 1.00 0.40 C ATOM 181 N2 DG A 6 18.281 0.827 -8.894 1.00 0.50 N ATOM 182 N3 DG A 6 16.917 1.538 -7.166 1.00 0.32 N ATOM 183 C4 DG A 6 16.512 2.654 -6.515 1.00 0.25 C ATOM 0 H5' DG A 6 11.626 1.768 -5.812 1.00 0.18 H new ATOM 0 H5'' DG A 6 11.819 0.457 -6.959 1.00 0.18 H new ATOM 0 H4' DG A 6 13.079 -0.814 -5.273 1.00 0.23 H new ATOM 0 H3' DG A 6 12.132 0.863 -3.287 1.00 0.28 H new ATOM 0 H2' DG A 6 13.508 2.793 -3.850 1.00 0.22 H new ATOM 0 H2'' DG A 6 14.575 1.944 -2.749 1.00 0.22 H new ATOM 0 H1' DG A 6 15.769 0.891 -4.462 1.00 0.20 H new ATOM 0 H8 DG A 6 14.888 4.374 -4.327 1.00 0.21 H new ATOM 0 H1 DG A 6 18.866 3.191 -9.227 1.00 0.43 H new ATOM 0 H21 DG A 6 18.005 -0.138 -8.714 1.00 0.50 H new ATOM 0 H22 DG A 6 18.940 1.038 -9.644 1.00 0.50 H new ATOM 195 P DG A 7 14.033 -0.255 -1.412 1.00 0.47 P ATOM 196 OP1 DG A 7 13.791 1.155 -1.035 1.00 0.56 O ATOM 197 OP2 DG A 7 15.353 -0.872 -1.156 1.00 0.63 O ATOM 198 O5' DG A 7 12.906 -1.164 -0.706 1.00 0.41 O ATOM 199 C5' DG A 7 11.738 -0.566 -0.139 1.00 0.39 C ATOM 200 C4' DG A 7 10.823 -1.614 0.489 1.00 0.28 C ATOM 201 O4' DG A 7 9.788 -0.968 1.217 1.00 0.34 O ATOM 202 C3' DG A 7 10.141 -2.532 -0.527 1.00 0.24 C ATOM 203 O3' DG A 7 10.703 -3.845 -0.438 1.00 0.27 O ATOM 204 C2' DG A 7 8.667 -2.571 -0.104 1.00 0.21 C ATOM 205 C1' DG A 7 8.673 -1.845 1.237 1.00 0.24 C ATOM 206 N9 DG A 7 7.473 -1.031 1.487 1.00 0.25 N ATOM 207 C8 DG A 7 7.300 0.314 1.293 1.00 0.26 C ATOM 208 N7 DG A 7 6.113 0.746 1.613 1.00 0.29 N ATOM 209 C5 DG A 7 5.448 -0.395 2.051 1.00 0.28 C ATOM 210 C6 DG A 7 4.118 -0.546 2.528 1.00 0.30 C ATOM 211 O6 DG A 7 3.252 0.316 2.659 1.00 0.31 O ATOM 212 N1 DG A 7 3.847 -1.865 2.867 1.00 0.30 N ATOM 213 C2 DG A 7 4.740 -2.909 2.760 1.00 0.30 C ATOM 214 N2 DG A 7 4.293 -4.109 3.134 1.00 0.32 N ATOM 215 N3 DG A 7 5.991 -2.769 2.312 1.00 0.27 N ATOM 216 C4 DG A 7 6.274 -1.489 1.977 1.00 0.26 C ATOM 0 H5' DG A 7 11.194 -0.023 -0.912 1.00 0.39 H new ATOM 0 H5'' DG A 7 12.031 0.163 0.617 1.00 0.39 H new ATOM 0 H4' DG A 7 11.469 -2.222 1.122 1.00 0.28 H new ATOM 0 H3' DG A 7 10.266 -2.181 -1.551 1.00 0.24 H new ATOM 0 H2' DG A 7 8.026 -2.071 -0.830 1.00 0.21 H new ATOM 0 H2'' DG A 7 8.302 -3.594 -0.007 1.00 0.21 H new ATOM 0 H1' DG A 7 8.709 -2.600 2.023 1.00 0.24 H new ATOM 0 H8 DG A 7 8.077 0.958 0.909 1.00 0.26 H new ATOM 0 H1 DG A 7 2.915 -2.078 3.223 1.00 0.30 H new ATOM 0 H21 DG A 7 4.907 -4.922 3.078 1.00 0.32 H new ATOM 0 H22 DG A 7 3.338 -4.214 3.476 1.00 0.32 H new ATOM 228 P DG A 8 10.470 -4.911 -1.621 1.00 0.29 P ATOM 229 OP1 DG A 8 11.472 -5.991 -1.480 1.00 0.36 O ATOM 230 OP2 DG A 8 10.363 -4.169 -2.897 1.00 0.38 O ATOM 231 O5' DG A 8 9.021 -5.521 -1.271 1.00 0.23 O ATOM 232 C5' DG A 8 8.892 -6.598 -0.339 1.00 0.26 C ATOM 233 C4' DG A 8 7.456 -7.105 -0.261 1.00 0.27 C ATOM 234 O4' DG A 8 6.589 -6.045 0.147 1.00 0.25 O ATOM 235 C3' DG A 8 6.913 -7.641 -1.593 1.00 0.34 C ATOM 236 O3' DG A 8 6.514 -9.004 -1.427 1.00 0.44 O ATOM 237 C2' DG A 8 5.690 -6.776 -1.895 1.00 0.32 C ATOM 238 C1' DG A 8 5.348 -6.224 -0.522 1.00 0.25 C ATOM 239 N9 DG A 8 4.648 -4.925 -0.546 1.00 0.22 N ATOM 240 C8 DG A 8 5.129 -3.697 -0.918 1.00 0.24 C ATOM 241 N7 DG A 8 4.254 -2.735 -0.825 1.00 0.25 N ATOM 242 C5 DG A 8 3.107 -3.371 -0.358 1.00 0.21 C ATOM 243 C6 DG A 8 1.824 -2.834 -0.064 1.00 0.21 C ATOM 244 O6 DG A 8 1.445 -1.668 -0.160 1.00 0.25 O ATOM 245 N1 DG A 8 0.951 -3.817 0.382 1.00 0.20 N ATOM 246 C2 DG A 8 1.271 -5.152 0.529 1.00 0.21 C ATOM 247 N2 DG A 8 0.299 -5.950 0.971 1.00 0.25 N ATOM 248 N3 DG A 8 2.477 -5.656 0.252 1.00 0.22 N ATOM 249 C4 DG A 8 3.340 -4.712 -0.184 1.00 0.21 C ATOM 0 H5' DG A 8 9.215 -6.266 0.648 1.00 0.26 H new ATOM 0 H5'' DG A 8 9.551 -7.415 -0.633 1.00 0.26 H new ATOM 0 H4' DG A 8 7.477 -7.926 0.456 1.00 0.27 H new ATOM 0 H3' DG A 8 7.652 -7.602 -2.393 1.00 0.34 H new ATOM 0 H2' DG A 8 5.917 -5.984 -2.609 1.00 0.32 H new ATOM 0 H2'' DG A 8 4.871 -7.360 -2.316 1.00 0.32 H new ATOM 0 H1' DG A 8 4.669 -6.923 -0.033 1.00 0.25 H new ATOM 0 H8 DG A 8 6.142 -3.540 -1.258 1.00 0.24 H new ATOM 0 H1 DG A 8 0.001 -3.531 0.619 1.00 0.20 H new ATOM 0 H21 DG A 8 0.476 -6.946 1.100 1.00 0.25 H new ATOM 0 H22 DG A 8 -0.622 -5.564 1.181 1.00 0.25 H new ATOM 261 P DG A 9 5.761 -9.785 -2.616 1.00 0.51 P ATOM 262 OP1 DG A 9 6.033 -11.232 -2.466 1.00 0.68 O ATOM 263 OP2 DG A 9 6.080 -9.103 -3.890 1.00 0.62 O ATOM 264 O5' DG A 9 4.208 -9.526 -2.280 1.00 0.35 O ATOM 265 C5' DG A 9 3.608 -10.126 -1.129 1.00 0.32 C ATOM 266 C4' DG A 9 2.101 -9.884 -1.089 1.00 0.25 C ATOM 267 O4' DG A 9 1.837 -8.481 -1.020 1.00 0.26 O ATOM 268 C3' DG A 9 1.351 -10.424 -2.314 1.00 0.24 C ATOM 269 O3' DG A 9 0.294 -11.287 -1.880 1.00 0.42 O ATOM 270 C2' DG A 9 0.761 -9.185 -2.981 1.00 0.23 C ATOM 271 C1' DG A 9 0.687 -8.220 -1.814 1.00 0.16 C ATOM 272 N9 DG A 9 0.707 -6.793 -2.195 1.00 0.20 N ATOM 273 C8 DG A 9 1.728 -6.059 -2.745 1.00 0.33 C ATOM 274 N7 DG A 9 1.424 -4.809 -2.957 1.00 0.42 N ATOM 275 C5 DG A 9 0.108 -4.704 -2.519 1.00 0.34 C ATOM 276 C6 DG A 9 -0.758 -3.576 -2.500 1.00 0.38 C ATOM 277 O6 DG A 9 -0.524 -2.429 -2.874 1.00 0.51 O ATOM 278 N1 DG A 9 -2.004 -3.900 -1.976 1.00 0.28 N ATOM 279 C2 DG A 9 -2.369 -5.155 -1.526 1.00 0.18 C ATOM 280 N2 DG A 9 -3.610 -5.281 -1.055 1.00 0.20 N ATOM 281 N3 DG A 9 -1.555 -6.213 -1.544 1.00 0.14 N ATOM 282 C4 DG A 9 -0.337 -5.914 -2.051 1.00 0.20 C ATOM 0 H5' DG A 9 4.066 -9.721 -0.227 1.00 0.32 H new ATOM 0 H5'' DG A 9 3.805 -11.198 -1.133 1.00 0.32 H new ATOM 0 H4' DG A 9 1.745 -10.419 -0.208 1.00 0.25 H new ATOM 0 H3' DG A 9 1.995 -10.992 -2.986 1.00 0.24 H new ATOM 0 H2' DG A 9 1.396 -8.810 -3.784 1.00 0.23 H new ATOM 0 H2'' DG A 9 -0.220 -9.380 -3.415 1.00 0.23 H new ATOM 0 H1' DG A 9 -0.262 -8.379 -1.303 1.00 0.16 H new ATOM 0 H8 DG A 9 2.695 -6.479 -2.981 1.00 0.33 H new ATOM 0 H1 DG A 9 -2.700 -3.157 -1.919 1.00 0.28 H new ATOM 0 H21 DG A 9 -3.935 -6.184 -0.709 1.00 0.20 H new ATOM 0 H22 DG A 9 -4.234 -4.474 -1.041 1.00 0.20 H new ATOM 294 P DG A 10 0.602 -12.812 -1.466 1.00 0.65 P ATOM 295 OP1 DG A 10 1.224 -13.490 -2.625 1.00 0.70 O ATOM 296 OP2 DG A 10 -0.618 -13.378 -0.847 1.00 1.21 O ATOM 297 O5' DG A 10 1.721 -12.649 -0.318 1.00 0.67 O ATOM 298 C5' DG A 10 2.468 -13.783 0.128 1.00 0.67 C ATOM 299 C4' DG A 10 2.001 -14.264 1.500 1.00 0.53 C ATOM 300 O4' DG A 10 2.707 -15.458 1.852 1.00 0.50 O ATOM 301 C3' DG A 10 2.233 -13.248 2.625 1.00 0.48 C ATOM 302 O3' DG A 10 1.026 -13.081 3.376 1.00 0.38 O ATOM 303 C2' DG A 10 3.300 -13.892 3.505 1.00 0.50 C ATOM 304 C1' DG A 10 3.079 -15.368 3.223 1.00 0.43 C ATOM 305 N9 DG A 10 4.270 -16.216 3.424 1.00 0.49 N ATOM 306 C8 DG A 10 5.584 -15.938 3.140 1.00 0.54 C ATOM 307 N7 DG A 10 6.404 -16.908 3.431 1.00 0.58 N ATOM 308 C5 DG A 10 5.579 -17.902 3.947 1.00 0.56 C ATOM 309 C6 DG A 10 5.909 -19.196 4.435 1.00 0.59 C ATOM 310 O6 DG A 10 7.017 -19.724 4.507 1.00 0.64 O ATOM 311 N1 DG A 10 4.780 -19.881 4.863 1.00 0.55 N ATOM 312 C2 DG A 10 3.493 -19.387 4.827 1.00 0.48 C ATOM 313 N2 DG A 10 2.537 -20.195 5.283 1.00 0.45 N ATOM 314 N3 DG A 10 3.181 -18.170 4.367 1.00 0.46 N ATOM 315 C4 DG A 10 4.271 -17.487 3.946 1.00 0.50 C ATOM 0 H5' DG A 10 3.526 -13.526 0.173 1.00 0.67 H new ATOM 0 H5'' DG A 10 2.367 -14.592 -0.595 1.00 0.67 H new ATOM 0 H4' DG A 10 0.927 -14.426 1.408 1.00 0.53 H new ATOM 0 H3' DG A 10 2.532 -12.268 2.253 1.00 0.48 H new ATOM 0 H2' DG A 10 4.305 -13.569 3.233 1.00 0.50 H new ATOM 0 H2'' DG A 10 3.162 -13.651 4.559 1.00 0.50 H new ATOM 0 H1' DG A 10 2.326 -15.732 3.922 1.00 0.43 H new ATOM 0 H8 DG A 10 5.909 -15.000 2.714 1.00 0.54 H new ATOM 0 H1 DG A 10 4.913 -20.822 5.233 1.00 0.55 H new ATOM 0 H21 DG A 10 1.565 -19.886 5.282 1.00 0.45 H new ATOM 0 H22 DG A 10 2.777 -21.123 5.633 1.00 0.45 H new ATOM 327 P DG A 11 0.954 -12.011 4.578 1.00 0.31 P ATOM 328 OP1 DG A 11 2.182 -12.148 5.392 1.00 0.37 O ATOM 329 OP2 DG A 11 -0.374 -12.123 5.222 1.00 0.43 O ATOM 330 O5' DG A 11 1.021 -10.603 3.799 1.00 0.28 O ATOM 331 C5' DG A 11 1.211 -9.383 4.520 1.00 0.27 C ATOM 332 C4' DG A 11 -0.078 -8.921 5.197 1.00 0.18 C ATOM 333 O4' DG A 11 0.190 -7.767 6.003 1.00 0.24 O ATOM 334 C3' DG A 11 -1.187 -8.541 4.220 1.00 0.14 C ATOM 335 O3' DG A 11 -2.086 -9.643 4.067 1.00 0.21 O ATOM 336 C2' DG A 11 -1.899 -7.394 4.918 1.00 0.17 C ATOM 337 C1' DG A 11 -0.770 -6.746 5.707 1.00 0.20 C ATOM 338 N9 DG A 11 -0.069 -5.663 4.990 1.00 0.20 N ATOM 339 C8 DG A 11 1.189 -5.665 4.445 1.00 0.26 C ATOM 340 N7 DG A 11 1.536 -4.528 3.911 1.00 0.29 N ATOM 341 C5 DG A 11 0.430 -3.709 4.116 1.00 0.24 C ATOM 342 C6 DG A 11 0.221 -2.352 3.751 1.00 0.28 C ATOM 343 O6 DG A 11 0.991 -1.592 3.167 1.00 0.35 O ATOM 344 N1 DG A 11 -1.034 -1.907 4.145 1.00 0.24 N ATOM 345 C2 DG A 11 -1.972 -2.671 4.805 1.00 0.20 C ATOM 346 N2 DG A 11 -3.124 -2.069 5.099 1.00 0.23 N ATOM 347 N3 DG A 11 -1.777 -3.947 5.150 1.00 0.17 N ATOM 348 C4 DG A 11 -0.559 -4.397 4.774 1.00 0.19 C ATOM 0 H5' DG A 11 1.562 -8.608 3.838 1.00 0.27 H new ATOM 0 H5'' DG A 11 1.988 -9.522 5.272 1.00 0.27 H new ATOM 0 H4' DG A 11 -0.422 -9.771 5.786 1.00 0.18 H new ATOM 0 H3' DG A 11 -0.817 -8.277 3.229 1.00 0.14 H new ATOM 0 H2' DG A 11 -2.348 -6.701 4.207 1.00 0.17 H new ATOM 0 H2'' DG A 11 -2.699 -7.747 5.568 1.00 0.17 H new ATOM 0 H1' DG A 11 -1.218 -6.296 6.593 1.00 0.20 H new ATOM 0 H8 DG A 11 1.834 -6.531 4.457 1.00 0.26 H new ATOM 0 H1 DG A 11 -1.280 -0.941 3.929 1.00 0.24 H new ATOM 0 H21 DG A 11 -3.858 -2.583 5.587 1.00 0.23 H new ATOM 0 H22 DG A 11 -3.272 -1.095 4.836 1.00 0.23 H new ATOM 360 P DG A 12 -3.013 -9.768 2.756 1.00 0.26 P ATOM 361 OP1 DG A 12 -3.848 -10.982 2.896 1.00 0.37 O ATOM 362 OP2 DG A 12 -2.152 -9.599 1.565 1.00 0.33 O ATOM 363 O5' DG A 12 -3.973 -8.480 2.872 1.00 0.19 O ATOM 364 C5' DG A 12 -5.014 -8.429 3.852 1.00 0.19 C ATOM 365 C4' DG A 12 -5.940 -7.239 3.622 1.00 0.17 C ATOM 366 O4' DG A 12 -5.169 -6.031 3.587 1.00 0.19 O ATOM 367 C3' DG A 12 -6.727 -7.314 2.314 1.00 0.15 C ATOM 368 O3' DG A 12 -8.070 -6.867 2.535 1.00 0.17 O ATOM 369 C2' DG A 12 -6.003 -6.347 1.390 1.00 0.16 C ATOM 370 C1' DG A 12 -5.455 -5.327 2.376 1.00 0.16 C ATOM 371 N9 DG A 12 -4.206 -4.675 1.933 1.00 0.16 N ATOM 372 C8 DG A 12 -2.978 -5.242 1.700 1.00 0.16 C ATOM 373 N7 DG A 12 -2.068 -4.392 1.317 1.00 0.17 N ATOM 374 C5 DG A 12 -2.734 -3.173 1.293 1.00 0.17 C ATOM 375 C6 DG A 12 -2.251 -1.881 0.951 1.00 0.21 C ATOM 376 O6 DG A 12 -1.117 -1.563 0.596 1.00 0.25 O ATOM 377 N1 DG A 12 -3.248 -0.920 1.058 1.00 0.22 N ATOM 378 C2 DG A 12 -4.549 -1.170 1.445 1.00 0.21 C ATOM 379 N2 DG A 12 -5.364 -0.116 1.489 1.00 0.23 N ATOM 380 N3 DG A 12 -5.005 -2.385 1.767 1.00 0.19 N ATOM 381 C4 DG A 12 -4.045 -3.335 1.669 1.00 0.17 C ATOM 0 H5' DG A 12 -4.575 -8.363 4.848 1.00 0.19 H new ATOM 0 H5'' DG A 12 -5.592 -9.353 3.819 1.00 0.19 H new ATOM 0 H4' DG A 12 -6.652 -7.254 4.447 1.00 0.17 H new ATOM 0 H3' DG A 12 -6.781 -8.323 1.906 1.00 0.15 H new ATOM 0 H2' DG A 12 -5.210 -6.837 0.825 1.00 0.16 H new ATOM 0 H2'' DG A 12 -6.677 -5.893 0.664 1.00 0.16 H new ATOM 0 H1' DG A 12 -6.202 -4.541 2.486 1.00 0.16 H new ATOM 0 H8 DG A 12 -2.784 -6.297 1.823 1.00 0.16 H new ATOM 0 H1 DG A 12 -3.000 0.044 0.834 1.00 0.22 H new ATOM 0 H21 DG A 12 -6.338 -0.236 1.768 1.00 0.23 H new ATOM 0 H22 DG A 12 -5.014 0.810 1.244 1.00 0.23 H new ATOM 393 P DG A 13 -9.161 -6.948 1.353 1.00 0.16 P ATOM 394 OP1 DG A 13 -10.471 -7.283 1.953 1.00 0.20 O ATOM 395 OP2 DG A 13 -8.608 -7.792 0.271 1.00 0.17 O ATOM 396 O5' DG A 13 -9.223 -5.429 0.824 1.00 0.18 O ATOM 397 C5' DG A 13 -9.930 -4.429 1.564 1.00 0.22 C ATOM 398 C4' DG A 13 -9.896 -3.079 0.853 1.00 0.24 C ATOM 399 O4' DG A 13 -8.542 -2.670 0.686 1.00 0.26 O ATOM 400 C3' DG A 13 -10.535 -3.099 -0.541 1.00 0.22 C ATOM 401 O3' DG A 13 -11.695 -2.254 -0.558 1.00 0.33 O ATOM 402 C2' DG A 13 -9.469 -2.538 -1.483 1.00 0.21 C ATOM 403 C1' DG A 13 -8.448 -1.937 -0.528 1.00 0.20 C ATOM 404 N9 DG A 13 -7.053 -2.033 -0.999 1.00 0.16 N ATOM 405 C8 DG A 13 -6.257 -3.143 -1.091 1.00 0.17 C ATOM 406 N7 DG A 13 -5.059 -2.898 -1.535 1.00 0.19 N ATOM 407 C5 DG A 13 -5.054 -1.527 -1.754 1.00 0.19 C ATOM 408 C6 DG A 13 -4.015 -0.689 -2.238 1.00 0.23 C ATOM 409 O6 DG A 13 -2.873 -1.007 -2.567 1.00 0.27 O ATOM 410 N1 DG A 13 -4.424 0.637 -2.311 1.00 0.26 N ATOM 411 C2 DG A 13 -5.679 1.098 -1.962 1.00 0.26 C ATOM 412 N2 DG A 13 -5.893 2.405 -2.101 1.00 0.33 N ATOM 413 N3 DG A 13 -6.656 0.307 -1.506 1.00 0.23 N ATOM 414 C4 DG A 13 -6.273 -0.986 -1.428 1.00 0.18 C ATOM 0 H5' DG A 13 -9.490 -4.330 2.556 1.00 0.22 H new ATOM 0 H5'' DG A 13 -10.965 -4.742 1.704 1.00 0.22 H new ATOM 0 H4' DG A 13 -10.469 -2.396 1.480 1.00 0.24 H new ATOM 0 H3' DG A 13 -10.851 -4.101 -0.832 1.00 0.22 H new ATOM 0 H2' DG A 13 -9.029 -3.318 -2.105 1.00 0.21 H new ATOM 0 H2'' DG A 13 -9.881 -1.787 -2.157 1.00 0.21 H new ATOM 0 H1' DG A 13 -8.675 -0.876 -0.427 1.00 0.20 H new ATOM 0 H8 DG A 13 -6.593 -4.133 -0.819 1.00 0.17 H new ATOM 0 H1 DG A 13 -3.747 1.322 -2.648 1.00 0.26 H new ATOM 0 H21 DG A 13 -6.801 2.802 -1.859 1.00 0.33 H new ATOM 0 H22 DG A 13 -5.149 3.009 -2.450 1.00 0.33 H new ATOM 426 P DG A 14 -11.645 -0.738 -0.008 1.00 0.40 P ATOM 427 OP1 DG A 14 -12.763 0.013 -0.622 1.00 0.61 O ATOM 428 OP2 DG A 14 -10.260 -0.238 -0.143 1.00 0.56 O ATOM 429 O5' DG A 14 -11.966 -0.923 1.560 1.00 0.31 O ATOM 430 C5' DG A 14 -13.247 -1.397 1.985 1.00 0.35 C ATOM 431 C4' DG A 14 -13.807 -0.561 3.134 1.00 0.32 C ATOM 432 O4' DG A 14 -15.120 -1.022 3.466 1.00 0.43 O ATOM 433 C3' DG A 14 -12.968 -0.622 4.417 1.00 0.38 C ATOM 434 O3' DG A 14 -12.691 0.710 4.864 1.00 0.47 O ATOM 435 C2' DG A 14 -13.864 -1.328 5.429 1.00 0.47 C ATOM 436 C1' DG A 14 -15.245 -1.015 4.883 1.00 0.47 C ATOM 437 N9 DG A 14 -16.283 -1.996 5.252 1.00 0.57 N ATOM 438 C8 DG A 14 -16.188 -3.363 5.316 1.00 0.69 C ATOM 439 N7 DG A 14 -17.294 -3.953 5.674 1.00 0.80 N ATOM 440 C5 DG A 14 -18.189 -2.905 5.861 1.00 0.73 C ATOM 441 C6 DG A 14 -19.554 -2.932 6.256 1.00 0.80 C ATOM 442 O6 DG A 14 -20.250 -3.910 6.523 1.00 0.95 O ATOM 443 N1 DG A 14 -20.090 -1.654 6.324 1.00 0.70 N ATOM 444 C2 DG A 14 -19.402 -0.491 6.049 1.00 0.57 C ATOM 445 N2 DG A 14 -20.088 0.645 6.170 1.00 0.53 N ATOM 446 N3 DG A 14 -18.118 -0.463 5.677 1.00 0.52 N ATOM 447 C4 DG A 14 -17.579 -1.703 5.605 1.00 0.59 C ATOM 0 H5' DG A 14 -13.164 -2.437 2.299 1.00 0.35 H new ATOM 0 H5'' DG A 14 -13.941 -1.372 1.145 1.00 0.35 H new ATOM 0 H4' DG A 14 -13.802 0.469 2.776 1.00 0.32 H new ATOM 0 H3' DG A 14 -12.016 -1.135 4.276 1.00 0.38 H new ATOM 0 H2' DG A 14 -13.672 -2.400 5.468 1.00 0.47 H new ATOM 0 H2'' DG A 14 -13.725 -0.942 6.439 1.00 0.47 H new ATOM 0 H1' DG A 14 -15.565 -0.062 5.303 1.00 0.47 H new ATOM 0 H8 DG A 14 -15.279 -3.902 5.090 1.00 0.69 H new ATOM 0 H1 DG A 14 -21.069 -1.568 6.599 1.00 0.70 H new ATOM 0 H21 DG A 14 -19.633 1.538 5.980 1.00 0.53 H new ATOM 0 H22 DG A 14 -21.068 0.621 6.453 1.00 0.53 H new ATOM 459 P DG A 15 -12.239 0.987 6.385 1.00 0.41 P ATOM 460 OP1 DG A 15 -11.623 -0.248 6.918 1.00 0.49 O ATOM 461 OP2 DG A 15 -13.374 1.613 7.100 1.00 0.58 O ATOM 462 O5' DG A 15 -11.082 2.092 6.212 1.00 0.32 O ATOM 463 C5' DG A 15 -9.705 1.705 6.195 1.00 0.27 C ATOM 464 C4' DG A 15 -8.808 2.835 5.699 1.00 0.19 C ATOM 465 O4' DG A 15 -7.447 2.476 5.889 1.00 0.21 O ATOM 466 C3' DG A 15 -8.984 3.156 4.212 1.00 0.18 C ATOM 467 O3' DG A 15 -9.566 4.457 4.070 1.00 0.24 O ATOM 468 C2' DG A 15 -7.566 3.157 3.631 1.00 0.18 C ATOM 469 C1' DG A 15 -6.685 3.112 4.874 1.00 0.20 C ATOM 470 N9 DG A 15 -5.443 2.338 4.704 1.00 0.23 N ATOM 471 C8 DG A 15 -5.234 1.004 4.932 1.00 0.30 C ATOM 472 N7 DG A 15 -4.016 0.612 4.689 1.00 0.33 N ATOM 473 C5 DG A 15 -3.367 1.769 4.271 1.00 0.28 C ATOM 474 C6 DG A 15 -2.018 1.961 3.870 1.00 0.29 C ATOM 475 O6 DG A 15 -1.116 1.129 3.803 1.00 0.34 O ATOM 476 N1 DG A 15 -1.773 3.283 3.524 1.00 0.24 N ATOM 477 C2 DG A 15 -2.709 4.296 3.560 1.00 0.18 C ATOM 478 N2 DG A 15 -2.285 5.505 3.192 1.00 0.17 N ATOM 479 N3 DG A 15 -3.978 4.117 3.937 1.00 0.17 N ATOM 480 C4 DG A 15 -4.235 2.833 4.278 1.00 0.22 C ATOM 0 H5' DG A 15 -9.580 0.833 5.553 1.00 0.27 H new ATOM 0 H5'' DG A 15 -9.397 1.410 7.198 1.00 0.27 H new ATOM 0 H4' DG A 15 -9.095 3.715 6.274 1.00 0.19 H new ATOM 0 H3' DG A 15 -9.633 2.440 3.708 1.00 0.18 H new ATOM 0 H2' DG A 15 -7.395 2.297 2.984 1.00 0.18 H new ATOM 0 H2'' DG A 15 -7.375 4.049 3.034 1.00 0.18 H new ATOM 0 H1' DG A 15 -6.390 4.135 5.108 1.00 0.20 H new ATOM 0 H8 DG A 15 -6.009 0.338 5.282 1.00 0.30 H new ATOM 0 H1 DG A 15 -0.830 3.524 3.220 1.00 0.24 H new ATOM 0 H21 DG A 15 -2.930 6.295 3.197 1.00 0.17 H new ATOM 0 H22 DG A 15 -1.316 5.640 2.905 1.00 0.17 H new ATOM 492 P DG A 16 -10.218 4.907 2.667 1.00 0.30 P ATOM 493 OP1 DG A 16 -11.122 6.051 2.920 1.00 0.43 O ATOM 494 OP2 DG A 16 -10.734 3.697 1.989 1.00 0.36 O ATOM 495 O5' DG A 16 -8.947 5.444 1.839 1.00 0.25 O ATOM 496 C5' DG A 16 -8.496 6.793 1.996 1.00 0.20 C ATOM 497 C4' DG A 16 -7.313 7.098 1.081 1.00 0.16 C ATOM 498 O4' DG A 16 -6.239 6.204 1.370 1.00 0.17 O ATOM 499 C3' DG A 16 -7.630 6.954 -0.411 1.00 0.12 C ATOM 500 O3' DG A 16 -7.433 8.212 -1.062 1.00 0.21 O ATOM 501 C2' DG A 16 -6.616 5.936 -0.935 1.00 0.11 C ATOM 502 C1' DG A 16 -5.553 5.948 0.151 1.00 0.12 C ATOM 503 N9 DG A 16 -4.822 4.675 0.298 1.00 0.14 N ATOM 504 C8 DG A 16 -5.299 3.454 0.696 1.00 0.15 C ATOM 505 N7 DG A 16 -4.395 2.514 0.716 1.00 0.19 N ATOM 506 C5 DG A 16 -3.234 3.158 0.301 1.00 0.17 C ATOM 507 C6 DG A 16 -1.921 2.642 0.127 1.00 0.19 C ATOM 508 O6 DG A 16 -1.522 1.492 0.307 1.00 0.24 O ATOM 509 N1 DG A 16 -1.041 3.626 -0.306 1.00 0.18 N ATOM 510 C2 DG A 16 -1.380 4.943 -0.541 1.00 0.17 C ATOM 511 N2 DG A 16 -0.397 5.744 -0.953 1.00 0.19 N ATOM 512 N3 DG A 16 -2.615 5.428 -0.378 1.00 0.16 N ATOM 513 C4 DG A 16 -3.486 4.482 0.043 1.00 0.15 C ATOM 0 H5' DG A 16 -8.208 6.963 3.033 1.00 0.20 H new ATOM 0 H5'' DG A 16 -9.314 7.479 1.776 1.00 0.20 H new ATOM 0 H4' DG A 16 -7.054 8.139 1.275 1.00 0.16 H new ATOM 0 H3' DG A 16 -8.658 6.640 -0.591 1.00 0.12 H new ATOM 0 H2' DG A 16 -7.059 4.948 -1.059 1.00 0.11 H new ATOM 0 H2'' DG A 16 -6.211 6.228 -1.904 1.00 0.11 H new ATOM 0 H1' DG A 16 -4.807 6.698 -0.112 1.00 0.12 H new ATOM 0 H8 DG A 16 -6.330 3.285 0.969 1.00 0.15 H new ATOM 0 H1 DG A 16 -0.070 3.354 -0.462 1.00 0.18 H new ATOM 0 H21 DG A 16 -0.587 6.728 -1.143 1.00 0.19 H new ATOM 0 H22 DG A 16 0.545 5.373 -1.078 1.00 0.19 H new ATOM 525 P DG A 17 -7.633 8.350 -2.653 1.00 0.26 P ATOM 526 OP1 DG A 17 -8.022 9.747 -2.953 1.00 0.37 O ATOM 527 OP2 DG A 17 -8.489 7.233 -3.109 1.00 0.27 O ATOM 528 O5' DG A 17 -6.145 8.110 -3.219 1.00 0.26 O ATOM 529 C5' DG A 17 -5.125 9.091 -3.015 1.00 0.29 C ATOM 530 C4' DG A 17 -3.832 8.715 -3.734 1.00 0.24 C ATOM 531 O4' DG A 17 -3.346 7.468 -3.232 1.00 0.28 O ATOM 532 C3' DG A 17 -3.985 8.564 -5.252 1.00 0.28 C ATOM 533 O3' DG A 17 -3.043 9.417 -5.910 1.00 0.31 O ATOM 534 C2' DG A 17 -3.645 7.103 -5.531 1.00 0.32 C ATOM 535 C1' DG A 17 -2.795 6.746 -4.326 1.00 0.26 C ATOM 536 N9 DG A 17 -2.806 5.311 -3.977 1.00 0.28 N ATOM 537 C8 DG A 17 -3.855 4.534 -3.551 1.00 0.28 C ATOM 538 N7 DG A 17 -3.533 3.292 -3.326 1.00 0.32 N ATOM 539 C5 DG A 17 -2.176 3.236 -3.622 1.00 0.34 C ATOM 540 C6 DG A 17 -1.278 2.136 -3.564 1.00 0.40 C ATOM 541 O6 DG A 17 -1.516 0.976 -3.231 1.00 0.44 O ATOM 542 N1 DG A 17 0.005 2.506 -3.946 1.00 0.43 N ATOM 543 C2 DG A 17 0.376 3.780 -4.336 1.00 0.41 C ATOM 544 N2 DG A 17 1.656 3.950 -4.669 1.00 0.46 N ATOM 545 N3 DG A 17 -0.468 4.812 -4.390 1.00 0.34 N ATOM 546 C4 DG A 17 -1.723 4.468 -4.021 1.00 0.32 C ATOM 0 H5' DG A 17 -4.931 9.198 -1.948 1.00 0.29 H new ATOM 0 H5'' DG A 17 -5.474 10.059 -3.374 1.00 0.29 H new ATOM 0 H4' DG A 17 -3.143 9.538 -3.543 1.00 0.24 H new ATOM 0 H3' DG A 17 -4.981 8.831 -5.605 1.00 0.28 H new ATOM 0 H2' DG A 17 -4.538 6.482 -5.600 1.00 0.32 H new ATOM 0 H2'' DG A 17 -3.099 6.982 -6.467 1.00 0.32 H new ATOM 0 H1' DG A 17 -1.759 6.994 -4.555 1.00 0.26 H new ATOM 0 H8 DG A 17 -4.855 4.918 -3.415 1.00 0.28 H new ATOM 0 H1 DG A 17 0.727 1.785 -3.938 1.00 0.43 H new ATOM 0 H21 DG A 17 1.988 4.868 -4.965 1.00 0.46 H new ATOM 0 H22 DG A 17 2.303 3.162 -4.628 1.00 0.46 H new ATOM 558 P DT A 18 -2.952 9.454 -7.518 1.00 0.47 P ATOM 559 OP1 DT A 18 -2.661 10.845 -7.934 1.00 0.55 O ATOM 560 OP2 DT A 18 -4.135 8.752 -8.066 1.00 0.63 O ATOM 561 O5' DT A 18 -1.650 8.556 -7.819 1.00 0.48 O ATOM 562 C5' DT A 18 -0.348 9.029 -7.461 1.00 0.50 C ATOM 563 C4' DT A 18 0.753 8.160 -8.062 1.00 0.51 C ATOM 564 O4' DT A 18 0.646 6.824 -7.550 1.00 0.50 O ATOM 565 C3' DT A 18 0.703 8.064 -9.590 1.00 0.56 C ATOM 566 O3' DT A 18 2.016 8.161 -10.157 1.00 0.68 O ATOM 567 C2' DT A 18 0.102 6.688 -9.830 1.00 0.50 C ATOM 568 C1' DT A 18 0.674 5.922 -8.653 1.00 0.48 C ATOM 569 N1 DT A 18 -0.084 4.712 -8.276 1.00 0.43 N ATOM 570 C2 DT A 18 0.617 3.522 -8.203 1.00 0.44 C ATOM 571 O2 DT A 18 1.821 3.457 -8.443 1.00 0.49 O ATOM 572 N3 DT A 18 -0.116 2.406 -7.844 1.00 0.45 N ATOM 573 C4 DT A 18 -1.470 2.377 -7.556 1.00 0.45 C ATOM 574 O4 DT A 18 -2.023 1.324 -7.246 1.00 0.52 O ATOM 575 C5 DT A 18 -2.118 3.665 -7.657 1.00 0.40 C ATOM 576 C7 DT A 18 -3.611 3.778 -7.367 1.00 0.42 C ATOM 577 C6 DT A 18 -1.426 4.769 -8.006 1.00 0.40 C ATOM 0 H5' DT A 18 -0.251 9.040 -6.375 1.00 0.50 H new ATOM 0 H5'' DT A 18 -0.228 10.057 -7.803 1.00 0.50 H new ATOM 0 H4' DT A 18 1.691 8.640 -7.783 1.00 0.51 H new ATOM 0 H3' DT A 18 0.129 8.868 -10.051 1.00 0.56 H new ATOM 0 H2' DT A 18 -0.988 6.705 -9.822 1.00 0.50 H new ATOM 0 H2'' DT A 18 0.407 6.264 -10.787 1.00 0.50 H new ATOM 0 HO3' DT A 18 1.957 8.095 -11.133 1.00 0.68 H new ATOM 0 H1' DT A 18 1.669 5.574 -8.930 1.00 0.48 H new ATOM 0 H3 DT A 18 0.388 1.521 -7.786 1.00 0.45 H new ATOM 0 H71 DT A 18 -4.104 2.841 -7.626 1.00 0.42 H new ATOM 0 H72 DT A 18 -3.761 3.986 -6.308 1.00 0.42 H new ATOM 0 H73 DT A 18 -4.037 4.588 -7.960 1.00 0.42 H new ATOM 0 H6 DT A 18 -1.940 5.716 -8.074 1.00 0.40 H new TER 591 DT A 18