USER MOD reduce.3.24.130724 H: found=0, std=0, add=102, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 102 hydrogens (8 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 Set 1.1: A 1 DC O5' : rot -83:sc= 1.19 USER MOD Set 1.2: A 9 DG O3' : rot 180:sc= 1.01 USER MOD Single : A 2 DT C7 :methyl 150:sc= -0.105 (180deg=-0.105) USER MOD Single : A 3 DT C7 :methyl 150:sc= -0.0666 (180deg=-0.0666) USER MOD Single : A 7 DT C7 :methyl 150:sc= -1.58! (180deg=-1.58!) USER MOD Single : A 8 DT C7 :methyl -30:sc= 0 (180deg=-0.143) USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -9.489 -5.035 12.696 1.00 0.00 O ATOM 2 C5' DC A 1 -8.856 -6.201 12.177 1.00 0.00 C ATOM 3 C4' DC A 1 -7.518 -5.858 11.507 1.00 0.00 C ATOM 4 O4' DC A 1 -6.512 -5.680 12.478 1.00 0.00 O ATOM 5 C3' DC A 1 -6.966 -6.929 10.552 1.00 0.00 C ATOM 6 O3' DC A 1 -7.197 -6.555 9.209 1.00 0.00 O ATOM 7 C2' DC A 1 -5.466 -6.979 10.874 1.00 0.00 C ATOM 8 C1' DC A 1 -5.292 -5.785 11.799 1.00 0.00 C ATOM 9 N1 DC A 1 -4.151 -5.973 12.713 1.00 0.00 N ATOM 10 C2 DC A 1 -2.941 -5.355 12.397 1.00 0.00 C ATOM 11 O2 DC A 1 -2.841 -4.627 11.413 1.00 0.00 O ATOM 12 N3 DC A 1 -1.841 -5.592 13.153 1.00 0.00 N ATOM 13 C4 DC A 1 -1.912 -6.475 14.131 1.00 0.00 C ATOM 14 N4 DC A 1 -0.800 -6.680 14.792 1.00 0.00 N ATOM 15 C5 DC A 1 -3.107 -7.194 14.431 1.00 0.00 C ATOM 16 C6 DC A 1 -4.218 -6.893 13.722 1.00 0.00 C ATOM 0 H5' DC A 1 -9.514 -6.683 11.454 1.00 0.00 H new ATOM 0 H5'' DC A 1 -8.689 -6.916 12.983 1.00 0.00 H new ATOM 0 H4' DC A 1 -7.746 -4.958 10.936 1.00 0.00 H new ATOM 0 H3' DC A 1 -7.442 -7.901 10.677 1.00 0.00 H new ATOM 0 H2' DC A 1 -5.185 -7.914 11.360 1.00 0.00 H new ATOM 0 H2'' DC A 1 -4.854 -6.890 9.976 1.00 0.00 H new ATOM 0 HO5' DC A 1 -9.114 -4.824 13.577 1.00 0.00 H new ATOM 0 H1' DC A 1 -5.061 -4.869 11.256 1.00 0.00 H new ATOM 0 H41 DC A 1 -0.780 -7.349 15.562 1.00 0.00 H new ATOM 0 H42 DC A 1 0.046 -6.170 14.537 1.00 0.00 H new ATOM 0 H5 DC A 1 -3.124 -7.953 15.199 1.00 0.00 H new ATOM 0 H6 DC A 1 -5.155 -7.378 13.952 1.00 0.00 H new ATOM 29 P DT A 2 -6.889 -7.562 8.000 1.00 0.00 P ATOM 30 OP1 DT A 2 -7.545 -7.046 6.781 1.00 0.00 O ATOM 31 OP2 DT A 2 -7.301 -8.927 8.386 1.00 0.00 O ATOM 32 O5' DT A 2 -5.293 -7.501 7.821 1.00 0.00 O ATOM 33 C5' DT A 2 -4.651 -8.059 6.695 1.00 0.00 C ATOM 34 C4' DT A 2 -3.224 -7.514 6.511 1.00 0.00 C ATOM 35 O4' DT A 2 -3.273 -6.111 6.322 1.00 0.00 O ATOM 36 C3' DT A 2 -2.311 -7.816 7.705 1.00 0.00 C ATOM 37 O3' DT A 2 -1.187 -8.619 7.319 1.00 0.00 O ATOM 38 C2' DT A 2 -1.979 -6.437 8.294 1.00 0.00 C ATOM 39 C1' DT A 2 -2.310 -5.478 7.147 1.00 0.00 C ATOM 40 N1 DT A 2 -2.869 -4.196 7.639 1.00 0.00 N ATOM 41 C2 DT A 2 -2.043 -3.072 7.650 1.00 0.00 C ATOM 42 O2 DT A 2 -0.841 -3.108 7.408 1.00 0.00 O ATOM 43 N3 DT A 2 -2.606 -1.890 8.070 1.00 0.00 N ATOM 44 C4 DT A 2 -3.872 -1.752 8.600 1.00 0.00 C ATOM 45 O4 DT A 2 -4.215 -0.649 9.011 1.00 0.00 O ATOM 46 C5 DT A 2 -4.670 -2.977 8.617 1.00 0.00 C ATOM 47 C7 DT A 2 -6.087 -2.956 9.159 1.00 0.00 C ATOM 48 C6 DT A 2 -4.154 -4.138 8.134 1.00 0.00 C ATOM 0 H5' DT A 2 -5.238 -7.846 5.801 1.00 0.00 H new ATOM 0 H5'' DT A 2 -4.613 -9.143 6.800 1.00 0.00 H new ATOM 0 H4' DT A 2 -2.806 -8.015 5.638 1.00 0.00 H new ATOM 0 H3' DT A 2 -2.778 -8.434 8.472 1.00 0.00 H new ATOM 0 H2' DT A 2 -2.575 -6.224 9.182 1.00 0.00 H new ATOM 0 H2'' DT A 2 -0.932 -6.366 8.589 1.00 0.00 H new ATOM 0 H1' DT A 2 -1.393 -5.251 6.603 1.00 0.00 H new ATOM 0 H3 DT A 2 -2.041 -1.045 7.982 1.00 0.00 H new ATOM 0 H71 DT A 2 -6.684 -3.711 8.647 1.00 0.00 H new ATOM 0 H72 DT A 2 -6.071 -3.170 10.228 1.00 0.00 H new ATOM 0 H73 DT A 2 -6.526 -1.972 8.992 1.00 0.00 H new ATOM 0 H6 DT A 2 -4.762 -5.031 8.138 1.00 0.00 H new ATOM 61 P DT A 3 0.117 -8.093 6.506 1.00 0.00 P ATOM 62 OP1 DT A 3 -0.207 -6.951 5.637 1.00 0.00 O ATOM 63 OP2 DT A 3 0.893 -9.209 5.921 1.00 0.00 O ATOM 64 O5' DT A 3 1.052 -7.571 7.680 1.00 0.00 O ATOM 65 C5' DT A 3 1.536 -6.244 7.765 1.00 0.00 C ATOM 66 C4' DT A 3 2.473 -6.188 8.965 1.00 0.00 C ATOM 67 O4' DT A 3 1.809 -6.382 10.194 1.00 0.00 O ATOM 68 C3' DT A 3 3.590 -7.258 8.849 1.00 0.00 C ATOM 69 O3' DT A 3 4.912 -6.790 8.632 1.00 0.00 O ATOM 70 C2' DT A 3 3.503 -8.046 10.150 1.00 0.00 C ATOM 71 C1' DT A 3 2.557 -7.243 11.037 1.00 0.00 C ATOM 72 N1 DT A 3 1.601 -8.119 11.764 1.00 0.00 N ATOM 73 C2 DT A 3 1.937 -8.590 13.035 1.00 0.00 C ATOM 74 O2 DT A 3 3.045 -8.454 13.541 1.00 0.00 O ATOM 75 N3 DT A 3 0.942 -9.250 13.730 1.00 0.00 N ATOM 76 C4 DT A 3 -0.364 -9.418 13.310 1.00 0.00 C ATOM 77 O4 DT A 3 -1.171 -9.909 14.093 1.00 0.00 O ATOM 78 C5 DT A 3 -0.627 -8.946 11.951 1.00 0.00 C ATOM 79 C7 DT A 3 -2.013 -8.992 11.336 1.00 0.00 C ATOM 80 C6 DT A 3 0.359 -8.368 11.226 1.00 0.00 C ATOM 0 H5' DT A 3 0.713 -5.540 7.885 1.00 0.00 H new ATOM 0 H5'' DT A 3 2.062 -5.966 6.852 1.00 0.00 H new ATOM 0 H4' DT A 3 2.898 -5.184 8.955 1.00 0.00 H new ATOM 0 H3' DT A 3 3.410 -7.842 7.947 1.00 0.00 H new ATOM 0 H2' DT A 3 3.122 -9.053 9.977 1.00 0.00 H new ATOM 0 H2'' DT A 3 4.484 -8.152 10.613 1.00 0.00 H new ATOM 0 H1' DT A 3 3.147 -6.698 11.774 1.00 0.00 H new ATOM 0 H3 DT A 3 1.194 -9.649 14.634 1.00 0.00 H new ATOM 0 H71 DT A 3 -2.121 -8.177 10.621 1.00 0.00 H new ATOM 0 H72 DT A 3 -2.153 -9.944 10.824 1.00 0.00 H new ATOM 0 H73 DT A 3 -2.763 -8.888 12.120 1.00 0.00 H new ATOM 0 H6 DT A 3 0.166 -8.095 10.199 1.00 0.00 H new ATOM 93 P DG A 4 5.394 -6.250 7.187 1.00 0.00 P ATOM 94 OP1 DG A 4 4.506 -6.830 6.145 1.00 0.00 O ATOM 95 OP2 DG A 4 6.869 -6.378 7.082 1.00 0.00 O ATOM 96 O5' DG A 4 5.103 -4.687 7.337 1.00 0.00 O ATOM 97 C5' DG A 4 5.649 -4.005 8.450 1.00 0.00 C ATOM 98 C4' DG A 4 5.446 -2.495 8.378 1.00 0.00 C ATOM 99 O4' DG A 4 4.101 -2.172 8.699 1.00 0.00 O ATOM 100 C3' DG A 4 6.344 -1.803 9.416 1.00 0.00 C ATOM 101 O3' DG A 4 7.421 -1.056 8.883 1.00 0.00 O ATOM 102 C2' DG A 4 5.384 -0.810 10.024 1.00 0.00 C ATOM 103 C1' DG A 4 4.066 -1.540 9.964 1.00 0.00 C ATOM 104 N9 DG A 4 3.866 -2.516 11.065 1.00 0.00 N ATOM 105 C8 DG A 4 4.666 -2.897 12.122 1.00 0.00 C ATOM 106 N7 DG A 4 4.080 -3.719 12.953 1.00 0.00 N ATOM 107 C5 DG A 4 2.778 -3.843 12.452 1.00 0.00 C ATOM 108 C6 DG A 4 1.602 -4.517 12.942 1.00 0.00 C ATOM 109 O6 DG A 4 1.445 -5.226 13.937 1.00 0.00 O ATOM 110 N1 DG A 4 0.489 -4.300 12.151 1.00 0.00 N ATOM 111 C2 DG A 4 0.504 -3.593 10.988 1.00 0.00 C ATOM 112 N2 DG A 4 -0.579 -3.560 10.261 1.00 0.00 N ATOM 113 N3 DG A 4 1.563 -2.966 10.506 1.00 0.00 N ATOM 114 C4 DG A 4 2.662 -3.117 11.290 1.00 0.00 C ATOM 0 H5' DG A 4 6.716 -4.221 8.515 1.00 0.00 H new ATOM 0 H5'' DG A 4 5.191 -4.385 9.363 1.00 0.00 H new ATOM 0 H4' DG A 4 5.691 -2.163 7.369 1.00 0.00 H new ATOM 0 H3' DG A 4 6.806 -2.543 10.069 1.00 0.00 H new ATOM 0 H2' DG A 4 5.659 -0.556 11.048 1.00 0.00 H new ATOM 0 H2'' DG A 4 5.356 0.123 9.460 1.00 0.00 H new ATOM 0 H1' DG A 4 3.225 -0.858 10.088 1.00 0.00 H new ATOM 0 H8 DG A 4 5.680 -2.549 12.251 1.00 0.00 H new ATOM 0 H1 DG A 4 -0.400 -4.695 12.459 1.00 0.00 H new ATOM 0 H21 DG A 4 -0.590 -3.036 9.386 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.415 -4.058 10.568 1.00 0.00 H new HETATM 126 O5' 3DR A 5 9.100 -1.991 10.475 1.00 0.00 O HETATM 127 P 3DR A 5 8.911 -1.624 8.909 1.00 0.00 P HETATM 128 OP1 3DR A 5 9.784 -0.471 8.579 1.00 0.00 O HETATM 129 OP2 3DR A 5 8.932 -2.874 8.105 1.00 0.00 O HETATM 130 C2' 3DR A 5 7.914 1.471 13.675 1.00 0.00 C HETATM 131 C5' 3DR A 5 9.446 -1.030 11.469 1.00 0.00 C HETATM 132 C4' 3DR A 5 8.297 -0.081 11.868 1.00 0.00 C HETATM 133 O4' 3DR A 5 7.445 -0.662 12.852 1.00 0.00 O HETATM 134 C1' 3DR A 5 7.649 0.026 14.075 1.00 0.00 C HETATM 135 C3' 3DR A 5 8.824 1.227 12.473 1.00 0.00 C HETATM 136 O3' 3DR A 5 8.934 2.270 11.508 1.00 0.00 O HETATM 0 H5'' 3DR A 5 9.792 -1.555 12.359 1.00 0.00 H new HETATM 0 H4'1 3DR A 5 7.749 0.109 10.945 1.00 0.00 H new HETATM 0 H2'' 3DR A 5 7.003 2.008 13.411 1.00 0.00 H new HETATM 0 H1'2 3DR A 5 8.491 -0.391 14.627 1.00 0.00 H new HETATM 0 H1'1 3DR A 5 6.775 -0.051 14.721 1.00 0.00 H new HETATM 0 H5' 3DR A 5 10.283 -0.434 11.105 1.00 0.00 H new HETATM 0 H3' 3DR A 5 9.858 1.180 12.814 1.00 0.00 H new HETATM 0 H2' 3DR A 5 8.403 2.043 14.464 1.00 0.00 H new ATOM 145 P DC A 6 7.741 3.220 10.958 1.00 0.00 P ATOM 146 OP1 DC A 6 8.192 3.533 9.584 1.00 0.00 O ATOM 147 OP2 DC A 6 7.423 4.310 11.915 1.00 0.00 O ATOM 148 O5' DC A 6 6.421 2.332 10.787 1.00 0.00 O ATOM 149 C5' DC A 6 5.440 2.688 9.821 1.00 0.00 C ATOM 150 C4' DC A 6 4.020 2.608 10.391 1.00 0.00 C ATOM 151 O4' DC A 6 3.704 1.356 10.976 1.00 0.00 O ATOM 152 C3' DC A 6 3.793 3.671 11.462 1.00 0.00 C ATOM 153 O3' DC A 6 2.889 4.652 10.976 1.00 0.00 O ATOM 154 C2' DC A 6 3.265 2.889 12.661 1.00 0.00 C ATOM 155 C1' DC A 6 2.798 1.579 12.031 1.00 0.00 C ATOM 156 N1 DC A 6 2.791 0.437 12.988 1.00 0.00 N ATOM 157 C2 DC A 6 1.588 -0.239 13.226 1.00 0.00 C ATOM 158 O2 DC A 6 0.562 0.037 12.610 1.00 0.00 O ATOM 159 N3 DC A 6 1.533 -1.227 14.158 1.00 0.00 N ATOM 160 C4 DC A 6 2.622 -1.520 14.851 1.00 0.00 C ATOM 161 N4 DC A 6 2.533 -2.519 15.691 1.00 0.00 N ATOM 162 C5 DC A 6 3.859 -0.836 14.676 1.00 0.00 C ATOM 163 C6 DC A 6 3.915 0.115 13.711 1.00 0.00 C ATOM 0 H5' DC A 6 5.523 2.026 8.959 1.00 0.00 H new ATOM 0 H5'' DC A 6 5.632 3.700 9.465 1.00 0.00 H new ATOM 0 H4' DC A 6 3.374 2.764 9.527 1.00 0.00 H new ATOM 0 H3' DC A 6 4.688 4.227 11.739 1.00 0.00 H new ATOM 0 H2' DC A 6 4.040 2.724 13.410 1.00 0.00 H new ATOM 0 H2'' DC A 6 2.448 3.413 13.158 1.00 0.00 H new ATOM 0 H1' DC A 6 1.763 1.652 11.696 1.00 0.00 H new ATOM 0 H41 DC A 6 3.342 -2.788 16.251 1.00 0.00 H new ATOM 0 H42 DC A 6 1.655 -3.029 15.786 1.00 0.00 H new ATOM 0 H5 DC A 6 4.719 -1.066 15.288 1.00 0.00 H new ATOM 0 H6 DC A 6 4.847 0.622 13.509 1.00 0.00 H new ATOM 175 P DT A 7 2.634 6.018 11.780 1.00 0.00 P ATOM 176 OP1 DT A 7 2.195 7.021 10.782 1.00 0.00 O ATOM 177 OP2 DT A 7 3.846 6.269 12.604 1.00 0.00 O ATOM 178 O5' DT A 7 1.380 5.587 12.702 1.00 0.00 O ATOM 179 C5' DT A 7 0.171 6.336 12.760 1.00 0.00 C ATOM 180 C4' DT A 7 -1.018 5.501 13.271 1.00 0.00 C ATOM 181 O4' DT A 7 -1.538 4.712 12.225 1.00 0.00 O ATOM 182 C3' DT A 7 -0.700 4.592 14.468 1.00 0.00 C ATOM 183 O3' DT A 7 -1.552 4.797 15.606 1.00 0.00 O ATOM 184 C2' DT A 7 -0.726 3.200 13.830 1.00 0.00 C ATOM 185 C1' DT A 7 -1.707 3.382 12.677 1.00 0.00 C ATOM 186 N1 DT A 7 -1.421 2.496 11.537 1.00 0.00 N ATOM 187 C2 DT A 7 -2.329 1.488 11.214 1.00 0.00 C ATOM 188 O2 DT A 7 -3.275 1.156 11.923 1.00 0.00 O ATOM 189 N3 DT A 7 -2.125 0.840 10.020 1.00 0.00 N ATOM 190 C4 DT A 7 -1.125 1.113 9.109 1.00 0.00 C ATOM 191 O4 DT A 7 -1.092 0.468 8.067 1.00 0.00 O ATOM 192 C5 DT A 7 -0.229 2.199 9.508 1.00 0.00 C ATOM 193 C7 DT A 7 0.830 2.749 8.585 1.00 0.00 C ATOM 194 C6 DT A 7 -0.391 2.825 10.696 1.00 0.00 C ATOM 0 H5' DT A 7 -0.061 6.722 11.768 1.00 0.00 H new ATOM 0 H5'' DT A 7 0.312 7.198 13.412 1.00 0.00 H new ATOM 0 H4' DT A 7 -1.748 6.230 13.624 1.00 0.00 H new ATOM 0 H3' DT A 7 0.260 4.797 14.942 1.00 0.00 H new ATOM 0 H2' DT A 7 0.260 2.896 13.479 1.00 0.00 H new ATOM 0 H2'' DT A 7 -1.063 2.438 14.533 1.00 0.00 H new ATOM 0 H1' DT A 7 -2.712 3.152 13.032 1.00 0.00 H new ATOM 0 H3 DT A 7 -2.772 0.088 9.785 1.00 0.00 H new ATOM 0 H71 DT A 7 0.999 3.802 8.812 1.00 0.00 H new ATOM 0 H72 DT A 7 1.758 2.194 8.724 1.00 0.00 H new ATOM 0 H73 DT A 7 0.499 2.649 7.551 1.00 0.00 H new ATOM 0 H6 DT A 7 0.304 3.598 10.987 1.00 0.00 H new ATOM 207 P DT A 8 -3.095 4.312 15.750 1.00 0.00 P ATOM 208 OP1 DT A 8 -3.821 4.493 14.483 1.00 0.00 O ATOM 209 OP2 DT A 8 -3.704 4.863 16.984 1.00 0.00 O ATOM 210 O5' DT A 8 -2.937 2.747 16.042 1.00 0.00 O ATOM 211 C5' DT A 8 -3.775 1.755 15.467 1.00 0.00 C ATOM 212 C4' DT A 8 -3.739 0.504 16.356 1.00 0.00 C ATOM 213 O4' DT A 8 -2.469 -0.122 16.238 1.00 0.00 O ATOM 214 C3' DT A 8 -3.956 0.871 17.837 1.00 0.00 C ATOM 215 O3' DT A 8 -5.001 0.143 18.457 1.00 0.00 O ATOM 216 C2' DT A 8 -2.624 0.575 18.502 1.00 0.00 C ATOM 217 C1' DT A 8 -1.935 -0.369 17.523 1.00 0.00 C ATOM 218 N1 DT A 8 -0.462 -0.158 17.522 1.00 0.00 N ATOM 219 C2 DT A 8 0.337 -1.100 18.180 1.00 0.00 C ATOM 220 O2 DT A 8 -0.105 -2.123 18.709 1.00 0.00 O ATOM 221 N3 DT A 8 1.691 -0.842 18.224 1.00 0.00 N ATOM 222 C4 DT A 8 2.326 0.241 17.650 1.00 0.00 C ATOM 223 O4 DT A 8 3.548 0.311 17.730 1.00 0.00 O ATOM 224 C5 DT A 8 1.435 1.198 17.000 1.00 0.00 C ATOM 225 C7 DT A 8 2.014 2.452 16.371 1.00 0.00 C ATOM 226 C6 DT A 8 0.090 0.981 16.966 1.00 0.00 C ATOM 0 H5' DT A 8 -3.437 1.512 14.460 1.00 0.00 H new ATOM 0 H5'' DT A 8 -4.796 2.127 15.380 1.00 0.00 H new ATOM 0 H4' DT A 8 -4.536 -0.165 16.030 1.00 0.00 H new ATOM 0 H3' DT A 8 -4.264 1.912 17.931 1.00 0.00 H new ATOM 0 H2' DT A 8 -2.043 1.484 18.658 1.00 0.00 H new ATOM 0 H2'' DT A 8 -2.758 0.111 19.479 1.00 0.00 H new ATOM 0 H1' DT A 8 -2.112 -1.403 17.819 1.00 0.00 H new ATOM 0 H3 DT A 8 2.275 -1.511 18.725 1.00 0.00 H new ATOM 0 H71 DT A 8 2.913 2.749 16.912 1.00 0.00 H new ATOM 0 H72 DT A 8 2.266 2.253 15.329 1.00 0.00 H new ATOM 0 H73 DT A 8 1.279 3.256 16.419 1.00 0.00 H new ATOM 0 H6 DT A 8 -0.555 1.710 16.498 1.00 0.00 H new ATOM 239 P DG A 9 -6.549 0.552 18.236 1.00 0.00 P ATOM 240 OP1 DG A 9 -6.579 1.962 17.765 1.00 0.00 O ATOM 241 OP2 DG A 9 -7.307 0.158 19.439 1.00 0.00 O ATOM 242 O5' DG A 9 -6.992 -0.404 17.020 1.00 0.00 O ATOM 243 C5' DG A 9 -7.092 -1.806 17.200 1.00 0.00 C ATOM 244 C4' DG A 9 -7.576 -2.467 15.895 1.00 0.00 C ATOM 245 O4' DG A 9 -6.525 -2.518 14.949 1.00 0.00 O ATOM 246 C3' DG A 9 -8.075 -3.919 16.044 1.00 0.00 C ATOM 247 O3' DG A 9 -9.222 -4.173 15.239 1.00 0.00 O ATOM 248 C2' DG A 9 -6.944 -4.798 15.519 1.00 0.00 C ATOM 249 C1' DG A 9 -5.920 -3.796 14.958 1.00 0.00 C ATOM 250 N9 DG A 9 -4.601 -3.759 15.641 1.00 0.00 N ATOM 251 C8 DG A 9 -4.172 -4.383 16.794 1.00 0.00 C ATOM 252 N7 DG A 9 -2.884 -4.318 17.002 1.00 0.00 N ATOM 253 C5 DG A 9 -2.427 -3.594 15.899 1.00 0.00 C ATOM 254 C6 DG A 9 -1.096 -3.226 15.529 1.00 0.00 C ATOM 255 O6 DG A 9 -0.056 -3.514 16.118 1.00 0.00 O ATOM 256 N1 DG A 9 -1.033 -2.439 14.400 1.00 0.00 N ATOM 257 C2 DG A 9 -2.129 -2.052 13.690 1.00 0.00 C ATOM 258 N2 DG A 9 -1.923 -1.149 12.766 1.00 0.00 N ATOM 259 N3 DG A 9 -3.379 -2.432 13.968 1.00 0.00 N ATOM 260 C4 DG A 9 -3.468 -3.201 15.095 1.00 0.00 C ATOM 0 H5' DG A 9 -7.786 -2.029 18.010 1.00 0.00 H new ATOM 0 H5'' DG A 9 -6.123 -2.215 17.488 1.00 0.00 H new ATOM 0 H4' DG A 9 -8.412 -1.842 15.582 1.00 0.00 H new ATOM 0 H3' DG A 9 -8.343 -4.112 17.083 1.00 0.00 H new ATOM 0 H2' DG A 9 -6.512 -5.408 16.312 1.00 0.00 H new ATOM 0 H2'' DG A 9 -7.296 -5.482 14.747 1.00 0.00 H new ATOM 0 HO3' DG A 9 -9.507 -5.103 15.359 1.00 0.00 H new ATOM 0 H1' DG A 9 -5.668 -4.137 13.954 1.00 0.00 H new ATOM 0 H8 DG A 9 -4.847 -4.885 17.471 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.116 -2.129 14.078 1.00 0.00 H new ATOM 0 H21 DG A 9 -2.701 -0.815 12.197 1.00 0.00 H new ATOM 0 H22 DG A 9 -0.984 -0.779 12.614 1.00 0.00 H new TER 273 DG A 9 HETATM 274 NA NA A 101 -0.753 -4.272 18.225 1.00 0.00 NA HETATM 275 NA NA A 102 6.064 5.919 12.682 1.00 0.00 NA HETATM 276 NA NA A 103 2.795 -8.069 5.420 1.00 0.00 NA HETATM 277 NA NA A 104 -5.707 3.964 17.382 1.00 0.00 NA HETATM 278 NA NA A 105 9.347 1.692 8.929 1.00 0.00 NA HETATM 279 NA NA A 106 8.492 -4.850 7.183 1.00 0.00 NA HETATM 280 NA NA A 107 -8.829 -8.947 6.646 1.00 0.00 NA HETATM 281 NA NA A 108 1.526 7.826 8.876 1.00 0.00 NA