USER MOD reduce.3.24.130724 H: found=0, std=0, add=198, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 196 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 DG O5' : rot 180:sc= 0 USER MOD Single : A 3 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT C7 :methyl 150:sc= -4.16! (180deg=-4.16!) USER MOD Single : A 5 DT C7 :methyl -30:sc= -4.71! (180deg=-5.92!) USER MOD Single : A 8 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 9 DT C7 :methyl 150:sc= -0.0159 (180deg=-0.0159) USER MOD Single : A 10 DT C7 :methyl -30:sc= -0.699 (180deg=-1.48) USER MOD Single : A 11 DT C7 :methyl -30:sc= -15.1! (180deg=-16.7!) USER MOD Single : A 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 15 DT C7 :methyl -30:sc= -1.41 (180deg=-2.93!) USER MOD Single : A 17 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 0.515 -2.518 -9.690 1.00 0.41 O ATOM 2 C5' DG A 1 -0.290 -2.690 -8.521 1.00 0.34 C ATOM 3 C4' DG A 1 -1.772 -2.638 -8.853 1.00 0.25 C ATOM 4 O4' DG A 1 -2.512 -3.025 -7.691 1.00 0.23 O ATOM 5 C3' DG A 1 -2.263 -1.248 -9.245 1.00 0.21 C ATOM 6 O3' DG A 1 -3.440 -1.359 -10.066 1.00 0.21 O ATOM 7 C2' DG A 1 -2.618 -0.658 -7.895 1.00 0.19 C ATOM 8 C1' DG A 1 -3.193 -1.876 -7.183 1.00 0.18 C ATOM 9 N9 DG A 1 -3.039 -1.856 -5.722 1.00 0.17 N ATOM 10 C8 DG A 1 -4.020 -1.874 -4.792 1.00 0.17 C ATOM 11 N7 DG A 1 -3.624 -1.818 -3.562 1.00 0.17 N ATOM 12 C5 DG A 1 -2.242 -1.758 -3.680 1.00 0.15 C ATOM 13 C6 DG A 1 -1.256 -1.682 -2.668 1.00 0.15 C ATOM 14 O6 DG A 1 -1.424 -1.662 -1.459 1.00 0.18 O ATOM 15 N1 DG A 1 0.020 -1.638 -3.199 1.00 0.16 N ATOM 16 C2 DG A 1 0.313 -1.664 -4.546 1.00 0.17 C ATOM 17 N2 DG A 1 1.598 -1.599 -4.872 1.00 0.19 N ATOM 18 N3 DG A 1 -0.613 -1.740 -5.507 1.00 0.17 N ATOM 19 C4 DG A 1 -1.867 -1.782 -5.002 1.00 0.16 C ATOM 0 H5' DG A 1 -0.051 -1.912 -7.796 1.00 0.34 H new ATOM 0 H5'' DG A 1 -0.054 -3.646 -8.053 1.00 0.34 H new ATOM 0 H4' DG A 1 -1.922 -3.304 -9.703 1.00 0.25 H new ATOM 0 H3' DG A 1 -1.544 -0.658 -9.814 1.00 0.21 H new ATOM 0 H2' DG A 1 -1.746 -0.254 -7.380 1.00 0.19 H new ATOM 0 H2'' DG A 1 -3.343 0.151 -7.977 1.00 0.19 H new ATOM 0 HO5' DG A 1 1.463 -2.555 -9.443 1.00 0.41 H new ATOM 0 H1' DG A 1 -4.266 -1.886 -7.375 1.00 0.18 H new ATOM 0 H8 DG A 1 -5.065 -1.931 -5.058 1.00 0.17 H new ATOM 0 H1 DG A 1 0.802 -1.582 -2.546 1.00 0.16 H new ATOM 0 H21 DG A 1 1.877 -1.614 -5.853 1.00 0.19 H new ATOM 0 H22 DG A 1 2.307 -1.534 -4.141 1.00 0.19 H new ATOM 31 P DG A 2 -4.086 -0.062 -10.779 1.00 0.22 P ATOM 32 OP1 DG A 2 -5.135 -0.517 -11.720 1.00 0.28 O ATOM 33 OP2 DG A 2 -2.977 0.791 -11.262 1.00 0.28 O ATOM 34 O5' DG A 2 -4.794 0.691 -9.547 1.00 0.21 O ATOM 35 C5' DG A 2 -5.838 0.057 -8.796 1.00 0.21 C ATOM 36 C4' DG A 2 -6.107 0.800 -7.491 1.00 0.20 C ATOM 37 O4' DG A 2 -5.106 0.473 -6.512 1.00 0.21 O ATOM 38 C3' DG A 2 -6.099 2.328 -7.648 1.00 0.19 C ATOM 39 O3' DG A 2 -7.369 2.860 -7.248 1.00 0.29 O ATOM 40 C2' DG A 2 -5.008 2.792 -6.687 1.00 0.16 C ATOM 41 C1' DG A 2 -4.926 1.633 -5.714 1.00 0.17 C ATOM 42 N9 DG A 2 -3.644 1.543 -4.980 1.00 0.16 N ATOM 43 C8 DG A 2 -2.368 1.679 -5.451 1.00 0.16 C ATOM 44 N7 DG A 2 -1.438 1.675 -4.545 1.00 0.19 N ATOM 45 C5 DG A 2 -2.151 1.517 -3.360 1.00 0.19 C ATOM 46 C6 DG A 2 -1.680 1.444 -2.023 1.00 0.22 C ATOM 47 O6 DG A 2 -0.527 1.527 -1.622 1.00 0.26 O ATOM 48 N1 DG A 2 -2.721 1.282 -1.123 1.00 0.23 N ATOM 49 C2 DG A 2 -4.052 1.198 -1.466 1.00 0.23 C ATOM 50 N2 DG A 2 -4.910 1.022 -0.469 1.00 0.26 N ATOM 51 N3 DG A 2 -4.502 1.269 -2.722 1.00 0.21 N ATOM 52 C4 DG A 2 -3.500 1.429 -3.616 1.00 0.18 C ATOM 0 H5' DG A 2 -5.559 -0.974 -8.580 1.00 0.21 H new ATOM 0 H5'' DG A 2 -6.750 0.023 -9.393 1.00 0.21 H new ATOM 0 H4' DG A 2 -7.101 0.482 -7.177 1.00 0.20 H new ATOM 0 H3' DG A 2 -5.920 2.652 -8.673 1.00 0.19 H new ATOM 0 H2' DG A 2 -4.061 2.963 -7.198 1.00 0.16 H new ATOM 0 H2'' DG A 2 -5.274 3.724 -6.189 1.00 0.16 H new ATOM 0 H1' DG A 2 -5.679 1.757 -4.936 1.00 0.17 H new ATOM 0 H8 DG A 2 -2.149 1.783 -6.503 1.00 0.16 H new ATOM 0 H1 DG A 2 -2.484 1.220 -0.133 1.00 0.23 H new ATOM 0 H21 DG A 2 -5.909 0.953 -0.662 1.00 0.26 H new ATOM 0 H22 DG A 2 -4.570 0.956 0.491 1.00 0.26 H new ATOM 64 P DT A 3 -7.745 4.409 -7.518 1.00 0.37 P ATOM 65 OP1 DT A 3 -9.215 4.540 -7.479 1.00 0.52 O ATOM 66 OP2 DT A 3 -6.993 4.874 -8.705 1.00 0.41 O ATOM 67 O5' DT A 3 -7.134 5.149 -6.224 1.00 0.37 O ATOM 68 C5' DT A 3 -7.256 4.564 -4.922 1.00 0.35 C ATOM 69 C4' DT A 3 -6.628 5.441 -3.841 1.00 0.34 C ATOM 70 O4' DT A 3 -5.357 5.945 -4.283 1.00 0.42 O ATOM 71 C3' DT A 3 -7.480 6.650 -3.455 1.00 0.33 C ATOM 72 O3' DT A 3 -7.346 6.892 -2.048 1.00 0.37 O ATOM 73 C2' DT A 3 -6.833 7.794 -4.233 1.00 0.37 C ATOM 74 C1' DT A 3 -5.372 7.377 -4.214 1.00 0.41 C ATOM 75 N1 DT A 3 -4.577 7.882 -5.350 1.00 0.51 N ATOM 76 C2 DT A 3 -3.418 8.579 -5.060 1.00 0.73 C ATOM 77 O2 DT A 3 -3.034 8.769 -3.908 1.00 0.83 O ATOM 78 N3 DT A 3 -2.702 9.040 -6.145 1.00 0.87 N ATOM 79 C4 DT A 3 -3.036 8.868 -7.475 1.00 0.82 C ATOM 80 O4 DT A 3 -2.320 9.327 -8.363 1.00 0.99 O ATOM 81 C5 DT A 3 -4.259 8.124 -7.685 1.00 0.60 C ATOM 82 C7 DT A 3 -4.745 7.857 -9.108 1.00 0.64 C ATOM 83 C6 DT A 3 -4.977 7.664 -6.642 1.00 0.47 C ATOM 0 H5' DT A 3 -6.777 3.585 -4.918 1.00 0.35 H new ATOM 0 H5'' DT A 3 -8.310 4.405 -4.693 1.00 0.35 H new ATOM 0 H4' DT A 3 -6.532 4.793 -2.970 1.00 0.34 H new ATOM 0 H3' DT A 3 -8.541 6.525 -3.672 1.00 0.33 H new ATOM 0 H2' DT A 3 -7.224 7.875 -5.247 1.00 0.37 H new ATOM 0 H2'' DT A 3 -6.991 8.759 -3.752 1.00 0.37 H new ATOM 0 H1' DT A 3 -4.924 7.792 -3.311 1.00 0.41 H new ATOM 0 H3 DT A 3 -1.845 9.557 -5.947 1.00 0.87 H new ATOM 0 H71 DT A 3 -5.297 6.917 -9.134 1.00 0.64 H new ATOM 0 H72 DT A 3 -5.397 8.670 -9.428 1.00 0.64 H new ATOM 0 H73 DT A 3 -3.888 7.793 -9.779 1.00 0.64 H new ATOM 0 H6 DT A 3 -5.886 7.112 -6.828 1.00 0.47 H new ATOM 96 P DT A 4 -7.694 5.742 -0.974 1.00 0.38 P ATOM 97 OP1 DT A 4 -8.986 5.125 -1.351 1.00 0.46 O ATOM 98 OP2 DT A 4 -7.515 6.308 0.381 1.00 0.49 O ATOM 99 O5' DT A 4 -6.525 4.654 -1.226 1.00 0.31 O ATOM 100 C5' DT A 4 -6.037 3.842 -0.153 1.00 0.30 C ATOM 101 C4' DT A 4 -4.597 4.197 0.218 1.00 0.24 C ATOM 102 O4' DT A 4 -3.704 3.857 -0.856 1.00 0.24 O ATOM 103 C3' DT A 4 -4.398 5.692 0.507 1.00 0.21 C ATOM 104 O3' DT A 4 -3.907 5.859 1.845 1.00 0.26 O ATOM 105 C2' DT A 4 -3.315 6.109 -0.502 1.00 0.18 C ATOM 106 C1' DT A 4 -2.631 4.780 -0.775 1.00 0.19 C ATOM 107 N1 DT A 4 -1.869 4.756 -2.038 1.00 0.19 N ATOM 108 C2 DT A 4 -0.475 4.856 -1.989 1.00 0.18 C ATOM 109 O2 DT A 4 0.200 4.794 -0.937 1.00 0.19 O ATOM 110 N3 DT A 4 0.143 4.997 -3.208 1.00 0.20 N ATOM 111 C4 DT A 4 -0.456 5.045 -4.443 1.00 0.22 C ATOM 112 O4 DT A 4 0.221 5.199 -5.456 1.00 0.28 O ATOM 113 C5 DT A 4 -1.888 4.919 -4.404 1.00 0.22 C ATOM 114 C7 DT A 4 -2.680 4.986 -5.703 1.00 0.26 C ATOM 115 C6 DT A 4 -2.538 4.775 -3.235 1.00 0.20 C ATOM 0 H5' DT A 4 -6.090 2.792 -0.439 1.00 0.30 H new ATOM 0 H5'' DT A 4 -6.679 3.968 0.719 1.00 0.30 H new ATOM 0 H4' DT A 4 -4.381 3.628 1.122 1.00 0.24 H new ATOM 0 H3' DT A 4 -5.313 6.277 0.419 1.00 0.21 H new ATOM 0 H2' DT A 4 -3.742 6.545 -1.406 1.00 0.18 H new ATOM 0 H2'' DT A 4 -2.628 6.846 -0.086 1.00 0.18 H new ATOM 0 H1' DT A 4 -1.899 4.560 0.002 1.00 0.19 H new ATOM 0 H3 DT A 4 1.160 5.075 -3.194 1.00 0.20 H new ATOM 0 H71 DT A 4 -3.582 4.381 -5.611 1.00 0.26 H new ATOM 0 H72 DT A 4 -2.956 6.020 -5.908 1.00 0.26 H new ATOM 0 H73 DT A 4 -2.070 4.604 -6.521 1.00 0.26 H new ATOM 0 H6 DT A 4 -3.613 4.672 -3.239 1.00 0.20 H new ATOM 128 P DT A 5 -4.390 7.107 2.751 1.00 0.34 P ATOM 129 OP1 DT A 5 -5.606 7.686 2.138 1.00 0.44 O ATOM 130 OP2 DT A 5 -3.218 7.976 3.016 1.00 0.43 O ATOM 131 O5' DT A 5 -4.821 6.403 4.132 1.00 0.39 O ATOM 132 C5' DT A 5 -3.941 6.402 5.263 1.00 0.36 C ATOM 133 C4' DT A 5 -2.997 5.204 5.243 1.00 0.27 C ATOM 134 O4' DT A 5 -2.196 5.231 4.051 1.00 0.22 O ATOM 135 C3' DT A 5 -2.033 5.159 6.432 1.00 0.23 C ATOM 136 O3' DT A 5 -1.996 3.817 6.935 1.00 0.27 O ATOM 137 C2' DT A 5 -0.671 5.532 5.805 1.00 0.19 C ATOM 138 C1' DT A 5 -0.834 4.989 4.413 1.00 0.19 C ATOM 139 N1 DT A 5 0.045 5.634 3.413 1.00 0.17 N ATOM 140 C2 DT A 5 1.409 5.453 3.561 1.00 0.17 C ATOM 141 O2 DT A 5 1.891 4.808 4.488 1.00 0.20 O ATOM 142 N3 DT A 5 2.205 6.035 2.597 1.00 0.18 N ATOM 143 C4 DT A 5 1.771 6.763 1.511 1.00 0.17 C ATOM 144 O4 DT A 5 2.576 7.245 0.719 1.00 0.20 O ATOM 145 C5 DT A 5 0.338 6.896 1.429 1.00 0.17 C ATOM 146 C7 DT A 5 -0.271 7.580 0.216 1.00 0.20 C ATOM 147 C6 DT A 5 -0.469 6.355 2.363 1.00 0.17 C ATOM 0 H5' DT A 5 -4.528 6.387 6.181 1.00 0.36 H new ATOM 0 H5'' DT A 5 -3.359 7.324 5.272 1.00 0.36 H new ATOM 0 H4' DT A 5 -3.641 4.326 5.289 1.00 0.27 H new ATOM 0 H3' DT A 5 -2.308 5.818 7.255 1.00 0.23 H new ATOM 0 H2' DT A 5 -0.496 6.608 5.810 1.00 0.19 H new ATOM 0 H2'' DT A 5 0.165 5.071 6.332 1.00 0.19 H new ATOM 0 H1' DT A 5 -0.561 3.934 4.416 1.00 0.19 H new ATOM 0 H3 DT A 5 3.213 5.915 2.698 1.00 0.18 H new ATOM 0 H71 DT A 5 0.425 8.325 -0.169 1.00 0.20 H new ATOM 0 H72 DT A 5 -0.473 6.838 -0.557 1.00 0.20 H new ATOM 0 H73 DT A 5 -1.202 8.068 0.503 1.00 0.20 H new ATOM 0 H6 DT A 5 -1.538 6.491 2.285 1.00 0.17 H new ATOM 160 P DG A 6 -3.140 3.289 7.942 1.00 0.29 P ATOM 161 OP1 DG A 6 -3.198 4.215 9.098 1.00 0.38 O ATOM 162 OP2 DG A 6 -2.919 1.847 8.164 1.00 0.33 O ATOM 163 O5' DG A 6 -4.490 3.469 7.082 1.00 0.30 O ATOM 164 C5' DG A 6 -5.754 3.689 7.726 1.00 0.33 C ATOM 165 C4' DG A 6 -6.753 2.578 7.401 1.00 0.25 C ATOM 166 O4' DG A 6 -6.783 2.379 5.980 1.00 0.24 O ATOM 167 C3' DG A 6 -6.422 1.232 8.044 1.00 0.23 C ATOM 168 O3' DG A 6 -7.643 0.548 8.371 1.00 0.25 O ATOM 169 C2' DG A 6 -5.683 0.494 6.923 1.00 0.20 C ATOM 170 C1' DG A 6 -6.367 1.042 5.680 1.00 0.18 C ATOM 171 N9 DG A 6 -5.516 1.093 4.477 1.00 0.16 N ATOM 172 C8 DG A 6 -5.905 1.095 3.175 1.00 0.18 C ATOM 173 N7 DG A 6 -4.942 1.139 2.308 1.00 0.18 N ATOM 174 C5 DG A 6 -3.801 1.171 3.106 1.00 0.14 C ATOM 175 C6 DG A 6 -2.435 1.225 2.734 1.00 0.16 C ATOM 176 O6 DG A 6 -1.961 1.268 1.602 1.00 0.20 O ATOM 177 N1 DG A 6 -1.604 1.238 3.844 1.00 0.14 N ATOM 178 C2 DG A 6 -2.031 1.208 5.152 1.00 0.14 C ATOM 179 N2 DG A 6 -1.091 1.225 6.095 1.00 0.17 N ATOM 180 N3 DG A 6 -3.310 1.159 5.501 1.00 0.14 N ATOM 181 C4 DG A 6 -4.140 1.143 4.435 1.00 0.13 C ATOM 0 H5' DG A 6 -6.162 4.649 7.410 1.00 0.33 H new ATOM 0 H5'' DG A 6 -5.609 3.744 8.805 1.00 0.33 H new ATOM 0 H4' DG A 6 -7.711 2.908 7.803 1.00 0.25 H new ATOM 0 H3' DG A 6 -5.842 1.308 8.963 1.00 0.23 H new ATOM 0 H2' DG A 6 -4.614 0.708 6.929 1.00 0.20 H new ATOM 0 H2'' DG A 6 -5.792 -0.587 7.005 1.00 0.20 H new ATOM 0 H1' DG A 6 -7.188 0.364 5.445 1.00 0.18 H new ATOM 0 H8 DG A 6 -6.944 1.062 2.883 1.00 0.18 H new ATOM 0 H1 DG A 6 -0.598 1.272 3.678 1.00 0.14 H new ATOM 0 H21 DG A 6 -1.356 1.204 7.080 1.00 0.17 H new ATOM 0 H22 DG A 6 -0.106 1.259 5.833 1.00 0.17 H new ATOM 193 P DG A 7 -7.706 -1.064 8.461 1.00 0.26 P ATOM 194 OP1 DG A 7 -8.889 -1.433 9.266 1.00 0.34 O ATOM 195 OP2 DG A 7 -6.367 -1.574 8.843 1.00 0.26 O ATOM 196 O5' DG A 7 -7.998 -1.477 6.936 1.00 0.27 O ATOM 197 C5' DG A 7 -9.248 -1.132 6.342 1.00 0.28 C ATOM 198 C4' DG A 7 -9.238 -1.304 4.831 1.00 0.25 C ATOM 199 O4' DG A 7 -7.955 -0.925 4.285 1.00 0.22 O ATOM 200 C3' DG A 7 -9.482 -2.742 4.392 1.00 0.23 C ATOM 201 O3' DG A 7 -10.185 -2.711 3.143 1.00 0.26 O ATOM 202 C2' DG A 7 -8.060 -3.243 4.199 1.00 0.19 C ATOM 203 C1' DG A 7 -7.474 -2.036 3.523 1.00 0.19 C ATOM 204 N9 DG A 7 -6.010 -2.011 3.498 1.00 0.18 N ATOM 205 C8 DG A 7 -5.134 -2.042 4.536 1.00 0.18 C ATOM 206 N7 DG A 7 -3.886 -2.003 4.206 1.00 0.17 N ATOM 207 C5 DG A 7 -3.933 -1.948 2.820 1.00 0.16 C ATOM 208 C6 DG A 7 -2.878 -1.895 1.894 1.00 0.16 C ATOM 209 O6 DG A 7 -1.680 -1.886 2.130 1.00 0.18 O ATOM 210 N1 DG A 7 -3.346 -1.857 0.590 1.00 0.15 N ATOM 211 C2 DG A 7 -4.674 -1.866 0.226 1.00 0.16 C ATOM 212 N2 DG A 7 -4.935 -1.849 -1.079 1.00 0.19 N ATOM 213 N3 DG A 7 -5.676 -1.914 1.102 1.00 0.17 N ATOM 214 C4 DG A 7 -5.232 -1.954 2.377 1.00 0.17 C ATOM 0 H5' DG A 7 -9.490 -0.098 6.586 1.00 0.28 H new ATOM 0 H5'' DG A 7 -10.035 -1.753 6.771 1.00 0.28 H new ATOM 0 H4' DG A 7 -10.044 -0.668 4.465 1.00 0.25 H new ATOM 0 H3' DG A 7 -10.066 -3.356 5.077 1.00 0.23 H new ATOM 0 H2' DG A 7 -7.566 -3.479 5.141 1.00 0.19 H new ATOM 0 H2'' DG A 7 -8.010 -4.138 3.579 1.00 0.19 H new ATOM 0 H1' DG A 7 -7.771 -2.026 2.474 1.00 0.19 H new ATOM 0 H8 DG A 7 -5.458 -2.095 5.565 1.00 0.18 H new ATOM 0 H1 DG A 7 -2.653 -1.819 -0.158 1.00 0.15 H new ATOM 0 H21 DG A 7 -5.901 -1.855 -1.406 1.00 0.19 H new ATOM 0 H22 DG A 7 -4.169 -1.830 -1.752 1.00 0.19 H new ATOM 226 P DT A 8 -10.523 -4.057 2.340 1.00 0.28 P ATOM 227 OP1 DT A 8 -11.530 -3.742 1.305 1.00 0.39 O ATOM 228 OP2 DT A 8 -10.781 -5.133 3.323 1.00 0.32 O ATOM 229 O5' DT A 8 -9.140 -4.374 1.606 1.00 0.23 O ATOM 230 C5' DT A 8 -8.730 -5.723 1.431 1.00 0.25 C ATOM 231 C4' DT A 8 -7.230 -5.820 1.214 1.00 0.21 C ATOM 232 O4' DT A 8 -6.545 -5.225 2.304 1.00 0.21 O ATOM 233 C3' DT A 8 -6.731 -7.245 1.135 1.00 0.23 C ATOM 234 O3' DT A 8 -6.655 -7.637 -0.235 1.00 0.26 O ATOM 235 C2' DT A 8 -5.318 -7.182 1.739 1.00 0.23 C ATOM 236 C1' DT A 8 -5.234 -5.775 2.333 1.00 0.20 C ATOM 237 N1 DT A 8 -4.754 -5.743 3.727 1.00 0.18 N ATOM 238 C2 DT A 8 -3.387 -5.746 3.915 1.00 0.19 C ATOM 239 O2 DT A 8 -2.595 -5.751 2.978 1.00 0.24 O ATOM 240 N3 DT A 8 -2.958 -5.730 5.220 1.00 0.22 N ATOM 241 C4 DT A 8 -3.760 -5.714 6.347 1.00 0.24 C ATOM 242 O4 DT A 8 -3.259 -5.717 7.467 1.00 0.31 O ATOM 243 C5 DT A 8 -5.178 -5.708 6.060 1.00 0.23 C ATOM 244 C7 DT A 8 -6.181 -5.684 7.212 1.00 0.30 C ATOM 245 C6 DT A 8 -5.628 -5.721 4.788 1.00 0.20 C ATOM 0 H5' DT A 8 -9.252 -6.156 0.578 1.00 0.25 H new ATOM 0 H5'' DT A 8 -9.011 -6.307 2.307 1.00 0.25 H new ATOM 0 H4' DT A 8 -7.038 -5.314 0.268 1.00 0.21 H new ATOM 0 H3' DT A 8 -7.375 -7.956 1.652 1.00 0.23 H new ATOM 0 H2' DT A 8 -5.175 -7.947 2.502 1.00 0.23 H new ATOM 0 H2'' DT A 8 -4.552 -7.342 0.980 1.00 0.23 H new ATOM 0 H1' DT A 8 -4.514 -5.210 1.740 1.00 0.20 H new ATOM 0 H3 DT A 8 -1.950 -5.730 5.373 1.00 0.22 H new ATOM 0 H71 DT A 8 -7.087 -5.168 6.895 1.00 0.30 H new ATOM 0 H72 DT A 8 -6.427 -6.706 7.501 1.00 0.30 H new ATOM 0 H73 DT A 8 -5.745 -5.161 8.063 1.00 0.30 H new ATOM 0 H6 DT A 8 -6.692 -5.714 4.600 1.00 0.20 H new ATOM 258 P DT A 9 -6.674 -9.192 -0.623 1.00 0.26 P ATOM 259 OP1 DT A 9 -8.074 -9.576 -0.913 1.00 0.41 O ATOM 260 OP2 DT A 9 -5.911 -9.929 0.407 1.00 0.32 O ATOM 261 O5' DT A 9 -5.845 -9.228 -2.007 1.00 0.25 O ATOM 262 C5' DT A 9 -4.995 -8.141 -2.412 1.00 0.24 C ATOM 263 C4' DT A 9 -3.550 -8.384 -2.054 1.00 0.20 C ATOM 264 O4' DT A 9 -3.329 -8.094 -0.678 1.00 0.20 O ATOM 265 C3' DT A 9 -3.099 -9.822 -2.311 1.00 0.21 C ATOM 266 O3' DT A 9 -2.032 -9.812 -3.278 1.00 0.25 O ATOM 267 C2' DT A 9 -2.593 -10.303 -0.932 1.00 0.23 C ATOM 268 C1' DT A 9 -2.349 -8.994 -0.195 1.00 0.22 C ATOM 269 N1 DT A 9 -2.507 -9.073 1.263 1.00 0.25 N ATOM 270 C2 DT A 9 -1.554 -8.458 2.054 1.00 0.32 C ATOM 271 O2 DT A 9 -0.576 -7.882 1.585 1.00 0.37 O ATOM 272 N3 DT A 9 -1.767 -8.524 3.414 1.00 0.37 N ATOM 273 C4 DT A 9 -2.831 -9.138 4.044 1.00 0.37 C ATOM 274 O4 DT A 9 -2.918 -9.132 5.269 1.00 0.45 O ATOM 275 C5 DT A 9 -3.776 -9.752 3.136 1.00 0.31 C ATOM 276 C7 DT A 9 -5.026 -10.426 3.695 1.00 0.36 C ATOM 277 C6 DT A 9 -3.585 -9.703 1.800 1.00 0.26 C ATOM 0 H5' DT A 9 -5.335 -7.220 -1.938 1.00 0.24 H new ATOM 0 H5'' DT A 9 -5.081 -7.996 -3.489 1.00 0.24 H new ATOM 0 H4' DT A 9 -2.968 -7.724 -2.697 1.00 0.20 H new ATOM 0 H3' DT A 9 -3.884 -10.468 -2.705 1.00 0.21 H new ATOM 0 H2' DT A 9 -3.331 -10.924 -0.423 1.00 0.23 H new ATOM 0 H2'' DT A 9 -1.682 -10.896 -1.018 1.00 0.23 H new ATOM 0 H1' DT A 9 -1.316 -8.695 -0.375 1.00 0.22 H new ATOM 0 H3 DT A 9 -1.072 -8.077 4.012 1.00 0.37 H new ATOM 0 H71 DT A 9 -5.835 -10.354 2.968 1.00 0.36 H new ATOM 0 H72 DT A 9 -4.813 -11.476 3.898 1.00 0.36 H new ATOM 0 H73 DT A 9 -5.324 -9.931 4.619 1.00 0.36 H new ATOM 0 H6 DT A 9 -4.303 -10.174 1.145 1.00 0.26 H new ATOM 290 P DT A 10 -2.245 -9.193 -4.765 1.00 0.28 P ATOM 291 OP1 DT A 10 -3.700 -9.097 -5.027 1.00 0.38 O ATOM 292 OP2 DT A 10 -1.376 -9.938 -5.704 1.00 0.41 O ATOM 293 O5' DT A 10 -1.662 -7.692 -4.618 1.00 0.27 O ATOM 294 C5' DT A 10 -1.065 -7.008 -5.735 1.00 0.26 C ATOM 295 C4' DT A 10 -0.139 -5.867 -5.285 1.00 0.21 C ATOM 296 O4' DT A 10 -0.901 -4.824 -4.659 1.00 0.22 O ATOM 297 C3' DT A 10 0.895 -6.284 -4.253 1.00 0.19 C ATOM 298 O3' DT A 10 1.968 -5.326 -4.239 1.00 0.19 O ATOM 299 C2' DT A 10 0.089 -6.177 -2.978 1.00 0.18 C ATOM 300 C1' DT A 10 -0.703 -4.905 -3.233 1.00 0.19 C ATOM 301 N1 DT A 10 -2.040 -4.883 -2.588 1.00 0.19 N ATOM 302 C2 DT A 10 -2.075 -4.978 -1.206 1.00 0.21 C ATOM 303 O2 DT A 10 -1.057 -5.090 -0.527 1.00 0.24 O ATOM 304 N3 DT A 10 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1.00 0.21 C ATOM 0 H5' DT A 11 1.453 -4.639 -1.245 1.00 0.20 H new ATOM 0 H5'' DT A 11 2.972 -3.825 -1.561 1.00 0.20 H new ATOM 0 H4' DT A 11 2.805 -3.931 0.738 1.00 0.21 H new ATOM 0 H3' DT A 11 5.080 -4.995 -0.227 1.00 0.22 H new ATOM 0 H2' DT A 11 4.359 -7.327 -0.354 1.00 0.29 H new ATOM 0 H2'' DT A 11 5.093 -7.280 1.237 1.00 0.29 H new ATOM 0 H1' DT A 11 3.069 -7.157 2.341 1.00 0.26 H new ATOM 0 H3 DT A 11 1.925 -11.431 1.519 1.00 0.37 H new ATOM 0 H71 DT A 11 0.289 -10.223 -2.717 1.00 0.25 H new ATOM 0 H72 DT A 11 -0.848 -9.059 -1.996 1.00 0.25 H new ATOM 0 H73 DT A 11 0.628 -8.478 -2.803 1.00 0.25 H new ATOM 0 H6 DT A 11 1.412 -7.310 -0.896 1.00 0.21 H new ATOM 354 P DG A 12 6.385 -4.848 2.199 1.00 0.21 P ATOM 355 OP1 DG A 12 6.939 -6.184 1.881 1.00 0.26 O ATOM 356 OP2 DG A 12 6.511 -4.308 3.567 1.00 0.30 O ATOM 357 O5' DG A 12 7.021 -3.775 1.187 1.00 0.26 O ATOM 358 C5' DG A 12 8.022 -4.161 0.242 1.00 0.28 C ATOM 359 C4' DG A 12 8.177 -3.107 -0.843 1.00 0.25 C ATOM 360 O4' DG A 12 6.946 -2.994 -1.557 1.00 0.27 O ATOM 361 C3' DG A 12 8.542 -1.720 -0.302 1.00 0.25 C ATOM 362 O3' DG A 12 9.758 -1.238 -0.918 1.00 0.32 O ATOM 363 C2' DG A 12 7.358 -0.811 -0.694 1.00 0.25 C ATOM 364 C1' DG A 12 6.629 -1.618 -1.763 1.00 0.22 C ATOM 365 N9 DG A 12 5.152 -1.513 -1.726 1.00 0.20 N ATOM 366 C8 DG A 12 4.280 -1.435 -2.771 1.00 0.20 C ATOM 367 N7 DG A 12 3.026 -1.408 -2.446 1.00 0.19 N ATOM 368 C5 DG A 12 3.052 -1.475 -1.058 1.00 0.17 C ATOM 369 C6 DG A 12 1.977 -1.487 -0.134 1.00 0.17 C ATOM 370 O6 DG A 12 0.779 -1.449 -0.373 1.00 0.19 O ATOM 371 N1 DG A 12 2.427 -1.562 1.175 1.00 0.18 N ATOM 372 C2 DG A 12 3.751 -1.620 1.546 1.00 0.18 C ATOM 373 N2 DG A 12 4.007 -1.653 2.849 1.00 0.21 N ATOM 374 N3 DG A 12 4.764 -1.613 0.679 1.00 0.19 N ATOM 375 C4 DG A 12 4.347 -1.539 -0.602 1.00 0.18 C ATOM 0 H5' DG A 12 7.753 -5.116 -0.209 1.00 0.28 H new ATOM 0 H5'' DG A 12 8.974 -4.306 0.753 1.00 0.28 H new ATOM 0 H4' DG A 12 8.997 -3.435 -1.482 1.00 0.25 H new ATOM 0 H3' DG A 12 8.713 -1.738 0.774 1.00 0.25 H new ATOM 0 H2' DG A 12 6.713 -0.601 0.160 1.00 0.25 H new ATOM 0 H2'' DG A 12 7.700 0.150 -1.080 1.00 0.25 H new ATOM 0 H1' DG A 12 6.956 -1.217 -2.722 1.00 0.22 H new ATOM 0 H8 DG A 12 4.611 -1.398 -3.798 1.00 0.20 H new ATOM 0 H1 DG A 12 1.727 -1.575 1.916 1.00 0.18 H new ATOM 0 H21 DG A 12 4.971 -1.696 3.178 1.00 0.21 H new ATOM 0 H22 DG A 12 3.239 -1.635 3.520 1.00 0.21 H new ATOM 387 P DG A 13 10.129 -1.488 -2.474 1.00 0.31 P ATOM 388 OP1 DG A 13 9.907 -2.917 -2.787 1.00 0.33 O ATOM 389 OP2 DG A 13 11.454 -0.879 -2.729 1.00 0.49 O ATOM 390 O5' DG A 13 9.025 -0.619 -3.258 1.00 0.37 O ATOM 391 C5' DG A 13 8.924 -0.690 -4.685 1.00 0.37 C ATOM 392 C4' DG A 13 8.326 0.588 -5.261 1.00 0.29 C ATOM 393 O4' DG A 13 7.024 0.782 -4.710 1.00 0.29 O ATOM 394 C3' DG A 13 9.158 1.836 -4.967 1.00 0.31 C ATOM 395 O3' DG A 13 9.446 2.511 -6.194 1.00 0.42 O ATOM 396 C2' DG A 13 8.252 2.726 -4.101 1.00 0.30 C ATOM 397 C1' DG A 13 6.862 2.145 -4.322 1.00 0.24 C ATOM 398 N9 DG A 13 6.015 2.145 -3.117 1.00 0.22 N ATOM 399 C8 DG A 13 6.386 2.174 -1.803 1.00 0.24 C ATOM 400 N7 DG A 13 5.409 2.115 -0.952 1.00 0.24 N ATOM 401 C5 DG A 13 4.283 2.044 -1.768 1.00 0.21 C ATOM 402 C6 DG A 13 2.909 1.959 -1.420 1.00 0.21 C ATOM 403 O6 DG A 13 2.414 1.931 -0.296 1.00 0.21 O ATOM 404 N1 DG A 13 2.097 1.908 -2.549 1.00 0.21 N ATOM 405 C2 DG A 13 2.553 1.932 -3.849 1.00 0.21 C ATOM 406 N2 DG A 13 1.630 1.858 -4.806 1.00 0.21 N ATOM 407 N3 DG A 13 3.841 2.010 -4.178 1.00 0.21 N ATOM 408 C4 DG A 13 4.647 2.063 -3.095 1.00 0.21 C ATOM 0 H5' DG A 13 8.306 -1.542 -4.966 1.00 0.37 H new ATOM 0 H5'' DG A 13 9.912 -0.858 -5.114 1.00 0.37 H new ATOM 0 H4' DG A 13 8.298 0.459 -6.343 1.00 0.29 H new ATOM 0 H3' DG A 13 10.101 1.599 -4.474 1.00 0.31 H new ATOM 0 H2' DG A 13 8.540 2.689 -3.050 1.00 0.30 H new ATOM 0 H2'' DG A 13 8.304 3.770 -4.409 1.00 0.30 H new ATOM 0 H1' DG A 13 6.373 2.767 -5.071 1.00 0.24 H new ATOM 0 H8 DG A 13 7.419 2.241 -1.495 1.00 0.24 H new ATOM 0 H1 DG A 13 1.089 1.848 -2.403 1.00 0.21 H new ATOM 0 H21 DG A 13 1.910 1.871 -5.787 1.00 0.21 H new ATOM 0 H22 DG A 13 0.643 1.788 -4.558 1.00 0.21 H new ATOM 420 P DT A 14 10.842 3.292 -6.378 1.00 0.56 P ATOM 421 OP1 DT A 14 10.869 3.868 -7.739 1.00 0.99 O ATOM 422 OP2 DT A 14 11.934 2.398 -5.932 1.00 0.99 O ATOM 423 O5' DT A 14 10.717 4.501 -5.320 1.00 0.41 O ATOM 424 C5' DT A 14 11.882 5.196 -4.855 1.00 0.38 C ATOM 425 C4' DT A 14 11.522 6.258 -3.817 1.00 0.33 C ATOM 426 O4' DT A 14 10.627 7.209 -4.400 1.00 0.38 O ATOM 427 C3' DT A 14 10.861 5.705 -2.568 1.00 0.30 C ATOM 428 O3' DT A 14 11.293 6.460 -1.432 1.00 0.37 O ATOM 429 C2' DT A 14 9.388 5.933 -2.822 1.00 0.33 C ATOM 430 C1' DT A 14 9.385 7.182 -3.700 1.00 0.39 C ATOM 431 N1 DT A 14 8.310 7.227 -4.717 1.00 0.46 N ATOM 432 C2 DT A 14 7.375 8.244 -4.618 1.00 0.58 C ATOM 433 O2 DT A 14 7.412 9.085 -3.724 1.00 0.65 O ATOM 434 N3 DT A 14 6.394 8.264 -5.588 1.00 0.68 N ATOM 435 C4 DT A 14 6.265 7.370 -6.635 1.00 0.68 C ATOM 436 O4 DT A 14 5.343 7.482 -7.439 1.00 0.80 O ATOM 437 C5 DT A 14 7.283 6.344 -6.662 1.00 0.58 C ATOM 438 C7 DT A 14 7.262 5.291 -7.768 1.00 0.65 C ATOM 439 C6 DT A 14 8.253 6.302 -5.728 1.00 0.47 C ATOM 0 H5' DT A 14 12.387 5.666 -5.698 1.00 0.38 H new ATOM 0 H5'' DT A 14 12.583 4.483 -4.420 1.00 0.38 H new ATOM 0 H4' DT A 14 12.467 6.709 -3.515 1.00 0.33 H new ATOM 0 H3' DT A 14 11.098 4.660 -2.370 1.00 0.30 H new ATOM 0 H2' DT A 14 8.928 5.083 -3.326 1.00 0.33 H new ATOM 0 H2'' DT A 14 8.837 6.089 -1.895 1.00 0.33 H new ATOM 0 H1' DT A 14 9.223 8.030 -3.035 1.00 0.39 H new ATOM 0 H3 DT A 14 5.699 9.008 -5.527 1.00 0.68 H new ATOM 0 H71 DT A 14 8.280 4.963 -7.978 1.00 0.65 H new ATOM 0 H72 DT A 14 6.665 4.438 -7.447 1.00 0.65 H new ATOM 0 H73 DT A 14 6.826 5.720 -8.670 1.00 0.65 H new ATOM 0 H6 DT A 14 9.001 5.524 -5.776 1.00 0.47 H new ATOM 452 P DT A 15 10.804 6.070 0.049 1.00 0.28 P ATOM 453 OP1 DT A 15 11.796 6.590 1.014 1.00 0.41 O ATOM 454 OP2 DT A 15 10.446 4.633 0.063 1.00 0.33 O ATOM 455 O5' DT A 15 9.451 6.934 0.200 1.00 0.28 O ATOM 456 C5' DT A 15 9.099 7.525 1.457 1.00 0.29 C ATOM 457 C4' DT A 15 8.150 6.632 2.255 1.00 0.20 C ATOM 458 O4' DT A 15 6.861 6.611 1.623 1.00 0.23 O ATOM 459 C3' DT A 15 8.610 5.175 2.375 1.00 0.19 C ATOM 460 O3' DT A 15 8.320 4.694 3.691 1.00 0.23 O ATOM 461 C2' DT A 15 7.729 4.449 1.368 1.00 0.18 C ATOM 462 C1' DT A 15 6.451 5.252 1.490 1.00 0.18 C ATOM 463 N1 DT A 15 5.530 5.172 0.337 1.00 0.17 N ATOM 464 C2 DT A 15 4.203 4.879 0.617 1.00 0.15 C ATOM 465 O2 DT A 15 3.838 4.554 1.740 1.00 0.18 O ATOM 466 N3 DT A 15 3.326 4.913 -0.455 1.00 0.15 N ATOM 467 C4 DT A 15 3.681 5.193 -1.764 1.00 0.18 C ATOM 468 O4 DT A 15 2.853 5.192 -2.647 1.00 0.23 O ATOM 469 C5 DT A 15 5.077 5.472 -1.965 1.00 0.21 C ATOM 470 C7 DT A 15 5.553 5.799 -3.375 1.00 0.29 C ATOM 471 C6 DT A 15 5.951 5.456 -0.938 1.00 0.21 C ATOM 0 H5' DT A 15 8.629 8.493 1.285 1.00 0.29 H new ATOM 0 H5'' DT A 15 10.002 7.708 2.039 1.00 0.29 H new ATOM 0 H4' DT A 15 8.123 7.063 3.256 1.00 0.20 H new ATOM 0 H3' DT A 15 9.677 5.039 2.198 1.00 0.19 H new ATOM 0 H2' DT A 15 8.142 4.478 0.360 1.00 0.18 H new ATOM 0 H2'' DT A 15 7.585 3.399 1.624 1.00 0.18 H new ATOM 0 H1' DT A 15 5.892 4.847 2.334 1.00 0.18 H new ATOM 0 H3 DT A 15 2.343 4.717 -0.266 1.00 0.15 H new ATOM 0 H71 DT A 15 4.922 5.285 -4.100 1.00 0.29 H new ATOM 0 H72 DT A 15 5.492 6.875 -3.539 1.00 0.29 H new ATOM 0 H73 DT A 15 6.586 5.471 -3.496 1.00 0.29 H new ATOM 0 H6 DT A 15 6.994 5.669 -1.121 1.00 0.21 H new ATOM 484 P DG A 16 9.227 5.096 4.957 1.00 0.29 P ATOM 485 OP1 DG A 16 9.134 6.560 5.157 1.00 0.45 O ATOM 486 OP2 DG A 16 10.548 4.449 4.805 1.00 0.41 O ATOM 487 O5' DG A 16 8.441 4.361 6.166 1.00 0.29 O ATOM 488 C5' DG A 16 8.332 2.927 6.204 1.00 0.25 C ATOM 489 C4' DG A 16 7.398 2.442 7.320 1.00 0.22 C ATOM 490 O4' DG A 16 6.028 2.778 6.999 1.00 0.23 O ATOM 491 C3' DG A 16 7.435 0.916 7.550 1.00 0.23 C ATOM 492 O3' DG A 16 7.412 0.644 8.970 1.00 0.28 O ATOM 493 C2' DG A 16 6.141 0.452 6.898 1.00 0.20 C ATOM 494 C1' DG A 16 5.237 1.612 7.236 1.00 0.20 C ATOM 495 N9 DG A 16 3.999 1.672 6.434 1.00 0.19 N ATOM 496 C8 DG A 16 2.704 1.595 6.865 1.00 0.21 C ATOM 497 N7 DG A 16 1.808 1.622 5.929 1.00 0.21 N ATOM 498 C5 DG A 16 2.566 1.728 4.764 1.00 0.18 C ATOM 499 C6 DG A 16 2.145 1.804 3.412 1.00 0.18 C ATOM 500 O6 DG A 16 1.004 1.781 2.972 1.00 0.21 O ATOM 501 N1 DG A 16 3.219 1.904 2.546 1.00 0.16 N ATOM 502 C2 DG A 16 4.544 1.925 2.927 1.00 0.16 C ATOM 503 N2 DG A 16 5.445 2.000 1.950 1.00 0.17 N ATOM 504 N3 DG A 16 4.948 1.856 4.200 1.00 0.17 N ATOM 505 C4 DG A 16 3.910 1.760 5.062 1.00 0.18 C ATOM 0 H5' DG A 16 9.322 2.494 6.348 1.00 0.25 H new ATOM 0 H5'' DG A 16 7.963 2.568 5.243 1.00 0.25 H new ATOM 0 H4' DG A 16 7.752 2.939 8.223 1.00 0.22 H new ATOM 0 H3' DG A 16 8.320 0.423 7.148 1.00 0.23 H new ATOM 0 H2' DG A 16 6.246 0.307 5.823 1.00 0.20 H new ATOM 0 H2'' DG A 16 5.781 -0.490 7.313 1.00 0.20 H new ATOM 0 H1' DG A 16 4.891 1.515 8.265 1.00 0.20 H new ATOM 0 H8 DG A 16 2.446 1.517 7.911 1.00 0.21 H new ATOM 0 H1 DG A 16 3.015 1.967 1.549 1.00 0.16 H new ATOM 0 H21 DG A 16 6.440 2.019 2.174 1.00 0.17 H new ATOM 0 H22 DG A 16 5.140 2.039 0.977 1.00 0.17 H new ATOM 517 P DG A 17 7.291 -0.864 9.555 1.00 0.32 P ATOM 518 OP1 DG A 17 7.823 -0.871 10.939 1.00 0.40 O ATOM 519 OP2 DG A 17 7.845 -1.797 8.548 1.00 0.37 O ATOM 520 O5' DG A 17 5.695 -1.082 9.623 1.00 0.34 O ATOM 521 C5' DG A 17 4.906 -0.378 10.590 1.00 0.33 C ATOM 522 C4' DG A 17 3.482 -0.924 10.658 1.00 0.31 C ATOM 523 O4' DG A 17 2.795 -0.630 9.432 1.00 0.32 O ATOM 524 C3' DG A 17 3.411 -2.441 10.874 1.00 0.34 C ATOM 525 O3' DG A 17 2.443 -2.777 11.875 1.00 0.43 O ATOM 526 C2' DG A 17 2.996 -2.965 9.506 1.00 0.30 C ATOM 527 C1' DG A 17 2.154 -1.819 8.982 1.00 0.24 C ATOM 528 N9 DG A 17 2.055 -1.758 7.512 1.00 0.20 N ATOM 529 C8 DG A 17 3.053 -1.670 6.588 1.00 0.22 C ATOM 530 N7 DG A 17 2.658 -1.627 5.352 1.00 0.21 N ATOM 531 C5 DG A 17 1.272 -1.694 5.459 1.00 0.19 C ATOM 532 C6 DG A 17 0.282 -1.690 4.440 1.00 0.19 C ATOM 533 O6 DG A 17 0.455 -1.610 3.230 1.00 0.23 O ATOM 534 N1 DG A 17 -1.005 -1.776 4.974 1.00 0.18 N ATOM 535 C2 DG A 17 -1.285 -1.855 6.327 1.00 0.18 C ATOM 536 N2 DG A 17 -2.565 -1.931 6.669 1.00 0.19 N ATOM 537 N3 DG A 17 -0.352 -1.855 7.279 1.00 0.18 N ATOM 538 C4 DG A 17 0.895 -1.775 6.778 1.00 0.18 C ATOM 0 H5' DG A 17 4.878 0.682 10.336 1.00 0.33 H new ATOM 0 H5'' DG A 17 5.374 -0.459 11.571 1.00 0.33 H new ATOM 0 H4' DG A 17 3.019 -0.440 11.518 1.00 0.31 H new ATOM 0 H3' DG A 17 4.349 -2.868 11.228 1.00 0.34 H new ATOM 0 H2' DG A 17 3.856 -3.167 8.867 1.00 0.30 H new ATOM 0 H2'' DG A 17 2.427 -3.892 9.578 1.00 0.30 H new ATOM 0 HO3' DG A 17 2.417 -3.750 11.991 1.00 0.43 H new ATOM 0 H1' DG A 17 1.135 -1.950 9.346 1.00 0.24 H new ATOM 0 H8 DG A 17 4.097 -1.638 6.864 1.00 0.22 H new ATOM 0 H1 DG A 17 -1.791 -1.781 4.324 1.00 0.18 H new ATOM 0 H21 DG A 17 -2.827 -1.991 7.653 1.00 0.19 H new ATOM 0 H22 DG A 17 -3.286 -1.929 5.948 1.00 0.19 H new TER 550 DG A 17