USER MOD reduce.3.24.130724 H: found=0, std=0, add=266, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 266 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= -0.0328 USER MOD Single : A 24 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 10.380 3.103 6.041 1.00 0.00 O ATOM 2 C5' DG A 1 9.244 2.473 5.445 1.00 0.00 C ATOM 3 C4' DG A 1 9.239 2.643 3.926 1.00 0.00 C ATOM 4 O4' DG A 1 7.989 2.150 3.357 1.00 0.00 O ATOM 5 C3' DG A 1 9.380 4.115 3.536 1.00 0.00 C ATOM 6 O3' DG A 1 10.499 4.259 2.658 1.00 0.00 O ATOM 7 C2' DG A 1 8.111 4.475 2.839 1.00 0.00 C ATOM 8 C1' DG A 1 7.485 3.164 2.452 1.00 0.00 C ATOM 9 N9 DG A 1 6.018 3.255 2.499 1.00 0.00 N ATOM 10 C8 DG A 1 5.219 3.771 3.459 1.00 0.00 C ATOM 11 N7 DG A 1 3.945 3.763 3.247 1.00 0.00 N ATOM 12 C5 DG A 1 3.874 3.168 1.984 1.00 0.00 C ATOM 13 C6 DG A 1 2.743 2.871 1.178 1.00 0.00 C ATOM 14 O6 DG A 1 1.556 3.077 1.425 1.00 0.00 O ATOM 15 N1 DG A 1 3.113 2.277 -0.020 1.00 0.00 N ATOM 16 C2 DG A 1 4.408 1.998 -0.403 1.00 0.00 C ATOM 17 N2 DG A 1 4.561 1.428 -1.597 1.00 0.00 N ATOM 18 N3 DG A 1 5.478 2.273 0.347 1.00 0.00 N ATOM 19 C4 DG A 1 5.141 2.855 1.521 1.00 0.00 C ATOM 0 H5' DG A 1 8.331 2.898 5.862 1.00 0.00 H new ATOM 0 H5'' DG A 1 9.244 1.412 5.693 1.00 0.00 H new ATOM 0 H4' DG A 1 10.084 2.073 3.539 1.00 0.00 H new ATOM 0 H3' DG A 1 9.547 4.762 4.397 1.00 0.00 H new ATOM 0 H2' DG A 1 7.452 5.048 3.492 1.00 0.00 H new ATOM 0 H2'' DG A 1 8.305 5.092 1.962 1.00 0.00 H new ATOM 0 HO5' DG A 1 10.352 2.977 7.012 1.00 0.00 H new ATOM 0 H1' DG A 1 7.747 2.901 1.427 1.00 0.00 H new ATOM 0 H8 DG A 1 5.631 4.176 4.371 1.00 0.00 H new ATOM 0 H1 DG A 1 2.367 2.027 -0.669 1.00 0.00 H new ATOM 0 H21 DG A 1 5.495 1.197 -1.936 1.00 0.00 H new ATOM 0 H22 DG A 1 3.744 1.222 -2.172 1.00 0.00 H new ATOM 32 P DG A 2 11.085 5.714 2.305 1.00 0.00 P ATOM 33 OP1 DG A 2 12.559 5.664 2.423 1.00 0.00 O ATOM 34 OP2 DG A 2 10.316 6.724 3.066 1.00 0.00 O ATOM 35 O5' DG A 2 10.704 5.854 0.746 1.00 0.00 O ATOM 36 C5' DG A 2 10.772 4.710 -0.112 1.00 0.00 C ATOM 37 C4' DG A 2 9.935 4.886 -1.379 1.00 0.00 C ATOM 38 O4' DG A 2 8.527 4.620 -1.120 1.00 0.00 O ATOM 39 C3' DG A 2 10.047 6.306 -1.934 1.00 0.00 C ATOM 40 O3' DG A 2 10.679 6.246 -3.216 1.00 0.00 O ATOM 41 C2' DG A 2 8.642 6.816 -2.049 1.00 0.00 C ATOM 42 C1' DG A 2 7.757 5.613 -1.838 1.00 0.00 C ATOM 43 N9 DG A 2 6.533 5.978 -1.105 1.00 0.00 N ATOM 44 C8 DG A 2 6.386 6.473 0.146 1.00 0.00 C ATOM 45 N7 DG A 2 5.185 6.720 0.554 1.00 0.00 N ATOM 46 C5 DG A 2 4.423 6.348 -0.561 1.00 0.00 C ATOM 47 C6 DG A 2 3.015 6.379 -0.757 1.00 0.00 C ATOM 48 O6 DG A 2 2.144 6.748 0.028 1.00 0.00 O ATOM 49 N1 DG A 2 2.666 5.918 -2.023 1.00 0.00 N ATOM 50 C2 DG A 2 3.557 5.480 -2.982 1.00 0.00 C ATOM 51 N2 DG A 2 3.028 5.075 -4.136 1.00 0.00 N ATOM 52 N3 DG A 2 4.880 5.447 -2.804 1.00 0.00 N ATOM 53 C4 DG A 2 5.245 5.892 -1.579 1.00 0.00 C ATOM 0 H5' DG A 2 10.426 3.830 0.431 1.00 0.00 H new ATOM 0 H5'' DG A 2 11.810 4.526 -0.388 1.00 0.00 H new ATOM 0 H4' DG A 2 10.326 4.174 -2.106 1.00 0.00 H new ATOM 0 H3' DG A 2 10.640 6.963 -1.298 1.00 0.00 H new ATOM 0 H2' DG A 2 8.442 7.586 -1.304 1.00 0.00 H new ATOM 0 H2'' DG A 2 8.467 7.265 -3.026 1.00 0.00 H new ATOM 0 H1' DG A 2 7.434 5.209 -2.798 1.00 0.00 H new ATOM 0 H8 DG A 2 7.241 6.655 0.780 1.00 0.00 H new ATOM 0 H1 DG A 2 1.674 5.903 -2.261 1.00 0.00 H new ATOM 0 H21 DG A 2 3.634 4.740 -4.885 1.00 0.00 H new ATOM 0 H22 DG A 2 2.017 5.100 -4.270 1.00 0.00 H new ATOM 65 P DA A 3 11.249 7.572 -3.927 1.00 0.00 P ATOM 66 OP1 DA A 3 12.717 7.600 -3.750 1.00 0.00 O ATOM 67 OP2 DA A 3 10.429 8.723 -3.488 1.00 0.00 O ATOM 68 O5' DA A 3 10.933 7.290 -5.484 1.00 0.00 O ATOM 69 C5' DA A 3 9.688 6.705 -5.886 1.00 0.00 C ATOM 70 C4' DA A 3 9.895 5.393 -6.640 1.00 0.00 C ATOM 71 O4' DA A 3 10.388 4.354 -5.744 1.00 0.00 O ATOM 72 C3' DA A 3 8.588 4.896 -7.247 1.00 0.00 C ATOM 73 O3' DA A 3 8.519 5.266 -8.626 1.00 0.00 O ATOM 74 C2' DA A 3 8.617 3.416 -7.080 1.00 0.00 C ATOM 75 C1' DA A 3 9.584 3.157 -5.940 1.00 0.00 C ATOM 76 N9 DA A 3 8.855 2.830 -4.696 1.00 0.00 N ATOM 77 C8 DA A 3 7.585 3.139 -4.331 1.00 0.00 C ATOM 78 N7 DA A 3 7.194 2.772 -3.157 1.00 0.00 N ATOM 79 C5 DA A 3 8.336 2.137 -2.665 1.00 0.00 C ATOM 80 C6 DA A 3 8.617 1.506 -1.449 1.00 0.00 C ATOM 81 N6 DA A 3 7.733 1.415 -0.456 1.00 0.00 N ATOM 82 N1 DA A 3 9.846 0.983 -1.292 1.00 0.00 N ATOM 83 C2 DA A 3 10.748 1.074 -2.271 1.00 0.00 C ATOM 84 N3 DA A 3 10.590 1.649 -3.460 1.00 0.00 N ATOM 85 C4 DA A 3 9.351 2.166 -3.595 1.00 0.00 C ATOM 0 H5' DA A 3 9.145 7.406 -6.519 1.00 0.00 H new ATOM 0 H5'' DA A 3 9.070 6.525 -5.006 1.00 0.00 H new ATOM 0 H4' DA A 3 10.621 5.592 -7.428 1.00 0.00 H new ATOM 0 H3' DA A 3 7.711 5.329 -6.766 1.00 0.00 H new ATOM 0 H2' DA A 3 7.625 3.027 -6.850 1.00 0.00 H new ATOM 0 H2'' DA A 3 8.948 2.924 -7.995 1.00 0.00 H new ATOM 0 H1' DA A 3 10.220 2.307 -6.187 1.00 0.00 H new ATOM 0 H8 DA A 3 6.925 3.673 -4.999 1.00 0.00 H new ATOM 0 H61 DA A 3 7.988 0.944 0.412 1.00 0.00 H new ATOM 0 H62 DA A 3 6.802 1.816 -0.564 1.00 0.00 H new ATOM 0 H2 DA A 3 11.714 0.632 -2.076 1.00 0.00 H new ATOM 97 P DG A 4 7.090 5.446 -9.346 1.00 0.00 P ATOM 98 OP1 DG A 4 7.277 5.248 -10.801 1.00 0.00 O ATOM 99 OP2 DG A 4 6.473 6.694 -8.845 1.00 0.00 O ATOM 100 O5' DG A 4 6.242 4.199 -8.773 1.00 0.00 O ATOM 101 C5' DG A 4 5.706 3.214 -9.664 1.00 0.00 C ATOM 102 C4' DG A 4 4.186 3.099 -9.540 1.00 0.00 C ATOM 103 O4' DG A 4 3.817 2.260 -8.411 1.00 0.00 O ATOM 104 C3' DG A 4 3.533 4.466 -9.339 1.00 0.00 C ATOM 105 O3' DG A 4 2.703 4.761 -10.465 1.00 0.00 O ATOM 106 C2' DG A 4 2.718 4.356 -8.088 1.00 0.00 C ATOM 107 C1' DG A 4 2.692 2.888 -7.752 1.00 0.00 C ATOM 108 N9 DG A 4 2.744 2.675 -6.295 1.00 0.00 N ATOM 109 C8 DG A 4 3.815 2.468 -5.488 1.00 0.00 C ATOM 110 N7 DG A 4 3.588 2.277 -4.232 1.00 0.00 N ATOM 111 C5 DG A 4 2.193 2.364 -4.177 1.00 0.00 C ATOM 112 C6 DG A 4 1.318 2.241 -3.067 1.00 0.00 C ATOM 113 O6 DG A 4 1.601 2.021 -1.893 1.00 0.00 O ATOM 114 N1 DG A 4 -0.009 2.397 -3.443 1.00 0.00 N ATOM 115 C2 DG A 4 -0.447 2.642 -4.728 1.00 0.00 C ATOM 116 N2 DG A 4 -1.763 2.775 -4.883 1.00 0.00 N ATOM 117 N3 DG A 4 0.369 2.758 -5.780 1.00 0.00 N ATOM 118 C4 DG A 4 1.669 2.610 -5.437 1.00 0.00 C ATOM 0 H5' DG A 4 6.162 2.247 -9.452 1.00 0.00 H new ATOM 0 H5'' DG A 4 5.968 3.472 -10.690 1.00 0.00 H new ATOM 0 H4' DG A 4 3.833 2.656 -10.472 1.00 0.00 H new ATOM 0 H3' DG A 4 4.267 5.267 -9.251 1.00 0.00 H new ATOM 0 H2' DG A 4 3.161 4.936 -7.279 1.00 0.00 H new ATOM 0 H2'' DG A 4 1.710 4.741 -8.241 1.00 0.00 H new ATOM 0 H1' DG A 4 1.760 2.443 -8.101 1.00 0.00 H new ATOM 0 H8 DG A 4 4.820 2.463 -5.882 1.00 0.00 H new ATOM 0 H1 DG A 4 -0.716 2.325 -2.711 1.00 0.00 H new ATOM 0 H21 DG A 4 -2.152 2.957 -5.808 1.00 0.00 H new ATOM 0 H22 DG A 4 -2.382 2.694 -4.076 1.00 0.00 H new ATOM 130 P DG A 5 2.137 6.249 -10.699 1.00 0.00 P ATOM 131 OP1 DG A 5 2.167 6.535 -12.150 1.00 0.00 O ATOM 132 OP2 DG A 5 2.820 7.159 -9.752 1.00 0.00 O ATOM 133 O5' DG A 5 0.599 6.104 -10.242 1.00 0.00 O ATOM 134 C5' DG A 5 -0.127 4.904 -10.527 1.00 0.00 C ATOM 135 C4' DG A 5 -1.456 4.848 -9.773 1.00 0.00 C ATOM 136 O4' DG A 5 -1.259 4.416 -8.399 1.00 0.00 O ATOM 137 C3' DG A 5 -2.133 6.216 -9.741 1.00 0.00 C ATOM 138 O3' DG A 5 -3.353 6.145 -10.485 1.00 0.00 O ATOM 139 C2' DG A 5 -2.393 6.519 -8.300 1.00 0.00 C ATOM 140 C1' DG A 5 -2.092 5.246 -7.554 1.00 0.00 C ATOM 141 N9 DG A 5 -1.407 5.549 -6.298 1.00 0.00 N ATOM 142 C8 DG A 5 -0.130 5.928 -6.097 1.00 0.00 C ATOM 143 N7 DG A 5 0.248 6.137 -4.879 1.00 0.00 N ATOM 144 C5 DG A 5 -0.929 5.866 -4.169 1.00 0.00 C ATOM 145 C6 DG A 5 -1.187 5.912 -2.771 1.00 0.00 C ATOM 146 O6 DG A 5 -0.415 6.206 -1.862 1.00 0.00 O ATOM 147 N1 DG A 5 -2.506 5.567 -2.485 1.00 0.00 N ATOM 148 C2 DG A 5 -3.458 5.223 -3.421 1.00 0.00 C ATOM 149 N2 DG A 5 -4.672 4.940 -2.949 1.00 0.00 N ATOM 150 N3 DG A 5 -3.223 5.176 -4.733 1.00 0.00 N ATOM 151 C4 DG A 5 -1.947 5.506 -5.036 1.00 0.00 C ATOM 0 H5' DG A 5 0.480 4.040 -10.257 1.00 0.00 H new ATOM 0 H5'' DG A 5 -0.315 4.839 -11.599 1.00 0.00 H new ATOM 0 H4' DG A 5 -2.086 4.135 -10.304 1.00 0.00 H new ATOM 0 H3' DG A 5 -1.519 6.999 -10.186 1.00 0.00 H new ATOM 0 H2' DG A 5 -1.761 7.336 -7.952 1.00 0.00 H new ATOM 0 H2'' DG A 5 -3.427 6.828 -8.145 1.00 0.00 H new ATOM 0 H1' DG A 5 -3.016 4.721 -7.313 1.00 0.00 H new ATOM 0 H8 DG A 5 0.553 6.053 -6.924 1.00 0.00 H new ATOM 0 H1 DG A 5 -2.790 5.569 -1.505 1.00 0.00 H new ATOM 0 H21 DG A 5 -5.420 4.678 -3.591 1.00 0.00 H new ATOM 0 H22 DG A 5 -4.852 4.985 -1.946 1.00 0.00 H new ATOM 163 P DA A 6 -4.145 7.475 -10.921 1.00 0.00 P ATOM 164 OP1 DA A 6 -3.807 7.775 -12.330 1.00 0.00 O ATOM 165 OP2 DA A 6 -3.937 8.502 -9.877 1.00 0.00 O ATOM 166 O5' DA A 6 -5.685 6.996 -10.862 1.00 0.00 O ATOM 167 C5' DA A 6 -6.281 6.599 -9.620 1.00 0.00 C ATOM 168 C4' DA A 6 -7.050 5.282 -9.753 1.00 0.00 C ATOM 169 O4' DA A 6 -6.209 4.245 -10.336 1.00 0.00 O ATOM 170 C3' DA A 6 -7.528 4.781 -8.399 1.00 0.00 C ATOM 171 O3' DA A 6 -8.889 5.158 -8.188 1.00 0.00 O ATOM 172 C2' DA A 6 -7.380 3.297 -8.455 1.00 0.00 C ATOM 173 C1' DA A 6 -6.360 3.031 -9.547 1.00 0.00 C ATOM 174 N9 DA A 6 -5.053 2.633 -8.978 1.00 0.00 N ATOM 175 C8 DA A 6 -4.573 2.756 -7.713 1.00 0.00 C ATOM 176 N7 DA A 6 -3.370 2.350 -7.486 1.00 0.00 N ATOM 177 C5 DA A 6 -2.984 1.896 -8.749 1.00 0.00 C ATOM 178 C6 DA A 6 -1.799 1.329 -9.226 1.00 0.00 C ATOM 179 N6 DA A 6 -0.733 1.117 -8.454 1.00 0.00 N ATOM 180 N1 DA A 6 -1.753 0.993 -10.527 1.00 0.00 N ATOM 181 C2 DA A 6 -2.809 1.205 -11.316 1.00 0.00 C ATOM 182 N3 DA A 6 -3.978 1.736 -10.969 1.00 0.00 N ATOM 183 C4 DA A 6 -4.000 2.062 -9.662 1.00 0.00 C ATOM 0 H5' DA A 6 -6.957 7.381 -9.275 1.00 0.00 H new ATOM 0 H5'' DA A 6 -5.505 6.492 -8.862 1.00 0.00 H new ATOM 0 H4' DA A 6 -7.905 5.484 -10.398 1.00 0.00 H new ATOM 0 H3' DA A 6 -6.957 5.205 -7.573 1.00 0.00 H new ATOM 0 H2' DA A 6 -7.042 2.900 -7.498 1.00 0.00 H new ATOM 0 H2'' DA A 6 -8.332 2.816 -8.682 1.00 0.00 H new ATOM 0 H1' DA A 6 -6.710 2.209 -10.171 1.00 0.00 H new ATOM 0 H8 DA A 6 -5.178 3.179 -6.925 1.00 0.00 H new ATOM 0 H61 DA A 6 0.109 0.700 -8.851 1.00 0.00 H new ATOM 0 H62 DA A 6 -0.759 1.372 -7.467 1.00 0.00 H new ATOM 0 H2 DA A 6 -2.702 0.913 -12.350 1.00 0.00 H new ATOM 195 P DG A 7 -9.525 5.064 -6.713 1.00 0.00 P ATOM 196 OP1 DG A 7 -10.941 4.653 -6.843 1.00 0.00 O ATOM 197 OP2 DG A 7 -9.180 6.303 -5.980 1.00 0.00 O ATOM 198 O5' DG A 7 -8.701 3.842 -6.057 1.00 0.00 O ATOM 199 C5' DG A 7 -9.369 2.632 -5.684 1.00 0.00 C ATOM 200 C4' DG A 7 -9.230 2.347 -4.190 1.00 0.00 C ATOM 201 O4' DG A 7 -7.959 1.703 -3.898 1.00 0.00 O ATOM 202 C3' DG A 7 -9.306 3.633 -3.367 1.00 0.00 C ATOM 203 O3' DG A 7 -10.496 3.619 -2.573 1.00 0.00 O ATOM 204 C2' DG A 7 -8.079 3.639 -2.502 1.00 0.00 C ATOM 205 C1' DG A 7 -7.461 2.269 -2.664 1.00 0.00 C ATOM 206 N9 DG A 7 -5.991 2.356 -2.674 1.00 0.00 N ATOM 207 C8 DG A 7 -5.128 2.364 -3.719 1.00 0.00 C ATOM 208 N7 DG A 7 -3.867 2.434 -3.453 1.00 0.00 N ATOM 209 C5 DG A 7 -3.874 2.483 -2.055 1.00 0.00 C ATOM 210 C6 DG A 7 -2.790 2.570 -1.140 1.00 0.00 C ATOM 211 O6 DG A 7 -1.587 2.620 -1.385 1.00 0.00 O ATOM 212 N1 DG A 7 -3.235 2.596 0.175 1.00 0.00 N ATOM 213 C2 DG A 7 -4.557 2.545 0.568 1.00 0.00 C ATOM 214 N2 DG A 7 -4.785 2.591 1.879 1.00 0.00 N ATOM 215 N3 DG A 7 -5.582 2.463 -0.284 1.00 0.00 N ATOM 216 C4 DG A 7 -5.173 2.436 -1.573 1.00 0.00 C ATOM 0 H5' DG A 7 -8.957 1.799 -6.253 1.00 0.00 H new ATOM 0 H5'' DG A 7 -10.425 2.704 -5.944 1.00 0.00 H new ATOM 0 H4' DG A 7 -10.056 1.688 -3.921 1.00 0.00 H new ATOM 0 H3' DG A 7 -9.343 4.526 -3.992 1.00 0.00 H new ATOM 0 H2' DG A 7 -7.385 4.421 -2.811 1.00 0.00 H new ATOM 0 H2'' DG A 7 -8.335 3.833 -1.460 1.00 0.00 H new ATOM 0 H1' DG A 7 -7.734 1.629 -1.825 1.00 0.00 H new ATOM 0 H8 DG A 7 -5.483 2.314 -4.738 1.00 0.00 H new ATOM 0 H1 DG A 7 -2.529 2.658 0.909 1.00 0.00 H new ATOM 0 H21 DG A 7 -5.741 2.557 2.232 1.00 0.00 H new ATOM 0 H22 DG A 7 -4.003 2.660 2.530 1.00 0.00 H new ATOM 228 P DG A 8 -11.022 4.968 -1.870 1.00 0.00 P ATOM 229 OP1 DG A 8 -12.486 4.849 -1.679 1.00 0.00 O ATOM 230 OP2 DG A 8 -10.465 6.123 -2.607 1.00 0.00 O ATOM 231 O5' DG A 8 -10.319 4.903 -0.424 1.00 0.00 O ATOM 232 C5' DG A 8 -10.488 3.755 0.411 1.00 0.00 C ATOM 233 C4' DG A 8 -9.909 3.979 1.808 1.00 0.00 C ATOM 234 O4' DG A 8 -8.462 3.792 1.810 1.00 0.00 O ATOM 235 C3' DG A 8 -10.196 5.395 2.305 1.00 0.00 C ATOM 236 O3' DG A 8 -10.838 5.302 3.581 1.00 0.00 O ATOM 237 C2' DG A 8 -8.866 6.061 2.420 1.00 0.00 C ATOM 238 C1' DG A 8 -7.869 4.937 2.473 1.00 0.00 C ATOM 239 N9 DG A 8 -6.616 5.333 1.832 1.00 0.00 N ATOM 240 C8 DG A 8 -6.422 5.881 0.619 1.00 0.00 C ATOM 241 N7 DG A 8 -5.206 6.156 0.272 1.00 0.00 N ATOM 242 C5 DG A 8 -4.491 5.740 1.403 1.00 0.00 C ATOM 243 C6 DG A 8 -3.094 5.773 1.669 1.00 0.00 C ATOM 244 O6 DG A 8 -2.189 6.180 0.943 1.00 0.00 O ATOM 245 N1 DG A 8 -2.802 5.260 2.929 1.00 0.00 N ATOM 246 C2 DG A 8 -3.733 4.777 3.826 1.00 0.00 C ATOM 247 N2 DG A 8 -3.259 4.341 4.992 1.00 0.00 N ATOM 248 N3 DG A 8 -5.045 4.742 3.583 1.00 0.00 N ATOM 249 C4 DG A 8 -5.353 5.236 2.362 1.00 0.00 C ATOM 0 H5' DG A 8 -10.002 2.895 -0.050 1.00 0.00 H new ATOM 0 H5'' DG A 8 -11.549 3.517 0.491 1.00 0.00 H new ATOM 0 H4' DG A 8 -10.384 3.250 2.464 1.00 0.00 H new ATOM 0 H3' DG A 8 -10.849 5.959 1.639 1.00 0.00 H new ATOM 0 H2' DG A 8 -8.678 6.715 1.569 1.00 0.00 H new ATOM 0 H2'' DG A 8 -8.811 6.680 3.316 1.00 0.00 H new ATOM 0 H1' DG A 8 -7.630 4.683 3.506 1.00 0.00 H new ATOM 0 H8 DG A 8 -7.252 6.084 -0.042 1.00 0.00 H new ATOM 0 H1 DG A 8 -1.822 5.239 3.212 1.00 0.00 H new ATOM 0 H21 DG A 8 -3.898 3.972 5.696 1.00 0.00 H new ATOM 0 H22 DG A 8 -2.257 4.376 5.180 1.00 0.00 H new ATOM 261 P DA A 9 -11.561 6.573 4.250 1.00 0.00 P ATOM 262 OP1 DA A 9 -13.025 6.398 4.117 1.00 0.00 O ATOM 263 OP2 DA A 9 -10.913 7.800 3.737 1.00 0.00 O ATOM 264 O5' DA A 9 -11.169 6.403 5.806 1.00 0.00 O ATOM 265 C5' DA A 9 -9.913 5.824 6.187 1.00 0.00 C ATOM 266 C4' DA A 9 -10.094 4.469 6.871 1.00 0.00 C ATOM 267 O4' DA A 9 -10.662 3.493 5.951 1.00 0.00 O ATOM 268 C3' DA A 9 -8.764 3.912 7.359 1.00 0.00 C ATOM 269 O3' DA A 9 -8.572 4.230 8.741 1.00 0.00 O ATOM 270 C2' DA A 9 -8.846 2.441 7.138 1.00 0.00 C ATOM 271 C1' DA A 9 -9.916 2.251 6.084 1.00 0.00 C ATOM 272 N9 DA A 9 -9.297 1.876 4.800 1.00 0.00 N ATOM 273 C8 DA A 9 -8.092 2.234 4.296 1.00 0.00 C ATOM 274 N7 DA A 9 -7.774 1.789 3.130 1.00 0.00 N ATOM 275 C5 DA A 9 -8.902 1.034 2.802 1.00 0.00 C ATOM 276 C6 DA A 9 -9.234 0.274 1.677 1.00 0.00 C ATOM 277 N6 DA A 9 -8.429 0.152 0.624 1.00 0.00 N ATOM 278 N1 DA A 9 -10.426 -0.346 1.678 1.00 0.00 N ATOM 279 C2 DA A 9 -11.248 -0.226 2.723 1.00 0.00 C ATOM 280 N3 DA A 9 -11.036 0.469 3.838 1.00 0.00 N ATOM 281 C4 DA A 9 -9.835 1.079 3.813 1.00 0.00 C ATOM 0 H5' DA A 9 -9.389 6.503 6.860 1.00 0.00 H new ATOM 0 H5'' DA A 9 -9.286 5.704 5.304 1.00 0.00 H new ATOM 0 H4' DA A 9 -10.764 4.635 7.715 1.00 0.00 H new ATOM 0 H3' DA A 9 -7.914 4.339 6.827 1.00 0.00 H new ATOM 0 H2' DA A 9 -7.889 2.040 6.803 1.00 0.00 H new ATOM 0 H2'' DA A 9 -9.105 1.919 8.059 1.00 0.00 H new ATOM 0 H1' DA A 9 -10.594 1.450 6.378 1.00 0.00 H new ATOM 0 H8 DA A 9 -7.421 2.871 4.853 1.00 0.00 H new ATOM 0 H61 DA A 9 -8.716 -0.414 -0.174 1.00 0.00 H new ATOM 0 H62 DA A 9 -7.525 0.625 0.615 1.00 0.00 H new ATOM 0 H2 DA A 9 -12.189 -0.751 2.656 1.00 0.00 H new ATOM 293 P DG A 10 -7.100 4.580 9.296 1.00 0.00 P ATOM 294 OP1 DG A 10 -7.094 4.362 10.759 1.00 0.00 O ATOM 295 OP2 DG A 10 -6.698 5.894 8.744 1.00 0.00 O ATOM 296 O5' DG A 10 -6.180 3.445 8.613 1.00 0.00 O ATOM 297 C5' DG A 10 -6.093 2.138 9.192 1.00 0.00 C ATOM 298 C4' DG A 10 -4.666 1.583 9.145 1.00 0.00 C ATOM 299 O4' DG A 10 -4.359 1.026 7.831 1.00 0.00 O ATOM 300 C3' DG A 10 -3.626 2.666 9.442 1.00 0.00 C ATOM 301 O3' DG A 10 -2.856 2.252 10.573 1.00 0.00 O ATOM 302 C2' DG A 10 -2.771 2.751 8.220 1.00 0.00 C ATOM 303 C1' DG A 10 -3.030 1.473 7.474 1.00 0.00 C ATOM 304 N9 DG A 10 -2.889 1.685 6.024 1.00 0.00 N ATOM 305 C8 DG A 10 -3.825 1.655 5.047 1.00 0.00 C ATOM 306 N7 DG A 10 -3.433 1.884 3.839 1.00 0.00 N ATOM 307 C5 DG A 10 -2.063 2.098 4.017 1.00 0.00 C ATOM 308 C6 DG A 10 -1.055 2.403 3.065 1.00 0.00 C ATOM 309 O6 DG A 10 -1.173 2.546 1.849 1.00 0.00 O ATOM 310 N1 DG A 10 0.190 2.541 3.666 1.00 0.00 N ATOM 311 C2 DG A 10 0.441 2.401 5.015 1.00 0.00 C ATOM 312 N2 DG A 10 1.706 2.570 5.401 1.00 0.00 N ATOM 313 N3 DG A 10 -0.501 2.114 5.918 1.00 0.00 N ATOM 314 C4 DG A 10 -1.723 1.976 5.355 1.00 0.00 C ATOM 0 H5' DG A 10 -6.763 1.461 8.661 1.00 0.00 H new ATOM 0 H5'' DG A 10 -6.433 2.177 10.227 1.00 0.00 H new ATOM 0 H4' DG A 10 -4.619 0.806 9.908 1.00 0.00 H new ATOM 0 H3' DG A 10 -4.071 3.635 9.670 1.00 0.00 H new ATOM 0 H2' DG A 10 -3.031 3.620 7.616 1.00 0.00 H new ATOM 0 H2'' DG A 10 -1.717 2.849 8.482 1.00 0.00 H new ATOM 0 H1' DG A 10 -2.303 0.707 7.744 1.00 0.00 H new ATOM 0 H8 DG A 10 -4.861 1.447 5.270 1.00 0.00 H new ATOM 0 H1 DG A 10 0.981 2.763 3.062 1.00 0.00 H new ATOM 0 H21 DG A 10 1.955 2.479 6.386 1.00 0.00 H new ATOM 0 H22 DG A 10 2.425 2.790 4.711 1.00 0.00 H new ATOM 326 P DG A 11 -1.901 3.288 11.342 1.00 0.00 P ATOM 327 OP1 DG A 11 -2.539 3.637 12.632 1.00 0.00 O ATOM 328 OP2 DG A 11 -1.516 4.358 10.395 1.00 0.00 O ATOM 329 O5' DG A 11 -0.596 2.390 11.651 1.00 0.00 O ATOM 330 C5' DG A 11 0.336 2.059 10.610 1.00 0.00 C ATOM 331 C4' DG A 11 1.595 2.907 10.683 1.00 0.00 C ATOM 332 O4' DG A 11 1.920 3.386 9.356 1.00 0.00 O ATOM 333 C3' DG A 11 1.381 4.111 11.592 1.00 0.00 C ATOM 334 O3' DG A 11 2.448 4.176 12.548 1.00 0.00 O ATOM 335 C2' DG A 11 1.384 5.291 10.684 1.00 0.00 C ATOM 336 C1' DG A 11 2.057 4.816 9.420 1.00 0.00 C ATOM 337 N9 DG A 11 1.459 5.431 8.221 1.00 0.00 N ATOM 338 C8 DG A 11 0.152 5.610 7.900 1.00 0.00 C ATOM 339 N7 DG A 11 -0.114 6.128 6.747 1.00 0.00 N ATOM 340 C5 DG A 11 1.165 6.323 6.219 1.00 0.00 C ATOM 341 C6 DG A 11 1.560 6.861 4.964 1.00 0.00 C ATOM 342 O6 DG A 11 0.846 7.282 4.057 1.00 0.00 O ATOM 343 N1 DG A 11 2.943 6.877 4.828 1.00 0.00 N ATOM 344 C2 DG A 11 3.841 6.434 5.779 1.00 0.00 C ATOM 345 N2 DG A 11 5.132 6.534 5.463 1.00 0.00 N ATOM 346 N3 DG A 11 3.478 5.927 6.962 1.00 0.00 N ATOM 347 C4 DG A 11 2.135 5.899 7.116 1.00 0.00 C ATOM 0 H5' DG A 11 -0.140 2.199 9.639 1.00 0.00 H new ATOM 0 H5'' DG A 11 0.604 1.005 10.685 1.00 0.00 H new ATOM 0 H4' DG A 11 2.404 2.295 11.083 1.00 0.00 H new ATOM 0 H3' DG A 11 0.451 4.061 12.158 1.00 0.00 H new ATOM 0 H2' DG A 11 0.370 5.637 10.484 1.00 0.00 H new ATOM 0 H2'' DG A 11 1.924 6.128 11.127 1.00 0.00 H new ATOM 0 H1' DG A 11 3.107 5.107 9.442 1.00 0.00 H new ATOM 0 H8 DG A 11 -0.636 5.330 8.583 1.00 0.00 H new ATOM 0 H1 DG A 11 3.325 7.245 3.957 1.00 0.00 H new ATOM 0 H21 DG A 11 5.844 6.224 6.124 1.00 0.00 H new ATOM 0 H22 DG A 11 5.408 6.921 4.560 1.00 0.00 H new ATOM 359 P DA A 12 2.170 3.879 14.109 1.00 0.00 P ATOM 360 OP1 DA A 12 0.912 4.558 14.492 1.00 0.00 O ATOM 361 OP2 DA A 12 3.415 4.157 14.860 1.00 0.00 O ATOM 362 O5' DA A 12 1.911 2.288 14.134 1.00 0.00 O ATOM 363 C5' DA A 12 0.589 1.758 13.974 1.00 0.00 C ATOM 364 C4' DA A 12 0.589 0.521 13.071 1.00 0.00 C ATOM 365 O4' DA A 12 1.591 0.696 12.037 1.00 0.00 O ATOM 366 C3' DA A 12 0.925 -0.753 13.838 1.00 0.00 C ATOM 367 O3' DA A 12 0.055 -1.796 13.377 1.00 0.00 O ATOM 368 C2' DA A 12 2.340 -1.059 13.465 1.00 0.00 C ATOM 369 C1' DA A 12 2.543 -0.378 12.128 1.00 0.00 C ATOM 370 N9 DA A 12 3.895 0.171 12.019 1.00 0.00 N ATOM 371 C8 DA A 12 4.603 0.839 12.941 1.00 0.00 C ATOM 372 N7 DA A 12 5.772 1.273 12.604 1.00 0.00 N ATOM 373 C5 DA A 12 5.853 0.840 11.275 1.00 0.00 C ATOM 374 C6 DA A 12 6.840 0.963 10.293 1.00 0.00 C ATOM 375 N6 DA A 12 8.000 1.588 10.499 1.00 0.00 N ATOM 376 N1 DA A 12 6.586 0.419 9.090 1.00 0.00 N ATOM 377 C2 DA A 12 5.431 -0.211 8.865 1.00 0.00 C ATOM 378 N3 DA A 12 4.432 -0.388 9.721 1.00 0.00 N ATOM 379 C4 DA A 12 4.709 0.165 10.915 1.00 0.00 C ATOM 0 H5' DA A 12 -0.062 2.522 13.548 1.00 0.00 H new ATOM 0 H5'' DA A 12 0.179 1.498 14.950 1.00 0.00 H new ATOM 0 H4' DA A 12 -0.413 0.419 12.653 1.00 0.00 H new ATOM 0 H3' DA A 12 0.805 -0.656 14.917 1.00 0.00 H new ATOM 0 H2' DA A 12 3.037 -0.680 14.212 1.00 0.00 H new ATOM 0 H2'' DA A 12 2.506 -2.134 13.391 1.00 0.00 H new ATOM 0 H1' DA A 12 2.405 -1.102 11.325 1.00 0.00 H new ATOM 0 H8 DA A 12 4.209 1.009 13.932 1.00 0.00 H new ATOM 0 H61 DA A 12 8.687 1.649 9.747 1.00 0.00 H new ATOM 0 H62 DA A 12 8.200 2.005 11.408 1.00 0.00 H new ATOM 0 H2 DA A 12 5.294 -0.623 7.876 1.00 0.00 H new ATOM 391 P DG A 13 -1.508 -1.812 13.765 1.00 0.00 P ATOM 392 OP1 DG A 13 -1.943 -0.417 13.991 1.00 0.00 O ATOM 393 OP2 DG A 13 -1.711 -2.830 14.820 1.00 0.00 O ATOM 394 O5' DG A 13 -2.205 -2.347 12.406 1.00 0.00 O ATOM 395 C5' DG A 13 -1.832 -1.822 11.122 1.00 0.00 C ATOM 396 C4' DG A 13 -3.004 -1.825 10.142 1.00 0.00 C ATOM 397 O4' DG A 13 -2.663 -1.089 8.936 1.00 0.00 O ATOM 398 C3' DG A 13 -3.394 -3.244 9.737 1.00 0.00 C ATOM 399 O3' DG A 13 -4.700 -3.530 10.246 1.00 0.00 O ATOM 400 C2' DG A 13 -3.376 -3.280 8.245 1.00 0.00 C ATOM 401 C1' DG A 13 -3.065 -1.877 7.788 1.00 0.00 C ATOM 402 N9 DG A 13 -2.013 -1.877 6.752 1.00 0.00 N ATOM 403 C8 DG A 13 -0.689 -2.162 6.852 1.00 0.00 C ATOM 404 N7 DG A 13 0.021 -2.086 5.776 1.00 0.00 N ATOM 405 C5 DG A 13 -0.934 -1.702 4.830 1.00 0.00 C ATOM 406 C6 DG A 13 -0.787 -1.448 3.440 1.00 0.00 C ATOM 407 O6 DG A 13 0.232 -1.515 2.756 1.00 0.00 O ATOM 408 N1 DG A 13 -1.995 -1.085 2.857 1.00 0.00 N ATOM 409 C2 DG A 13 -3.199 -0.979 3.525 1.00 0.00 C ATOM 410 N2 DG A 13 -4.249 -0.612 2.793 1.00 0.00 N ATOM 411 N3 DG A 13 -3.345 -1.217 4.832 1.00 0.00 N ATOM 412 C4 DG A 13 -2.181 -1.571 5.420 1.00 0.00 C ATOM 0 H5' DG A 13 -1.014 -2.414 10.711 1.00 0.00 H new ATOM 0 H5'' DG A 13 -1.460 -0.804 11.240 1.00 0.00 H new ATOM 0 H4' DG A 13 -3.843 -1.351 10.652 1.00 0.00 H new ATOM 0 H3' DG A 13 -2.710 -3.992 10.138 1.00 0.00 H new ATOM 0 H2' DG A 13 -2.625 -3.982 7.883 1.00 0.00 H new ATOM 0 H2'' DG A 13 -4.337 -3.612 7.853 1.00 0.00 H new ATOM 0 H1' DG A 13 -3.956 -1.437 7.340 1.00 0.00 H new ATOM 0 H8 DG A 13 -0.246 -2.442 7.796 1.00 0.00 H new ATOM 0 H1 DG A 13 -1.992 -0.881 1.858 1.00 0.00 H new ATOM 0 H21 DG A 13 -5.166 -0.516 3.229 1.00 0.00 H new ATOM 0 H22 DG A 13 -4.136 -0.427 1.796 1.00 0.00 H new ATOM 424 P DG A 14 -5.250 -5.040 10.288 1.00 0.00 P ATOM 425 OP1 DG A 14 -6.214 -5.152 11.405 1.00 0.00 O ATOM 426 OP2 DG A 14 -4.092 -5.958 10.216 1.00 0.00 O ATOM 427 O5' DG A 14 -6.066 -5.147 8.904 1.00 0.00 O ATOM 428 C5' DG A 14 -7.018 -4.142 8.541 1.00 0.00 C ATOM 429 C4' DG A 14 -7.541 -4.360 7.124 1.00 0.00 C ATOM 430 O4' DG A 14 -6.586 -3.857 6.137 1.00 0.00 O ATOM 431 C3' DG A 14 -7.751 -5.847 6.849 1.00 0.00 C ATOM 432 O3' DG A 14 -9.046 -6.024 6.263 1.00 0.00 O ATOM 433 C2' DG A 14 -6.670 -6.221 5.890 1.00 0.00 C ATOM 434 C1' DG A 14 -6.306 -4.934 5.208 1.00 0.00 C ATOM 435 N9 DG A 14 -4.898 -4.944 4.802 1.00 0.00 N ATOM 436 C8 DG A 14 -3.795 -5.125 5.554 1.00 0.00 C ATOM 437 N7 DG A 14 -2.650 -5.108 4.954 1.00 0.00 N ATOM 438 C5 DG A 14 -3.032 -4.891 3.622 1.00 0.00 C ATOM 439 C6 DG A 14 -2.237 -4.771 2.449 1.00 0.00 C ATOM 440 O6 DG A 14 -1.013 -4.831 2.348 1.00 0.00 O ATOM 441 N1 DG A 14 -3.022 -4.561 1.320 1.00 0.00 N ATOM 442 C2 DG A 14 -4.400 -4.475 1.316 1.00 0.00 C ATOM 443 N2 DG A 14 -4.974 -4.280 0.128 1.00 0.00 N ATOM 444 N3 DG A 14 -5.152 -4.585 2.413 1.00 0.00 N ATOM 445 C4 DG A 14 -4.410 -4.790 3.525 1.00 0.00 C ATOM 0 H5' DG A 14 -6.556 -3.157 8.613 1.00 0.00 H new ATOM 0 H5'' DG A 14 -7.851 -4.156 9.244 1.00 0.00 H new ATOM 0 H4' DG A 14 -8.486 -3.823 7.043 1.00 0.00 H new ATOM 0 H3' DG A 14 -7.707 -6.465 7.746 1.00 0.00 H new ATOM 0 H2' DG A 14 -5.813 -6.652 6.407 1.00 0.00 H new ATOM 0 H2'' DG A 14 -7.016 -6.965 5.173 1.00 0.00 H new ATOM 0 H1' DG A 14 -6.890 -4.799 4.298 1.00 0.00 H new ATOM 0 H8 DG A 14 -3.865 -5.279 6.621 1.00 0.00 H new ATOM 0 H1 DG A 14 -2.542 -4.463 0.425 1.00 0.00 H new ATOM 0 H21 DG A 14 -5.989 -4.208 0.058 1.00 0.00 H new ATOM 0 H22 DG A 14 -4.398 -4.203 -0.710 1.00 0.00 H new ATOM 457 P DA A 15 -9.717 -7.481 6.158 1.00 0.00 P ATOM 458 OP1 DA A 15 -10.781 -7.578 7.182 1.00 0.00 O ATOM 459 OP2 DA A 15 -8.635 -8.490 6.119 1.00 0.00 O ATOM 460 O5' DA A 15 -10.417 -7.435 4.706 1.00 0.00 O ATOM 461 C5' DA A 15 -9.883 -6.611 3.661 1.00 0.00 C ATOM 462 C4' DA A 15 -10.792 -5.418 3.361 1.00 0.00 C ATOM 463 O4' DA A 15 -10.694 -4.414 4.412 1.00 0.00 O ATOM 464 C3' DA A 15 -10.408 -4.747 2.048 1.00 0.00 C ATOM 465 O3' DA A 15 -11.259 -5.211 0.997 1.00 0.00 O ATOM 466 C2' DA A 15 -10.584 -3.283 2.286 1.00 0.00 C ATOM 467 C1' DA A 15 -10.523 -3.109 3.790 1.00 0.00 C ATOM 468 N9 DA A 15 -9.233 -2.518 4.202 1.00 0.00 N ATOM 469 C8 DA A 15 -8.006 -2.618 3.626 1.00 0.00 C ATOM 470 N7 DA A 15 -7.023 -2.022 4.210 1.00 0.00 N ATOM 471 C5 DA A 15 -7.656 -1.450 5.315 1.00 0.00 C ATOM 472 C6 DA A 15 -7.185 -0.666 6.371 1.00 0.00 C ATOM 473 N6 DA A 15 -5.910 -0.309 6.497 1.00 0.00 N ATOM 474 N1 DA A 15 -8.076 -0.267 7.293 1.00 0.00 N ATOM 475 C2 DA A 15 -9.357 -0.617 7.186 1.00 0.00 C ATOM 476 N3 DA A 15 -9.914 -1.357 6.231 1.00 0.00 N ATOM 477 C4 DA A 15 -9.000 -1.744 5.318 1.00 0.00 C ATOM 0 H5' DA A 15 -9.755 -7.207 2.757 1.00 0.00 H new ATOM 0 H5'' DA A 15 -8.895 -6.252 3.949 1.00 0.00 H new ATOM 0 H4' DA A 15 -11.808 -5.807 3.299 1.00 0.00 H new ATOM 0 H3' DA A 15 -9.386 -4.975 1.745 1.00 0.00 H new ATOM 0 H2' DA A 15 -9.801 -2.708 1.792 1.00 0.00 H new ATOM 0 H2'' DA A 15 -11.536 -2.932 1.888 1.00 0.00 H new ATOM 0 H1' DA A 15 -11.316 -2.432 4.107 1.00 0.00 H new ATOM 0 H8 DA A 15 -7.860 -3.176 2.713 1.00 0.00 H new ATOM 0 H61 DA A 15 -5.617 0.265 7.288 1.00 0.00 H new ATOM 0 H62 DA A 15 -5.225 -0.609 5.803 1.00 0.00 H new ATOM 0 H2 DA A 15 -10.018 -0.260 7.962 1.00 0.00 H new ATOM 489 P DG A 16 -10.856 -4.949 -0.538 1.00 0.00 P ATOM 490 OP1 DG A 16 -12.085 -4.605 -1.288 1.00 0.00 O ATOM 491 OP2 DG A 16 -10.004 -6.071 -0.992 1.00 0.00 O ATOM 492 O5' DG A 16 -9.939 -3.627 -0.437 1.00 0.00 O ATOM 493 C5' DG A 16 -10.385 -2.387 -0.995 1.00 0.00 C ATOM 494 C4' DG A 16 -9.421 -1.869 -2.061 1.00 0.00 C ATOM 495 O4' DG A 16 -8.302 -1.173 -1.450 1.00 0.00 O ATOM 496 C3' DG A 16 -8.861 -3.009 -2.912 1.00 0.00 C ATOM 497 O3' DG A 16 -9.376 -2.903 -4.242 1.00 0.00 O ATOM 498 C2' DG A 16 -7.371 -2.842 -2.887 1.00 0.00 C ATOM 499 C1' DG A 16 -7.115 -1.521 -2.196 1.00 0.00 C ATOM 500 N9 DG A 16 -5.952 -1.627 -1.299 1.00 0.00 N ATOM 501 C8 DG A 16 -5.906 -1.687 0.054 1.00 0.00 C ATOM 502 N7 DG A 16 -4.747 -1.801 0.609 1.00 0.00 N ATOM 503 C5 DG A 16 -3.901 -1.820 -0.502 1.00 0.00 C ATOM 504 C6 DG A 16 -2.488 -1.929 -0.567 1.00 0.00 C ATOM 505 O6 DG A 16 -1.687 -2.032 0.360 1.00 0.00 O ATOM 506 N1 DG A 16 -2.036 -1.908 -1.879 1.00 0.00 N ATOM 507 C2 DG A 16 -2.839 -1.796 -2.996 1.00 0.00 C ATOM 508 N2 DG A 16 -2.217 -1.785 -4.173 1.00 0.00 N ATOM 509 N3 DG A 16 -4.170 -1.693 -2.944 1.00 0.00 N ATOM 510 C4 DG A 16 -4.633 -1.712 -1.675 1.00 0.00 C ATOM 0 H5' DG A 16 -10.484 -1.646 -0.202 1.00 0.00 H new ATOM 0 H5'' DG A 16 -11.375 -2.520 -1.432 1.00 0.00 H new ATOM 0 H4' DG A 16 -9.990 -1.187 -2.693 1.00 0.00 H new ATOM 0 H3' DG A 16 -9.143 -3.992 -2.535 1.00 0.00 H new ATOM 0 H2' DG A 16 -6.895 -3.663 -2.350 1.00 0.00 H new ATOM 0 H2'' DG A 16 -6.961 -2.841 -3.897 1.00 0.00 H new ATOM 0 H1' DG A 16 -6.894 -0.747 -2.931 1.00 0.00 H new ATOM 0 H8 DG A 16 -6.808 -1.641 0.647 1.00 0.00 H new ATOM 0 H1 DG A 16 -1.030 -1.981 -2.030 1.00 0.00 H new ATOM 0 H21 DG A 16 -2.757 -1.704 -5.035 1.00 0.00 H new ATOM 0 H22 DG A 16 -1.200 -1.857 -4.213 1.00 0.00 H new ATOM 522 P DG A 17 -9.753 -4.226 -5.078 1.00 0.00 P ATOM 523 OP1 DG A 17 -10.956 -3.935 -5.889 1.00 0.00 O ATOM 524 OP2 DG A 17 -9.750 -5.378 -4.149 1.00 0.00 O ATOM 525 O5' DG A 17 -8.498 -4.375 -6.071 1.00 0.00 O ATOM 526 C5' DG A 17 -8.083 -3.273 -6.880 1.00 0.00 C ATOM 527 C4' DG A 17 -6.694 -3.498 -7.469 1.00 0.00 C ATOM 528 O4' DG A 17 -5.654 -3.193 -6.490 1.00 0.00 O ATOM 529 C3' DG A 17 -6.508 -4.945 -7.912 1.00 0.00 C ATOM 530 O3' DG A 17 -6.110 -4.947 -9.287 1.00 0.00 O ATOM 531 C2' DG A 17 -5.429 -5.495 -7.043 1.00 0.00 C ATOM 532 C1' DG A 17 -4.712 -4.291 -6.503 1.00 0.00 C ATOM 533 N9 DG A 17 -4.178 -4.569 -5.169 1.00 0.00 N ATOM 534 C8 DG A 17 -4.807 -5.053 -4.082 1.00 0.00 C ATOM 535 N7 DG A 17 -4.100 -5.246 -3.016 1.00 0.00 N ATOM 536 C5 DG A 17 -2.828 -4.838 -3.444 1.00 0.00 C ATOM 537 C6 DG A 17 -1.590 -4.804 -2.743 1.00 0.00 C ATOM 538 O6 DG A 17 -1.363 -5.130 -1.580 1.00 0.00 O ATOM 539 N1 DG A 17 -0.560 -4.327 -3.550 1.00 0.00 N ATOM 540 C2 DG A 17 -0.698 -3.933 -4.865 1.00 0.00 C ATOM 541 N2 DG A 17 0.407 -3.506 -5.473 1.00 0.00 N ATOM 542 N3 DG A 17 -1.857 -3.962 -5.528 1.00 0.00 N ATOM 543 C4 DG A 17 -2.873 -4.421 -4.764 1.00 0.00 C ATOM 0 H5' DG A 17 -8.081 -2.362 -6.281 1.00 0.00 H new ATOM 0 H5'' DG A 17 -8.801 -3.123 -7.687 1.00 0.00 H new ATOM 0 H4' DG A 17 -6.608 -2.833 -8.328 1.00 0.00 H new ATOM 0 H3' DG A 17 -7.416 -5.542 -7.822 1.00 0.00 H new ATOM 0 H2' DG A 17 -5.842 -6.102 -6.238 1.00 0.00 H new ATOM 0 H2'' DG A 17 -4.753 -6.135 -7.610 1.00 0.00 H new ATOM 0 H1' DG A 17 -3.859 -4.031 -7.130 1.00 0.00 H new ATOM 0 H8 DG A 17 -5.864 -5.272 -4.099 1.00 0.00 H new ATOM 0 H1 DG A 17 0.370 -4.264 -3.136 1.00 0.00 H new ATOM 0 H21 DG A 17 0.369 -3.201 -6.446 1.00 0.00 H new ATOM 0 H22 DG A 17 1.292 -3.484 -4.966 1.00 0.00 H new ATOM 555 P DA A 18 -6.129 -6.293 -10.164 1.00 0.00 P ATOM 556 OP1 DA A 18 -7.324 -6.262 -11.036 1.00 0.00 O ATOM 557 OP2 DA A 18 -5.903 -7.442 -9.258 1.00 0.00 O ATOM 558 O5' DA A 18 -4.820 -6.112 -11.090 1.00 0.00 O ATOM 559 C5' DA A 18 -3.643 -5.465 -10.584 1.00 0.00 C ATOM 560 C4' DA A 18 -3.394 -4.120 -11.270 1.00 0.00 C ATOM 561 O4' DA A 18 -4.357 -3.123 -10.822 1.00 0.00 O ATOM 562 C3' DA A 18 -2.002 -3.587 -10.954 1.00 0.00 C ATOM 563 O3' DA A 18 -1.100 -3.911 -12.014 1.00 0.00 O ATOM 564 C2' DA A 18 -2.169 -2.109 -10.817 1.00 0.00 C ATOM 565 C1' DA A 18 -3.641 -1.893 -10.516 1.00 0.00 C ATOM 566 N9 DA A 18 -3.838 -1.528 -9.099 1.00 0.00 N ATOM 567 C8 DA A 18 -3.055 -1.779 -8.020 1.00 0.00 C ATOM 568 N7 DA A 18 -3.478 -1.381 -6.868 1.00 0.00 N ATOM 569 C5 DA A 18 -4.697 -0.786 -7.207 1.00 0.00 C ATOM 570 C6 DA A 18 -5.684 -0.153 -6.446 1.00 0.00 C ATOM 571 N6 DA A 18 -5.607 -0.017 -5.124 1.00 0.00 N ATOM 572 N1 DA A 18 -6.761 0.319 -7.099 1.00 0.00 N ATOM 573 C2 DA A 18 -6.865 0.178 -8.422 1.00 0.00 C ATOM 574 N3 DA A 18 -5.992 -0.406 -9.238 1.00 0.00 N ATOM 575 C4 DA A 18 -4.923 -0.870 -8.563 1.00 0.00 C ATOM 0 H5' DA A 18 -2.780 -6.114 -10.732 1.00 0.00 H new ATOM 0 H5'' DA A 18 -3.746 -5.312 -9.510 1.00 0.00 H new ATOM 0 H4' DA A 18 -3.494 -4.293 -12.342 1.00 0.00 H new ATOM 0 H3' DA A 18 -1.585 -4.024 -10.047 1.00 0.00 H new ATOM 0 H2' DA A 18 -1.543 -1.716 -10.016 1.00 0.00 H new ATOM 0 H2'' DA A 18 -1.876 -1.595 -11.732 1.00 0.00 H new ATOM 0 H1' DA A 18 -4.022 -1.074 -11.126 1.00 0.00 H new ATOM 0 H8 DA A 18 -2.111 -2.294 -8.122 1.00 0.00 H new ATOM 0 H61 DA A 18 -6.355 0.454 -4.615 1.00 0.00 H new ATOM 0 H62 DA A 18 -4.800 -0.384 -4.620 1.00 0.00 H new ATOM 0 H2 DA A 18 -7.755 0.582 -8.880 1.00 0.00 H new ATOM 587 P DG A 19 0.489 -3.786 -11.785 1.00 0.00 P ATOM 588 OP1 DG A 19 1.116 -3.434 -13.078 1.00 0.00 O ATOM 589 OP2 DG A 19 0.946 -4.983 -11.045 1.00 0.00 O ATOM 590 O5' DG A 19 0.607 -2.510 -10.804 1.00 0.00 O ATOM 591 C5' DG A 19 1.489 -1.429 -11.123 1.00 0.00 C ATOM 592 C4' DG A 19 2.599 -1.274 -10.084 1.00 0.00 C ATOM 593 O4' DG A 19 2.134 -0.518 -8.932 1.00 0.00 O ATOM 594 C3' DG A 19 3.095 -2.633 -9.586 1.00 0.00 C ATOM 595 O3' DG A 19 4.467 -2.793 -9.957 1.00 0.00 O ATOM 596 C2' DG A 19 2.945 -2.603 -8.095 1.00 0.00 C ATOM 597 C1' DG A 19 2.654 -1.164 -7.750 1.00 0.00 C ATOM 598 N9 DG A 19 1.709 -1.060 -6.627 1.00 0.00 N ATOM 599 C8 DG A 19 0.354 -1.004 -6.629 1.00 0.00 C ATOM 600 N7 DG A 19 -0.237 -0.865 -5.489 1.00 0.00 N ATOM 601 C5 DG A 19 0.849 -0.821 -4.607 1.00 0.00 C ATOM 602 C6 DG A 19 0.872 -0.678 -3.194 1.00 0.00 C ATOM 603 O6 DG A 19 -0.076 -0.551 -2.425 1.00 0.00 O ATOM 604 N1 DG A 19 2.172 -0.685 -2.702 1.00 0.00 N ATOM 605 C2 DG A 19 3.311 -0.812 -3.470 1.00 0.00 C ATOM 606 N2 DG A 19 4.471 -0.799 -2.815 1.00 0.00 N ATOM 607 N3 DG A 19 3.298 -0.944 -4.798 1.00 0.00 N ATOM 608 C4 DG A 19 2.042 -0.941 -5.299 1.00 0.00 C ATOM 0 H5' DG A 19 0.919 -0.502 -11.186 1.00 0.00 H new ATOM 0 H5'' DG A 19 1.932 -1.599 -12.105 1.00 0.00 H new ATOM 0 H4' DG A 19 3.413 -0.744 -10.578 1.00 0.00 H new ATOM 0 H3' DG A 19 2.536 -3.465 -10.014 1.00 0.00 H new ATOM 0 H2' DG A 19 2.136 -3.257 -7.768 1.00 0.00 H new ATOM 0 H2'' DG A 19 3.853 -2.949 -7.602 1.00 0.00 H new ATOM 0 H1' DG A 19 3.571 -0.670 -7.428 1.00 0.00 H new ATOM 0 H8 DG A 19 -0.209 -1.073 -7.548 1.00 0.00 H new ATOM 0 H1 DG A 19 2.293 -0.589 -1.694 1.00 0.00 H new ATOM 0 H21 DG A 19 5.348 -0.889 -3.329 1.00 0.00 H new ATOM 0 H22 DG A 19 4.482 -0.699 -1.800 1.00 0.00 H new ATOM 620 P DG A 20 5.176 -4.234 -9.860 1.00 0.00 P ATOM 621 OP1 DG A 20 6.365 -4.226 -10.741 1.00 0.00 O ATOM 622 OP2 DG A 20 4.137 -5.274 -10.029 1.00 0.00 O ATOM 623 O5' DG A 20 5.679 -4.264 -8.330 1.00 0.00 O ATOM 624 C5' DG A 20 6.839 -3.527 -7.930 1.00 0.00 C ATOM 625 C4' DG A 20 7.340 -3.974 -6.556 1.00 0.00 C ATOM 626 O4' DG A 20 6.556 -3.353 -5.492 1.00 0.00 O ATOM 627 C3' DG A 20 7.220 -5.491 -6.406 1.00 0.00 C ATOM 628 O3' DG A 20 8.456 -6.011 -5.908 1.00 0.00 O ATOM 629 C2' DG A 20 6.128 -5.691 -5.406 1.00 0.00 C ATOM 630 C1' DG A 20 6.092 -4.409 -4.618 1.00 0.00 C ATOM 631 N9 DG A 20 4.739 -4.140 -4.112 1.00 0.00 N ATOM 632 C8 DG A 20 3.567 -4.123 -4.774 1.00 0.00 C ATOM 633 N7 DG A 20 2.496 -3.881 -4.094 1.00 0.00 N ATOM 634 C5 DG A 20 3.012 -3.713 -2.804 1.00 0.00 C ATOM 635 C6 DG A 20 2.344 -3.424 -1.583 1.00 0.00 C ATOM 636 O6 DG A 20 1.143 -3.254 -1.394 1.00 0.00 O ATOM 637 N1 DG A 20 3.238 -3.340 -0.521 1.00 0.00 N ATOM 638 C2 DG A 20 4.604 -3.513 -0.616 1.00 0.00 C ATOM 639 N2 DG A 20 5.294 -3.398 0.518 1.00 0.00 N ATOM 640 N3 DG A 20 5.239 -3.784 -1.761 1.00 0.00 N ATOM 641 C4 DG A 20 4.389 -3.870 -2.809 1.00 0.00 C ATOM 0 H5' DG A 20 6.604 -2.463 -7.905 1.00 0.00 H new ATOM 0 H5'' DG A 20 7.630 -3.662 -8.668 1.00 0.00 H new ATOM 0 H4' DG A 20 8.384 -3.670 -6.477 1.00 0.00 H new ATOM 0 H3' DG A 20 7.003 -5.997 -7.347 1.00 0.00 H new ATOM 0 H2' DG A 20 5.173 -5.882 -5.895 1.00 0.00 H new ATOM 0 H2'' DG A 20 6.333 -6.546 -4.762 1.00 0.00 H new ATOM 0 H1' DG A 20 6.737 -4.477 -3.742 1.00 0.00 H new ATOM 0 H8 DG A 20 3.524 -4.306 -5.838 1.00 0.00 H new ATOM 0 H1 DG A 20 2.854 -3.134 0.401 1.00 0.00 H new ATOM 0 H21 DG A 20 6.307 -3.515 0.513 1.00 0.00 H new ATOM 0 H22 DG A 20 4.809 -3.193 1.391 1.00 0.00 H new ATOM 653 P DA A 21 9.756 -6.112 -6.850 1.00 0.00 P ATOM 654 OP1 DA A 21 9.599 -5.150 -7.964 1.00 0.00 O ATOM 655 OP2 DA A 21 10.013 -7.541 -7.137 1.00 0.00 O ATOM 656 O5' DA A 21 10.921 -5.572 -5.875 1.00 0.00 O ATOM 657 C5' DA A 21 10.655 -5.343 -4.485 1.00 0.00 C ATOM 658 C4' DA A 21 11.263 -4.023 -4.006 1.00 0.00 C ATOM 659 O4' DA A 21 10.967 -2.948 -4.939 1.00 0.00 O ATOM 660 C3' DA A 21 10.718 -3.617 -2.642 1.00 0.00 C ATOM 661 O3' DA A 21 11.626 -4.028 -1.618 1.00 0.00 O ATOM 662 C2' DA A 21 10.596 -2.130 -2.700 1.00 0.00 C ATOM 663 C1' DA A 21 10.550 -1.781 -4.178 1.00 0.00 C ATOM 664 N9 DA A 21 9.193 -1.367 -4.591 1.00 0.00 N ATOM 665 C8 DA A 21 7.994 -1.582 -3.995 1.00 0.00 C ATOM 666 N7 DA A 21 6.943 -1.112 -4.580 1.00 0.00 N ATOM 667 C5 DA A 21 7.500 -0.508 -5.711 1.00 0.00 C ATOM 668 C6 DA A 21 6.939 0.192 -6.784 1.00 0.00 C ATOM 669 N6 DA A 21 5.631 0.415 -6.904 1.00 0.00 N ATOM 670 N1 DA A 21 7.776 0.651 -7.728 1.00 0.00 N ATOM 671 C2 DA A 21 9.088 0.440 -7.626 1.00 0.00 C ATOM 672 N3 DA A 21 9.726 -0.207 -6.657 1.00 0.00 N ATOM 673 C4 DA A 21 8.867 -0.659 -5.724 1.00 0.00 C ATOM 0 H5' DA A 21 11.060 -6.166 -3.896 1.00 0.00 H new ATOM 0 H5'' DA A 21 9.578 -5.331 -4.317 1.00 0.00 H new ATOM 0 H4' DA A 21 12.339 -4.184 -3.939 1.00 0.00 H new ATOM 0 H3' DA A 21 9.759 -4.082 -2.413 1.00 0.00 H new ATOM 0 H2' DA A 21 9.695 -1.790 -2.189 1.00 0.00 H new ATOM 0 H2'' DA A 21 11.442 -1.648 -2.210 1.00 0.00 H new ATOM 0 H1' DA A 21 11.220 -0.943 -4.368 1.00 0.00 H new ATOM 0 H8 DA A 21 7.921 -2.126 -3.065 1.00 0.00 H new ATOM 0 H61 DA A 21 5.273 0.932 -7.707 1.00 0.00 H new ATOM 0 H62 DA A 21 4.987 0.069 -6.193 1.00 0.00 H new ATOM 0 H2 DA A 21 9.701 0.840 -8.420 1.00 0.00 H new ATOM 685 P DG A 22 11.111 -4.197 -0.102 1.00 0.00 P ATOM 686 OP1 DG A 22 12.283 -4.103 0.798 1.00 0.00 O ATOM 687 OP2 DG A 22 10.229 -5.384 -0.042 1.00 0.00 O ATOM 688 O5' DG A 22 10.204 -2.882 0.110 1.00 0.00 O ATOM 689 C5' DG A 22 10.739 -1.730 0.769 1.00 0.00 C ATOM 690 C4' DG A 22 9.866 -1.293 1.943 1.00 0.00 C ATOM 691 O4' DG A 22 8.734 -0.499 1.488 1.00 0.00 O ATOM 692 C3' DG A 22 9.318 -2.499 2.707 1.00 0.00 C ATOM 693 O3' DG A 22 9.902 -2.537 4.013 1.00 0.00 O ATOM 694 C2' DG A 22 7.833 -2.294 2.781 1.00 0.00 C ATOM 695 C1' DG A 22 7.585 -0.892 2.274 1.00 0.00 C ATOM 696 N9 DG A 22 6.352 -0.832 1.468 1.00 0.00 N ATOM 697 C8 DG A 22 6.199 -0.843 0.123 1.00 0.00 C ATOM 698 N7 DG A 22 4.999 -0.759 -0.343 1.00 0.00 N ATOM 699 C5 DG A 22 4.241 -0.681 0.828 1.00 0.00 C ATOM 700 C6 DG A 22 2.835 -0.570 0.995 1.00 0.00 C ATOM 701 O6 DG A 22 1.966 -0.517 0.127 1.00 0.00 O ATOM 702 N1 DG A 22 2.483 -0.523 2.338 1.00 0.00 N ATOM 703 C2 DG A 22 3.369 -0.575 3.396 1.00 0.00 C ATOM 704 N2 DG A 22 2.831 -0.524 4.616 1.00 0.00 N ATOM 705 N3 DG A 22 4.695 -0.678 3.247 1.00 0.00 N ATOM 706 C4 DG A 22 5.062 -0.727 1.945 1.00 0.00 C ATOM 0 H5' DG A 22 10.826 -0.911 0.056 1.00 0.00 H new ATOM 0 H5'' DG A 22 11.745 -1.950 1.126 1.00 0.00 H new ATOM 0 H4' DG A 22 10.501 -0.697 2.598 1.00 0.00 H new ATOM 0 H3' DG A 22 9.553 -3.446 2.220 1.00 0.00 H new ATOM 0 H2' DG A 22 7.306 -3.029 2.172 1.00 0.00 H new ATOM 0 H2'' DG A 22 7.473 -2.410 3.803 1.00 0.00 H new ATOM 0 H1' DG A 22 7.449 -0.209 3.112 1.00 0.00 H new ATOM 0 H8 DG A 22 7.051 -0.919 -0.536 1.00 0.00 H new ATOM 0 H1 DG A 22 1.491 -0.444 2.560 1.00 0.00 H new ATOM 0 H21 DG A 22 3.431 -0.558 5.440 1.00 0.00 H new ATOM 0 H22 DG A 22 1.819 -0.451 4.725 1.00 0.00 H new ATOM 718 P DG A 23 11.009 -3.647 4.385 1.00 0.00 P ATOM 719 OP1 DG A 23 12.059 -2.998 5.202 1.00 0.00 O ATOM 720 OP2 DG A 23 11.378 -4.365 3.145 1.00 0.00 O ATOM 721 O5' DG A 23 10.188 -4.660 5.330 1.00 0.00 O ATOM 722 C5' DG A 23 9.098 -4.188 6.128 1.00 0.00 C ATOM 723 C4' DG A 23 8.095 -5.302 6.438 1.00 0.00 C ATOM 724 O4' DG A 23 6.734 -4.850 6.183 1.00 0.00 O ATOM 725 C3' DG A 23 8.352 -6.539 5.575 1.00 0.00 C ATOM 726 O3' DG A 23 8.721 -7.635 6.419 1.00 0.00 O ATOM 727 C2' DG A 23 7.065 -6.815 4.857 1.00 0.00 C ATOM 728 C1' DG A 23 6.031 -5.919 5.508 1.00 0.00 C ATOM 729 N9 DG A 23 5.081 -5.380 4.513 1.00 0.00 N ATOM 730 C8 DG A 23 5.296 -4.968 3.240 1.00 0.00 C ATOM 731 N7 DG A 23 4.283 -4.531 2.572 1.00 0.00 N ATOM 732 C5 DG A 23 3.249 -4.662 3.503 1.00 0.00 C ATOM 733 C6 DG A 23 1.869 -4.348 3.380 1.00 0.00 C ATOM 734 O6 DG A 23 1.275 -3.885 2.408 1.00 0.00 O ATOM 735 N1 DG A 23 1.176 -4.631 4.550 1.00 0.00 N ATOM 736 C2 DG A 23 1.736 -5.150 5.700 1.00 0.00 C ATOM 737 N2 DG A 23 0.903 -5.353 6.721 1.00 0.00 N ATOM 738 N3 DG A 23 3.033 -5.448 5.824 1.00 0.00 N ATOM 739 C4 DG A 23 3.730 -5.182 4.696 1.00 0.00 C ATOM 0 H5' DG A 23 8.590 -3.377 5.606 1.00 0.00 H new ATOM 0 H5'' DG A 23 9.483 -3.775 7.061 1.00 0.00 H new ATOM 0 H4' DG A 23 8.219 -5.559 7.490 1.00 0.00 H new ATOM 0 H3' DG A 23 9.163 -6.390 4.863 1.00 0.00 H new ATOM 0 H2' DG A 23 7.156 -6.598 3.793 1.00 0.00 H new ATOM 0 H2'' DG A 23 6.785 -7.865 4.946 1.00 0.00 H new ATOM 0 H1' DG A 23 5.441 -6.494 6.222 1.00 0.00 H new ATOM 0 H8 DG A 23 6.282 -5.004 2.800 1.00 0.00 H new ATOM 0 H1 DG A 23 0.174 -4.440 4.560 1.00 0.00 H new ATOM 0 H21 DG A 23 1.256 -5.735 7.599 1.00 0.00 H new ATOM 0 H22 DG A 23 -0.087 -5.127 6.624 1.00 0.00 H new ATOM 751 P DA A 24 9.406 -8.952 5.797 1.00 0.00 P ATOM 752 OP1 DA A 24 10.613 -9.266 6.593 1.00 0.00 O ATOM 753 OP2 DA A 24 9.514 -8.769 4.332 1.00 0.00 O ATOM 754 O5' DA A 24 8.303 -10.091 6.083 1.00 0.00 O ATOM 755 C5' DA A 24 7.225 -9.849 6.992 1.00 0.00 C ATOM 756 C4' DA A 24 5.921 -10.474 6.497 1.00 0.00 C ATOM 757 O4' DA A 24 5.173 -9.520 5.699 1.00 0.00 O ATOM 758 C3' DA A 24 6.195 -11.699 5.633 1.00 0.00 C ATOM 759 O3' DA A 24 5.856 -12.901 6.331 1.00 0.00 O ATOM 760 C2' DA A 24 5.341 -11.531 4.414 1.00 0.00 C ATOM 761 C1' DA A 24 4.564 -10.243 4.608 1.00 0.00 C ATOM 762 N9 DA A 24 4.584 -9.435 3.381 1.00 0.00 N ATOM 763 C8 DA A 24 5.610 -9.189 2.542 1.00 0.00 C ATOM 764 N7 DA A 24 5.383 -8.431 1.522 1.00 0.00 N ATOM 765 C5 DA A 24 4.028 -8.126 1.697 1.00 0.00 C ATOM 766 C6 DA A 24 3.127 -7.351 0.961 1.00 0.00 C ATOM 767 N6 DA A 24 3.464 -6.703 -0.154 1.00 0.00 N ATOM 768 N1 DA A 24 1.865 -7.266 1.419 1.00 0.00 N ATOM 769 C2 DA A 24 1.507 -7.906 2.535 1.00 0.00 C ATOM 770 N3 DA A 24 2.277 -8.666 3.308 1.00 0.00 N ATOM 771 C4 DA A 24 3.535 -8.736 2.828 1.00 0.00 C ATOM 0 H5' DA A 24 7.089 -8.775 7.119 1.00 0.00 H new ATOM 0 H5'' DA A 24 7.476 -10.256 7.971 1.00 0.00 H new ATOM 0 H4' DA A 24 5.347 -10.765 7.377 1.00 0.00 H new ATOM 0 H3' DA A 24 7.251 -11.780 5.375 1.00 0.00 H new ATOM 0 H2' DA A 24 5.954 -11.483 3.514 1.00 0.00 H new ATOM 0 H2'' DA A 24 4.665 -12.378 4.294 1.00 0.00 H new ATOM 0 HO3' DA A 24 6.038 -13.675 5.758 1.00 0.00 H new ATOM 0 H1' DA A 24 3.521 -10.465 4.836 1.00 0.00 H new ATOM 0 H8 DA A 24 6.588 -9.612 2.717 1.00 0.00 H new ATOM 0 H61 DA A 24 2.767 -6.151 -0.653 1.00 0.00 H new ATOM 0 H62 DA A 24 4.419 -6.759 -0.508 1.00 0.00 H new ATOM 0 H2 DA A 24 0.478 -7.794 2.844 1.00 0.00 H new TER 784 DA A 24