USER MOD reduce.3.24.130724 H: found=0, std=0, add=127, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 127 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 43:sc= 1.31 USER MOD Single : A 3 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.64 (180deg=-1.64) USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 9 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -4.730 0.886 -6.585 1.00 0.00 O ATOM 2 C5' DG A 1 -5.340 0.457 -7.795 1.00 0.00 C ATOM 3 C4' DG A 1 -5.872 -0.986 -7.746 1.00 0.00 C ATOM 4 O4' DG A 1 -4.766 -1.874 -7.725 1.00 0.00 O ATOM 5 C3' DG A 1 -6.774 -1.254 -6.521 1.00 0.00 C ATOM 6 O3' DG A 1 -8.080 -1.776 -6.808 1.00 0.00 O ATOM 7 C2' DG A 1 -5.877 -2.127 -5.655 1.00 0.00 C ATOM 8 C1' DG A 1 -4.900 -2.768 -6.638 1.00 0.00 C ATOM 9 N9 DG A 1 -3.567 -3.020 -6.047 1.00 0.00 N ATOM 10 C8 DG A 1 -2.906 -4.218 -5.989 1.00 0.00 C ATOM 11 N7 DG A 1 -1.767 -4.186 -5.353 1.00 0.00 N ATOM 12 C5 DG A 1 -1.665 -2.841 -4.951 1.00 0.00 C ATOM 13 C6 DG A 1 -0.655 -2.134 -4.206 1.00 0.00 C ATOM 14 O6 DG A 1 0.397 -2.568 -3.742 1.00 0.00 O ATOM 15 N1 DG A 1 -0.948 -0.796 -4.016 1.00 0.00 N ATOM 16 C2 DG A 1 -2.063 -0.183 -4.474 1.00 0.00 C ATOM 17 N2 DG A 1 -2.238 1.093 -4.236 1.00 0.00 N ATOM 18 N3 DG A 1 -3.017 -0.796 -5.167 1.00 0.00 N ATOM 19 C4 DG A 1 -2.765 -2.125 -5.374 1.00 0.00 C ATOM 0 H5' DG A 1 -4.615 0.540 -8.605 1.00 0.00 H new ATOM 0 H5'' DG A 1 -6.164 1.130 -8.034 1.00 0.00 H new ATOM 0 H4' DG A 1 -6.489 -1.144 -8.630 1.00 0.00 H new ATOM 0 H3' DG A 1 -7.089 -0.342 -6.014 1.00 0.00 H new ATOM 0 H2' DG A 1 -5.353 -1.535 -4.904 1.00 0.00 H new ATOM 0 H2'' DG A 1 -6.454 -2.882 -5.121 1.00 0.00 H new ATOM 0 HO5' DG A 1 -4.167 0.167 -6.230 1.00 0.00 H new ATOM 0 H1' DG A 1 -5.292 -3.739 -6.940 1.00 0.00 H new ATOM 0 H8 DG A 1 -3.297 -5.120 -6.435 1.00 0.00 H new ATOM 0 H1 DG A 1 -0.277 -0.232 -3.494 1.00 0.00 H new ATOM 0 H21 DG A 1 -3.075 1.565 -4.577 1.00 0.00 H new ATOM 0 H22 DG A 1 -1.537 1.614 -3.710 1.00 0.00 H new ATOM 32 P DG A 2 -8.407 -3.290 -7.254 1.00 0.00 P ATOM 33 OP1 DG A 2 -7.409 -3.741 -8.240 1.00 0.00 O ATOM 34 OP2 DG A 2 -9.847 -3.414 -7.576 1.00 0.00 O ATOM 35 O5' DG A 2 -8.187 -4.091 -5.895 1.00 0.00 O ATOM 36 C5' DG A 2 -7.852 -5.465 -5.844 1.00 0.00 C ATOM 37 C4' DG A 2 -7.700 -5.947 -4.387 1.00 0.00 C ATOM 38 O4' DG A 2 -6.421 -5.546 -3.883 1.00 0.00 O ATOM 39 C3' DG A 2 -8.789 -5.347 -3.468 1.00 0.00 C ATOM 40 O3' DG A 2 -9.510 -6.258 -2.634 1.00 0.00 O ATOM 41 C2' DG A 2 -8.002 -4.287 -2.706 1.00 0.00 C ATOM 42 C1' DG A 2 -6.625 -4.934 -2.617 1.00 0.00 C ATOM 43 N9 DG A 2 -5.548 -3.995 -2.238 1.00 0.00 N ATOM 44 C8 DG A 2 -5.443 -2.644 -2.452 1.00 0.00 C ATOM 45 N7 DG A 2 -4.407 -2.090 -1.896 1.00 0.00 N ATOM 46 C5 DG A 2 -3.768 -3.155 -1.256 1.00 0.00 C ATOM 47 C6 DG A 2 -2.573 -3.218 -0.465 1.00 0.00 C ATOM 48 O6 DG A 2 -1.794 -2.333 -0.142 1.00 0.00 O ATOM 49 N1 DG A 2 -2.274 -4.482 -0.005 1.00 0.00 N ATOM 50 C2 DG A 2 -3.032 -5.570 -0.270 1.00 0.00 C ATOM 51 N2 DG A 2 -2.646 -6.717 0.223 1.00 0.00 N ATOM 52 N3 DG A 2 -4.143 -5.574 -0.992 1.00 0.00 N ATOM 53 C4 DG A 2 -4.462 -4.326 -1.462 1.00 0.00 C ATOM 0 H5' DG A 2 -6.922 -5.636 -6.385 1.00 0.00 H new ATOM 0 H5'' DG A 2 -8.624 -6.049 -6.345 1.00 0.00 H new ATOM 0 H4' DG A 2 -7.800 -7.032 -4.389 1.00 0.00 H new ATOM 0 H3' DG A 2 -9.631 -4.960 -4.042 1.00 0.00 H new ATOM 0 H2' DG A 2 -7.974 -3.336 -3.238 1.00 0.00 H new ATOM 0 H2'' DG A 2 -8.427 -4.090 -1.722 1.00 0.00 H new ATOM 0 H1' DG A 2 -6.588 -5.666 -1.810 1.00 0.00 H new ATOM 0 H8 DG A 2 -6.162 -2.087 -3.034 1.00 0.00 H new ATOM 0 H1 DG A 2 -1.437 -4.603 0.565 1.00 0.00 H new ATOM 0 H21 DG A 2 -3.193 -7.559 0.044 1.00 0.00 H new ATOM 0 H22 DG A 2 -1.798 -6.770 0.787 1.00 0.00 H new ATOM 65 P DT A 3 -8.906 -7.156 -1.449 1.00 0.00 P ATOM 66 OP1 DT A 3 -7.738 -7.902 -1.963 1.00 0.00 O ATOM 67 OP2 DT A 3 -10.047 -7.949 -0.948 1.00 0.00 O ATOM 68 O5' DT A 3 -8.422 -6.151 -0.295 1.00 0.00 O ATOM 69 C5' DT A 3 -9.354 -5.365 0.430 1.00 0.00 C ATOM 70 C4' DT A 3 -8.779 -4.453 1.535 1.00 0.00 C ATOM 71 O4' DT A 3 -8.576 -5.216 2.714 1.00 0.00 O ATOM 72 C3' DT A 3 -7.483 -3.664 1.287 1.00 0.00 C ATOM 73 O3' DT A 3 -7.485 -2.452 2.037 1.00 0.00 O ATOM 74 C2' DT A 3 -6.419 -4.595 1.849 1.00 0.00 C ATOM 75 C1' DT A 3 -7.182 -5.314 2.978 1.00 0.00 C ATOM 76 N1 DT A 3 -6.839 -6.756 3.145 1.00 0.00 N ATOM 77 C2 DT A 3 -6.729 -7.260 4.449 1.00 0.00 C ATOM 78 O2 DT A 3 -6.891 -6.597 5.472 1.00 0.00 O ATOM 79 N3 DT A 3 -6.437 -8.596 4.578 1.00 0.00 N ATOM 80 C4 DT A 3 -6.310 -9.494 3.547 1.00 0.00 C ATOM 81 O4 DT A 3 -6.110 -10.674 3.828 1.00 0.00 O ATOM 82 C5 DT A 3 -6.469 -8.925 2.209 1.00 0.00 C ATOM 83 C7 DT A 3 -6.382 -9.816 0.983 1.00 0.00 C ATOM 84 C6 DT A 3 -6.725 -7.598 2.054 1.00 0.00 C ATOM 0 H5' DT A 3 -10.082 -6.035 0.887 1.00 0.00 H new ATOM 0 H5'' DT A 3 -9.897 -4.740 -0.279 1.00 0.00 H new ATOM 0 H4' DT A 3 -9.548 -3.682 1.593 1.00 0.00 H new ATOM 0 H3' DT A 3 -7.340 -3.392 0.241 1.00 0.00 H new ATOM 0 H2' DT A 3 -6.050 -5.293 1.098 1.00 0.00 H new ATOM 0 H2'' DT A 3 -5.556 -4.047 2.226 1.00 0.00 H new ATOM 0 H1' DT A 3 -6.889 -4.819 3.904 1.00 0.00 H new ATOM 0 H3 DT A 3 -6.303 -8.953 5.524 1.00 0.00 H new ATOM 0 H71 DT A 3 -7.009 -9.407 0.191 1.00 0.00 H new ATOM 0 H72 DT A 3 -5.348 -9.863 0.640 1.00 0.00 H new ATOM 0 H73 DT A 3 -6.726 -10.819 1.237 1.00 0.00 H new ATOM 0 H6 DT A 3 -6.842 -7.194 1.059 1.00 0.00 H new ATOM 97 P DT A 4 -6.632 -1.178 1.556 1.00 0.00 P ATOM 98 OP1 DT A 4 -7.551 -0.378 0.715 1.00 0.00 O ATOM 99 OP2 DT A 4 -5.362 -1.677 1.003 1.00 0.00 O ATOM 100 O5' DT A 4 -6.308 -0.343 2.905 1.00 0.00 O ATOM 101 C5' DT A 4 -5.332 0.702 2.914 1.00 0.00 C ATOM 102 C4' DT A 4 -5.694 1.942 3.745 1.00 0.00 C ATOM 103 O4' DT A 4 -6.993 2.344 3.324 1.00 0.00 O ATOM 104 C3' DT A 4 -5.737 1.698 5.260 1.00 0.00 C ATOM 105 O3' DT A 4 -5.166 2.712 6.107 1.00 0.00 O ATOM 106 C2' DT A 4 -7.200 1.398 5.529 1.00 0.00 C ATOM 107 C1' DT A 4 -7.910 2.121 4.378 1.00 0.00 C ATOM 108 N1 DT A 4 -9.199 1.491 3.949 1.00 0.00 N ATOM 109 C2 DT A 4 -10.337 2.308 3.868 1.00 0.00 C ATOM 110 O2 DT A 4 -10.332 3.521 4.096 1.00 0.00 O ATOM 111 N3 DT A 4 -11.534 1.694 3.563 1.00 0.00 N ATOM 112 C4 DT A 4 -11.722 0.340 3.385 1.00 0.00 C ATOM 113 O4 DT A 4 -12.848 -0.091 3.137 1.00 0.00 O ATOM 114 C5 DT A 4 -10.513 -0.464 3.529 1.00 0.00 C ATOM 115 C7 DT A 4 -10.590 -1.975 3.408 1.00 0.00 C ATOM 116 C6 DT A 4 -9.315 0.123 3.781 1.00 0.00 C ATOM 0 H5' DT A 4 -5.153 1.016 1.886 1.00 0.00 H new ATOM 0 H5'' DT A 4 -4.394 0.295 3.291 1.00 0.00 H new ATOM 0 H4' DT A 4 -4.921 2.692 3.580 1.00 0.00 H new ATOM 0 H3' DT A 4 -5.073 0.878 5.532 1.00 0.00 H new ATOM 0 H2' DT A 4 -7.402 0.327 5.520 1.00 0.00 H new ATOM 0 H2'' DT A 4 -7.518 1.774 6.501 1.00 0.00 H new ATOM 0 H1' DT A 4 -8.241 3.091 4.749 1.00 0.00 H new ATOM 0 H3 DT A 4 -12.352 2.295 3.460 1.00 0.00 H new ATOM 0 H71 DT A 4 -9.648 -2.357 3.016 1.00 0.00 H new ATOM 0 H72 DT A 4 -10.777 -2.410 4.390 1.00 0.00 H new ATOM 0 H73 DT A 4 -11.401 -2.245 2.731 1.00 0.00 H new ATOM 0 H6 DT A 4 -8.431 -0.493 3.852 1.00 0.00 H new ATOM 129 P DG A 5 -5.599 4.269 6.283 1.00 0.00 P ATOM 130 OP1 DG A 5 -4.905 4.710 7.518 1.00 0.00 O ATOM 131 OP2 DG A 5 -7.069 4.423 6.259 1.00 0.00 O ATOM 132 O5' DG A 5 -4.973 5.153 5.105 1.00 0.00 O ATOM 133 C5' DG A 5 -5.654 5.490 3.896 1.00 0.00 C ATOM 134 C4' DG A 5 -4.690 6.219 2.947 1.00 0.00 C ATOM 135 O4' DG A 5 -3.457 5.519 2.914 1.00 0.00 O ATOM 136 C3' DG A 5 -5.143 6.388 1.483 1.00 0.00 C ATOM 137 O3' DG A 5 -4.836 7.744 1.157 1.00 0.00 O ATOM 138 C2' DG A 5 -4.321 5.309 0.775 1.00 0.00 C ATOM 139 C1' DG A 5 -3.027 5.280 1.584 1.00 0.00 C ATOM 140 N9 DG A 5 -2.249 4.010 1.645 1.00 0.00 N ATOM 141 C8 DG A 5 -1.242 3.817 2.551 1.00 0.00 C ATOM 142 N7 DG A 5 -0.885 2.583 2.758 1.00 0.00 N ATOM 143 C5 DG A 5 -1.733 1.873 1.909 1.00 0.00 C ATOM 144 C6 DG A 5 -1.831 0.458 1.678 1.00 0.00 C ATOM 145 O6 DG A 5 -1.160 -0.437 2.208 1.00 0.00 O ATOM 146 N1 DG A 5 -2.802 0.142 0.749 1.00 0.00 N ATOM 147 C2 DG A 5 -3.579 1.054 0.121 1.00 0.00 C ATOM 148 N2 DG A 5 -4.455 0.619 -0.732 1.00 0.00 N ATOM 149 N3 DG A 5 -3.517 2.366 0.310 1.00 0.00 N ATOM 150 C4 DG A 5 -2.570 2.731 1.223 1.00 0.00 C ATOM 0 H5' DG A 5 -6.513 6.124 4.115 1.00 0.00 H new ATOM 0 H5'' DG A 5 -6.037 4.588 3.419 1.00 0.00 H new ATOM 0 H4' DG A 5 -4.629 7.225 3.363 1.00 0.00 H new ATOM 0 H3' DG A 5 -6.193 6.253 1.223 1.00 0.00 H new ATOM 0 H2' DG A 5 -4.826 4.343 0.787 1.00 0.00 H new ATOM 0 H2'' DG A 5 -4.139 5.561 -0.270 1.00 0.00 H new ATOM 0 H1' DG A 5 -2.354 5.991 1.104 1.00 0.00 H new ATOM 0 H8 DG A 5 -0.770 4.642 3.065 1.00 0.00 H new ATOM 0 H1 DG A 5 -2.943 -0.842 0.522 1.00 0.00 H new ATOM 0 H21 DG A 5 -5.058 1.278 -1.224 1.00 0.00 H new ATOM 0 H22 DG A 5 -4.540 -0.382 -0.910 1.00 0.00 H new ATOM 162 P DG A 6 -4.768 8.359 -0.313 1.00 0.00 P ATOM 163 OP1 DG A 6 -5.088 9.802 -0.194 1.00 0.00 O ATOM 164 OP2 DG A 6 -5.562 7.544 -1.249 1.00 0.00 O ATOM 165 O5' DG A 6 -3.209 8.240 -0.650 1.00 0.00 O ATOM 166 C5' DG A 6 -2.252 8.944 0.142 1.00 0.00 C ATOM 167 C4' DG A 6 -0.801 8.570 -0.188 1.00 0.00 C ATOM 168 O4' DG A 6 -0.637 7.172 0.023 1.00 0.00 O ATOM 169 C3' DG A 6 -0.406 8.905 -1.641 1.00 0.00 C ATOM 170 O3' DG A 6 0.722 9.738 -1.936 1.00 0.00 O ATOM 171 C2' DG A 6 -0.291 7.538 -2.291 1.00 0.00 C ATOM 172 C1' DG A 6 -0.062 6.570 -1.121 1.00 0.00 C ATOM 173 N9 DG A 6 -0.626 5.204 -1.343 1.00 0.00 N ATOM 174 C8 DG A 6 -1.601 4.794 -2.227 1.00 0.00 C ATOM 175 N7 DG A 6 -1.690 3.500 -2.403 1.00 0.00 N ATOM 176 C5 DG A 6 -0.680 3.015 -1.559 1.00 0.00 C ATOM 177 C6 DG A 6 -0.234 1.682 -1.277 1.00 0.00 C ATOM 178 O6 DG A 6 -0.642 0.623 -1.720 1.00 0.00 O ATOM 179 N1 DG A 6 0.804 1.614 -0.381 1.00 0.00 N ATOM 180 C2 DG A 6 1.370 2.693 0.199 1.00 0.00 C ATOM 181 N2 DG A 6 2.349 2.484 1.033 1.00 0.00 N ATOM 182 N3 DG A 6 1.000 3.947 -0.022 1.00 0.00 N ATOM 183 C4 DG A 6 -0.032 4.045 -0.913 1.00 0.00 C ATOM 0 H5' DG A 6 -2.442 8.740 1.196 1.00 0.00 H new ATOM 0 H5'' DG A 6 -2.386 10.016 -0.005 1.00 0.00 H new ATOM 0 H4' DG A 6 -0.154 9.157 0.464 1.00 0.00 H new ATOM 0 H3' DG A 6 -1.169 9.580 -2.028 1.00 0.00 H new ATOM 0 H2' DG A 6 -1.196 7.285 -2.844 1.00 0.00 H new ATOM 0 H2'' DG A 6 0.536 7.505 -3.000 1.00 0.00 H new ATOM 0 H1' DG A 6 1.009 6.407 -1.004 1.00 0.00 H new ATOM 0 H8 DG A 6 -2.247 5.492 -2.739 1.00 0.00 H new ATOM 0 H1 DG A 6 1.169 0.693 -0.139 1.00 0.00 H new ATOM 0 H21 DG A 6 2.804 3.272 1.493 1.00 0.00 H new ATOM 0 H22 DG A 6 2.660 1.532 1.226 1.00 0.00 H new ATOM 195 P DT A 7 2.104 9.836 -1.125 1.00 0.00 P ATOM 196 OP1 DT A 7 1.800 10.284 0.250 1.00 0.00 O ATOM 197 OP2 DT A 7 3.002 10.696 -1.926 1.00 0.00 O ATOM 198 O5' DT A 7 2.772 8.382 -1.084 1.00 0.00 O ATOM 199 C5' DT A 7 3.544 7.988 0.041 1.00 0.00 C ATOM 200 C4' DT A 7 4.431 6.756 -0.194 1.00 0.00 C ATOM 201 O4' DT A 7 3.632 5.633 -0.547 1.00 0.00 O ATOM 202 C3' DT A 7 5.493 6.906 -1.302 1.00 0.00 C ATOM 203 O3' DT A 7 6.654 6.183 -0.878 1.00 0.00 O ATOM 204 C2' DT A 7 4.792 6.239 -2.479 1.00 0.00 C ATOM 205 C1' DT A 7 4.206 5.065 -1.709 1.00 0.00 C ATOM 206 N1 DT A 7 3.274 4.201 -2.470 1.00 0.00 N ATOM 207 C2 DT A 7 3.419 2.826 -2.283 1.00 0.00 C ATOM 208 O2 DT A 7 4.234 2.330 -1.512 1.00 0.00 O ATOM 209 N3 DT A 7 2.569 2.013 -2.986 1.00 0.00 N ATOM 210 C4 DT A 7 1.624 2.434 -3.888 1.00 0.00 C ATOM 211 O4 DT A 7 0.936 1.581 -4.437 1.00 0.00 O ATOM 212 C5 DT A 7 1.523 3.887 -4.051 1.00 0.00 C ATOM 213 C7 DT A 7 0.480 4.487 -4.977 1.00 0.00 C ATOM 214 C6 DT A 7 2.324 4.715 -3.326 1.00 0.00 C ATOM 0 H5' DT A 7 2.871 7.782 0.873 1.00 0.00 H new ATOM 0 H5'' DT A 7 4.177 8.823 0.342 1.00 0.00 H new ATOM 0 H4' DT A 7 4.955 6.628 0.753 1.00 0.00 H new ATOM 0 H3' DT A 7 5.822 7.918 -1.538 1.00 0.00 H new ATOM 0 H2' DT A 7 4.033 6.871 -2.941 1.00 0.00 H new ATOM 0 H2'' DT A 7 5.477 5.934 -3.270 1.00 0.00 H new ATOM 0 H1' DT A 7 4.993 4.350 -1.468 1.00 0.00 H new ATOM 0 H3 DT A 7 2.645 1.009 -2.825 1.00 0.00 H new ATOM 0 H71 DT A 7 0.184 5.468 -4.605 1.00 0.00 H new ATOM 0 H72 DT A 7 0.898 4.590 -5.978 1.00 0.00 H new ATOM 0 H73 DT A 7 -0.392 3.835 -5.014 1.00 0.00 H new ATOM 0 H6 DT A 7 2.214 5.785 -3.422 1.00 0.00 H new ATOM 227 P DG A 8 7.920 5.913 -1.814 1.00 0.00 P ATOM 228 OP1 DG A 8 9.055 5.663 -0.896 1.00 0.00 O ATOM 229 OP2 DG A 8 8.012 7.051 -2.754 1.00 0.00 O ATOM 230 O5' DG A 8 7.597 4.562 -2.644 1.00 0.00 O ATOM 231 C5' DG A 8 7.623 3.252 -2.056 1.00 0.00 C ATOM 232 C4' DG A 8 7.728 2.088 -3.079 1.00 0.00 C ATOM 233 O4' DG A 8 6.461 1.812 -3.672 1.00 0.00 O ATOM 234 C3' DG A 8 8.720 2.396 -4.215 1.00 0.00 C ATOM 235 O3' DG A 8 9.696 1.357 -4.463 1.00 0.00 O ATOM 236 C2' DG A 8 7.766 2.837 -5.325 1.00 0.00 C ATOM 237 C1' DG A 8 6.544 1.940 -5.082 1.00 0.00 C ATOM 238 N9 DG A 8 5.268 2.460 -5.654 1.00 0.00 N ATOM 239 C8 DG A 8 4.936 3.767 -5.909 1.00 0.00 C ATOM 240 N7 DG A 8 3.857 3.921 -6.628 1.00 0.00 N ATOM 241 C5 DG A 8 3.369 2.612 -6.773 1.00 0.00 C ATOM 242 C6 DG A 8 2.166 2.104 -7.391 1.00 0.00 C ATOM 243 O6 DG A 8 1.331 2.687 -8.083 1.00 0.00 O ATOM 244 N1 DG A 8 1.929 0.767 -7.136 1.00 0.00 N ATOM 245 C2 DG A 8 2.783 -0.013 -6.420 1.00 0.00 C ATOM 246 N2 DG A 8 2.403 -1.237 -6.157 1.00 0.00 N ATOM 247 N3 DG A 8 3.958 0.378 -5.919 1.00 0.00 N ATOM 248 C4 DG A 8 4.188 1.719 -6.105 1.00 0.00 C ATOM 0 H5' DG A 8 6.719 3.116 -1.462 1.00 0.00 H new ATOM 0 H5'' DG A 8 8.467 3.193 -1.369 1.00 0.00 H new ATOM 0 H4' DG A 8 8.083 1.226 -2.514 1.00 0.00 H new ATOM 0 H3' DG A 8 9.456 3.176 -4.017 1.00 0.00 H new ATOM 0 H2' DG A 8 7.515 3.895 -5.249 1.00 0.00 H new ATOM 0 H2'' DG A 8 8.194 2.681 -6.315 1.00 0.00 H new ATOM 0 H1' DG A 8 6.677 0.987 -5.594 1.00 0.00 H new ATOM 0 H8 DG A 8 5.519 4.600 -5.545 1.00 0.00 H new ATOM 0 H1 DG A 8 1.075 0.346 -7.501 1.00 0.00 H new ATOM 0 H21 DG A 8 3.012 -1.857 -5.623 1.00 0.00 H new ATOM 0 H22 DG A 8 1.497 -1.572 -6.486 1.00 0.00 H new ATOM 260 P DT A 9 9.621 0.074 -5.461 1.00 0.00 P ATOM 261 OP1 DT A 9 11.011 -0.435 -5.483 1.00 0.00 O ATOM 262 OP2 DT A 9 9.054 0.519 -6.747 1.00 0.00 O ATOM 263 O5' DT A 9 8.666 -1.096 -4.893 1.00 0.00 O ATOM 264 C5' DT A 9 9.068 -1.961 -3.829 1.00 0.00 C ATOM 265 C4' DT A 9 8.309 -3.312 -3.722 1.00 0.00 C ATOM 266 O4' DT A 9 7.084 -3.286 -4.451 1.00 0.00 O ATOM 267 C3' DT A 9 9.057 -4.523 -4.305 1.00 0.00 C ATOM 268 O3' DT A 9 8.694 -5.712 -3.621 1.00 0.00 O ATOM 269 C2' DT A 9 8.475 -4.633 -5.705 1.00 0.00 C ATOM 270 C1' DT A 9 7.019 -4.298 -5.433 1.00 0.00 C ATOM 271 N1 DT A 9 6.310 -3.826 -6.653 1.00 0.00 N ATOM 272 C2 DT A 9 5.504 -4.729 -7.369 1.00 0.00 C ATOM 273 O2 DT A 9 5.272 -5.892 -7.022 1.00 0.00 O ATOM 274 N3 DT A 9 4.945 -4.259 -8.537 1.00 0.00 N ATOM 275 C4 DT A 9 5.073 -2.984 -9.039 1.00 0.00 C ATOM 276 O4 DT A 9 4.511 -2.714 -10.099 1.00 0.00 O ATOM 277 C5 DT A 9 5.906 -2.088 -8.237 1.00 0.00 C ATOM 278 C7 DT A 9 6.151 -0.653 -8.664 1.00 0.00 C ATOM 279 C6 DT A 9 6.497 -2.536 -7.101 1.00 0.00 C ATOM 0 H5' DT A 9 8.948 -1.425 -2.887 1.00 0.00 H new ATOM 0 H5'' DT A 9 10.131 -2.173 -3.942 1.00 0.00 H new ATOM 0 H4' DT A 9 8.179 -3.425 -2.646 1.00 0.00 H new ATOM 0 H3' DT A 9 10.139 -4.405 -4.247 1.00 0.00 H new ATOM 0 H2' DT A 9 8.937 -3.933 -6.401 1.00 0.00 H new ATOM 0 H2'' DT A 9 8.598 -5.630 -6.127 1.00 0.00 H new ATOM 0 H1' DT A 9 6.452 -5.170 -5.108 1.00 0.00 H new ATOM 0 H3 DT A 9 4.385 -4.916 -9.080 1.00 0.00 H new ATOM 0 H71 DT A 9 6.300 -0.031 -7.781 1.00 0.00 H new ATOM 0 H72 DT A 9 7.039 -0.608 -9.294 1.00 0.00 H new ATOM 0 H73 DT A 9 5.290 -0.288 -9.224 1.00 0.00 H new ATOM 0 H6 DT A 9 7.128 -1.867 -6.535 1.00 0.00 H new ATOM 292 P DG A 10 9.466 -6.240 -2.331 1.00 0.00 P ATOM 293 OP1 DG A 10 10.885 -6.397 -2.722 1.00 0.00 O ATOM 294 OP2 DG A 10 8.736 -7.453 -1.898 1.00 0.00 O ATOM 295 O5' DG A 10 9.323 -5.104 -1.196 1.00 0.00 O ATOM 296 C5' DG A 10 10.355 -4.153 -0.928 1.00 0.00 C ATOM 297 C4' DG A 10 10.029 -3.177 0.225 1.00 0.00 C ATOM 298 O4' DG A 10 9.141 -2.123 -0.176 1.00 0.00 O ATOM 299 C3' DG A 10 9.436 -3.874 1.475 1.00 0.00 C ATOM 300 O3' DG A 10 10.123 -3.788 2.740 1.00 0.00 O ATOM 301 C2' DG A 10 8.026 -3.300 1.513 1.00 0.00 C ATOM 302 C1' DG A 10 8.225 -1.923 0.888 1.00 0.00 C ATOM 303 N9 DG A 10 6.933 -1.212 0.667 1.00 0.00 N ATOM 304 C8 DG A 10 6.046 -0.987 1.688 1.00 0.00 C ATOM 305 N7 DG A 10 4.826 -0.713 1.331 1.00 0.00 N ATOM 306 C5 DG A 10 4.895 -0.753 -0.064 1.00 0.00 C ATOM 307 C6 DG A 10 3.880 -0.534 -1.059 1.00 0.00 C ATOM 308 O6 DG A 10 2.692 -0.260 -0.919 1.00 0.00 O ATOM 309 N1 DG A 10 4.337 -0.656 -2.349 1.00 0.00 N ATOM 310 C2 DG A 10 5.604 -0.952 -2.661 1.00 0.00 C ATOM 311 N2 DG A 10 5.819 -1.017 -3.942 1.00 0.00 N ATOM 312 N3 DG A 10 6.588 -1.169 -1.790 1.00 0.00 N ATOM 313 C4 DG A 10 6.177 -1.056 -0.487 1.00 0.00 C ATOM 0 H5' DG A 10 10.548 -3.578 -1.833 1.00 0.00 H new ATOM 0 H5'' DG A 10 11.274 -4.688 -0.688 1.00 0.00 H new ATOM 0 H4' DG A 10 10.996 -2.752 0.493 1.00 0.00 H new ATOM 0 H3' DG A 10 9.517 -4.955 1.359 1.00 0.00 H new ATOM 0 H2' DG A 10 7.323 -3.908 0.944 1.00 0.00 H new ATOM 0 H2'' DG A 10 7.640 -3.234 2.530 1.00 0.00 H new ATOM 0 H1' DG A 10 8.688 -1.175 1.532 1.00 0.00 H new ATOM 0 H8 DG A 10 6.342 -1.034 2.725 1.00 0.00 H new ATOM 0 H1 DG A 10 3.674 -0.513 -3.111 1.00 0.00 H new ATOM 0 H21 DG A 10 6.752 -1.236 -4.292 1.00 0.00 H new ATOM 0 H22 DG A 10 5.055 -0.849 -4.596 1.00 0.00 H new ATOM 325 P DG A 11 10.518 -2.438 3.542 1.00 0.00 P ATOM 326 OP1 DG A 11 11.248 -1.532 2.638 1.00 0.00 O ATOM 327 OP2 DG A 11 11.180 -2.865 4.799 1.00 0.00 O ATOM 328 O5' DG A 11 9.171 -1.706 4.001 1.00 0.00 O ATOM 329 C5' DG A 11 9.240 -0.397 4.558 1.00 0.00 C ATOM 330 C4' DG A 11 8.069 -0.065 5.491 1.00 0.00 C ATOM 331 O4' DG A 11 6.828 0.013 4.801 1.00 0.00 O ATOM 332 C3' DG A 11 7.865 -1.097 6.603 1.00 0.00 C ATOM 333 O3' DG A 11 8.744 -0.938 7.708 1.00 0.00 O ATOM 334 C2' DG A 11 6.426 -0.792 7.000 1.00 0.00 C ATOM 335 C1' DG A 11 5.774 -0.368 5.674 1.00 0.00 C ATOM 336 N9 DG A 11 4.970 -1.452 5.049 1.00 0.00 N ATOM 337 C8 DG A 11 5.200 -2.807 5.064 1.00 0.00 C ATOM 338 N7 DG A 11 4.243 -3.529 4.542 1.00 0.00 N ATOM 339 C5 DG A 11 3.294 -2.567 4.146 1.00 0.00 C ATOM 340 C6 DG A 11 2.006 -2.698 3.506 1.00 0.00 C ATOM 341 O6 DG A 11 1.434 -3.733 3.155 1.00 0.00 O ATOM 342 N1 DG A 11 1.368 -1.490 3.281 1.00 0.00 N ATOM 343 C2 DG A 11 1.906 -0.297 3.631 1.00 0.00 C ATOM 344 N2 DG A 11 1.206 0.763 3.364 1.00 0.00 N ATOM 345 N3 DG A 11 3.087 -0.116 4.223 1.00 0.00 N ATOM 346 C4 DG A 11 3.736 -1.298 4.456 1.00 0.00 C ATOM 0 H5' DG A 11 9.267 0.332 3.748 1.00 0.00 H new ATOM 0 H5'' DG A 11 10.174 -0.295 5.110 1.00 0.00 H new ATOM 0 H4' DG A 11 8.349 0.900 5.915 1.00 0.00 H new ATOM 0 H3' DG A 11 8.065 -2.119 6.280 1.00 0.00 H new ATOM 0 H2' DG A 11 5.934 -1.665 7.429 1.00 0.00 H new ATOM 0 H2'' DG A 11 6.374 0.002 7.745 1.00 0.00 H new ATOM 0 HO3' DG A 11 8.556 -1.628 8.378 1.00 0.00 H new ATOM 0 H1' DG A 11 5.079 0.450 5.865 1.00 0.00 H new ATOM 0 H8 DG A 11 6.100 -3.241 5.474 1.00 0.00 H new ATOM 0 H1 DG A 11 0.452 -1.499 2.832 1.00 0.00 H new ATOM 0 H21 DG A 11 1.565 1.686 3.607 1.00 0.00 H new ATOM 0 H22 DG A 11 0.296 0.673 2.911 1.00 0.00 H new TER 359 DG A 11