USER MOD reduce.3.24.130724 H: found=0, std=0, add=249, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 274 hydrogens (25 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 4 DT C7 :methyl -30:sc= 0 (180deg=-0.00187) USER MOD Single : A 4 DT O5' : rot -86:sc= 1.16 USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 25 DA O3' : rot -42:sc= 0.0135 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 4 6.130 -9.718 -11.828 1.00 1.22 O ATOM 2 C5' DT A 4 6.511 -10.601 -10.769 1.00 0.83 C ATOM 3 C4' DT A 4 8.013 -10.715 -10.653 1.00 0.67 C ATOM 4 O4' DT A 4 8.346 -11.267 -9.353 1.00 0.64 O ATOM 5 C3' DT A 4 8.670 -11.638 -11.684 1.00 0.65 C ATOM 6 O3' DT A 4 9.929 -11.098 -12.103 1.00 0.72 O ATOM 7 C2' DT A 4 8.872 -12.935 -10.923 1.00 0.60 C ATOM 8 C1' DT A 4 9.116 -12.449 -9.506 1.00 0.55 C ATOM 9 N1 DT A 4 8.705 -13.400 -8.453 1.00 0.57 N ATOM 10 C2 DT A 4 7.364 -13.692 -8.325 1.00 0.74 C ATOM 11 O2 DT A 4 6.503 -13.204 -9.038 1.00 0.90 O ATOM 12 N3 DT A 4 7.066 -14.581 -7.324 1.00 0.84 N ATOM 13 C4 DT A 4 7.952 -15.192 -6.460 1.00 0.79 C ATOM 14 O4 DT A 4 7.535 -15.971 -5.608 1.00 0.93 O ATOM 15 C5 DT A 4 9.341 -14.840 -6.651 1.00 0.67 C ATOM 16 C7 DT A 4 10.372 -15.455 -5.756 1.00 0.82 C ATOM 17 C6 DT A 4 9.649 -13.972 -7.625 1.00 0.58 C ATOM 0 H5' DT A 4 6.083 -11.588 -10.946 1.00 0.83 H new ATOM 0 H5'' DT A 4 6.099 -10.239 -9.827 1.00 0.83 H new ATOM 0 H4' DT A 4 8.387 -9.704 -10.816 1.00 0.67 H new ATOM 0 H3' DT A 4 8.073 -11.766 -12.587 1.00 0.65 H new ATOM 0 H2' DT A 4 7.997 -13.583 -10.985 1.00 0.60 H new ATOM 0 H2'' DT A 4 9.718 -13.504 -11.308 1.00 0.60 H new ATOM 0 HO5' DT A 4 6.118 -8.796 -11.497 1.00 1.22 H new ATOM 0 H1' DT A 4 10.189 -12.306 -9.382 1.00 0.55 H new ATOM 0 H3 DT A 4 6.081 -14.817 -7.205 1.00 0.84 H new ATOM 0 H71 DT A 4 9.930 -15.663 -4.781 1.00 0.82 H new ATOM 0 H72 DT A 4 10.730 -16.385 -6.198 1.00 0.82 H new ATOM 0 H73 DT A 4 11.208 -14.765 -5.636 1.00 0.82 H new ATOM 0 H6 DT A 4 10.686 -13.708 -7.769 1.00 0.58 H new ATOM 31 P DG A 5 10.062 -10.414 -13.552 1.00 0.96 P ATOM 32 OP1 DG A 5 8.853 -9.577 -13.762 1.00 1.80 O ATOM 33 OP2 DG A 5 10.402 -11.472 -14.537 1.00 1.57 O ATOM 34 O5' DG A 5 11.319 -9.445 -13.406 1.00 0.64 O ATOM 35 C5' DG A 5 11.159 -8.026 -13.412 1.00 0.57 C ATOM 36 C4' DG A 5 12.509 -7.349 -13.408 1.00 0.48 C ATOM 37 O4' DG A 5 13.290 -7.853 -12.294 1.00 0.44 O ATOM 38 C3' DG A 5 13.357 -7.597 -14.657 1.00 0.55 C ATOM 39 O3' DG A 5 14.145 -6.442 -14.963 1.00 0.64 O ATOM 40 C2' DG A 5 14.245 -8.757 -14.248 1.00 0.48 C ATOM 41 C1' DG A 5 14.465 -8.496 -12.768 1.00 0.39 C ATOM 42 N9 DG A 5 14.674 -9.700 -11.968 1.00 0.41 N ATOM 43 C8 DG A 5 13.722 -10.421 -11.290 1.00 0.43 C ATOM 44 N7 DG A 5 14.208 -11.455 -10.661 1.00 0.56 N ATOM 45 C5 DG A 5 15.568 -11.417 -10.941 1.00 0.73 C ATOM 46 C6 DG A 5 16.614 -12.284 -10.533 1.00 1.03 C ATOM 47 O6 DG A 5 16.542 -13.292 -9.818 1.00 1.17 O ATOM 48 N1 DG A 5 17.849 -11.885 -11.040 1.00 1.24 N ATOM 49 C2 DG A 5 18.040 -10.783 -11.842 1.00 1.16 C ATOM 50 N2 DG A 5 19.301 -10.554 -12.237 1.00 1.43 N ATOM 51 N3 DG A 5 17.073 -9.967 -12.230 1.00 0.87 N ATOM 52 C4 DG A 5 15.872 -10.341 -11.746 1.00 0.65 C ATOM 0 H5' DG A 5 10.585 -7.714 -12.540 1.00 0.57 H new ATOM 0 H5'' DG A 5 10.593 -7.720 -14.292 1.00 0.57 H new ATOM 0 H4' DG A 5 12.288 -6.283 -13.351 1.00 0.48 H new ATOM 0 H3' DG A 5 12.763 -7.806 -15.547 1.00 0.55 H new ATOM 0 H2' DG A 5 13.763 -9.719 -14.423 1.00 0.48 H new ATOM 0 H2'' DG A 5 15.183 -8.765 -14.803 1.00 0.48 H new ATOM 0 H1' DG A 5 15.372 -7.901 -12.666 1.00 0.39 H new ATOM 0 H8 DG A 5 12.675 -10.158 -11.279 1.00 0.43 H new ATOM 0 H1 DG A 5 18.666 -12.447 -10.801 1.00 1.24 H new ATOM 0 H21 DG A 5 19.511 -9.753 -12.833 1.00 1.43 H new ATOM 0 H22 DG A 5 20.050 -11.180 -11.941 1.00 1.43 H new ATOM 64 P DA A 6 13.729 -5.490 -16.191 1.00 0.70 P ATOM 65 OP1 DA A 6 13.443 -6.366 -17.356 1.00 0.92 O ATOM 66 OP2 DA A 6 14.748 -4.416 -16.314 1.00 0.93 O ATOM 67 O5' DA A 6 12.358 -4.829 -15.720 1.00 0.60 O ATOM 68 C5' DA A 6 12.346 -3.743 -14.793 1.00 0.52 C ATOM 69 C4' DA A 6 10.941 -3.210 -14.633 1.00 0.44 C ATOM 70 O4' DA A 6 10.057 -4.290 -14.266 1.00 0.39 O ATOM 71 C3' DA A 6 10.767 -2.175 -13.531 1.00 0.44 C ATOM 72 O3' DA A 6 11.025 -0.861 -14.038 1.00 0.58 O ATOM 73 C2' DA A 6 9.305 -2.329 -13.148 1.00 0.38 C ATOM 74 C1' DA A 6 9.009 -3.800 -13.438 1.00 0.36 C ATOM 75 N9 DA A 6 8.946 -4.649 -12.246 1.00 0.37 N ATOM 76 C8 DA A 6 9.931 -4.862 -11.312 1.00 0.44 C ATOM 77 N7 DA A 6 9.579 -5.681 -10.351 1.00 0.49 N ATOM 78 C5 DA A 6 8.275 -6.032 -10.672 1.00 0.47 C ATOM 79 C6 DA A 6 7.341 -6.875 -10.045 1.00 0.55 C ATOM 80 N6 DA A 6 7.588 -7.547 -8.917 1.00 0.63 N ATOM 81 N1 DA A 6 6.127 -7.008 -10.623 1.00 0.59 N ATOM 82 C2 DA A 6 5.879 -6.335 -11.754 1.00 0.57 C ATOM 83 N3 DA A 6 6.674 -5.514 -12.436 1.00 0.48 N ATOM 84 C4 DA A 6 7.872 -5.404 -11.836 1.00 0.42 C ATOM 0 H5' DA A 6 13.006 -2.949 -15.143 1.00 0.52 H new ATOM 0 H5'' DA A 6 12.729 -4.075 -13.828 1.00 0.52 H new ATOM 0 H4' DA A 6 10.718 -2.746 -15.594 1.00 0.44 H new ATOM 0 H3' DA A 6 11.447 -2.314 -12.690 1.00 0.44 H new ATOM 0 H2' DA A 6 9.138 -2.086 -12.099 1.00 0.38 H new ATOM 0 H2'' DA A 6 8.666 -1.669 -13.734 1.00 0.38 H new ATOM 0 H1' DA A 6 8.025 -3.843 -13.905 1.00 0.36 H new ATOM 0 H8 DA A 6 10.905 -4.398 -11.365 1.00 0.44 H new ATOM 0 H61 DA A 6 6.867 -8.144 -8.511 1.00 0.63 H new ATOM 0 H62 DA A 6 8.497 -7.463 -8.462 1.00 0.63 H new ATOM 0 H2 DA A 6 4.894 -6.479 -12.172 1.00 0.57 H new ATOM 96 P DG A 7 10.736 0.426 -13.118 1.00 0.62 P ATOM 97 OP1 DG A 7 11.612 1.523 -13.601 1.00 0.74 O ATOM 98 OP2 DG A 7 10.802 0.008 -11.694 1.00 0.65 O ATOM 99 O5' DG A 7 9.228 0.810 -13.458 1.00 0.74 O ATOM 100 C5' DG A 7 8.570 1.878 -12.777 1.00 0.78 C ATOM 101 C4' DG A 7 7.071 1.704 -12.863 1.00 0.65 C ATOM 102 O4' DG A 7 6.723 0.372 -12.410 1.00 0.52 O ATOM 103 C3' DG A 7 6.261 2.663 -11.991 1.00 0.69 C ATOM 104 O3' DG A 7 5.008 2.967 -12.615 1.00 0.77 O ATOM 105 C2' DG A 7 6.048 1.870 -10.716 1.00 0.62 C ATOM 106 C1' DG A 7 5.936 0.443 -11.228 1.00 0.52 C ATOM 107 N9 DG A 7 6.431 -0.569 -10.297 1.00 0.47 N ATOM 108 C8 DG A 7 7.735 -0.790 -9.929 1.00 0.48 C ATOM 109 N7 DG A 7 7.873 -1.762 -9.070 1.00 0.48 N ATOM 110 C5 DG A 7 6.577 -2.213 -8.858 1.00 0.45 C ATOM 111 C6 DG A 7 6.095 -3.254 -8.025 1.00 0.48 C ATOM 112 O6 DG A 7 6.741 -4.003 -7.284 1.00 0.51 O ATOM 113 N1 DG A 7 4.709 -3.384 -8.102 1.00 0.52 N ATOM 114 C2 DG A 7 3.898 -2.600 -8.890 1.00 0.56 C ATOM 115 N2 DG A 7 2.584 -2.869 -8.840 1.00 0.66 N ATOM 116 N3 DG A 7 4.337 -1.626 -9.671 1.00 0.53 N ATOM 117 C4 DG A 7 5.676 -1.489 -9.606 1.00 0.47 C ATOM 0 H5' DG A 7 8.859 2.833 -13.217 1.00 0.78 H new ATOM 0 H5'' DG A 7 8.882 1.901 -11.733 1.00 0.78 H new ATOM 0 H4' DG A 7 6.825 1.900 -13.907 1.00 0.65 H new ATOM 0 H3' DG A 7 6.756 3.619 -11.822 1.00 0.69 H new ATOM 0 H2' DG A 7 6.880 1.987 -10.022 1.00 0.62 H new ATOM 0 H2'' DG A 7 5.147 2.184 -10.189 1.00 0.62 H new ATOM 0 H1' DG A 7 4.879 0.228 -11.384 1.00 0.52 H new ATOM 0 H8 DG A 7 8.565 -0.216 -10.313 1.00 0.48 H new ATOM 0 H1 DG A 7 4.267 -4.109 -7.537 1.00 0.52 H new ATOM 0 H21 DG A 7 1.930 -2.323 -9.401 1.00 0.66 H new ATOM 0 H22 DG A 7 2.240 -3.619 -8.241 1.00 0.66 H new ATOM 129 P DG A 8 4.080 4.140 -12.023 1.00 0.80 P ATOM 130 OP1 DG A 8 3.239 4.646 -13.137 1.00 1.36 O ATOM 131 OP2 DG A 8 4.943 5.085 -11.268 1.00 1.30 O ATOM 132 O5' DG A 8 3.128 3.393 -10.986 1.00 0.60 O ATOM 133 C5' DG A 8 2.212 4.123 -10.170 1.00 0.50 C ATOM 134 C4' DG A 8 1.214 3.181 -9.537 1.00 0.50 C ATOM 135 O4' DG A 8 1.892 1.955 -9.158 1.00 0.52 O ATOM 136 C3' DG A 8 0.549 3.709 -8.258 1.00 0.61 C ATOM 137 O3' DG A 8 -0.844 3.374 -8.248 1.00 0.89 O ATOM 138 C2' DG A 8 1.284 2.978 -7.148 1.00 0.57 C ATOM 139 C1' DG A 8 1.606 1.652 -7.804 1.00 0.52 C ATOM 140 N9 DG A 8 2.760 0.957 -7.236 1.00 0.47 N ATOM 141 C8 DG A 8 4.083 1.148 -7.548 1.00 0.53 C ATOM 142 N7 DG A 8 4.889 0.376 -6.874 1.00 0.56 N ATOM 143 C5 DG A 8 4.045 -0.373 -6.064 1.00 0.48 C ATOM 144 C6 DG A 8 4.344 -1.380 -5.112 1.00 0.51 C ATOM 145 O6 DG A 8 5.453 -1.818 -4.783 1.00 0.62 O ATOM 146 N1 DG A 8 3.193 -1.886 -4.511 1.00 0.46 N ATOM 147 C2 DG A 8 1.915 -1.463 -4.801 1.00 0.44 C ATOM 148 N2 DG A 8 0.923 -2.054 -4.117 1.00 0.50 N ATOM 149 N3 DG A 8 1.626 -0.524 -5.686 1.00 0.45 N ATOM 150 C4 DG A 8 2.730 -0.027 -6.276 1.00 0.43 C ATOM 0 H5' DG A 8 1.690 4.867 -10.772 1.00 0.50 H new ATOM 0 H5'' DG A 8 2.755 4.664 -9.395 1.00 0.50 H new ATOM 0 H4' DG A 8 0.439 3.044 -10.291 1.00 0.50 H new ATOM 0 H3' DG A 8 0.605 4.793 -8.160 1.00 0.61 H new ATOM 0 H2' DG A 8 2.184 3.508 -6.836 1.00 0.57 H new ATOM 0 H2'' DG A 8 0.664 2.854 -6.260 1.00 0.57 H new ATOM 0 H1' DG A 8 0.758 0.983 -7.658 1.00 0.52 H new ATOM 0 H8 DG A 8 4.423 1.867 -8.279 1.00 0.53 H new ATOM 0 H1 DG A 8 3.305 -2.618 -3.810 1.00 0.46 H new ATOM 0 H21 DG A 8 -0.046 -1.783 -4.287 1.00 0.50 H new ATOM 0 H22 DG A 8 1.138 -2.774 -3.427 1.00 0.50 H new ATOM 162 P DG A 9 -1.781 3.863 -7.035 1.00 1.15 P ATOM 163 OP1 DG A 9 -3.160 3.999 -7.567 1.00 1.64 O ATOM 164 OP2 DG A 9 -1.129 5.027 -6.381 1.00 1.40 O ATOM 165 O5' DG A 9 -1.762 2.640 -6.014 1.00 0.87 O ATOM 166 C5' DG A 9 -2.228 1.347 -6.404 1.00 0.93 C ATOM 167 C4' DG A 9 -2.799 0.613 -5.212 1.00 0.64 C ATOM 168 O4' DG A 9 -1.720 -0.036 -4.491 1.00 0.54 O ATOM 169 C3' DG A 9 -3.512 1.502 -4.188 1.00 0.64 C ATOM 170 O3' DG A 9 -4.643 0.818 -3.637 1.00 0.77 O ATOM 171 C2' DG A 9 -2.454 1.729 -3.124 1.00 0.62 C ATOM 172 C1' DG A 9 -1.689 0.418 -3.147 1.00 0.42 C ATOM 173 N9 DG A 9 -0.289 0.524 -2.737 1.00 0.40 N ATOM 174 C8 DG A 9 0.661 1.379 -3.242 1.00 0.47 C ATOM 175 N7 DG A 9 1.831 1.241 -2.680 1.00 0.53 N ATOM 176 C5 DG A 9 1.642 0.232 -1.745 1.00 0.47 C ATOM 177 C6 DG A 9 2.555 -0.353 -0.831 1.00 0.53 C ATOM 178 O6 DG A 9 3.750 -0.085 -0.668 1.00 0.64 O ATOM 179 N1 DG A 9 1.955 -1.347 -0.060 1.00 0.50 N ATOM 180 C2 DG A 9 0.636 -1.722 -0.166 1.00 0.47 C ATOM 181 N2 DG A 9 0.230 -2.701 0.659 1.00 0.56 N ATOM 182 N3 DG A 9 -0.225 -1.184 -1.014 1.00 0.43 N ATOM 183 C4 DG A 9 0.341 -0.220 -1.767 1.00 0.40 C ATOM 0 H5' DG A 9 -1.408 0.772 -6.835 1.00 0.93 H new ATOM 0 H5'' DG A 9 -2.989 1.446 -7.178 1.00 0.93 H new ATOM 0 H4' DG A 9 -3.531 -0.077 -5.632 1.00 0.64 H new ATOM 0 H3' DG A 9 -3.893 2.430 -4.615 1.00 0.64 H new ATOM 0 H2' DG A 9 -1.813 2.578 -3.362 1.00 0.62 H new ATOM 0 H2'' DG A 9 -2.895 1.926 -2.147 1.00 0.62 H new ATOM 0 H1' DG A 9 -2.161 -0.257 -2.433 1.00 0.42 H new ATOM 0 H8 DG A 9 0.460 2.094 -4.026 1.00 0.47 H new ATOM 0 H1 DG A 9 2.533 -1.829 0.629 1.00 0.50 H new ATOM 0 H21 DG A 9 -0.737 -3.024 0.630 1.00 0.56 H new ATOM 0 H22 DG A 9 0.889 -3.121 1.315 1.00 0.56 H new ATOM 195 P DT A 10 -5.947 1.647 -3.190 1.00 0.78 P ATOM 196 OP1 DT A 10 -5.704 3.075 -3.515 1.00 1.30 O ATOM 197 OP2 DT A 10 -6.289 1.261 -1.797 1.00 0.98 O ATOM 198 O5' DT A 10 -7.096 1.108 -4.154 1.00 1.11 O ATOM 199 C5' DT A 10 -6.826 0.804 -5.523 1.00 0.96 C ATOM 200 C4' DT A 10 -6.576 -0.677 -5.688 1.00 0.91 C ATOM 201 O4' DT A 10 -7.839 -1.384 -5.597 1.00 0.86 O ATOM 202 C3' DT A 10 -5.969 -1.081 -7.032 1.00 0.91 C ATOM 203 O3' DT A 10 -5.093 -2.202 -6.866 1.00 1.13 O ATOM 204 C2' DT A 10 -7.182 -1.467 -7.857 1.00 0.74 C ATOM 205 C1' DT A 10 -8.109 -2.067 -6.814 1.00 0.69 C ATOM 206 N1 DT A 10 -9.546 -1.914 -7.115 1.00 0.62 N ATOM 207 C2 DT A 10 -10.156 -2.880 -7.883 1.00 0.89 C ATOM 208 O2 DT A 10 -9.565 -3.853 -8.324 1.00 1.19 O ATOM 209 N3 DT A 10 -11.490 -2.667 -8.119 1.00 1.19 N ATOM 210 C4 DT A 10 -12.256 -1.608 -7.673 1.00 1.31 C ATOM 211 O4 DT A 10 -13.447 -1.551 -7.966 1.00 1.71 O ATOM 212 C5 DT A 10 -11.552 -0.631 -6.872 1.00 1.23 C ATOM 213 C7 DT A 10 -12.304 0.553 -6.346 1.00 1.77 C ATOM 214 C6 DT A 10 -10.247 -0.826 -6.633 1.00 0.94 C ATOM 0 H5' DT A 10 -5.957 1.367 -5.864 1.00 0.96 H new ATOM 0 H5'' DT A 10 -7.668 1.110 -6.144 1.00 0.96 H new ATOM 0 H4' DT A 10 -5.865 -0.931 -4.902 1.00 0.91 H new ATOM 0 H3' DT A 10 -5.373 -0.293 -7.492 1.00 0.91 H new ATOM 0 H2' DT A 10 -7.630 -0.604 -8.350 1.00 0.74 H new ATOM 0 H2'' DT A 10 -6.930 -2.185 -8.638 1.00 0.74 H new ATOM 0 H1' DT A 10 -7.919 -3.140 -6.776 1.00 0.69 H new ATOM 0 H3 DT A 10 -11.969 -3.367 -8.686 1.00 1.19 H new ATOM 0 H71 DT A 10 -11.862 0.875 -5.403 1.00 1.77 H new ATOM 0 H72 DT A 10 -12.251 1.368 -7.068 1.00 1.77 H new ATOM 0 H73 DT A 10 -13.346 0.279 -6.184 1.00 1.77 H new ATOM 0 H6 DT A 10 -9.719 -0.098 -6.035 1.00 0.94 H new ATOM 227 P DG A 11 -3.888 -2.437 -7.904 1.00 1.16 P ATOM 228 OP1 DG A 11 -2.758 -1.574 -7.475 1.00 1.57 O ATOM 229 OP2 DG A 11 -4.426 -2.309 -9.282 1.00 1.24 O ATOM 230 O5' DG A 11 -3.468 -3.956 -7.669 1.00 1.34 O ATOM 231 C5' DG A 11 -4.375 -5.021 -7.953 1.00 0.96 C ATOM 232 C4' DG A 11 -4.068 -6.216 -7.080 1.00 0.94 C ATOM 233 O4' DG A 11 -2.690 -6.616 -7.293 1.00 0.79 O ATOM 234 C3' DG A 11 -4.207 -5.966 -5.575 1.00 1.09 C ATOM 235 O3' DG A 11 -4.761 -7.119 -4.930 1.00 1.28 O ATOM 236 C2' DG A 11 -2.778 -5.733 -5.121 1.00 0.90 C ATOM 237 C1' DG A 11 -1.989 -6.624 -6.061 1.00 0.76 C ATOM 238 N9 DG A 11 -0.621 -6.177 -6.314 1.00 0.63 N ATOM 239 C8 DG A 11 -0.211 -5.241 -7.232 1.00 0.65 C ATOM 240 N7 DG A 11 1.079 -5.048 -7.232 1.00 0.61 N ATOM 241 C5 DG A 11 1.552 -5.911 -6.252 1.00 0.53 C ATOM 242 C6 DG A 11 2.875 -6.145 -5.799 1.00 0.50 C ATOM 243 O6 DG A 11 3.922 -5.615 -6.189 1.00 0.57 O ATOM 244 N1 DG A 11 2.918 -7.102 -4.787 1.00 0.46 N ATOM 245 C2 DG A 11 1.812 -7.749 -4.282 1.00 0.49 C ATOM 246 N2 DG A 11 2.042 -8.642 -3.307 1.00 0.55 N ATOM 247 N3 DG A 11 0.573 -7.538 -4.697 1.00 0.55 N ATOM 248 C4 DG A 11 0.518 -6.614 -5.676 1.00 0.54 C ATOM 0 H5' DG A 11 -4.301 -5.301 -9.004 1.00 0.96 H new ATOM 0 H5'' DG A 11 -5.400 -4.691 -7.783 1.00 0.96 H new ATOM 0 H4' DG A 11 -4.799 -6.972 -7.367 1.00 0.94 H new ATOM 0 H3' DG A 11 -4.868 -5.133 -5.337 1.00 1.09 H new ATOM 0 H2' DG A 11 -2.488 -4.686 -5.214 1.00 0.90 H new ATOM 0 H2'' DG A 11 -2.632 -6.013 -4.078 1.00 0.90 H new ATOM 0 H1' DG A 11 -1.903 -7.607 -5.599 1.00 0.76 H new ATOM 0 H8 DG A 11 -0.890 -4.717 -7.889 1.00 0.65 H new ATOM 0 H1 DG A 11 3.829 -7.339 -4.394 1.00 0.46 H new ATOM 0 H21 DG A 11 1.264 -9.155 -2.891 1.00 0.55 H new ATOM 0 H22 DG A 11 2.994 -8.808 -2.982 1.00 0.55 H new ATOM 260 P DG A 12 -5.363 -6.996 -3.444 1.00 1.45 P ATOM 261 OP1 DG A 12 -6.264 -8.157 -3.233 1.00 1.97 O ATOM 262 OP2 DG A 12 -5.888 -5.618 -3.264 1.00 1.71 O ATOM 263 O5' DG A 12 -4.094 -7.176 -2.497 1.00 0.94 O ATOM 264 C5' DG A 12 -4.112 -6.715 -1.147 1.00 0.58 C ATOM 265 C4' DG A 12 -3.132 -7.507 -0.313 1.00 0.38 C ATOM 266 O4' DG A 12 -1.819 -7.428 -0.924 1.00 0.40 O ATOM 267 C3' DG A 12 -2.961 -7.008 1.124 1.00 0.29 C ATOM 268 O3' DG A 12 -2.821 -8.116 2.021 1.00 0.42 O ATOM 269 C2' DG A 12 -1.681 -6.195 1.074 1.00 0.35 C ATOM 270 C1' DG A 12 -0.878 -6.903 -0.002 1.00 0.38 C ATOM 271 N9 DG A 12 0.037 -6.035 -0.739 1.00 0.40 N ATOM 272 C8 DG A 12 -0.289 -5.129 -1.718 1.00 0.50 C ATOM 273 N7 DG A 12 0.743 -4.494 -2.199 1.00 0.50 N ATOM 274 C5 DG A 12 1.821 -5.013 -1.494 1.00 0.41 C ATOM 275 C6 DG A 12 3.203 -4.710 -1.580 1.00 0.42 C ATOM 276 O6 DG A 12 3.762 -3.896 -2.324 1.00 0.48 O ATOM 277 N1 DG A 12 3.959 -5.465 -0.686 1.00 0.43 N ATOM 278 C2 DG A 12 3.434 -6.396 0.181 1.00 0.43 C ATOM 279 N2 DG A 12 4.314 -7.030 0.971 1.00 0.54 N ATOM 280 N3 DG A 12 2.147 -6.688 0.270 1.00 0.37 N ATOM 281 C4 DG A 12 1.403 -5.964 -0.590 1.00 0.36 C ATOM 0 H5' DG A 12 -5.116 -6.815 -0.734 1.00 0.58 H new ATOM 0 H5'' DG A 12 -3.857 -5.656 -1.113 1.00 0.58 H new ATOM 0 H4' DG A 12 -3.543 -8.516 -0.275 1.00 0.38 H new ATOM 0 H3' DG A 12 -3.813 -6.429 1.479 1.00 0.29 H new ATOM 0 H2' DG A 12 -1.873 -5.153 0.817 1.00 0.35 H new ATOM 0 H2'' DG A 12 -1.163 -6.196 2.033 1.00 0.35 H new ATOM 0 H1' DG A 12 -0.260 -7.657 0.485 1.00 0.38 H new ATOM 0 H8 DG A 12 -1.301 -4.959 -2.056 1.00 0.50 H new ATOM 0 H1 DG A 12 4.968 -5.318 -0.673 1.00 0.43 H new ATOM 0 H21 DG A 12 3.989 -7.732 1.636 1.00 0.54 H new ATOM 0 H22 DG A 12 5.308 -6.810 0.906 1.00 0.54 H new ATOM 293 P DG A 13 -3.005 -7.895 3.604 1.00 0.61 P ATOM 294 OP1 DG A 13 -4.000 -8.891 4.078 1.00 1.11 O ATOM 295 OP2 DG A 13 -3.239 -6.450 3.852 1.00 1.12 O ATOM 296 O5' DG A 13 -1.585 -8.285 4.213 1.00 0.45 O ATOM 297 C5' DG A 13 -1.255 -7.970 5.566 1.00 0.48 C ATOM 298 C4' DG A 13 0.182 -8.338 5.850 1.00 0.38 C ATOM 299 O4' DG A 13 1.019 -7.852 4.769 1.00 0.34 O ATOM 300 C3' DG A 13 0.759 -7.734 7.134 1.00 0.48 C ATOM 301 O3' DG A 13 1.635 -8.669 7.773 1.00 0.57 O ATOM 302 C2' DG A 13 1.534 -6.527 6.638 1.00 0.58 C ATOM 303 C1' DG A 13 2.025 -6.991 5.280 1.00 0.47 C ATOM 304 N9 DG A 13 2.234 -5.916 4.312 1.00 0.47 N ATOM 305 C8 DG A 13 1.292 -5.338 3.496 1.00 0.48 C ATOM 306 N7 DG A 13 1.776 -4.397 2.734 1.00 0.50 N ATOM 307 C5 DG A 13 3.123 -4.349 3.066 1.00 0.51 C ATOM 308 C6 DG A 13 4.159 -3.521 2.567 1.00 0.58 C ATOM 309 O6 DG A 13 4.085 -2.638 1.705 1.00 0.63 O ATOM 310 N1 DG A 13 5.384 -3.796 3.174 1.00 0.62 N ATOM 311 C2 DG A 13 5.572 -4.755 4.143 1.00 0.59 C ATOM 312 N2 DG A 13 6.822 -4.882 4.616 1.00 0.66 N ATOM 313 N3 DG A 13 4.612 -5.534 4.616 1.00 0.53 N ATOM 314 C4 DG A 13 3.422 -5.278 4.038 1.00 0.49 C ATOM 0 H5' DG A 13 -1.917 -8.508 6.244 1.00 0.48 H new ATOM 0 H5'' DG A 13 -1.409 -6.906 5.748 1.00 0.48 H new ATOM 0 H4' DG A 13 0.180 -9.423 5.956 1.00 0.38 H new ATOM 0 H3' DG A 13 -0.004 -7.476 7.869 1.00 0.48 H new ATOM 0 H2' DG A 13 0.902 -5.642 6.561 1.00 0.58 H new ATOM 0 H2'' DG A 13 2.359 -6.273 7.303 1.00 0.58 H new ATOM 0 H1' DG A 13 2.996 -7.466 5.419 1.00 0.47 H new ATOM 0 H8 DG A 13 0.253 -5.634 3.487 1.00 0.48 H new ATOM 0 H1 DG A 13 6.194 -3.250 2.880 1.00 0.62 H new ATOM 0 H21 DG A 13 7.027 -5.575 5.336 1.00 0.66 H new ATOM 0 H22 DG A 13 7.567 -4.285 4.256 1.00 0.66 H new ATOM 326 P DT A 14 1.893 -8.576 9.359 1.00 0.65 P ATOM 327 OP1 DT A 14 0.987 -7.529 9.899 1.00 1.10 O ATOM 328 OP2 DT A 14 3.356 -8.467 9.587 1.00 1.08 O ATOM 329 O5' DT A 14 1.404 -9.987 9.913 1.00 0.77 O ATOM 330 C5' DT A 14 0.181 -10.571 9.463 1.00 0.88 C ATOM 331 C4' DT A 14 -0.076 -11.869 10.193 1.00 0.40 C ATOM 332 O4' DT A 14 -0.520 -11.580 11.539 1.00 0.74 O ATOM 333 C3' DT A 14 -1.173 -12.739 9.590 1.00 0.88 C ATOM 334 O3' DT A 14 -0.621 -13.636 8.620 1.00 0.77 O ATOM 335 C2' DT A 14 -1.693 -13.502 10.794 1.00 1.52 C ATOM 336 C1' DT A 14 -1.541 -12.494 11.927 1.00 1.45 C ATOM 337 N1 DT A 14 -2.763 -11.717 12.216 1.00 1.98 N ATOM 338 C2 DT A 14 -3.690 -12.260 13.079 1.00 2.79 C ATOM 339 O2 DT A 14 -3.547 -13.348 13.612 1.00 3.16 O ATOM 340 N3 DT A 14 -4.796 -11.479 13.296 1.00 3.30 N ATOM 341 C4 DT A 14 -5.061 -10.239 12.750 1.00 3.24 C ATOM 342 O4 DT A 14 -6.102 -9.654 13.040 1.00 3.85 O ATOM 343 C5 DT A 14 -4.047 -9.729 11.854 1.00 2.62 C ATOM 344 C7 DT A 14 -4.251 -8.390 11.216 1.00 2.98 C ATOM 345 C6 DT A 14 -2.960 -10.482 11.632 1.00 1.97 C ATOM 0 H5' DT A 14 0.229 -10.752 8.389 1.00 0.88 H new ATOM 0 H5'' DT A 14 -0.645 -9.880 9.633 1.00 0.88 H new ATOM 0 H4' DT A 14 0.870 -12.408 10.136 1.00 0.40 H new ATOM 0 H3' DT A 14 -1.946 -12.172 9.071 1.00 0.88 H new ATOM 0 H2' DT A 14 -2.731 -13.807 10.661 1.00 1.52 H new ATOM 0 H2'' DT A 14 -1.115 -14.408 10.979 1.00 1.52 H new ATOM 0 H1' DT A 14 -1.309 -13.054 12.833 1.00 1.45 H new ATOM 0 H3 DT A 14 -5.500 -11.856 13.931 1.00 3.30 H new ATOM 0 H71 DT A 14 -3.283 -7.921 11.037 1.00 2.98 H new ATOM 0 H72 DT A 14 -4.775 -8.515 10.268 1.00 2.98 H new ATOM 0 H73 DT A 14 -4.843 -7.758 11.878 1.00 2.98 H new ATOM 0 H6 DT A 14 -2.201 -10.103 10.963 1.00 1.97 H new ATOM 358 P DA A 15 -1.592 -14.387 7.581 1.00 0.58 P ATOM 359 OP1 DA A 15 -2.384 -13.345 6.880 1.00 1.20 O ATOM 360 OP2 DA A 15 -2.293 -15.479 8.304 1.00 0.82 O ATOM 361 O5' DA A 15 -0.594 -15.043 6.527 1.00 0.64 O ATOM 362 C5' DA A 15 -1.065 -15.965 5.544 1.00 0.62 C ATOM 363 C4' DA A 15 0.026 -16.257 4.540 1.00 0.56 C ATOM 364 O4' DA A 15 -0.388 -17.363 3.699 1.00 0.65 O ATOM 365 C3' DA A 15 0.349 -15.102 3.587 1.00 0.59 C ATOM 366 O3' DA A 15 1.753 -15.061 3.312 1.00 0.85 O ATOM 367 C2' DA A 15 -0.432 -15.451 2.334 1.00 0.48 C ATOM 368 C1' DA A 15 -0.392 -16.968 2.336 1.00 0.42 C ATOM 369 N9 DA A 15 -1.538 -17.604 1.683 1.00 0.62 N ATOM 370 C8 DA A 15 -2.796 -17.804 2.199 1.00 1.04 C ATOM 371 N7 DA A 15 -3.616 -18.405 1.372 1.00 1.34 N ATOM 372 C5 DA A 15 -2.849 -18.616 0.235 1.00 1.08 C ATOM 373 C6 DA A 15 -3.139 -19.211 -1.005 1.00 1.23 C ATOM 374 N6 DA A 15 -4.330 -19.726 -1.320 1.00 1.67 N ATOM 375 N1 DA A 15 -2.150 -19.262 -1.924 1.00 0.99 N ATOM 376 C2 DA A 15 -0.955 -18.746 -1.609 1.00 0.73 C ATOM 377 N3 DA A 15 -0.561 -18.161 -0.480 1.00 0.57 N ATOM 378 C4 DA A 15 -1.567 -18.127 0.412 1.00 0.66 C ATOM 0 H5' DA A 15 -1.937 -15.553 5.036 1.00 0.62 H new ATOM 0 H5'' DA A 15 -1.384 -16.890 6.025 1.00 0.62 H new ATOM 0 H4' DA A 15 0.913 -16.462 5.139 1.00 0.56 H new ATOM 0 H3' DA A 15 0.088 -14.124 3.992 1.00 0.59 H new ATOM 0 H2' DA A 15 -1.453 -15.072 2.373 1.00 0.48 H new ATOM 0 H2'' DA A 15 0.029 -15.034 1.439 1.00 0.48 H new ATOM 0 H1' DA A 15 0.489 -17.281 1.775 1.00 0.42 H new ATOM 0 H8 DA A 15 -3.082 -17.495 3.193 1.00 1.04 H new ATOM 0 H61 DA A 15 -4.478 -20.145 -2.238 1.00 1.67 H new ATOM 0 H62 DA A 15 -5.092 -19.701 -0.642 1.00 1.67 H new ATOM 0 H2 DA A 15 -0.203 -18.814 -2.382 1.00 0.73 H new ATOM 390 P DG A 16 2.733 -14.226 4.275 1.00 1.51 P ATOM 391 OP1 DG A 16 2.947 -15.036 5.501 1.00 2.49 O ATOM 392 OP2 DG A 16 2.205 -12.842 4.393 1.00 2.21 O ATOM 393 O5' DG A 16 4.109 -14.170 3.473 1.00 1.06 O ATOM 394 C5' DG A 16 4.233 -13.401 2.276 1.00 0.47 C ATOM 395 C4' DG A 16 5.664 -12.951 2.095 1.00 0.36 C ATOM 396 O4' DG A 16 5.834 -12.441 0.747 1.00 0.35 O ATOM 397 C3' DG A 16 6.109 -11.822 3.036 1.00 0.38 C ATOM 398 O3' DG A 16 7.416 -12.095 3.554 1.00 0.40 O ATOM 399 C2' DG A 16 6.133 -10.593 2.144 1.00 0.43 C ATOM 400 C1' DG A 16 6.480 -11.183 0.792 1.00 0.34 C ATOM 401 N9 DG A 16 6.023 -10.393 -0.350 1.00 0.33 N ATOM 402 C8 DG A 16 4.767 -10.384 -0.905 1.00 0.43 C ATOM 403 N7 DG A 16 4.659 -9.576 -1.924 1.00 0.43 N ATOM 404 C5 DG A 16 5.923 -9.016 -2.050 1.00 0.32 C ATOM 405 C6 DG A 16 6.416 -8.065 -2.979 1.00 0.30 C ATOM 406 O6 DG A 16 5.808 -7.512 -3.902 1.00 0.38 O ATOM 407 N1 DG A 16 7.759 -7.766 -2.756 1.00 0.25 N ATOM 408 C2 DG A 16 8.523 -8.322 -1.755 1.00 0.25 C ATOM 409 N2 DG A 16 9.798 -7.909 -1.683 1.00 0.34 N ATOM 410 N3 DG A 16 8.074 -9.209 -0.882 1.00 0.25 N ATOM 411 C4 DG A 16 6.776 -9.508 -1.087 1.00 0.27 C ATOM 0 H5' DG A 16 3.574 -12.534 2.321 1.00 0.47 H new ATOM 0 H5'' DG A 16 3.919 -13.996 1.418 1.00 0.47 H new ATOM 0 H4' DG A 16 6.267 -13.832 2.314 1.00 0.36 H new ATOM 0 H3' DG A 16 5.453 -11.702 3.898 1.00 0.38 H new ATOM 0 H2' DG A 16 5.170 -10.082 2.130 1.00 0.43 H new ATOM 0 H2'' DG A 16 6.875 -9.866 2.473 1.00 0.43 H new ATOM 0 H1' DG A 16 7.566 -11.227 0.706 1.00 0.34 H new ATOM 0 H8 DG A 16 3.950 -10.986 -0.535 1.00 0.43 H new ATOM 0 H1 DG A 16 8.205 -7.090 -3.376 1.00 0.25 H new ATOM 0 H21 DG A 16 10.416 -8.284 -0.963 1.00 0.34 H new ATOM 0 H22 DG A 16 10.149 -7.220 -2.348 1.00 0.34 H new ATOM 423 P DG A 17 8.006 -11.204 4.757 1.00 0.51 P ATOM 424 OP1 DG A 17 8.797 -12.107 5.632 1.00 0.75 O ATOM 425 OP2 DG A 17 6.895 -10.408 5.339 1.00 0.66 O ATOM 426 O5' DG A 17 9.015 -10.202 4.036 1.00 0.74 O ATOM 427 C5' DG A 17 10.230 -10.674 3.453 1.00 0.50 C ATOM 428 C4' DG A 17 11.219 -9.539 3.317 1.00 0.44 C ATOM 429 O4' DG A 17 10.848 -8.721 2.177 1.00 0.46 O ATOM 430 C3' DG A 17 11.277 -8.588 4.515 1.00 0.40 C ATOM 431 O3' DG A 17 12.619 -8.137 4.731 1.00 0.51 O ATOM 432 C2' DG A 17 10.387 -7.434 4.091 1.00 0.37 C ATOM 433 C1' DG A 17 10.613 -7.384 2.591 1.00 0.37 C ATOM 434 N9 DG A 17 9.479 -6.869 1.825 1.00 0.33 N ATOM 435 C8 DG A 17 8.171 -7.282 1.901 1.00 0.39 C ATOM 436 N7 DG A 17 7.378 -6.638 1.091 1.00 0.40 N ATOM 437 C5 DG A 17 8.213 -5.742 0.438 1.00 0.32 C ATOM 438 C6 DG A 17 7.920 -4.776 -0.557 1.00 0.36 C ATOM 439 O6 DG A 17 6.827 -4.516 -1.072 1.00 0.47 O ATOM 440 N1 DG A 17 9.057 -4.073 -0.952 1.00 0.36 N ATOM 441 C2 DG A 17 10.318 -4.285 -0.440 1.00 0.35 C ATOM 442 N2 DG A 17 11.296 -3.513 -0.938 1.00 0.45 N ATOM 443 N3 DG A 17 10.602 -5.183 0.488 1.00 0.33 N ATOM 444 C4 DG A 17 9.511 -5.871 0.879 1.00 0.28 C ATOM 0 H5' DG A 17 10.027 -11.109 2.474 1.00 0.50 H new ATOM 0 H5'' DG A 17 10.655 -11.465 4.071 1.00 0.50 H new ATOM 0 H4' DG A 17 12.191 -10.023 3.220 1.00 0.44 H new ATOM 0 H3' DG A 17 10.957 -9.053 5.448 1.00 0.40 H new ATOM 0 H2' DG A 17 9.341 -7.615 4.339 1.00 0.37 H new ATOM 0 H2'' DG A 17 10.673 -6.501 4.576 1.00 0.37 H new ATOM 0 H1' DG A 17 11.443 -6.703 2.402 1.00 0.37 H new ATOM 0 H8 DG A 17 7.833 -8.063 2.566 1.00 0.39 H new ATOM 0 H1 DG A 17 8.948 -3.354 -1.667 1.00 0.36 H new ATOM 0 H21 DG A 17 12.253 -3.621 -0.600 1.00 0.45 H new ATOM 0 H22 DG A 17 11.083 -2.819 -1.654 1.00 0.45 H new ATOM 456 P DG A 18 13.015 -7.433 6.122 1.00 0.55 P ATOM 457 OP1 DG A 18 14.240 -8.104 6.626 1.00 0.83 O ATOM 458 OP2 DG A 18 11.804 -7.376 6.980 1.00 0.83 O ATOM 459 O5' DG A 18 13.402 -5.944 5.703 1.00 0.56 O ATOM 460 C5' DG A 18 14.626 -5.667 5.024 1.00 0.41 C ATOM 461 C4' DG A 18 14.775 -4.180 4.802 1.00 0.33 C ATOM 462 O4' DG A 18 13.720 -3.726 3.915 1.00 0.44 O ATOM 463 C3' DG A 18 14.662 -3.324 6.069 1.00 0.36 C ATOM 464 O3' DG A 18 15.621 -2.260 6.040 1.00 0.38 O ATOM 465 C2' DG A 18 13.250 -2.770 6.002 1.00 0.44 C ATOM 466 C1' DG A 18 13.023 -2.644 4.507 1.00 0.38 C ATOM 467 N9 DG A 18 11.623 -2.727 4.094 1.00 0.37 N ATOM 468 C8 DG A 18 10.660 -3.573 4.589 1.00 0.42 C ATOM 469 N7 DG A 18 9.495 -3.416 4.024 1.00 0.43 N ATOM 470 C5 DG A 18 9.700 -2.404 3.096 1.00 0.39 C ATOM 471 C6 DG A 18 8.798 -1.802 2.183 1.00 0.44 C ATOM 472 O6 DG A 18 7.600 -2.055 2.013 1.00 0.51 O ATOM 473 N1 DG A 18 9.412 -0.811 1.420 1.00 0.48 N ATOM 474 C2 DG A 18 10.736 -0.453 1.533 1.00 0.47 C ATOM 475 N2 DG A 18 11.156 0.524 0.714 1.00 0.58 N ATOM 476 N3 DG A 18 11.587 -1.007 2.381 1.00 0.40 N ATOM 477 C4 DG A 18 11.006 -1.968 3.126 1.00 0.36 C ATOM 0 H5' DG A 18 14.646 -6.189 4.067 1.00 0.41 H new ATOM 0 H5'' DG A 18 15.467 -6.041 5.608 1.00 0.41 H new ATOM 0 H4' DG A 18 15.779 -4.054 4.398 1.00 0.33 H new ATOM 0 H3' DG A 18 14.854 -3.887 6.982 1.00 0.36 H new ATOM 0 H2' DG A 18 12.528 -3.440 6.468 1.00 0.44 H new ATOM 0 H2'' DG A 18 13.166 -1.809 6.509 1.00 0.44 H new ATOM 0 H1' DG A 18 13.368 -1.658 4.196 1.00 0.38 H new ATOM 0 H8 DG A 18 10.849 -4.296 5.369 1.00 0.42 H new ATOM 0 H1 DG A 18 8.842 -0.318 0.732 1.00 0.48 H new ATOM 0 H21 DG A 18 12.127 0.836 0.748 1.00 0.58 H new ATOM 0 H22 DG A 18 10.505 0.955 0.058 1.00 0.58 H new ATOM 489 P DT A 19 17.132 -2.525 6.523 1.00 0.37 P ATOM 490 OP1 DT A 19 17.134 -3.776 7.323 1.00 0.55 O ATOM 491 OP2 DT A 19 17.656 -1.271 7.122 1.00 0.64 O ATOM 492 O5' DT A 19 17.927 -2.802 5.170 1.00 0.75 O ATOM 493 C5' DT A 19 17.887 -1.869 4.090 1.00 0.78 C ATOM 494 C4' DT A 19 18.677 -2.396 2.914 1.00 0.76 C ATOM 495 O4' DT A 19 20.093 -2.299 3.213 1.00 0.83 O ATOM 496 C3' DT A 19 18.417 -3.865 2.571 1.00 0.78 C ATOM 497 O3' DT A 19 18.436 -4.056 1.152 1.00 0.83 O ATOM 498 C2' DT A 19 19.579 -4.592 3.224 1.00 0.85 C ATOM 499 C1' DT A 19 20.702 -3.577 3.116 1.00 0.86 C ATOM 500 N1 DT A 19 21.721 -3.680 4.180 1.00 0.93 N ATOM 501 C2 DT A 19 22.802 -4.507 3.967 1.00 1.35 C ATOM 502 O2 DT A 19 22.955 -5.155 2.944 1.00 1.66 O ATOM 503 N3 DT A 19 23.703 -4.549 5.000 1.00 1.48 N ATOM 504 C4 DT A 19 23.632 -3.863 6.196 1.00 1.24 C ATOM 505 O4 DT A 19 24.520 -4.001 7.033 1.00 1.46 O ATOM 506 C5 DT A 19 22.472 -3.013 6.352 1.00 0.88 C ATOM 507 C7 DT A 19 22.313 -2.231 7.620 1.00 0.92 C ATOM 508 C6 DT A 19 21.582 -2.962 5.351 1.00 0.76 C ATOM 0 H5' DT A 19 18.296 -0.911 4.412 1.00 0.78 H new ATOM 0 H5'' DT A 19 16.854 -1.690 3.792 1.00 0.78 H new ATOM 0 H4' DT A 19 18.360 -1.789 2.066 1.00 0.76 H new ATOM 0 H3' DT A 19 17.446 -4.221 2.916 1.00 0.78 H new ATOM 0 H2' DT A 19 19.365 -4.852 4.261 1.00 0.85 H new ATOM 0 H2'' DT A 19 19.820 -5.520 2.706 1.00 0.85 H new ATOM 0 H1' DT A 19 21.226 -3.754 2.176 1.00 0.86 H new ATOM 0 H3 DT A 19 24.514 -5.153 4.871 1.00 1.48 H new ATOM 0 H71 DT A 19 21.770 -1.309 7.413 1.00 0.92 H new ATOM 0 H72 DT A 19 21.757 -2.824 8.346 1.00 0.92 H new ATOM 0 H73 DT A 19 23.296 -1.990 8.025 1.00 0.92 H new ATOM 0 H6 DT A 19 20.715 -2.329 5.466 1.00 0.76 H new ATOM 521 P DG A 20 17.603 -5.265 0.496 1.00 1.03 P ATOM 522 OP1 DG A 20 16.275 -5.303 1.159 1.00 1.62 O ATOM 523 OP2 DG A 20 18.460 -6.478 0.500 1.00 1.51 O ATOM 524 O5' DG A 20 17.389 -4.808 -1.016 1.00 0.73 O ATOM 525 C5' DG A 20 16.295 -5.306 -1.785 1.00 0.60 C ATOM 526 C4' DG A 20 16.307 -4.693 -3.166 1.00 0.40 C ATOM 527 O4' DG A 20 15.239 -5.280 -3.953 1.00 0.48 O ATOM 528 C3' DG A 20 16.072 -3.181 -3.201 1.00 0.35 C ATOM 529 O3' DG A 20 16.849 -2.579 -4.243 1.00 0.46 O ATOM 530 C2' DG A 20 14.590 -3.061 -3.501 1.00 0.29 C ATOM 531 C1' DG A 20 14.328 -4.275 -4.374 1.00 0.33 C ATOM 532 N9 DG A 20 12.975 -4.817 -4.259 1.00 0.31 N ATOM 533 C8 DG A 20 12.541 -5.787 -3.389 1.00 0.35 C ATOM 534 N7 DG A 20 11.273 -6.065 -3.516 1.00 0.34 N ATOM 535 C5 DG A 20 10.841 -5.226 -4.535 1.00 0.29 C ATOM 536 C6 DG A 20 9.556 -5.076 -5.114 1.00 0.29 C ATOM 537 O6 DG A 20 8.514 -5.676 -4.830 1.00 0.33 O ATOM 538 N1 DG A 20 9.549 -4.114 -6.123 1.00 0.29 N ATOM 539 C2 DG A 20 10.651 -3.390 -6.515 1.00 0.31 C ATOM 540 N2 DG A 20 10.457 -2.503 -7.503 1.00 0.38 N ATOM 541 N3 DG A 20 11.856 -3.521 -5.981 1.00 0.31 N ATOM 542 C4 DG A 20 11.878 -4.450 -5.004 1.00 0.28 C ATOM 0 H5' DG A 20 15.354 -5.075 -1.285 1.00 0.60 H new ATOM 0 H5'' DG A 20 16.358 -6.392 -1.860 1.00 0.60 H new ATOM 0 H4' DG A 20 17.306 -4.891 -3.554 1.00 0.40 H new ATOM 0 H3' DG A 20 16.360 -2.681 -2.277 1.00 0.35 H new ATOM 0 H2' DG A 20 13.990 -3.079 -2.591 1.00 0.29 H new ATOM 0 H2'' DG A 20 14.356 -2.131 -4.019 1.00 0.29 H new ATOM 0 H1' DG A 20 14.450 -3.970 -5.413 1.00 0.33 H new ATOM 0 H8 DG A 20 13.186 -6.272 -2.671 1.00 0.35 H new ATOM 0 H1 DG A 20 8.667 -3.935 -6.603 1.00 0.29 H new ATOM 0 H21 DG A 20 11.235 -1.935 -7.839 1.00 0.38 H new ATOM 0 H22 DG A 20 9.531 -2.397 -7.918 1.00 0.38 H new ATOM 554 P DG A 21 17.306 -1.042 -4.118 1.00 0.64 P ATOM 555 OP1 DG A 21 18.436 -0.838 -5.060 1.00 0.97 O ATOM 556 OP2 DG A 21 17.486 -0.722 -2.679 1.00 0.82 O ATOM 557 O5' DG A 21 16.051 -0.220 -4.660 1.00 0.54 O ATOM 558 C5' DG A 21 16.114 0.482 -5.902 1.00 0.64 C ATOM 559 C4' DG A 21 14.988 1.486 -5.995 1.00 0.46 C ATOM 560 O4' DG A 21 13.721 0.789 -5.879 1.00 0.51 O ATOM 561 C3' DG A 21 14.986 2.560 -4.897 1.00 0.49 C ATOM 562 O3' DG A 21 14.718 3.847 -5.465 1.00 0.59 O ATOM 563 C2' DG A 21 13.852 2.136 -3.978 1.00 0.52 C ATOM 564 C1' DG A 21 12.900 1.454 -4.938 1.00 0.44 C ATOM 565 N9 DG A 21 12.017 0.464 -4.324 1.00 0.44 N ATOM 566 C8 DG A 21 12.335 -0.431 -3.332 1.00 0.48 C ATOM 567 N7 DG A 21 11.335 -1.192 -2.983 1.00 0.53 N ATOM 568 C5 DG A 21 10.290 -0.774 -3.795 1.00 0.50 C ATOM 569 C6 DG A 21 8.950 -1.232 -3.872 1.00 0.55 C ATOM 570 O6 DG A 21 8.409 -2.126 -3.212 1.00 0.61 O ATOM 571 N1 DG A 21 8.216 -0.537 -4.832 1.00 0.57 N ATOM 572 C2 DG A 21 8.724 0.475 -5.615 1.00 0.55 C ATOM 573 N2 DG A 21 7.871 1.034 -6.486 1.00 0.63 N ATOM 574 N3 DG A 21 9.972 0.910 -5.552 1.00 0.49 N ATOM 575 C4 DG A 21 10.693 0.246 -4.628 1.00 0.46 C ATOM 0 H5' DG A 21 16.050 -0.224 -6.730 1.00 0.64 H new ATOM 0 H5'' DG A 21 17.073 0.992 -5.991 1.00 0.64 H new ATOM 0 H4' DG A 21 15.133 1.985 -6.953 1.00 0.46 H new ATOM 0 H3' DG A 21 15.941 2.641 -4.378 1.00 0.49 H new ATOM 0 H2' DG A 21 14.194 1.460 -3.195 1.00 0.52 H new ATOM 0 H2'' DG A 21 13.389 2.989 -3.483 1.00 0.52 H new ATOM 0 H1' DG A 21 12.242 2.213 -5.361 1.00 0.44 H new ATOM 0 H8 DG A 21 13.316 -0.498 -2.885 1.00 0.48 H new ATOM 0 H1 DG A 21 7.238 -0.795 -4.963 1.00 0.57 H new ATOM 0 H21 DG A 21 8.186 1.789 -7.095 1.00 0.63 H new ATOM 0 H22 DG A 21 6.907 0.704 -6.539 1.00 0.63 H new ATOM 587 P DG A 22 14.964 5.178 -4.595 1.00 0.85 P ATOM 588 OP1 DG A 22 16.017 5.968 -5.282 1.00 1.02 O ATOM 589 OP2 DG A 22 15.153 4.782 -3.176 1.00 1.02 O ATOM 590 O5' DG A 22 13.588 5.975 -4.717 1.00 0.89 O ATOM 591 C5' DG A 22 12.670 6.038 -3.624 1.00 0.55 C ATOM 592 C4' DG A 22 11.249 6.072 -4.140 1.00 0.45 C ATOM 593 O4' DG A 22 10.773 4.720 -4.314 1.00 0.39 O ATOM 594 C3' DG A 22 10.240 6.726 -3.206 1.00 0.45 C ATOM 595 O3' DG A 22 10.163 8.133 -3.463 1.00 0.54 O ATOM 596 C2' DG A 22 8.937 6.040 -3.577 1.00 0.51 C ATOM 597 C1' DG A 22 9.377 4.654 -4.044 1.00 0.44 C ATOM 598 N9 DG A 22 9.159 3.592 -3.062 1.00 0.43 N ATOM 599 C8 DG A 22 10.103 2.996 -2.263 1.00 0.43 C ATOM 600 N7 DG A 22 9.610 2.075 -1.482 1.00 0.48 N ATOM 601 C5 DG A 22 8.255 2.060 -1.785 1.00 0.49 C ATOM 602 C6 DG A 22 7.208 1.265 -1.256 1.00 0.55 C ATOM 603 O6 DG A 22 7.277 0.388 -0.388 1.00 0.60 O ATOM 604 N1 DG A 22 5.979 1.568 -1.838 1.00 0.61 N ATOM 605 C2 DG A 22 5.794 2.524 -2.811 1.00 0.62 C ATOM 606 N2 DG A 22 4.538 2.679 -3.259 1.00 0.73 N ATOM 607 N3 DG A 22 6.764 3.273 -3.312 1.00 0.57 N ATOM 608 C4 DG A 22 7.960 2.990 -2.757 1.00 0.48 C ATOM 0 H5' DG A 22 12.868 6.926 -3.023 1.00 0.55 H new ATOM 0 H5'' DG A 22 12.808 5.175 -2.973 1.00 0.55 H new ATOM 0 H4' DG A 22 11.307 6.655 -5.059 1.00 0.45 H new ATOM 0 H3' DG A 22 10.493 6.623 -2.151 1.00 0.45 H new ATOM 0 H2' DG A 22 8.260 5.979 -2.725 1.00 0.51 H new ATOM 0 H2'' DG A 22 8.411 6.579 -4.364 1.00 0.51 H new ATOM 0 H1' DG A 22 8.775 4.402 -4.917 1.00 0.44 H new ATOM 0 H8 DG A 22 11.149 3.263 -2.279 1.00 0.43 H new ATOM 0 H1 DG A 22 5.161 1.046 -1.522 1.00 0.61 H new ATOM 0 H21 DG A 22 4.336 3.372 -3.980 1.00 0.73 H new ATOM 0 H22 DG A 22 3.786 2.104 -2.878 1.00 0.73 H new ATOM 620 P DT A 23 9.582 9.122 -2.336 1.00 0.61 P ATOM 621 OP1 DT A 23 9.651 10.503 -2.879 1.00 0.87 O ATOM 622 OP2 DT A 23 10.250 8.807 -1.047 1.00 0.74 O ATOM 623 O5' DT A 23 8.047 8.713 -2.218 1.00 0.50 O ATOM 624 C5' DT A 23 7.169 9.403 -1.328 1.00 0.57 C ATOM 625 C4' DT A 23 5.731 9.121 -1.695 1.00 0.56 C ATOM 626 O4' DT A 23 5.510 7.687 -1.675 1.00 0.54 O ATOM 627 C3' DT A 23 4.694 9.722 -0.740 1.00 0.61 C ATOM 628 O3' DT A 23 3.562 10.203 -1.475 1.00 0.72 O ATOM 629 C2' DT A 23 4.303 8.550 0.141 1.00 0.61 C ATOM 630 C1' DT A 23 4.434 7.373 -0.806 1.00 0.58 C ATOM 631 N1 DT A 23 4.737 6.088 -0.145 1.00 0.62 N ATOM 632 C2 DT A 23 3.697 5.213 0.085 1.00 0.70 C ATOM 633 O2 DT A 23 2.543 5.450 -0.234 1.00 0.75 O ATOM 634 N3 DT A 23 4.060 4.046 0.705 1.00 0.79 N ATOM 635 C4 DT A 23 5.325 3.674 1.109 1.00 0.81 C ATOM 636 O4 DT A 23 5.493 2.587 1.657 1.00 0.95 O ATOM 637 C5 DT A 23 6.368 4.637 0.838 1.00 0.73 C ATOM 638 C7 DT A 23 7.774 4.318 1.245 1.00 0.81 C ATOM 639 C6 DT A 23 6.030 5.785 0.231 1.00 0.64 C ATOM 0 H5' DT A 23 7.361 10.475 -1.374 1.00 0.57 H new ATOM 0 H5'' DT A 23 7.359 9.089 -0.302 1.00 0.57 H new ATOM 0 H4' DT A 23 5.594 9.577 -2.675 1.00 0.56 H new ATOM 0 H3' DT A 23 5.074 10.571 -0.171 1.00 0.61 H new ATOM 0 H2' DT A 23 4.962 8.453 1.004 1.00 0.61 H new ATOM 0 H2'' DT A 23 3.288 8.651 0.525 1.00 0.61 H new ATOM 0 H1' DT A 23 3.476 7.234 -1.308 1.00 0.58 H new ATOM 0 H3 DT A 23 3.311 3.378 0.888 1.00 0.79 H new ATOM 0 H71 DT A 23 8.470 4.805 0.562 1.00 0.81 H new ATOM 0 H72 DT A 23 7.950 4.677 2.259 1.00 0.81 H new ATOM 0 H73 DT A 23 7.927 3.239 1.211 1.00 0.81 H new ATOM 0 H6 DT A 23 6.807 6.507 0.027 1.00 0.64 H new ATOM 652 P DA A 24 2.371 10.966 -0.707 1.00 0.77 P ATOM 653 OP1 DA A 24 1.953 12.107 -1.561 1.00 1.03 O ATOM 654 OP2 DA A 24 2.801 11.216 0.692 1.00 0.65 O ATOM 655 O5' DA A 24 1.185 9.901 -0.687 1.00 0.86 O ATOM 656 C5' DA A 24 0.334 9.762 0.452 1.00 0.89 C ATOM 657 C4' DA A 24 0.003 8.305 0.676 1.00 0.89 C ATOM 658 O4' DA A 24 1.162 7.636 1.236 1.00 0.92 O ATOM 659 C3' DA A 24 -1.141 8.045 1.659 1.00 0.94 C ATOM 660 O3' DA A 24 -1.878 6.883 1.264 1.00 1.05 O ATOM 661 C2' DA A 24 -0.420 7.803 2.971 1.00 1.07 C ATOM 662 C1' DA A 24 0.853 7.109 2.519 1.00 0.97 C ATOM 663 N9 DA A 24 2.008 7.336 3.391 1.00 1.08 N ATOM 664 C8 DA A 24 2.917 8.364 3.333 1.00 1.15 C ATOM 665 N7 DA A 24 3.848 8.298 4.254 1.00 1.45 N ATOM 666 C5 DA A 24 3.531 7.150 4.967 1.00 1.55 C ATOM 667 C6 DA A 24 4.135 6.526 6.073 1.00 1.90 C ATOM 668 N6 DA A 24 5.229 6.992 6.681 1.00 2.24 N ATOM 669 N1 DA A 24 3.568 5.393 6.541 1.00 1.93 N ATOM 670 C2 DA A 24 2.471 4.925 5.933 1.00 1.67 C ATOM 671 N3 DA A 24 1.813 5.421 4.887 1.00 1.38 N ATOM 672 C4 DA A 24 2.401 6.547 4.446 1.00 1.31 C ATOM 0 H5' DA A 24 -0.583 10.333 0.303 1.00 0.89 H new ATOM 0 H5'' DA A 24 0.825 10.172 1.335 1.00 0.89 H new ATOM 0 H4' DA A 24 -0.298 7.934 -0.304 1.00 0.89 H new ATOM 0 H3' DA A 24 -1.862 8.861 1.713 1.00 0.94 H new ATOM 0 H2' DA A 24 -0.210 8.734 3.497 1.00 1.07 H new ATOM 0 H2'' DA A 24 -1.005 7.179 3.647 1.00 1.07 H new ATOM 0 H1' DA A 24 0.670 6.035 2.530 1.00 0.97 H new ATOM 0 H8 DA A 24 2.869 9.153 2.597 1.00 1.15 H new ATOM 0 H61 DA A 24 5.620 6.493 7.480 1.00 2.24 H new ATOM 0 H62 DA A 24 5.673 7.847 6.346 1.00 2.24 H new ATOM 0 H2 DA A 24 2.062 4.017 6.350 1.00 1.67 H new ATOM 684 P DA A 25 -3.361 6.633 1.836 1.00 0.55 P ATOM 685 OP1 DA A 25 -4.316 7.234 0.870 1.00 0.91 O ATOM 686 OP2 DA A 25 -3.392 7.057 3.259 1.00 0.97 O ATOM 687 O5' DA A 25 -3.532 5.049 1.781 1.00 0.74 O ATOM 688 C5' DA A 25 -2.538 4.225 1.170 1.00 0.91 C ATOM 689 C4' DA A 25 -2.688 2.793 1.632 1.00 0.84 C ATOM 690 O4' DA A 25 -1.691 1.970 0.988 1.00 0.93 O ATOM 691 C3' DA A 25 -2.465 2.571 3.121 1.00 0.79 C ATOM 692 O3' DA A 25 -3.672 2.793 3.855 1.00 0.88 O ATOM 693 C2' DA A 25 -2.052 1.112 3.176 1.00 0.86 C ATOM 694 C1' DA A 25 -1.298 0.914 1.861 1.00 0.85 C ATOM 695 N9 DA A 25 0.162 0.953 1.991 1.00 0.82 N ATOM 696 C8 DA A 25 1.041 1.794 1.354 1.00 0.92 C ATOM 697 N7 DA A 25 2.295 1.592 1.678 1.00 0.92 N ATOM 698 C5 DA A 25 2.240 0.547 2.590 1.00 0.81 C ATOM 699 C6 DA A 25 3.238 -0.136 3.308 1.00 0.83 C ATOM 700 N6 DA A 25 4.541 0.149 3.224 1.00 0.98 N ATOM 701 N1 DA A 25 2.847 -1.130 4.134 1.00 0.77 N ATOM 702 C2 DA A 25 1.541 -1.411 4.227 1.00 0.72 C ATOM 703 N3 DA A 25 0.511 -0.840 3.606 1.00 0.72 N ATOM 704 C4 DA A 25 0.933 0.143 2.792 1.00 0.75 C ATOM 0 H5' DA A 25 -1.544 4.594 1.423 1.00 0.91 H new ATOM 0 H5'' DA A 25 -2.630 4.276 0.085 1.00 0.91 H new ATOM 0 H4' DA A 25 -3.718 2.538 1.382 1.00 0.84 H new ATOM 0 H3' DA A 25 -1.730 3.246 3.560 1.00 0.79 H new ATOM 0 H2' DA A 25 -1.419 0.905 4.039 1.00 0.86 H new ATOM 0 H2'' DA A 25 -2.916 0.451 3.249 1.00 0.86 H new ATOM 0 HO3' DA A 25 -4.123 3.591 3.509 1.00 0.88 H new ATOM 0 H1' DA A 25 -1.549 -0.079 1.489 1.00 0.85 H new ATOM 0 H8 DA A 25 0.728 2.552 0.651 1.00 0.92 H new ATOM 0 H61 DA A 25 5.216 -0.384 3.772 1.00 0.98 H new ATOM 0 H62 DA A 25 4.860 0.900 2.612 1.00 0.98 H new ATOM 0 H2 DA A 25 1.287 -2.215 4.902 1.00 0.72 H new TER 717 DA A 25 HETATM 718 C17 BO6 A 101 13.467 -7.597 -6.574 1.00 0.52 C HETATM 719 C18 BO6 A 101 14.400 -6.738 -7.147 1.00 0.53 C HETATM 720 N19 BO6 A 101 13.991 -5.781 -8.074 1.00 0.52 N HETATM 721 C31 BO6 A 101 14.983 -4.866 -8.684 1.00 0.63 C HETATM 722 C20 BO6 A 101 12.645 -5.687 -8.425 1.00 0.53 C HETATM 723 C21 BO6 A 101 11.713 -6.547 -7.850 1.00 0.51 C HETATM 724 C16 BO6 A 101 12.111 -7.510 -6.922 1.00 0.48 C HETATM 725 C15 BO6 A 101 11.207 -8.382 -6.328 1.00 0.55 C HETATM 726 C14 BO6 A 101 11.528 -9.843 -5.994 1.00 0.80 C HETATM 727 C7 BO6 A 101 10.696 -10.653 -5.227 1.00 0.67 C HETATM 728 C6 BO6 A 101 9.366 -10.791 -5.598 1.00 0.59 C HETATM 729 C8 BO6 A 101 11.142 -11.325 -4.112 1.00 0.69 C HETATM 730 C9 BO6 A 101 10.260 -12.115 -3.396 1.00 0.67 C HETATM 731 C2 BO6 A 101 8.983 -12.223 -3.786 1.00 0.60 C HETATM 732 N1 BO6 A 101 7.962 -12.906 -3.275 1.00 0.66 N HETATM 733 C3 BO6 A 101 8.539 -11.567 -4.878 1.00 0.53 C HETATM 734 C4 BO6 A 101 7.247 -11.853 -5.029 1.00 0.50 C HETATM 735 C10 BO6 A 101 6.351 -11.459 -5.949 1.00 0.49 C HETATM 736 C5 BO6 A 101 6.889 -12.686 -4.031 1.00 0.59 C HETATM 737 C13 BO6 A 101 5.632 -13.140 -3.936 1.00 0.68 C HETATM 738 C12 BO6 A 101 4.683 -12.755 -4.866 1.00 0.64 C HETATM 739 C11 BO6 A 101 5.038 -11.906 -5.886 1.00 0.53 C HETATM 740 C22 BO6 A 101 4.125 -11.489 -6.849 1.00 0.57 C HETATM 741 C23 BO6 A 101 4.002 -10.035 -7.322 1.00 0.56 C HETATM 742 C24 BO6 A 101 2.872 -9.524 -7.952 1.00 0.57 C HETATM 743 C25 BO6 A 101 1.607 -9.960 -7.531 1.00 0.64 C HETATM 744 C26 BO6 A 101 0.453 -9.471 -8.135 1.00 0.73 C HETATM 745 N27 BO6 A 101 0.547 -8.539 -9.168 1.00 0.74 N HETATM 746 C30 BO6 A 101 -0.681 -8.017 -9.811 1.00 0.88 C HETATM 747 C28 BO6 A 101 1.800 -8.099 -9.593 1.00 0.70 C HETATM 748 C29 BO6 A 101 2.953 -8.589 -8.988 1.00 0.64 C