USER MOD reduce.3.24.130724 H: found=0, std=0, add=231, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 231 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 33:sc= 1.28 USER MOD Single : A 3 DT C7 :methyl -30:sc= 0 (180deg=-1.92!) USER MOD Single : A 4 DT C7 :methyl 150:sc= -0.0939 (180deg=-0.0939) USER MOD Single : A 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl -30:sc= 0 (180deg=-1.5) USER MOD Single : A 15 DT C7 :methyl -30:sc= -0.72 (180deg=-5.11!) USER MOD Single : A 16 DT C7 :methyl -30:sc= -1.34 (180deg=-3.65!) USER MOD Single : A 17 DT C7 :methyl 150:sc= -0.0563 (180deg=-0.0563) USER MOD Single : A 20 DT C7 :methyl 150:sc= -0.335 (180deg=-0.335) USER MOD Single : A 20 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.689 4.090 6.133 1.00 0.00 O ATOM 2 C5' DG A 1 -3.760 4.361 7.044 1.00 0.00 C ATOM 3 C4' DG A 1 -5.113 3.955 6.468 1.00 0.00 C ATOM 4 O4' DG A 1 -5.376 4.639 5.222 1.00 0.00 O ATOM 5 C3' DG A 1 -5.138 2.462 6.192 1.00 0.00 C ATOM 6 O3' DG A 1 -5.988 1.767 7.112 1.00 0.00 O ATOM 7 C2' DG A 1 -5.655 2.317 4.786 1.00 0.00 C ATOM 8 C1' DG A 1 -5.929 3.710 4.268 1.00 0.00 C ATOM 9 N9 DG A 1 -5.329 3.861 2.933 1.00 0.00 N ATOM 10 C8 DG A 1 -5.933 4.011 1.734 1.00 0.00 C ATOM 11 N7 DG A 1 -5.183 4.029 0.687 1.00 0.00 N ATOM 12 C5 DG A 1 -3.913 3.875 1.240 1.00 0.00 C ATOM 13 C6 DG A 1 -2.649 3.815 0.601 1.00 0.00 C ATOM 14 O6 DG A 1 -2.405 3.900 -0.602 1.00 0.00 O ATOM 15 N1 DG A 1 -1.621 3.650 1.520 1.00 0.00 N ATOM 16 C2 DG A 1 -1.795 3.555 2.893 1.00 0.00 C ATOM 17 N2 DG A 1 -0.704 3.386 3.631 1.00 0.00 N ATOM 18 N3 DG A 1 -2.984 3.615 3.495 1.00 0.00 N ATOM 19 C4 DG A 1 -3.993 3.774 2.617 1.00 0.00 C ATOM 0 H5' DG A 1 -3.772 5.424 7.284 1.00 0.00 H new ATOM 0 H5'' DG A 1 -3.587 3.825 7.977 1.00 0.00 H new ATOM 0 H4' DG A 1 -5.872 4.224 7.203 1.00 0.00 H new ATOM 0 H3' DG A 1 -4.145 2.029 6.311 1.00 0.00 H new ATOM 0 H2' DG A 1 -4.924 1.809 4.157 1.00 0.00 H new ATOM 0 H2'' DG A 1 -6.563 1.714 4.770 1.00 0.00 H new ATOM 0 HO5' DG A 1 -3.006 4.202 5.213 1.00 0.00 H new ATOM 0 H1' DG A 1 -6.997 3.902 4.161 1.00 0.00 H new ATOM 0 H8 DG A 1 -7.005 4.112 1.656 1.00 0.00 H new ATOM 0 H1 DG A 1 -0.669 3.595 1.159 1.00 0.00 H new ATOM 0 H21 DG A 1 -0.781 3.311 4.645 1.00 0.00 H new ATOM 0 H22 DG A 1 0.211 3.331 3.183 1.00 0.00 H new ATOM 32 P DG A 2 -5.861 0.169 7.299 1.00 0.00 P ATOM 33 OP1 DG A 2 -6.291 -0.170 8.674 1.00 0.00 O ATOM 34 OP2 DG A 2 -4.526 -0.250 6.816 1.00 0.00 O ATOM 35 O5' DG A 2 -6.957 -0.413 6.274 1.00 0.00 O ATOM 36 C5' DG A 2 -8.290 0.104 6.232 1.00 0.00 C ATOM 37 C4' DG A 2 -8.843 0.038 4.815 1.00 0.00 C ATOM 38 O4' DG A 2 -7.891 0.616 3.883 1.00 0.00 O ATOM 39 C3' DG A 2 -9.078 -1.412 4.416 1.00 0.00 C ATOM 40 O3' DG A 2 -10.407 -1.621 3.921 1.00 0.00 O ATOM 41 C2' DG A 2 -8.071 -1.690 3.329 1.00 0.00 C ATOM 42 C1' DG A 2 -7.541 -0.353 2.873 1.00 0.00 C ATOM 43 N9 DG A 2 -6.085 -0.445 2.656 1.00 0.00 N ATOM 44 C8 DG A 2 -5.081 -0.672 3.540 1.00 0.00 C ATOM 45 N7 DG A 2 -3.876 -0.724 3.074 1.00 0.00 N ATOM 46 C5 DG A 2 -4.093 -0.517 1.709 1.00 0.00 C ATOM 47 C6 DG A 2 -3.164 -0.468 0.640 1.00 0.00 C ATOM 48 O6 DG A 2 -1.946 -0.579 0.691 1.00 0.00 O ATOM 49 N1 DG A 2 -3.794 -0.248 -0.576 1.00 0.00 N ATOM 50 C2 DG A 2 -5.153 -0.093 -0.742 1.00 0.00 C ATOM 51 N2 DG A 2 -5.591 0.056 -1.987 1.00 0.00 N ATOM 52 N3 DG A 2 -6.031 -0.132 0.258 1.00 0.00 N ATOM 53 C4 DG A 2 -5.440 -0.348 1.449 1.00 0.00 C ATOM 0 H5' DG A 2 -8.298 1.136 6.584 1.00 0.00 H new ATOM 0 H5'' DG A 2 -8.929 -0.467 6.905 1.00 0.00 H new ATOM 0 H4' DG A 2 -9.781 0.593 4.786 1.00 0.00 H new ATOM 0 H3' DG A 2 -8.966 -2.076 5.273 1.00 0.00 H new ATOM 0 H2' DG A 2 -7.263 -2.319 3.702 1.00 0.00 H new ATOM 0 H2'' DG A 2 -8.535 -2.225 2.500 1.00 0.00 H new ATOM 0 H1' DG A 2 -7.978 -0.045 1.923 1.00 0.00 H new ATOM 0 H8 DG A 2 -5.281 -0.804 4.593 1.00 0.00 H new ATOM 0 H1 DG A 2 -3.208 -0.197 -1.409 1.00 0.00 H new ATOM 0 H21 DG A 2 -6.588 0.174 -2.166 1.00 0.00 H new ATOM 0 H22 DG A 2 -4.930 0.052 -2.764 1.00 0.00 H new ATOM 65 P DT A 3 -10.910 -3.110 3.533 1.00 0.00 P ATOM 66 OP1 DT A 3 -12.282 -3.001 2.988 1.00 0.00 O ATOM 67 OP2 DT A 3 -10.648 -4.007 4.680 1.00 0.00 O ATOM 68 O5' DT A 3 -9.918 -3.543 2.325 1.00 0.00 O ATOM 69 C5' DT A 3 -10.120 -3.057 0.988 1.00 0.00 C ATOM 70 C4' DT A 3 -8.933 -3.378 0.072 1.00 0.00 C ATOM 71 O4' DT A 3 -7.692 -2.935 0.668 1.00 0.00 O ATOM 72 C3' DT A 3 -8.820 -4.875 -0.197 1.00 0.00 C ATOM 73 O3' DT A 3 -9.187 -5.188 -1.548 1.00 0.00 O ATOM 74 C2' DT A 3 -7.381 -5.232 0.055 1.00 0.00 C ATOM 75 C1' DT A 3 -6.718 -4.002 0.669 1.00 0.00 C ATOM 76 N1 DT A 3 -6.273 -4.294 2.047 1.00 0.00 N ATOM 77 C2 DT A 3 -4.942 -4.081 2.351 1.00 0.00 C ATOM 78 O2 DT A 3 -4.121 -3.735 1.504 1.00 0.00 O ATOM 79 N3 DT A 3 -4.575 -4.304 3.663 1.00 0.00 N ATOM 80 C4 DT A 3 -5.412 -4.711 4.685 1.00 0.00 C ATOM 81 O4 DT A 3 -4.975 -4.867 5.824 1.00 0.00 O ATOM 82 C5 DT A 3 -6.783 -4.914 4.276 1.00 0.00 C ATOM 83 C7 DT A 3 -7.821 -5.341 5.308 1.00 0.00 C ATOM 84 C6 DT A 3 -7.165 -4.713 2.999 1.00 0.00 C ATOM 0 H5' DT A 3 -10.276 -1.978 1.014 1.00 0.00 H new ATOM 0 H5'' DT A 3 -11.026 -3.500 0.575 1.00 0.00 H new ATOM 0 H4' DT A 3 -9.111 -2.853 -0.867 1.00 0.00 H new ATOM 0 H3' DT A 3 -9.494 -5.441 0.446 1.00 0.00 H new ATOM 0 H2' DT A 3 -7.308 -6.086 0.728 1.00 0.00 H new ATOM 0 H2'' DT A 3 -6.885 -5.514 -0.874 1.00 0.00 H new ATOM 0 H1' DT A 3 -5.839 -3.714 0.092 1.00 0.00 H new ATOM 0 H3 DT A 3 -3.594 -4.154 3.900 1.00 0.00 H new ATOM 0 H71 DT A 3 -7.339 -5.934 6.085 1.00 0.00 H new ATOM 0 H72 DT A 3 -8.275 -4.457 5.755 1.00 0.00 H new ATOM 0 H73 DT A 3 -8.593 -5.938 4.822 1.00 0.00 H new ATOM 0 H6 DT A 3 -8.194 -4.886 2.721 1.00 0.00 H new ATOM 97 P DT A 4 -8.926 -6.662 -2.159 1.00 0.00 P ATOM 98 OP1 DT A 4 -9.594 -6.743 -3.476 1.00 0.00 O ATOM 99 OP2 DT A 4 -9.235 -7.660 -1.111 1.00 0.00 O ATOM 100 O5' DT A 4 -7.331 -6.668 -2.401 1.00 0.00 O ATOM 101 C5' DT A 4 -6.756 -6.033 -3.554 1.00 0.00 C ATOM 102 C4' DT A 4 -5.235 -6.189 -3.582 1.00 0.00 C ATOM 103 O4' DT A 4 -4.673 -5.769 -2.319 1.00 0.00 O ATOM 104 C3' DT A 4 -4.828 -7.645 -3.819 1.00 0.00 C ATOM 105 O3' DT A 4 -3.887 -7.773 -4.899 1.00 0.00 O ATOM 106 C2' DT A 4 -4.188 -8.093 -2.539 1.00 0.00 C ATOM 107 C1' DT A 4 -3.860 -6.823 -1.771 1.00 0.00 C ATOM 108 N1 DT A 4 -4.093 -6.983 -0.315 1.00 0.00 N ATOM 109 C2 DT A 4 -3.127 -6.476 0.537 1.00 0.00 C ATOM 110 O2 DT A 4 -2.113 -5.919 0.124 1.00 0.00 O ATOM 111 N3 DT A 4 -3.363 -6.638 1.888 1.00 0.00 N ATOM 112 C4 DT A 4 -4.462 -7.254 2.455 1.00 0.00 C ATOM 113 O4 DT A 4 -4.569 -7.341 3.674 1.00 0.00 O ATOM 114 C5 DT A 4 -5.418 -7.755 1.493 1.00 0.00 C ATOM 115 C7 DT A 4 -6.678 -8.462 1.983 1.00 0.00 C ATOM 116 C6 DT A 4 -5.215 -7.610 0.170 1.00 0.00 C ATOM 0 H5' DT A 4 -7.014 -4.974 -3.553 1.00 0.00 H new ATOM 0 H5'' DT A 4 -7.183 -6.465 -4.459 1.00 0.00 H new ATOM 0 H4' DT A 4 -4.859 -5.571 -4.398 1.00 0.00 H new ATOM 0 H3' DT A 4 -5.696 -8.245 -4.093 1.00 0.00 H new ATOM 0 H2' DT A 4 -4.862 -8.732 -1.968 1.00 0.00 H new ATOM 0 H2'' DT A 4 -3.287 -8.675 -2.735 1.00 0.00 H new ATOM 0 H1' DT A 4 -2.802 -6.585 -1.879 1.00 0.00 H new ATOM 0 H3 DT A 4 -2.660 -6.268 2.527 1.00 0.00 H new ATOM 0 H71 DT A 4 -7.486 -8.301 1.269 1.00 0.00 H new ATOM 0 H72 DT A 4 -6.483 -9.530 2.076 1.00 0.00 H new ATOM 0 H73 DT A 4 -6.966 -8.060 2.954 1.00 0.00 H new ATOM 0 H6 DT A 4 -5.948 -7.994 -0.523 1.00 0.00 H new ATOM 129 P DT A 5 -4.227 -7.299 -6.404 1.00 0.00 P ATOM 130 OP1 DT A 5 -5.469 -6.494 -6.378 1.00 0.00 O ATOM 131 OP2 DT A 5 -4.135 -8.480 -7.291 1.00 0.00 O ATOM 132 O5' DT A 5 -2.989 -6.316 -6.731 1.00 0.00 O ATOM 133 C5' DT A 5 -1.907 -6.730 -7.583 1.00 0.00 C ATOM 134 C4' DT A 5 -0.759 -5.717 -7.566 1.00 0.00 C ATOM 135 O4' DT A 5 -1.275 -4.387 -7.762 1.00 0.00 O ATOM 136 C3' DT A 5 -0.053 -5.713 -6.218 1.00 0.00 C ATOM 137 O3' DT A 5 1.337 -5.357 -6.358 1.00 0.00 O ATOM 138 C2' DT A 5 -0.779 -4.673 -5.433 1.00 0.00 C ATOM 139 C1' DT A 5 -1.452 -3.765 -6.467 1.00 0.00 C ATOM 140 N1 DT A 5 -2.900 -3.601 -6.152 1.00 0.00 N ATOM 141 C2 DT A 5 -3.257 -3.298 -4.844 1.00 0.00 C ATOM 142 O2 DT A 5 -2.432 -3.186 -3.943 1.00 0.00 O ATOM 143 N3 DT A 5 -4.611 -3.160 -4.600 1.00 0.00 N ATOM 144 C4 DT A 5 -5.626 -3.286 -5.527 1.00 0.00 C ATOM 145 O4 DT A 5 -6.801 -3.160 -5.187 1.00 0.00 O ATOM 146 C5 DT A 5 -5.167 -3.589 -6.861 1.00 0.00 C ATOM 147 C7 DT A 5 -6.180 -3.733 -7.992 1.00 0.00 C ATOM 148 C6 DT A 5 -3.855 -3.736 -7.129 1.00 0.00 C ATOM 0 H5' DT A 5 -2.272 -6.851 -8.603 1.00 0.00 H new ATOM 0 H5'' DT A 5 -1.539 -7.703 -7.259 1.00 0.00 H new ATOM 0 H4' DT A 5 -0.067 -6.001 -8.359 1.00 0.00 H new ATOM 0 H3' DT A 5 -0.067 -6.694 -5.742 1.00 0.00 H new ATOM 0 H2' DT A 5 -1.517 -5.127 -4.771 1.00 0.00 H new ATOM 0 H2'' DT A 5 -0.092 -4.107 -4.804 1.00 0.00 H new ATOM 0 H1' DT A 5 -1.006 -2.771 -6.458 1.00 0.00 H new ATOM 0 H3 DT A 5 -4.887 -2.944 -3.642 1.00 0.00 H new ATOM 0 H71 DT A 5 -5.720 -3.432 -8.933 1.00 0.00 H new ATOM 0 H72 DT A 5 -6.503 -4.772 -8.061 1.00 0.00 H new ATOM 0 H73 DT A 5 -7.043 -3.098 -7.791 1.00 0.00 H new ATOM 0 H6 DT A 5 -3.547 -3.966 -8.138 1.00 0.00 H new ATOM 161 P DT A 6 2.372 -5.427 -5.113 1.00 0.00 P ATOM 162 OP1 DT A 6 3.613 -4.725 -5.495 1.00 0.00 O ATOM 163 OP2 DT A 6 2.441 -6.834 -4.654 1.00 0.00 O ATOM 164 O5' DT A 6 1.653 -4.553 -3.964 1.00 0.00 O ATOM 165 C5' DT A 6 2.085 -3.214 -3.664 1.00 0.00 C ATOM 166 C4' DT A 6 3.026 -3.172 -2.454 1.00 0.00 C ATOM 167 O4' DT A 6 2.515 -3.993 -1.374 1.00 0.00 O ATOM 168 C3' DT A 6 4.403 -3.693 -2.824 1.00 0.00 C ATOM 169 O3' DT A 6 5.429 -2.854 -2.261 1.00 0.00 O ATOM 170 C2' DT A 6 4.459 -5.081 -2.233 1.00 0.00 C ATOM 171 C1' DT A 6 3.429 -5.080 -1.100 1.00 0.00 C ATOM 172 N1 DT A 6 2.702 -6.366 -1.040 1.00 0.00 N ATOM 173 C2 DT A 6 2.975 -7.226 0.012 1.00 0.00 C ATOM 174 O2 DT A 6 3.816 -6.974 0.873 1.00 0.00 O ATOM 175 N3 DT A 6 2.242 -8.398 0.038 1.00 0.00 N ATOM 176 C4 DT A 6 1.278 -8.780 -0.881 1.00 0.00 C ATOM 177 O4 DT A 6 0.680 -9.846 -0.755 1.00 0.00 O ATOM 178 C5 DT A 6 1.067 -7.820 -1.943 1.00 0.00 C ATOM 179 C7 DT A 6 0.041 -8.117 -3.041 1.00 0.00 C ATOM 180 C6 DT A 6 1.772 -6.672 -1.985 1.00 0.00 C ATOM 0 H5' DT A 6 1.215 -2.587 -3.468 1.00 0.00 H new ATOM 0 H5'' DT A 6 2.592 -2.793 -4.532 1.00 0.00 H new ATOM 0 H4' DT A 6 3.092 -2.132 -2.134 1.00 0.00 H new ATOM 0 H3' DT A 6 4.568 -3.700 -3.901 1.00 0.00 H new ATOM 0 H2' DT A 6 4.220 -5.837 -2.981 1.00 0.00 H new ATOM 0 H2'' DT A 6 5.457 -5.309 -1.857 1.00 0.00 H new ATOM 0 H1' DT A 6 3.919 -4.951 -0.135 1.00 0.00 H new ATOM 0 H3 DT A 6 2.429 -9.042 0.806 1.00 0.00 H new ATOM 0 H71 DT A 6 -0.378 -7.181 -3.411 1.00 0.00 H new ATOM 0 H72 DT A 6 0.528 -8.645 -3.861 1.00 0.00 H new ATOM 0 H73 DT A 6 -0.758 -8.736 -2.634 1.00 0.00 H new ATOM 0 H6 DT A 6 1.594 -5.976 -2.791 1.00 0.00 H new ATOM 193 P DG A 7 6.988 -3.267 -2.341 1.00 0.00 P ATOM 194 OP1 DG A 7 7.394 -3.333 -3.762 1.00 0.00 O ATOM 195 OP2 DG A 7 7.191 -4.452 -1.475 1.00 0.00 O ATOM 196 O5' DG A 7 7.744 -2.024 -1.646 1.00 0.00 O ATOM 197 C5' DG A 7 7.465 -0.666 -2.008 1.00 0.00 C ATOM 198 C4' DG A 7 7.459 -0.455 -3.518 1.00 0.00 C ATOM 199 O4' DG A 7 6.301 -1.084 -4.113 1.00 0.00 O ATOM 200 C3' DG A 7 7.411 1.028 -3.840 1.00 0.00 C ATOM 201 O3' DG A 7 8.574 1.455 -4.550 1.00 0.00 O ATOM 202 C2' DG A 7 6.186 1.235 -4.661 1.00 0.00 C ATOM 203 C1' DG A 7 5.595 -0.151 -4.947 1.00 0.00 C ATOM 204 N9 DG A 7 4.159 -0.134 -4.625 1.00 0.00 N ATOM 205 C8 DG A 7 3.086 -0.134 -5.446 1.00 0.00 C ATOM 206 N7 DG A 7 1.917 -0.100 -4.911 1.00 0.00 N ATOM 207 C5 DG A 7 2.234 -0.076 -3.555 1.00 0.00 C ATOM 208 C6 DG A 7 1.381 -0.044 -2.431 1.00 0.00 C ATOM 209 O6 DG A 7 0.154 -0.039 -2.413 1.00 0.00 O ATOM 210 N1 DG A 7 2.105 -0.034 -1.246 1.00 0.00 N ATOM 211 C2 DG A 7 3.483 -0.051 -1.159 1.00 0.00 C ATOM 212 N2 DG A 7 4.006 -0.038 0.061 1.00 0.00 N ATOM 213 N3 DG A 7 4.290 -0.079 -2.215 1.00 0.00 N ATOM 214 C4 DG A 7 3.606 -0.093 -3.375 1.00 0.00 C ATOM 0 H5' DG A 7 8.211 -0.012 -1.556 1.00 0.00 H new ATOM 0 H5'' DG A 7 6.497 -0.376 -1.600 1.00 0.00 H new ATOM 0 H4' DG A 7 8.370 -0.898 -3.921 1.00 0.00 H new ATOM 0 H3' DG A 7 7.385 1.618 -2.924 1.00 0.00 H new ATOM 0 H2' DG A 7 5.467 1.858 -4.129 1.00 0.00 H new ATOM 0 H2'' DG A 7 6.428 1.750 -5.591 1.00 0.00 H new ATOM 0 H1' DG A 7 5.700 -0.434 -5.994 1.00 0.00 H new ATOM 0 H8 DG A 7 3.206 -0.162 -6.519 1.00 0.00 H new ATOM 0 H1 DG A 7 1.578 -0.012 -0.373 1.00 0.00 H new ATOM 0 H21 DG A 7 5.019 -0.050 0.182 1.00 0.00 H new ATOM 0 H22 DG A 7 3.395 -0.016 0.878 1.00 0.00 H new ATOM 226 P DG A 8 8.851 3.028 -4.765 1.00 0.00 P ATOM 227 OP1 DG A 8 10.202 3.171 -5.345 1.00 0.00 O ATOM 228 OP2 DG A 8 8.513 3.735 -3.508 1.00 0.00 O ATOM 229 O5' DG A 8 7.765 3.440 -5.888 1.00 0.00 O ATOM 230 C5' DG A 8 7.945 3.031 -7.249 1.00 0.00 C ATOM 231 C4' DG A 8 6.721 3.323 -8.119 1.00 0.00 C ATOM 232 O4' DG A 8 5.507 2.875 -7.474 1.00 0.00 O ATOM 233 C3' DG A 8 6.592 4.815 -8.398 1.00 0.00 C ATOM 234 O3' DG A 8 6.602 5.066 -9.807 1.00 0.00 O ATOM 235 C2' DG A 8 5.252 5.229 -7.807 1.00 0.00 C ATOM 236 C1' DG A 8 4.528 3.938 -7.440 1.00 0.00 C ATOM 237 N9 DG A 8 3.938 4.052 -6.099 1.00 0.00 N ATOM 238 C8 DG A 8 4.558 4.063 -4.901 1.00 0.00 C ATOM 239 N7 DG A 8 3.818 4.036 -3.844 1.00 0.00 N ATOM 240 C5 DG A 8 2.535 4.028 -4.397 1.00 0.00 C ATOM 241 C6 DG A 8 1.273 4.012 -3.751 1.00 0.00 C ATOM 242 O6 DG A 8 1.047 3.954 -2.549 1.00 0.00 O ATOM 243 N1 DG A 8 0.228 4.031 -4.666 1.00 0.00 N ATOM 244 C2 DG A 8 0.377 4.058 -6.040 1.00 0.00 C ATOM 245 N2 DG A 8 -0.745 4.136 -6.758 1.00 0.00 N ATOM 246 N3 DG A 8 1.568 4.060 -6.656 1.00 0.00 N ATOM 247 C4 DG A 8 2.598 4.047 -5.780 1.00 0.00 C ATOM 0 H5' DG A 8 8.160 1.963 -7.278 1.00 0.00 H new ATOM 0 H5'' DG A 8 8.813 3.542 -7.666 1.00 0.00 H new ATOM 0 H4' DG A 8 6.861 2.784 -9.056 1.00 0.00 H new ATOM 0 H3' DG A 8 7.421 5.374 -7.964 1.00 0.00 H new ATOM 0 H2' DG A 8 5.393 5.859 -6.929 1.00 0.00 H new ATOM 0 H2'' DG A 8 4.673 5.809 -8.526 1.00 0.00 H new ATOM 0 H1' DG A 8 3.718 3.734 -8.140 1.00 0.00 H new ATOM 0 H8 DG A 8 5.635 4.093 -4.829 1.00 0.00 H new ATOM 0 H1 DG A 8 -0.722 4.025 -4.296 1.00 0.00 H new ATOM 0 H21 DG A 8 -0.698 4.159 -7.777 1.00 0.00 H new ATOM 0 H22 DG A 8 -1.650 4.172 -6.288 1.00 0.00 H new ATOM 259 P DC A 9 7.932 4.823 -10.681 1.00 0.00 P ATOM 260 OP1 DC A 9 9.045 4.496 -9.761 1.00 0.00 O ATOM 261 OP2 DC A 9 8.071 5.948 -11.631 1.00 0.00 O ATOM 262 O5' DC A 9 7.567 3.497 -11.515 1.00 0.00 O ATOM 263 C5' DC A 9 6.474 3.492 -12.440 1.00 0.00 C ATOM 264 C4' DC A 9 6.035 2.071 -12.769 1.00 0.00 C ATOM 265 O4' DC A 9 7.148 1.313 -13.311 1.00 0.00 O ATOM 266 C3' DC A 9 5.538 1.367 -11.511 1.00 0.00 C ATOM 267 O3' DC A 9 4.262 0.746 -11.736 1.00 0.00 O ATOM 268 C2' DC A 9 6.594 0.331 -11.203 1.00 0.00 C ATOM 269 C1' DC A 9 7.396 0.144 -12.501 1.00 0.00 C ATOM 270 N1 DC A 9 8.831 0.005 -12.180 1.00 0.00 N ATOM 271 C2 DC A 9 9.447 -1.205 -12.469 1.00 0.00 C ATOM 272 O2 DC A 9 8.819 -2.106 -13.020 1.00 0.00 O ATOM 273 N3 DC A 9 10.756 -1.357 -12.129 1.00 0.00 N ATOM 274 C4 DC A 9 11.432 -0.365 -11.532 1.00 0.00 C ATOM 275 N4 DC A 9 12.712 -0.548 -11.213 1.00 0.00 N ATOM 276 C5 DC A 9 10.801 0.882 -11.238 1.00 0.00 C ATOM 277 C6 DC A 9 9.507 1.022 -11.578 1.00 0.00 C ATOM 0 H5' DC A 9 6.767 4.006 -13.356 1.00 0.00 H new ATOM 0 H5'' DC A 9 5.635 4.046 -12.018 1.00 0.00 H new ATOM 0 H4' DC A 9 5.232 2.127 -13.504 1.00 0.00 H new ATOM 0 H3' DC A 9 5.393 2.064 -10.685 1.00 0.00 H new ATOM 0 H2' DC A 9 7.240 0.662 -10.390 1.00 0.00 H new ATOM 0 H2'' DC A 9 6.139 -0.608 -10.887 1.00 0.00 H new ATOM 0 H1' DC A 9 7.097 -0.756 -13.039 1.00 0.00 H new ATOM 0 H41 DC A 9 13.236 0.200 -10.759 1.00 0.00 H new ATOM 0 H42 DC A 9 13.168 -1.436 -11.423 1.00 0.00 H new ATOM 0 H5 DC A 9 11.343 1.684 -10.760 1.00 0.00 H new ATOM 0 H6 DC A 9 8.998 1.952 -11.371 1.00 0.00 H new ATOM 289 P DA A 10 3.274 0.388 -10.507 1.00 0.00 P ATOM 290 OP1 DA A 10 1.949 0.989 -10.785 1.00 0.00 O ATOM 291 OP2 DA A 10 3.966 0.702 -9.239 1.00 0.00 O ATOM 292 O5' DA A 10 3.133 -1.217 -10.616 1.00 0.00 O ATOM 293 C5' DA A 10 2.386 -1.819 -11.684 1.00 0.00 C ATOM 294 C4' DA A 10 1.620 -3.066 -11.230 1.00 0.00 C ATOM 295 O4' DA A 10 2.515 -4.070 -10.703 1.00 0.00 O ATOM 296 C3' DA A 10 0.615 -2.714 -10.150 1.00 0.00 C ATOM 297 O3' DA A 10 -0.656 -3.280 -10.449 1.00 0.00 O ATOM 298 C2' DA A 10 1.157 -3.298 -8.863 1.00 0.00 C ATOM 299 C1' DA A 10 2.302 -4.252 -9.286 1.00 0.00 C ATOM 300 N9 DA A 10 3.556 -3.950 -8.571 1.00 0.00 N ATOM 301 C8 DA A 10 4.166 -2.761 -8.370 1.00 0.00 C ATOM 302 N7 DA A 10 5.295 -2.765 -7.751 1.00 0.00 N ATOM 303 C5 DA A 10 5.472 -4.126 -7.500 1.00 0.00 C ATOM 304 C6 DA A 10 6.485 -4.842 -6.863 1.00 0.00 C ATOM 305 N6 DA A 10 7.550 -4.258 -6.322 1.00 0.00 N ATOM 306 N1 DA A 10 6.349 -6.179 -6.789 1.00 0.00 N ATOM 307 C2 DA A 10 5.276 -6.776 -7.311 1.00 0.00 C ATOM 308 N3 DA A 10 4.256 -6.193 -7.936 1.00 0.00 N ATOM 309 C4 DA A 10 4.418 -4.857 -7.997 1.00 0.00 C ATOM 0 H5' DA A 10 3.066 -2.088 -12.493 1.00 0.00 H new ATOM 0 H5'' DA A 10 1.683 -1.091 -12.087 1.00 0.00 H new ATOM 0 H4' DA A 10 1.107 -3.460 -12.107 1.00 0.00 H new ATOM 0 H3' DA A 10 0.479 -1.635 -10.074 1.00 0.00 H new ATOM 0 H2' DA A 10 1.525 -2.514 -8.201 1.00 0.00 H new ATOM 0 H2'' DA A 10 0.380 -3.835 -8.319 1.00 0.00 H new ATOM 0 H1' DA A 10 2.022 -5.277 -9.044 1.00 0.00 H new ATOM 0 H8 DA A 10 3.722 -1.840 -8.717 1.00 0.00 H new ATOM 0 H61 DA A 10 8.266 -4.824 -5.866 1.00 0.00 H new ATOM 0 H62 DA A 10 7.651 -3.244 -6.363 1.00 0.00 H new ATOM 0 H2 DA A 10 5.230 -7.851 -7.216 1.00 0.00 H new ATOM 321 P DG A 11 -1.980 -2.544 -9.932 1.00 0.00 P ATOM 322 OP1 DG A 11 -1.684 -1.968 -8.602 1.00 0.00 O ATOM 323 OP2 DG A 11 -3.125 -3.462 -10.108 1.00 0.00 O ATOM 324 O5' DG A 11 -2.117 -1.342 -10.986 1.00 0.00 O ATOM 325 C5' DG A 11 -2.372 -0.014 -10.535 1.00 0.00 C ATOM 326 C4' DG A 11 -3.839 0.174 -10.183 1.00 0.00 C ATOM 327 O4' DG A 11 -4.253 -0.703 -9.109 1.00 0.00 O ATOM 328 C3' DG A 11 -4.100 1.587 -9.720 1.00 0.00 C ATOM 329 O3' DG A 11 -4.499 2.431 -10.798 1.00 0.00 O ATOM 330 C2' DG A 11 -5.188 1.453 -8.695 1.00 0.00 C ATOM 331 C1' DG A 11 -5.167 0.006 -8.240 1.00 0.00 C ATOM 332 N9 DG A 11 -4.759 -0.067 -6.832 1.00 0.00 N ATOM 333 C8 DG A 11 -5.530 -0.146 -5.726 1.00 0.00 C ATOM 334 N7 DG A 11 -4.935 -0.150 -4.587 1.00 0.00 N ATOM 335 C5 DG A 11 -3.594 -0.065 -4.962 1.00 0.00 C ATOM 336 C6 DG A 11 -2.430 -0.029 -4.156 1.00 0.00 C ATOM 337 O6 DG A 11 -2.356 -0.067 -2.934 1.00 0.00 O ATOM 338 N1 DG A 11 -1.279 0.057 -4.926 1.00 0.00 N ATOM 339 C2 DG A 11 -1.251 0.105 -6.309 1.00 0.00 C ATOM 340 N2 DG A 11 -0.052 0.194 -6.881 1.00 0.00 N ATOM 341 N3 DG A 11 -2.346 0.073 -7.071 1.00 0.00 N ATOM 342 C4 DG A 11 -3.477 -0.013 -6.338 1.00 0.00 C ATOM 0 H5' DG A 11 -2.087 0.697 -11.310 1.00 0.00 H new ATOM 0 H5'' DG A 11 -1.755 0.201 -9.662 1.00 0.00 H new ATOM 0 H4' DG A 11 -4.400 -0.055 -11.089 1.00 0.00 H new ATOM 0 H3' DG A 11 -3.204 2.054 -9.311 1.00 0.00 H new ATOM 0 H2' DG A 11 -5.017 2.127 -7.856 1.00 0.00 H new ATOM 0 H2'' DG A 11 -6.157 1.713 -9.120 1.00 0.00 H new ATOM 0 H1' DG A 11 -6.155 -0.451 -8.305 1.00 0.00 H new ATOM 0 H8 DG A 11 -6.606 -0.204 -5.796 1.00 0.00 H new ATOM 0 H1 DG A 11 -0.385 0.087 -4.435 1.00 0.00 H new ATOM 0 H21 DG A 11 0.027 0.233 -7.897 1.00 0.00 H new ATOM 0 H22 DG A 11 0.788 0.224 -6.303 1.00 0.00 H new ATOM 354 P DG A 12 -4.307 4.024 -10.686 1.00 0.00 P ATOM 355 OP1 DG A 12 -4.286 4.580 -12.054 1.00 0.00 O ATOM 356 OP2 DG A 12 -3.182 4.298 -9.762 1.00 0.00 O ATOM 357 O5' DG A 12 -5.668 4.483 -9.964 1.00 0.00 O ATOM 358 C5' DG A 12 -6.923 3.909 -10.343 1.00 0.00 C ATOM 359 C4' DG A 12 -7.934 3.989 -9.206 1.00 0.00 C ATOM 360 O4' DG A 12 -7.422 3.364 -8.002 1.00 0.00 O ATOM 361 C3' DG A 12 -8.226 5.438 -8.890 1.00 0.00 C ATOM 362 O3' DG A 12 -9.636 5.672 -8.847 1.00 0.00 O ATOM 363 C2' DG A 12 -7.589 5.690 -7.550 1.00 0.00 C ATOM 364 C1' DG A 12 -7.306 4.342 -6.941 1.00 0.00 C ATOM 365 N9 DG A 12 -5.957 4.340 -6.361 1.00 0.00 N ATOM 366 C8 DG A 12 -4.773 4.440 -6.991 1.00 0.00 C ATOM 367 N7 DG A 12 -3.698 4.399 -6.270 1.00 0.00 N ATOM 368 C5 DG A 12 -4.231 4.261 -4.982 1.00 0.00 C ATOM 369 C6 DG A 12 -3.571 4.161 -3.726 1.00 0.00 C ATOM 370 O6 DG A 12 -2.360 4.147 -3.503 1.00 0.00 O ATOM 371 N1 DG A 12 -4.482 4.046 -2.680 1.00 0.00 N ATOM 372 C2 DG A 12 -5.861 4.028 -2.824 1.00 0.00 C ATOM 373 N2 DG A 12 -6.581 3.955 -1.706 1.00 0.00 N ATOM 374 N3 DG A 12 -6.483 4.112 -4.001 1.00 0.00 N ATOM 375 C4 DG A 12 -5.618 4.227 -5.032 1.00 0.00 C ATOM 0 H5' DG A 12 -6.777 2.868 -10.630 1.00 0.00 H new ATOM 0 H5'' DG A 12 -7.314 4.429 -11.217 1.00 0.00 H new ATOM 0 H4' DG A 12 -8.836 3.469 -9.527 1.00 0.00 H new ATOM 0 H3' DG A 12 -7.830 6.110 -9.652 1.00 0.00 H new ATOM 0 H2' DG A 12 -6.669 6.264 -7.661 1.00 0.00 H new ATOM 0 H2'' DG A 12 -8.253 6.272 -6.910 1.00 0.00 H new ATOM 0 H1' DG A 12 -8.008 4.107 -6.141 1.00 0.00 H new ATOM 0 H8 DG A 12 -4.720 4.551 -8.064 1.00 0.00 H new ATOM 0 H1 DG A 12 -4.106 3.969 -1.735 1.00 0.00 H new ATOM 0 H21 DG A 12 -7.600 3.939 -1.756 1.00 0.00 H new ATOM 0 H22 DG A 12 -6.114 3.915 -0.800 1.00 0.00 H new ATOM 387 P DG A 13 -10.237 7.139 -9.120 1.00 0.00 P ATOM 388 OP1 DG A 13 -11.689 7.000 -9.370 1.00 0.00 O ATOM 389 OP2 DG A 13 -9.382 7.827 -10.112 1.00 0.00 O ATOM 390 O5' DG A 13 -10.037 7.869 -7.703 1.00 0.00 O ATOM 391 C5' DG A 13 -10.666 7.364 -6.523 1.00 0.00 C ATOM 392 C4' DG A 13 -10.124 8.055 -5.278 1.00 0.00 C ATOM 393 O4' DG A 13 -8.688 7.907 -5.198 1.00 0.00 O ATOM 394 C3' DG A 13 -10.428 9.541 -5.321 1.00 0.00 C ATOM 395 O3' DG A 13 -10.824 9.990 -4.020 1.00 0.00 O ATOM 396 C2' DG A 13 -9.145 10.182 -5.764 1.00 0.00 C ATOM 397 C1' DG A 13 -8.049 9.191 -5.382 1.00 0.00 C ATOM 398 N9 DG A 13 -6.964 9.087 -6.397 1.00 0.00 N ATOM 399 C8 DG A 13 -6.970 9.303 -7.750 1.00 0.00 C ATOM 400 N7 DG A 13 -5.862 9.129 -8.386 1.00 0.00 N ATOM 401 C5 DG A 13 -4.995 8.749 -7.360 1.00 0.00 C ATOM 402 C6 DG A 13 -3.616 8.415 -7.417 1.00 0.00 C ATOM 403 O6 DG A 13 -2.879 8.389 -8.398 1.00 0.00 O ATOM 404 N1 DG A 13 -3.117 8.092 -6.166 1.00 0.00 N ATOM 405 C2 DG A 13 -3.844 8.083 -4.997 1.00 0.00 C ATOM 406 N2 DG A 13 -3.181 7.735 -3.899 1.00 0.00 N ATOM 407 N3 DG A 13 -5.143 8.394 -4.930 1.00 0.00 N ATOM 408 C4 DG A 13 -5.657 8.719 -6.142 1.00 0.00 C ATOM 0 H5' DG A 13 -10.499 6.289 -6.449 1.00 0.00 H new ATOM 0 H5'' DG A 13 -11.744 7.515 -6.588 1.00 0.00 H new ATOM 0 H4' DG A 13 -10.602 7.592 -4.414 1.00 0.00 H new ATOM 0 H3' DG A 13 -11.247 9.792 -5.996 1.00 0.00 H new ATOM 0 H2' DG A 13 -9.149 10.370 -6.838 1.00 0.00 H new ATOM 0 H2'' DG A 13 -8.995 11.143 -5.273 1.00 0.00 H new ATOM 0 H1' DG A 13 -7.561 9.540 -4.472 1.00 0.00 H new ATOM 0 H8 DG A 13 -7.869 9.608 -8.265 1.00 0.00 H new ATOM 0 H1 DG A 13 -2.130 7.840 -6.106 1.00 0.00 H new ATOM 0 H21 DG A 13 -3.662 7.708 -3.000 1.00 0.00 H new ATOM 0 H22 DG A 13 -2.191 7.495 -3.956 1.00 0.00 H new ATOM 420 P DT A 14 -10.901 11.550 -3.624 1.00 0.00 P ATOM 421 OP1 DT A 14 -12.325 11.921 -3.498 1.00 0.00 O ATOM 422 OP2 DT A 14 -10.012 12.325 -4.521 1.00 0.00 O ATOM 423 O5' DT A 14 -10.245 11.546 -2.157 1.00 0.00 O ATOM 424 C5' DT A 14 -10.442 10.427 -1.285 1.00 0.00 C ATOM 425 C4' DT A 14 -9.145 10.018 -0.600 1.00 0.00 C ATOM 426 O4' DT A 14 -8.134 9.660 -1.569 1.00 0.00 O ATOM 427 C3' DT A 14 -8.603 11.160 0.243 1.00 0.00 C ATOM 428 O3' DT A 14 -8.675 10.837 1.634 1.00 0.00 O ATOM 429 C2' DT A 14 -7.182 11.367 -0.209 1.00 0.00 C ATOM 430 C1' DT A 14 -6.885 10.297 -1.229 1.00 0.00 C ATOM 431 N1 DT A 14 -6.256 10.892 -2.412 1.00 0.00 N ATOM 432 C2 DT A 14 -5.039 10.392 -2.820 1.00 0.00 C ATOM 433 O2 DT A 14 -4.461 9.498 -2.212 1.00 0.00 O ATOM 434 N3 DT A 14 -4.500 10.966 -3.950 1.00 0.00 N ATOM 435 C4 DT A 14 -5.066 11.982 -4.697 1.00 0.00 C ATOM 436 O4 DT A 14 -4.496 12.416 -5.694 1.00 0.00 O ATOM 437 C5 DT A 14 -6.340 12.443 -4.189 1.00 0.00 C ATOM 438 C7 DT A 14 -7.093 13.543 -4.936 1.00 0.00 C ATOM 439 C6 DT A 14 -6.878 11.895 -3.080 1.00 0.00 C ATOM 0 H5' DT A 14 -10.835 9.585 -1.855 1.00 0.00 H new ATOM 0 H5'' DT A 14 -11.189 10.678 -0.532 1.00 0.00 H new ATOM 0 H4' DT A 14 -9.373 9.158 0.030 1.00 0.00 H new ATOM 0 H3' DT A 14 -9.186 12.072 0.115 1.00 0.00 H new ATOM 0 H2' DT A 14 -7.056 12.359 -0.642 1.00 0.00 H new ATOM 0 H2'' DT A 14 -6.495 11.298 0.634 1.00 0.00 H new ATOM 0 H1' DT A 14 -6.191 9.559 -0.828 1.00 0.00 H new ATOM 0 H3 DT A 14 -3.599 10.608 -4.265 1.00 0.00 H new ATOM 0 H71 DT A 14 -6.379 14.197 -5.437 1.00 0.00 H new ATOM 0 H72 DT A 14 -7.754 13.093 -5.676 1.00 0.00 H new ATOM 0 H73 DT A 14 -7.683 14.125 -4.228 1.00 0.00 H new ATOM 0 H6 DT A 14 -7.826 12.263 -2.716 1.00 0.00 H new ATOM 452 P DT A 15 -8.143 11.864 2.752 1.00 0.00 P ATOM 453 OP1 DT A 15 -8.598 11.384 4.076 1.00 0.00 O ATOM 454 OP2 DT A 15 -8.466 13.238 2.314 1.00 0.00 O ATOM 455 O5' DT A 15 -6.547 11.679 2.668 1.00 0.00 O ATOM 456 C5' DT A 15 -5.965 10.375 2.738 1.00 0.00 C ATOM 457 C4' DT A 15 -4.456 10.417 2.512 1.00 0.00 C ATOM 458 O4' DT A 15 -4.128 11.327 1.436 1.00 0.00 O ATOM 459 C3' DT A 15 -3.743 10.894 3.760 1.00 0.00 C ATOM 460 O3' DT A 15 -2.588 10.090 4.014 1.00 0.00 O ATOM 461 C2' DT A 15 -3.336 12.314 3.449 1.00 0.00 C ATOM 462 C1' DT A 15 -3.328 12.417 1.942 1.00 0.00 C ATOM 463 N1 DT A 15 -3.854 13.720 1.501 1.00 0.00 N ATOM 464 C2 DT A 15 -3.041 14.522 0.719 1.00 0.00 C ATOM 465 O2 DT A 15 -1.902 14.194 0.392 1.00 0.00 O ATOM 466 N3 DT A 15 -3.582 15.733 0.331 1.00 0.00 N ATOM 467 C4 DT A 15 -4.842 16.203 0.652 1.00 0.00 C ATOM 468 O4 DT A 15 -5.220 17.302 0.254 1.00 0.00 O ATOM 469 C5 DT A 15 -5.615 15.297 1.473 1.00 0.00 C ATOM 470 C7 DT A 15 -7.025 15.693 1.907 1.00 0.00 C ATOM 471 C6 DT A 15 -5.107 14.109 1.863 1.00 0.00 C ATOM 0 H5' DT A 15 -6.427 9.730 1.991 1.00 0.00 H new ATOM 0 H5'' DT A 15 -6.175 9.935 3.713 1.00 0.00 H new ATOM 0 H4' DT A 15 -4.135 9.406 2.260 1.00 0.00 H new ATOM 0 H3' DT A 15 -4.374 10.828 4.647 1.00 0.00 H new ATOM 0 H2' DT A 15 -4.036 13.026 3.886 1.00 0.00 H new ATOM 0 H2'' DT A 15 -2.353 12.539 3.862 1.00 0.00 H new ATOM 0 H1' DT A 15 -2.311 12.349 1.556 1.00 0.00 H new ATOM 0 H3 DT A 15 -2.997 16.337 -0.246 1.00 0.00 H new ATOM 0 H71 DT A 15 -7.087 16.778 1.996 1.00 0.00 H new ATOM 0 H72 DT A 15 -7.745 15.348 1.165 1.00 0.00 H new ATOM 0 H73 DT A 15 -7.251 15.236 2.871 1.00 0.00 H new ATOM 0 H6 DT A 15 -5.708 13.453 2.475 1.00 0.00 H new ATOM 484 P DT A 16 -2.633 8.858 5.051 1.00 0.00 P ATOM 485 OP1 DT A 16 -3.571 7.836 4.539 1.00 0.00 O ATOM 486 OP2 DT A 16 -2.815 9.406 6.415 1.00 0.00 O ATOM 487 O5' DT A 16 -1.131 8.287 4.941 1.00 0.00 O ATOM 488 C5' DT A 16 -0.827 6.945 4.517 1.00 0.00 C ATOM 489 C4' DT A 16 -0.827 6.789 2.990 1.00 0.00 C ATOM 490 O4' DT A 16 -2.105 6.351 2.476 1.00 0.00 O ATOM 491 C3' DT A 16 -0.480 8.102 2.299 1.00 0.00 C ATOM 492 O3' DT A 16 0.712 7.963 1.510 1.00 0.00 O ATOM 493 C2' DT A 16 -1.677 8.405 1.435 1.00 0.00 C ATOM 494 C1' DT A 16 -2.393 7.096 1.280 1.00 0.00 C ATOM 495 N1 DT A 16 -3.839 7.277 1.088 1.00 0.00 N ATOM 496 C2 DT A 16 -4.335 7.283 -0.203 1.00 0.00 C ATOM 497 O2 DT A 16 -3.606 7.226 -1.189 1.00 0.00 O ATOM 498 N3 DT A 16 -5.707 7.367 -0.320 1.00 0.00 N ATOM 499 C4 DT A 16 -6.610 7.437 0.726 1.00 0.00 C ATOM 500 O4 DT A 16 -7.815 7.517 0.508 1.00 0.00 O ATOM 501 C5 DT A 16 -5.994 7.425 2.034 1.00 0.00 C ATOM 502 C7 DT A 16 -6.879 7.412 3.280 1.00 0.00 C ATOM 503 C6 DT A 16 -4.653 7.364 2.163 1.00 0.00 C ATOM 0 H5' DT A 16 -1.556 6.259 4.948 1.00 0.00 H new ATOM 0 H5'' DT A 16 0.150 6.658 4.907 1.00 0.00 H new ATOM 0 H4' DT A 16 -0.073 6.031 2.777 1.00 0.00 H new ATOM 0 H3' DT A 16 -0.277 8.904 3.008 1.00 0.00 H new ATOM 0 H2' DT A 16 -2.319 9.152 1.901 1.00 0.00 H new ATOM 0 H2'' DT A 16 -1.373 8.804 0.467 1.00 0.00 H new ATOM 0 H1' DT A 16 -2.054 6.567 0.389 1.00 0.00 H new ATOM 0 H3 DT A 16 -6.091 7.379 -1.265 1.00 0.00 H new ATOM 0 H71 DT A 16 -7.816 7.927 3.066 1.00 0.00 H new ATOM 0 H72 DT A 16 -7.088 6.381 3.567 1.00 0.00 H new ATOM 0 H73 DT A 16 -6.365 7.918 4.097 1.00 0.00 H new ATOM 0 H6 DT A 16 -4.218 7.385 3.151 1.00 0.00 H new ATOM 516 P DT A 17 1.762 9.177 1.385 1.00 0.00 P ATOM 517 OP1 DT A 17 2.016 9.712 2.743 1.00 0.00 O ATOM 518 OP2 DT A 17 1.285 10.084 0.312 1.00 0.00 O ATOM 519 O5' DT A 17 3.108 8.437 0.870 1.00 0.00 O ATOM 520 C5' DT A 17 3.978 7.758 1.793 1.00 0.00 C ATOM 521 C4' DT A 17 5.079 6.968 1.075 1.00 0.00 C ATOM 522 O4' DT A 17 4.501 6.072 0.101 1.00 0.00 O ATOM 523 C3' DT A 17 6.031 7.896 0.329 1.00 0.00 C ATOM 524 O3' DT A 17 7.390 7.450 0.440 1.00 0.00 O ATOM 525 C2' DT A 17 5.595 7.816 -1.103 1.00 0.00 C ATOM 526 C1' DT A 17 4.857 6.498 -1.235 1.00 0.00 C ATOM 527 N1 DT A 17 3.662 6.656 -2.075 1.00 0.00 N ATOM 528 C2 DT A 17 3.849 6.843 -3.436 1.00 0.00 C ATOM 529 O2 DT A 17 4.965 6.829 -3.960 1.00 0.00 O ATOM 530 N3 DT A 17 2.703 7.025 -4.181 1.00 0.00 N ATOM 531 C4 DT A 17 1.410 7.034 -3.695 1.00 0.00 C ATOM 532 O4 DT A 17 0.459 7.195 -4.456 1.00 0.00 O ATOM 533 C5 DT A 17 1.314 6.828 -2.266 1.00 0.00 C ATOM 534 C7 DT A 17 -0.056 6.818 -1.600 1.00 0.00 C ATOM 535 C6 DT A 17 2.417 6.647 -1.515 1.00 0.00 C ATOM 0 H5' DT A 17 3.391 7.080 2.412 1.00 0.00 H new ATOM 0 H5'' DT A 17 4.434 8.487 2.463 1.00 0.00 H new ATOM 0 H4' DT A 17 5.622 6.414 1.840 1.00 0.00 H new ATOM 0 H3' DT A 17 5.998 8.908 0.733 1.00 0.00 H new ATOM 0 H2' DT A 17 4.948 8.654 -1.363 1.00 0.00 H new ATOM 0 H2'' DT A 17 6.452 7.854 -1.776 1.00 0.00 H new ATOM 0 H1' DT A 17 5.486 5.749 -1.717 1.00 0.00 H new ATOM 0 H3 DT A 17 2.821 7.166 -5.184 1.00 0.00 H new ATOM 0 H71 DT A 17 -0.031 6.166 -0.727 1.00 0.00 H new ATOM 0 H72 DT A 17 -0.317 7.830 -1.290 1.00 0.00 H new ATOM 0 H73 DT A 17 -0.801 6.451 -2.306 1.00 0.00 H new ATOM 0 H6 DT A 17 2.315 6.492 -0.451 1.00 0.00 H new ATOM 548 P DG A 18 8.254 7.670 1.777 1.00 0.00 P ATOM 549 OP1 DG A 18 7.918 8.998 2.340 1.00 0.00 O ATOM 550 OP2 DG A 18 9.662 7.333 1.466 1.00 0.00 O ATOM 551 O5' DG A 18 7.676 6.535 2.769 1.00 0.00 O ATOM 552 C5' DG A 18 8.079 5.155 2.668 1.00 0.00 C ATOM 553 C4' DG A 18 7.514 4.339 3.830 1.00 0.00 C ATOM 554 O4' DG A 18 6.091 4.567 3.946 1.00 0.00 O ATOM 555 C3' DG A 18 7.736 2.839 3.620 1.00 0.00 C ATOM 556 O3' DG A 18 8.421 2.240 4.740 1.00 0.00 O ATOM 557 C2' DG A 18 6.361 2.259 3.474 1.00 0.00 C ATOM 558 C1' DG A 18 5.404 3.308 3.986 1.00 0.00 C ATOM 559 N9 DG A 18 4.159 3.337 3.207 1.00 0.00 N ATOM 560 C8 DG A 18 2.901 3.381 3.674 1.00 0.00 C ATOM 561 N7 DG A 18 1.943 3.426 2.825 1.00 0.00 N ATOM 562 C5 DG A 18 2.631 3.411 1.616 1.00 0.00 C ATOM 563 C6 DG A 18 2.119 3.446 0.300 1.00 0.00 C ATOM 564 O6 DG A 18 0.943 3.493 -0.045 1.00 0.00 O ATOM 565 N1 DG A 18 3.134 3.421 -0.646 1.00 0.00 N ATOM 566 C2 DG A 18 4.490 3.363 -0.354 1.00 0.00 C ATOM 567 N2 DG A 18 5.327 3.359 -1.393 1.00 0.00 N ATOM 568 N3 DG A 18 4.981 3.323 0.895 1.00 0.00 N ATOM 569 C4 DG A 18 3.999 3.353 1.830 1.00 0.00 C ATOM 0 H5' DG A 18 9.167 5.088 2.666 1.00 0.00 H new ATOM 0 H5'' DG A 18 7.732 4.738 1.722 1.00 0.00 H new ATOM 0 H4' DG A 18 8.033 4.658 4.734 1.00 0.00 H new ATOM 0 H3' DG A 18 8.363 2.649 2.749 1.00 0.00 H new ATOM 0 H2' DG A 18 6.150 2.015 2.433 1.00 0.00 H new ATOM 0 H2'' DG A 18 6.266 1.335 4.044 1.00 0.00 H new ATOM 0 H1' DG A 18 5.102 3.078 5.008 1.00 0.00 H new ATOM 0 H8 DG A 18 2.702 3.379 4.736 1.00 0.00 H new ATOM 0 H1 DG A 18 2.864 3.447 -1.629 1.00 0.00 H new ATOM 0 H21 DG A 18 6.334 3.318 -1.236 1.00 0.00 H new ATOM 0 H22 DG A 18 4.960 3.397 -2.344 1.00 0.00 H new ATOM 581 P DG A 19 8.502 0.628 4.911 1.00 0.00 P ATOM 582 OP1 DG A 19 9.590 0.317 5.862 1.00 0.00 O ATOM 583 OP2 DG A 19 8.505 0.022 3.560 1.00 0.00 O ATOM 584 O5' DG A 19 7.097 0.280 5.611 1.00 0.00 O ATOM 585 C5' DG A 19 6.849 0.657 6.966 1.00 0.00 C ATOM 586 C4' DG A 19 5.453 0.244 7.413 1.00 0.00 C ATOM 587 O4' DG A 19 4.448 0.720 6.490 1.00 0.00 O ATOM 588 C3' DG A 19 5.341 -1.269 7.468 1.00 0.00 C ATOM 589 O3' DG A 19 5.291 -1.745 8.813 1.00 0.00 O ATOM 590 C2' DG A 19 4.079 -1.610 6.732 1.00 0.00 C ATOM 591 C1' DG A 19 3.470 -0.318 6.277 1.00 0.00 C ATOM 592 N9 DG A 19 3.094 -0.445 4.870 1.00 0.00 N ATOM 593 C8 DG A 19 3.881 -0.594 3.789 1.00 0.00 C ATOM 594 N7 DG A 19 3.304 -0.695 2.641 1.00 0.00 N ATOM 595 C5 DG A 19 1.956 -0.618 2.997 1.00 0.00 C ATOM 596 C6 DG A 19 0.795 -0.678 2.186 1.00 0.00 C ATOM 597 O6 DG A 19 0.725 -0.798 0.967 1.00 0.00 O ATOM 598 N1 DG A 19 -0.362 -0.579 2.945 1.00 0.00 N ATOM 599 C2 DG A 19 -0.400 -0.437 4.317 1.00 0.00 C ATOM 600 N2 DG A 19 -1.606 -0.429 4.877 1.00 0.00 N ATOM 601 N3 DG A 19 0.691 -0.370 5.084 1.00 0.00 N ATOM 602 C4 DG A 19 1.824 -0.468 4.364 1.00 0.00 C ATOM 0 H5' DG A 19 6.962 1.736 7.071 1.00 0.00 H new ATOM 0 H5'' DG A 19 7.592 0.194 7.615 1.00 0.00 H new ATOM 0 H4' DG A 19 5.291 0.680 8.399 1.00 0.00 H new ATOM 0 H3' DG A 19 6.213 -1.743 7.017 1.00 0.00 H new ATOM 0 H2' DG A 19 4.293 -2.256 5.880 1.00 0.00 H new ATOM 0 H2'' DG A 19 3.391 -2.153 7.379 1.00 0.00 H new ATOM 0 H1' DG A 19 2.567 -0.068 6.835 1.00 0.00 H new ATOM 0 H8 DG A 19 4.957 -0.628 3.880 1.00 0.00 H new ATOM 0 H1 DG A 19 -1.254 -0.614 2.451 1.00 0.00 H new ATOM 0 H21 DG A 19 -1.698 -0.327 5.888 1.00 0.00 H new ATOM 0 H22 DG A 19 -2.439 -0.525 4.296 1.00 0.00 H new ATOM 614 P DT A 20 5.241 -3.327 9.107 1.00 0.00 P ATOM 615 OP1 DT A 20 5.489 -3.533 10.547 1.00 0.00 O ATOM 616 OP2 DT A 20 6.093 -4.013 8.108 1.00 0.00 O ATOM 617 O5' DT A 20 3.700 -3.700 8.796 1.00 0.00 O ATOM 618 C5' DT A 20 2.654 -3.287 9.686 1.00 0.00 C ATOM 619 C4' DT A 20 1.295 -3.873 9.293 1.00 0.00 C ATOM 620 O4' DT A 20 0.887 -3.417 7.984 1.00 0.00 O ATOM 621 C3' DT A 20 1.338 -5.395 9.273 1.00 0.00 C ATOM 622 O3' DT A 20 0.577 -5.942 10.355 1.00 0.00 O ATOM 623 C2' DT A 20 0.762 -5.810 7.942 1.00 0.00 C ATOM 624 C1' DT A 20 0.485 -4.537 7.162 1.00 0.00 C ATOM 625 N1 DT A 20 1.216 -4.524 5.877 1.00 0.00 N ATOM 626 C2 DT A 20 0.474 -4.396 4.713 1.00 0.00 C ATOM 627 O2 DT A 20 -0.758 -4.352 4.714 1.00 0.00 O ATOM 628 N3 DT A 20 1.199 -4.337 3.537 1.00 0.00 N ATOM 629 C4 DT A 20 2.577 -4.399 3.422 1.00 0.00 C ATOM 630 O4 DT A 20 3.119 -4.313 2.322 1.00 0.00 O ATOM 631 C5 DT A 20 3.268 -4.543 4.684 1.00 0.00 C ATOM 632 C7 DT A 20 4.790 -4.670 4.694 1.00 0.00 C ATOM 633 C6 DT A 20 2.585 -4.598 5.847 1.00 0.00 C ATOM 0 H5' DT A 20 2.591 -2.199 9.690 1.00 0.00 H new ATOM 0 H5'' DT A 20 2.901 -3.596 10.702 1.00 0.00 H new ATOM 0 H4' DT A 20 0.579 -3.533 10.041 1.00 0.00 H new ATOM 0 H3' DT A 20 2.356 -5.765 9.395 1.00 0.00 H new ATOM 0 H2' DT A 20 1.461 -6.449 7.402 1.00 0.00 H new ATOM 0 H2'' DT A 20 -0.154 -6.385 8.080 1.00 0.00 H new ATOM 0 HO3' DT A 20 0.617 -6.921 10.321 1.00 0.00 H new ATOM 0 H1' DT A 20 -0.577 -4.476 6.925 1.00 0.00 H new ATOM 0 H3 DT A 20 0.668 -4.238 2.672 1.00 0.00 H new ATOM 0 H71 DT A 20 5.184 -4.250 5.619 1.00 0.00 H new ATOM 0 H72 DT A 20 5.068 -5.722 4.626 1.00 0.00 H new ATOM 0 H73 DT A 20 5.206 -4.129 3.844 1.00 0.00 H new ATOM 0 H6 DT A 20 3.129 -4.703 6.774 1.00 0.00 H new TER 647 DT A 20