USER MOD reduce.3.24.130724 H: found=0, std=0, add=260, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 258 hydrogens (11 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 NoAdj-H: A 23 PIQ HN2 : A 23 PIQ N : A 6 DG C8 :(H bumps) USER MOD NoAdj-H: A 23 PIQ HN1 : A 23 PIQ N : A 6 DG C8 :(H bumps) USER MOD Single : A 1 DC O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.91 (180deg=-1.91) USER MOD Single : A 8 DT C7 :methyl 150:sc= -2.44 (180deg=-2.44) USER MOD Single : A 11 DC O3' : rot 180:sc= 0 USER MOD Single : B 12 DG O5' : rot 180:sc= 0 USER MOD Single : B 14 DT C7 :methyl -30:sc= -3.32! (180deg=-5.38!) USER MOD Single : B 20 DT C7 :methyl 150:sc= -1.53 (180deg=-1.53) USER MOD Single : B 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -10.504 12.131 -6.441 1.00 0.00 O ATOM 2 C5' DC A 1 -9.321 12.695 -5.846 1.00 0.00 C ATOM 3 C4' DC A 1 -8.126 12.447 -6.738 1.00 0.00 C ATOM 4 O4' DC A 1 -6.931 13.002 -6.120 1.00 0.00 O ATOM 5 C3' DC A 1 -7.757 10.986 -6.973 1.00 0.00 C ATOM 6 O3' DC A 1 -7.200 10.873 -8.285 1.00 0.00 O ATOM 7 C2' DC A 1 -6.662 10.662 -5.961 1.00 0.00 C ATOM 8 C1' DC A 1 -5.951 12.002 -5.880 1.00 0.00 C ATOM 9 N1 DC A 1 -5.378 12.254 -4.561 1.00 0.00 N ATOM 10 C2 DC A 1 -4.082 12.686 -4.436 1.00 0.00 C ATOM 11 O2 DC A 1 -3.381 12.868 -5.466 1.00 0.00 O ATOM 12 N3 DC A 1 -3.541 12.920 -3.267 1.00 0.00 N ATOM 13 C4 DC A 1 -4.293 12.727 -2.137 1.00 0.00 C ATOM 14 N4 DC A 1 -3.716 12.972 -0.965 1.00 0.00 N ATOM 15 C5 DC A 1 -5.648 12.277 -2.214 1.00 0.00 C ATOM 16 C6 DC A 1 -6.139 12.057 -3.452 1.00 0.00 C ATOM 0 H5' DC A 1 -9.151 12.252 -4.865 1.00 0.00 H new ATOM 0 H5'' DC A 1 -9.456 13.766 -5.694 1.00 0.00 H new ATOM 0 H4' DC A 1 -8.425 12.900 -7.683 1.00 0.00 H new ATOM 0 H3' DC A 1 -8.617 10.324 -6.873 1.00 0.00 H new ATOM 0 H2' DC A 1 -7.067 10.349 -4.999 1.00 0.00 H new ATOM 0 H2'' DC A 1 -6.004 9.864 -6.304 1.00 0.00 H new ATOM 0 HO5' DC A 1 -11.274 12.294 -5.857 1.00 0.00 H new ATOM 0 H1' DC A 1 -5.137 12.008 -6.605 1.00 0.00 H new ATOM 0 H41 DC A 1 -4.241 12.841 -0.101 1.00 0.00 H new ATOM 0 H42 DC A 1 -2.748 13.291 -0.930 1.00 0.00 H new ATOM 0 H5 DC A 1 -6.247 12.121 -1.329 1.00 0.00 H new ATOM 0 H6 DC A 1 -7.158 11.717 -3.564 1.00 0.00 H new ATOM 29 P DC A 2 -6.791 9.451 -8.893 1.00 0.00 P ATOM 30 OP1 DC A 2 -7.376 9.302 -10.245 1.00 0.00 O ATOM 31 OP2 DC A 2 -7.300 8.371 -8.018 1.00 0.00 O ATOM 32 O5' DC A 2 -5.195 9.558 -8.903 1.00 0.00 O ATOM 33 C5' DC A 2 -4.518 10.535 -9.716 1.00 0.00 C ATOM 34 C4' DC A 2 -3.048 10.200 -9.810 1.00 0.00 C ATOM 35 O4' DC A 2 -2.369 10.632 -8.598 1.00 0.00 O ATOM 36 C3' DC A 2 -2.702 8.718 -9.896 1.00 0.00 C ATOM 37 O3' DC A 2 -1.502 8.582 -10.661 1.00 0.00 O ATOM 38 C2' DC A 2 -2.410 8.276 -8.466 1.00 0.00 C ATOM 39 C1' DC A 2 -1.781 9.541 -7.906 1.00 0.00 C ATOM 40 N1 DC A 2 -2.056 9.719 -6.483 1.00 0.00 N ATOM 41 C2 DC A 2 -1.054 10.085 -5.620 1.00 0.00 C ATOM 42 O2 DC A 2 0.112 10.268 -6.059 1.00 0.00 O ATOM 43 N3 DC A 2 -1.270 10.252 -4.339 1.00 0.00 N ATOM 44 C4 DC A 2 -2.535 10.056 -3.851 1.00 0.00 C ATOM 45 N4 DC A 2 -2.724 10.235 -2.546 1.00 0.00 N ATOM 46 C5 DC A 2 -3.614 9.675 -4.707 1.00 0.00 C ATOM 47 C6 DC A 2 -3.317 9.520 -6.015 1.00 0.00 C ATOM 0 H5' DC A 2 -4.646 11.529 -9.287 1.00 0.00 H new ATOM 0 H5'' DC A 2 -4.958 10.559 -10.713 1.00 0.00 H new ATOM 0 H4' DC A 2 -2.742 10.697 -10.730 1.00 0.00 H new ATOM 0 H3' DC A 2 -3.501 8.134 -10.352 1.00 0.00 H new ATOM 0 H2' DC A 2 -3.314 7.990 -7.928 1.00 0.00 H new ATOM 0 H2'' DC A 2 -1.732 7.424 -8.426 1.00 0.00 H new ATOM 0 H1' DC A 2 -0.700 9.479 -8.032 1.00 0.00 H new ATOM 0 H41 DC A 2 -3.651 10.099 -2.142 1.00 0.00 H new ATOM 0 H42 DC A 2 -1.942 10.508 -1.950 1.00 0.00 H new ATOM 0 H5 DC A 2 -4.613 9.519 -4.328 1.00 0.00 H new ATOM 0 H6 DC A 2 -4.097 9.232 -6.704 1.00 0.00 H new ATOM 59 P DA A 3 -0.896 7.142 -11.009 1.00 0.00 P ATOM 60 OP1 DA A 3 -0.562 7.080 -12.450 1.00 0.00 O ATOM 61 OP2 DA A 3 -1.892 6.095 -10.691 1.00 0.00 O ATOM 62 O5' DA A 3 0.390 7.104 -10.058 1.00 0.00 O ATOM 63 C5' DA A 3 1.397 8.130 -10.123 1.00 0.00 C ATOM 64 C4' DA A 3 2.551 7.781 -9.213 1.00 0.00 C ATOM 65 O4' DA A 3 2.248 8.211 -7.856 1.00 0.00 O ATOM 66 C3' DA A 3 2.855 6.295 -9.059 1.00 0.00 C ATOM 67 O3' DA A 3 4.277 6.138 -9.035 1.00 0.00 O ATOM 68 C2' DA A 3 2.312 5.859 -7.703 1.00 0.00 C ATOM 69 C1' DA A 3 2.432 7.158 -6.921 1.00 0.00 C ATOM 70 N9 DA A 3 1.403 7.292 -5.894 1.00 0.00 N ATOM 71 C8 DA A 3 0.065 7.080 -6.004 1.00 0.00 C ATOM 72 N7 DA A 3 -0.592 7.293 -4.868 1.00 0.00 N ATOM 73 C5 DA A 3 0.394 7.666 -3.977 1.00 0.00 C ATOM 74 C6 DA A 3 0.349 8.024 -2.615 1.00 0.00 C ATOM 75 N6 DA A 3 -0.772 8.062 -1.901 1.00 0.00 N ATOM 76 N1 DA A 3 1.530 8.345 -2.020 1.00 0.00 N ATOM 77 C2 DA A 3 2.675 8.300 -2.770 1.00 0.00 C ATOM 78 N3 DA A 3 2.824 7.986 -4.023 1.00 0.00 N ATOM 79 C4 DA A 3 1.634 7.674 -4.580 1.00 0.00 C ATOM 0 H5' DA A 3 0.970 9.089 -9.830 1.00 0.00 H new ATOM 0 H5'' DA A 3 1.752 8.238 -11.148 1.00 0.00 H new ATOM 0 H4' DA A 3 3.400 8.274 -9.687 1.00 0.00 H new ATOM 0 H3' DA A 3 2.414 5.713 -9.869 1.00 0.00 H new ATOM 0 H2' DA A 3 1.283 5.506 -7.764 1.00 0.00 H new ATOM 0 H2'' DA A 3 2.900 5.054 -7.261 1.00 0.00 H new ATOM 0 H1' DA A 3 3.401 7.180 -6.423 1.00 0.00 H new ATOM 0 H8 DA A 3 -0.415 6.770 -6.920 1.00 0.00 H new ATOM 0 H61 DA A 3 -0.741 8.329 -0.917 1.00 0.00 H new ATOM 0 H62 DA A 3 -1.663 7.824 -2.337 1.00 0.00 H new ATOM 0 H2 DA A 3 3.583 8.562 -2.247 1.00 0.00 H new ATOM 91 P DT A 4 4.950 4.702 -8.817 1.00 0.00 P ATOM 92 OP1 DT A 4 6.027 4.503 -9.815 1.00 0.00 O ATOM 93 OP2 DT A 4 3.929 3.644 -8.982 1.00 0.00 O ATOM 94 O5' DT A 4 5.492 4.831 -7.318 1.00 0.00 O ATOM 95 C5' DT A 4 6.424 5.865 -6.948 1.00 0.00 C ATOM 96 C4' DT A 4 6.799 5.725 -5.492 1.00 0.00 C ATOM 97 O4' DT A 4 5.661 6.099 -4.664 1.00 0.00 O ATOM 98 C3' DT A 4 7.160 4.318 -5.032 1.00 0.00 C ATOM 99 O3' DT A 4 8.432 4.380 -4.383 1.00 0.00 O ATOM 100 C2' DT A 4 6.125 3.899 -3.992 1.00 0.00 C ATOM 101 C1' DT A 4 5.555 5.234 -3.543 1.00 0.00 C ATOM 102 N1 DT A 4 4.143 5.151 -3.175 1.00 0.00 N ATOM 103 C2 DT A 4 3.772 5.487 -1.889 1.00 0.00 C ATOM 104 O2 DT A 4 4.559 5.853 -1.031 1.00 0.00 O ATOM 105 N3 DT A 4 2.422 5.381 -1.623 1.00 0.00 N ATOM 106 C4 DT A 4 1.447 4.980 -2.512 1.00 0.00 C ATOM 107 O4 DT A 4 0.264 4.929 -2.141 1.00 0.00 O ATOM 108 C5 DT A 4 1.904 4.647 -3.826 1.00 0.00 C ATOM 109 C7 DT A 4 0.891 4.203 -4.838 1.00 0.00 C ATOM 110 C6 DT A 4 3.214 4.748 -4.091 1.00 0.00 C ATOM 0 H5' DT A 4 5.982 6.845 -7.126 1.00 0.00 H new ATOM 0 H5'' DT A 4 7.317 5.801 -7.570 1.00 0.00 H new ATOM 0 H4' DT A 4 7.678 6.361 -5.388 1.00 0.00 H new ATOM 0 H3' DT A 4 7.185 3.622 -5.870 1.00 0.00 H new ATOM 0 H2' DT A 4 5.358 3.253 -4.419 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.578 3.352 -3.165 1.00 0.00 H new ATOM 0 H1' DT A 4 6.100 5.578 -2.664 1.00 0.00 H new ATOM 0 H3 DT A 4 2.117 5.622 -0.680 1.00 0.00 H new ATOM 0 H71 DT A 4 1.224 4.489 -5.836 1.00 0.00 H new ATOM 0 H72 DT A 4 0.779 3.120 -4.790 1.00 0.00 H new ATOM 0 H73 DT A 4 -0.067 4.677 -4.625 1.00 0.00 H new ATOM 0 H6 DT A 4 3.554 4.497 -5.085 1.00 0.00 H new ATOM 123 P DC A 5 9.257 3.052 -4.040 1.00 0.00 P ATOM 124 OP1 DC A 5 10.708 3.335 -4.119 1.00 0.00 O ATOM 125 OP2 DC A 5 8.911 1.989 -5.010 1.00 0.00 O ATOM 126 O5' DC A 5 8.753 2.742 -2.553 1.00 0.00 O ATOM 127 C5' DC A 5 9.182 3.545 -1.438 1.00 0.00 C ATOM 128 C4' DC A 5 8.389 3.181 -0.205 1.00 0.00 C ATOM 129 O4' DC A 5 6.988 3.501 -0.433 1.00 0.00 O ATOM 130 C3' DC A 5 8.419 1.708 0.184 1.00 0.00 C ATOM 131 O3' DC A 5 9.227 1.559 1.354 1.00 0.00 O ATOM 132 C2' DC A 5 6.970 1.400 0.548 1.00 0.00 C ATOM 133 C1' DC A 5 6.208 2.711 0.454 1.00 0.00 C ATOM 134 N1 DC A 5 4.874 2.561 -0.120 1.00 0.00 N ATOM 135 C2 DC A 5 3.759 2.822 0.634 1.00 0.00 C ATOM 136 O2 DC A 5 3.886 3.196 1.831 1.00 0.00 O ATOM 137 N3 DC A 5 2.549 2.696 0.148 1.00 0.00 N ATOM 138 C4 DC A 5 2.397 2.290 -1.152 1.00 0.00 C ATOM 139 N4 DC A 5 1.158 2.171 -1.617 1.00 0.00 N ATOM 140 C5 DC A 5 3.527 2.005 -1.980 1.00 0.00 C ATOM 141 C6 DC A 5 4.742 2.157 -1.411 1.00 0.00 C ATOM 0 H5' DC A 5 9.048 4.602 -1.668 1.00 0.00 H new ATOM 0 H5'' DC A 5 10.245 3.390 -1.255 1.00 0.00 H new ATOM 0 H4' DC A 5 8.858 3.748 0.599 1.00 0.00 H new ATOM 0 H3' DC A 5 8.814 1.062 -0.600 1.00 0.00 H new ATOM 0 H2' DC A 5 6.550 0.658 -0.131 1.00 0.00 H new ATOM 0 H2'' DC A 5 6.903 0.985 1.554 1.00 0.00 H new ATOM 0 H1' DC A 5 6.066 3.137 1.447 1.00 0.00 H new ATOM 0 H41 DC A 5 1.001 1.871 -2.579 1.00 0.00 H new ATOM 0 H42 DC A 5 0.364 2.379 -1.012 1.00 0.00 H new ATOM 0 H5 DC A 5 3.415 1.685 -3.005 1.00 0.00 H new ATOM 0 H6 DC A 5 5.628 1.953 -1.994 1.00 0.00 H new ATOM 153 P DG A 6 9.797 0.131 1.796 1.00 0.00 P ATOM 154 OP1 DG A 6 11.073 0.309 2.524 1.00 0.00 O ATOM 155 OP2 DG A 6 10.030 -0.704 0.595 1.00 0.00 O ATOM 156 O5' DG A 6 8.609 -0.411 2.722 1.00 0.00 O ATOM 157 C5' DG A 6 8.404 0.107 4.049 1.00 0.00 C ATOM 158 C4' DG A 6 6.998 -0.195 4.509 1.00 0.00 C ATOM 159 O4' DG A 6 6.057 0.257 3.495 1.00 0.00 O ATOM 160 C3' DG A 6 6.675 -1.670 4.723 1.00 0.00 C ATOM 161 O3' DG A 6 6.353 -1.860 6.103 1.00 0.00 O ATOM 162 C2' DG A 6 5.425 -1.953 3.898 1.00 0.00 C ATOM 163 C1' DG A 6 4.908 -0.578 3.512 1.00 0.00 C ATOM 164 N9 DG A 6 4.309 -0.548 2.180 1.00 0.00 N ATOM 165 C8 DG A 6 3.110 -0.080 1.856 1.00 0.00 C ATOM 166 N7 DG A 6 2.906 -0.220 0.549 1.00 0.00 N ATOM 167 C5 DG A 6 4.030 -0.808 0.003 1.00 0.00 C ATOM 168 C6 DG A 6 4.390 -1.196 -1.314 1.00 0.00 C ATOM 169 O6 DG A 6 3.741 -1.094 -2.353 1.00 0.00 O ATOM 170 N1 DG A 6 5.662 -1.757 -1.333 1.00 0.00 N ATOM 171 C2 DG A 6 6.471 -1.921 -0.251 1.00 0.00 C ATOM 172 N2 DG A 6 7.662 -2.486 -0.495 1.00 0.00 N ATOM 173 N3 DG A 6 6.130 -1.558 0.971 1.00 0.00 N ATOM 174 C4 DG A 6 4.912 -1.014 1.030 1.00 0.00 C ATOM 0 H5' DG A 6 8.575 1.183 4.059 1.00 0.00 H new ATOM 0 H5'' DG A 6 9.124 -0.337 4.737 1.00 0.00 H new ATOM 0 H4' DG A 6 6.917 0.314 5.469 1.00 0.00 H new ATOM 0 H3' DG A 6 7.506 -2.317 4.440 1.00 0.00 H new ATOM 0 H2' DG A 6 5.657 -2.552 3.017 1.00 0.00 H new ATOM 0 H2'' DG A 6 4.685 -2.508 4.475 1.00 0.00 H new ATOM 0 H1' DG A 6 4.134 -0.267 4.213 1.00 0.00 H new ATOM 0 H8 DG A 6 2.404 0.351 2.551 1.00 0.00 H new ATOM 0 H1 DG A 6 6.019 -2.073 -2.235 1.00 0.00 H new ATOM 0 H21 DG A 6 8.320 -2.640 0.269 1.00 0.00 H new ATOM 0 H22 DG A 6 7.910 -2.762 -1.445 1.00 0.00 H new ATOM 185 P DC A 7 6.282 -3.324 6.747 1.00 0.00 P ATOM 186 OP1 DC A 7 6.857 -3.295 8.110 1.00 0.00 O ATOM 187 OP2 DC A 7 7.052 -4.271 5.909 1.00 0.00 O ATOM 188 O5' DC A 7 4.707 -3.601 6.729 1.00 0.00 O ATOM 189 C5' DC A 7 3.839 -3.042 7.735 1.00 0.00 C ATOM 190 C4' DC A 7 2.448 -3.608 7.589 1.00 0.00 C ATOM 191 O4' DC A 7 1.861 -3.143 6.341 1.00 0.00 O ATOM 192 C3' DC A 7 2.351 -5.126 7.493 1.00 0.00 C ATOM 193 O3' DC A 7 1.258 -5.549 8.313 1.00 0.00 O ATOM 194 C2' DC A 7 2.013 -5.474 6.047 1.00 0.00 C ATOM 195 C1' DC A 7 1.286 -4.214 5.608 1.00 0.00 C ATOM 196 N1 DC A 7 1.467 -3.928 4.188 1.00 0.00 N ATOM 197 C2 DC A 7 0.384 -3.695 3.380 1.00 0.00 C ATOM 198 O2 DC A 7 -0.778 -3.727 3.867 1.00 0.00 O ATOM 199 N3 DC A 7 0.514 -3.436 2.103 1.00 0.00 N ATOM 200 C4 DC A 7 1.771 -3.396 1.561 1.00 0.00 C ATOM 201 N4 DC A 7 1.872 -3.130 0.261 1.00 0.00 N ATOM 202 C5 DC A 7 2.935 -3.632 2.358 1.00 0.00 C ATOM 203 C6 DC A 7 2.723 -3.893 3.666 1.00 0.00 C ATOM 0 H5' DC A 7 3.811 -1.957 7.640 1.00 0.00 H new ATOM 0 H5'' DC A 7 4.229 -3.265 8.728 1.00 0.00 H new ATOM 0 H4' DC A 7 1.946 -3.276 8.498 1.00 0.00 H new ATOM 0 H3' DC A 7 3.280 -5.602 7.807 1.00 0.00 H new ATOM 0 H2' DC A 7 2.904 -5.665 5.450 1.00 0.00 H new ATOM 0 H2'' DC A 7 1.383 -6.361 5.973 1.00 0.00 H new ATOM 0 H1' DC A 7 0.218 -4.342 5.785 1.00 0.00 H new ATOM 0 H41 DC A 7 2.790 -3.091 -0.182 1.00 0.00 H new ATOM 0 H42 DC A 7 1.031 -2.965 -0.293 1.00 0.00 H new ATOM 0 H5 DC A 7 3.929 -3.603 1.937 1.00 0.00 H new ATOM 0 H6 DC A 7 3.569 -4.078 4.312 1.00 0.00 H new ATOM 215 P DT A 8 1.069 -7.084 8.720 1.00 0.00 P ATOM 216 OP1 DT A 8 0.656 -7.175 10.138 1.00 0.00 O ATOM 217 OP2 DT A 8 2.346 -7.808 8.533 1.00 0.00 O ATOM 218 O5' DT A 8 -0.074 -7.545 7.699 1.00 0.00 O ATOM 219 C5' DT A 8 -1.413 -7.025 7.794 1.00 0.00 C ATOM 220 C4' DT A 8 -2.210 -7.424 6.576 1.00 0.00 C ATOM 221 O4' DT A 8 -1.727 -6.673 5.428 1.00 0.00 O ATOM 222 C3' DT A 8 -2.115 -8.895 6.184 1.00 0.00 C ATOM 223 O3' DT A 8 -3.279 -9.581 6.651 1.00 0.00 O ATOM 224 C2' DT A 8 -2.161 -8.812 4.662 1.00 0.00 C ATOM 225 C1' DT A 8 -2.183 -7.344 4.264 1.00 0.00 C ATOM 226 N1 DT A 8 -1.275 -7.032 3.165 1.00 0.00 N ATOM 227 C2 DT A 8 -1.808 -6.666 1.944 1.00 0.00 C ATOM 228 O2 DT A 8 -3.006 -6.587 1.727 1.00 0.00 O ATOM 229 N3 DT A 8 -0.883 -6.388 0.960 1.00 0.00 N ATOM 230 C4 DT A 8 0.490 -6.443 1.095 1.00 0.00 C ATOM 231 O4 DT A 8 1.210 -6.166 0.123 1.00 0.00 O ATOM 232 C5 DT A 8 0.972 -6.830 2.384 1.00 0.00 C ATOM 233 C7 DT A 8 2.454 -6.909 2.592 1.00 0.00 C ATOM 234 C6 DT A 8 0.078 -7.101 3.345 1.00 0.00 C ATOM 0 H5' DT A 8 -1.385 -5.939 7.880 1.00 0.00 H new ATOM 0 H5'' DT A 8 -1.896 -7.404 8.695 1.00 0.00 H new ATOM 0 H4' DT A 8 -3.246 -7.218 6.845 1.00 0.00 H new ATOM 0 H3' DT A 8 -1.243 -9.413 6.583 1.00 0.00 H new ATOM 0 H2' DT A 8 -1.294 -9.310 4.228 1.00 0.00 H new ATOM 0 H2'' DT A 8 -3.045 -9.322 4.280 1.00 0.00 H new ATOM 0 H1' DT A 8 -3.177 -7.055 3.923 1.00 0.00 H new ATOM 0 H3 DT A 8 -1.247 -6.116 0.047 1.00 0.00 H new ATOM 0 H71 DT A 8 2.688 -6.684 3.633 1.00 0.00 H new ATOM 0 H72 DT A 8 2.802 -7.913 2.351 1.00 0.00 H new ATOM 0 H73 DT A 8 2.951 -6.187 1.944 1.00 0.00 H new ATOM 0 H6 DT A 8 0.448 -7.391 4.317 1.00 0.00 H new ATOM 247 P DA A 9 -3.472 -11.151 6.408 1.00 0.00 P ATOM 248 OP1 DA A 9 -4.155 -11.754 7.576 1.00 0.00 O ATOM 249 OP2 DA A 9 -2.149 -11.792 6.229 1.00 0.00 O ATOM 250 O5' DA A 9 -4.363 -11.159 5.080 1.00 0.00 O ATOM 251 C5' DA A 9 -5.655 -10.523 5.044 1.00 0.00 C ATOM 252 C4' DA A 9 -6.240 -10.620 3.656 1.00 0.00 C ATOM 253 O4' DA A 9 -5.349 -9.977 2.703 1.00 0.00 O ATOM 254 C3' DA A 9 -6.401 -12.028 3.094 1.00 0.00 C ATOM 255 O3' DA A 9 -7.512 -12.029 2.194 1.00 0.00 O ATOM 256 C2' DA A 9 -5.133 -12.292 2.288 1.00 0.00 C ATOM 257 C1' DA A 9 -4.848 -10.901 1.747 1.00 0.00 C ATOM 258 N9 DA A 9 -3.419 -10.642 1.591 1.00 0.00 N ATOM 259 C8 DA A 9 -2.407 -10.945 2.447 1.00 0.00 C ATOM 260 N7 DA A 9 -1.212 -10.568 1.996 1.00 0.00 N ATOM 261 C5 DA A 9 -1.486 -9.988 0.774 1.00 0.00 C ATOM 262 C6 DA A 9 -0.654 -9.394 -0.196 1.00 0.00 C ATOM 263 N6 DA A 9 0.666 -9.293 -0.069 1.00 0.00 N ATOM 264 N1 DA A 9 -1.256 -8.908 -1.314 1.00 0.00 N ATOM 265 C2 DA A 9 -2.617 -9.021 -1.429 1.00 0.00 C ATOM 266 N3 DA A 9 -3.469 -9.546 -0.598 1.00 0.00 N ATOM 267 C4 DA A 9 -2.837 -10.018 0.497 1.00 0.00 C ATOM 0 H5' DA A 9 -5.563 -9.477 5.336 1.00 0.00 H new ATOM 0 H5'' DA A 9 -6.323 -10.997 5.763 1.00 0.00 H new ATOM 0 H4' DA A 9 -7.222 -10.162 3.770 1.00 0.00 H new ATOM 0 H3' DA A 9 -6.559 -12.771 3.876 1.00 0.00 H new ATOM 0 H2' DA A 9 -4.320 -12.669 2.908 1.00 0.00 H new ATOM 0 H2'' DA A 9 -5.292 -13.021 1.493 1.00 0.00 H new ATOM 0 H1' DA A 9 -5.314 -10.808 0.766 1.00 0.00 H new ATOM 0 H8 DA A 9 -2.557 -11.440 3.395 1.00 0.00 H new ATOM 0 H61 DA A 9 1.217 -8.852 -0.806 1.00 0.00 H new ATOM 0 H62 DA A 9 1.127 -9.656 0.765 1.00 0.00 H new ATOM 0 H2 DA A 9 -3.042 -8.618 -2.337 1.00 0.00 H new ATOM 279 P DC A 10 -7.982 -13.367 1.455 1.00 0.00 P ATOM 280 OP1 DC A 10 -9.425 -13.588 1.698 1.00 0.00 O ATOM 281 OP2 DC A 10 -7.215 -14.520 1.978 1.00 0.00 O ATOM 282 O5' DC A 10 -7.645 -13.021 -0.071 1.00 0.00 O ATOM 283 C5' DC A 10 -8.263 -11.905 -0.737 1.00 0.00 C ATOM 284 C4' DC A 10 -7.740 -11.792 -2.149 1.00 0.00 C ATOM 285 O4' DC A 10 -6.343 -11.386 -2.121 1.00 0.00 O ATOM 286 C3' DC A 10 -7.721 -13.083 -2.961 1.00 0.00 C ATOM 287 O3' DC A 10 -8.095 -12.764 -4.304 1.00 0.00 O ATOM 288 C2' DC A 10 -6.280 -13.580 -2.981 1.00 0.00 C ATOM 289 C1' DC A 10 -5.527 -12.263 -2.885 1.00 0.00 C ATOM 290 N1 DC A 10 -4.250 -12.396 -2.191 1.00 0.00 N ATOM 291 C2 DC A 10 -3.086 -11.990 -2.791 1.00 0.00 C ATOM 292 O2 DC A 10 -3.119 -11.498 -3.950 1.00 0.00 O ATOM 293 N3 DC A 10 -1.925 -12.097 -2.194 1.00 0.00 N ATOM 294 C4 DC A 10 -1.875 -12.630 -0.933 1.00 0.00 C ATOM 295 N4 DC A 10 -0.683 -12.726 -0.354 1.00 0.00 N ATOM 296 C5 DC A 10 -3.060 -13.069 -0.263 1.00 0.00 C ATOM 297 C6 DC A 10 -4.219 -12.929 -0.940 1.00 0.00 C ATOM 0 H5' DC A 10 -8.058 -10.985 -0.190 1.00 0.00 H new ATOM 0 H5'' DC A 10 -9.345 -12.033 -0.750 1.00 0.00 H new ATOM 0 H4' DC A 10 -8.429 -11.086 -2.613 1.00 0.00 H new ATOM 0 H3' DC A 10 -8.395 -13.829 -2.540 1.00 0.00 H new ATOM 0 H2' DC A 10 -6.060 -14.245 -2.146 1.00 0.00 H new ATOM 0 H2'' DC A 10 -6.043 -14.127 -3.894 1.00 0.00 H new ATOM 0 H1' DC A 10 -5.321 -11.902 -3.893 1.00 0.00 H new ATOM 0 H41 DC A 10 -0.602 -13.117 0.585 1.00 0.00 H new ATOM 0 H42 DC A 10 0.151 -12.409 -0.848 1.00 0.00 H new ATOM 0 H5 DC A 10 -3.029 -13.490 0.731 1.00 0.00 H new ATOM 0 H6 DC A 10 -5.142 -13.247 -0.478 1.00 0.00 H new ATOM 309 P DC A 11 -8.378 -13.911 -5.384 1.00 0.00 P ATOM 310 OP1 DC A 11 -9.724 -13.723 -5.967 1.00 0.00 O ATOM 311 OP2 DC A 11 -8.307 -15.237 -4.729 1.00 0.00 O ATOM 312 O5' DC A 11 -7.193 -13.659 -6.430 1.00 0.00 O ATOM 313 C5' DC A 11 -7.151 -12.466 -7.234 1.00 0.00 C ATOM 314 C4' DC A 11 -5.882 -12.439 -8.052 1.00 0.00 C ATOM 315 O4' DC A 11 -4.731 -12.410 -7.163 1.00 0.00 O ATOM 316 C3' DC A 11 -5.626 -13.657 -8.931 1.00 0.00 C ATOM 317 O3' DC A 11 -5.087 -13.198 -10.174 1.00 0.00 O ATOM 318 C2' DC A 11 -4.559 -14.500 -8.240 1.00 0.00 C ATOM 319 C1' DC A 11 -3.791 -13.422 -7.493 1.00 0.00 C ATOM 320 N1 DC A 11 -3.209 -13.911 -6.247 1.00 0.00 N ATOM 321 C2 DC A 11 -1.870 -13.748 -5.992 1.00 0.00 C ATOM 322 O2 DC A 11 -1.137 -13.175 -6.841 1.00 0.00 O ATOM 323 N3 DC A 11 -1.320 -14.176 -4.883 1.00 0.00 N ATOM 324 C4 DC A 11 -2.106 -14.801 -3.952 1.00 0.00 C ATOM 325 N4 DC A 11 -1.518 -15.224 -2.837 1.00 0.00 N ATOM 326 C5 DC A 11 -3.507 -14.995 -4.168 1.00 0.00 C ATOM 327 C6 DC A 11 -4.004 -14.529 -5.333 1.00 0.00 C ATOM 0 H5' DC A 11 -7.200 -11.585 -6.595 1.00 0.00 H new ATOM 0 H5'' DC A 11 -8.019 -12.431 -7.893 1.00 0.00 H new ATOM 0 H4' DC A 11 -6.013 -11.562 -8.686 1.00 0.00 H new ATOM 0 H3' DC A 11 -6.540 -14.228 -9.093 1.00 0.00 H new ATOM 0 H2' DC A 11 -4.989 -15.243 -7.568 1.00 0.00 H new ATOM 0 H2'' DC A 11 -3.932 -15.038 -8.951 1.00 0.00 H new ATOM 0 HO3' DC A 11 -4.912 -13.965 -10.758 1.00 0.00 H new ATOM 0 H1' DC A 11 -2.975 -13.070 -8.124 1.00 0.00 H new ATOM 0 H41 DC A 11 -2.067 -15.694 -2.118 1.00 0.00 H new ATOM 0 H42 DC A 11 -0.518 -15.078 -2.701 1.00 0.00 H new ATOM 0 H5 DC A 11 -4.133 -15.488 -3.438 1.00 0.00 H new ATOM 0 H6 DC A 11 -5.056 -14.650 -5.544 1.00 0.00 H new TER 339 DC A 11 ATOM 340 O5' DG B 12 8.814 -14.984 -2.782 1.00 0.00 O ATOM 341 C5' DG B 12 9.386 -15.183 -4.088 1.00 0.00 C ATOM 342 C4' DG B 12 8.742 -14.246 -5.081 1.00 0.00 C ATOM 343 O4' DG B 12 7.311 -14.502 -5.141 1.00 0.00 O ATOM 344 C3' DG B 12 8.819 -12.760 -4.748 1.00 0.00 C ATOM 345 O3' DG B 12 8.870 -12.027 -5.976 1.00 0.00 O ATOM 346 C2' DG B 12 7.509 -12.420 -4.045 1.00 0.00 C ATOM 347 C1' DG B 12 6.555 -13.361 -4.764 1.00 0.00 C ATOM 348 N9 DG B 12 5.465 -13.817 -3.906 1.00 0.00 N ATOM 349 C8 DG B 12 5.565 -14.305 -2.673 1.00 0.00 C ATOM 350 N7 DG B 12 4.359 -14.614 -2.206 1.00 0.00 N ATOM 351 C5 DG B 12 3.433 -14.311 -3.185 1.00 0.00 C ATOM 352 C6 DG B 12 2.020 -14.419 -3.263 1.00 0.00 C ATOM 353 O6 DG B 12 1.232 -14.840 -2.418 1.00 0.00 O ATOM 354 N1 DG B 12 1.557 -13.968 -4.493 1.00 0.00 N ATOM 355 C2 DG B 12 2.332 -13.483 -5.501 1.00 0.00 C ATOM 356 N2 DG B 12 1.677 -13.101 -6.606 1.00 0.00 N ATOM 357 N3 DG B 12 3.645 -13.385 -5.421 1.00 0.00 N ATOM 358 C4 DG B 12 4.129 -13.809 -4.252 1.00 0.00 C ATOM 0 H5' DG B 12 9.242 -16.216 -4.404 1.00 0.00 H new ATOM 0 H5'' DG B 12 10.461 -15.007 -4.054 1.00 0.00 H new ATOM 0 H4' DG B 12 9.298 -14.441 -5.998 1.00 0.00 H new ATOM 0 H3' DG B 12 9.689 -12.522 -4.135 1.00 0.00 H new ATOM 0 H2' DG B 12 7.552 -12.613 -2.973 1.00 0.00 H new ATOM 0 H2'' DG B 12 7.231 -11.373 -4.170 1.00 0.00 H new ATOM 0 HO5' DG B 12 9.235 -15.596 -2.144 1.00 0.00 H new ATOM 0 H1' DG B 12 6.115 -12.832 -5.610 1.00 0.00 H new ATOM 0 H8 DG B 12 6.490 -14.432 -2.130 1.00 0.00 H new ATOM 0 H1 DG B 12 0.550 -14.003 -4.654 1.00 0.00 H new ATOM 0 H21 DG B 12 2.194 -12.727 -7.402 1.00 0.00 H new ATOM 0 H22 DG B 12 0.661 -13.184 -6.651 1.00 0.00 H new ATOM 371 P DG B 13 9.044 -10.437 -5.989 1.00 0.00 P ATOM 372 OP1 DG B 13 10.230 -10.075 -6.797 1.00 0.00 O ATOM 373 OP2 DG B 13 9.227 -9.946 -4.604 1.00 0.00 O ATOM 374 O5' DG B 13 7.662 -9.973 -6.648 1.00 0.00 O ATOM 375 C5' DG B 13 7.266 -10.435 -7.952 1.00 0.00 C ATOM 376 C4' DG B 13 5.873 -9.947 -8.272 1.00 0.00 C ATOM 377 O4' DG B 13 4.916 -10.585 -7.383 1.00 0.00 O ATOM 378 C3' DG B 13 5.623 -8.457 -8.061 1.00 0.00 C ATOM 379 O3' DG B 13 4.795 -7.993 -9.132 1.00 0.00 O ATOM 380 C2' DG B 13 4.836 -8.311 -6.763 1.00 0.00 C ATOM 381 C1' DG B 13 4.081 -9.630 -6.744 1.00 0.00 C ATOM 382 N9 DG B 13 3.820 -10.107 -5.388 1.00 0.00 N ATOM 383 C8 DG B 13 4.711 -10.305 -4.422 1.00 0.00 C ATOM 384 N7 DG B 13 4.103 -10.744 -3.324 1.00 0.00 N ATOM 385 C5 DG B 13 2.752 -10.835 -3.593 1.00 0.00 C ATOM 386 C6 DG B 13 1.627 -11.235 -2.826 1.00 0.00 C ATOM 387 O6 DG B 13 1.587 -11.621 -1.658 1.00 0.00 O ATOM 388 N1 DG B 13 0.460 -11.144 -3.576 1.00 0.00 N ATOM 389 C2 DG B 13 0.382 -10.732 -4.870 1.00 0.00 C ATOM 390 N2 DG B 13 -0.847 -10.720 -5.404 1.00 0.00 N ATOM 391 N3 DG B 13 1.433 -10.362 -5.577 1.00 0.00 N ATOM 392 C4 DG B 13 2.575 -10.435 -4.890 1.00 0.00 C ATOM 0 H5' DG B 13 7.295 -11.524 -7.985 1.00 0.00 H new ATOM 0 H5'' DG B 13 7.968 -10.074 -8.703 1.00 0.00 H new ATOM 0 H4' DG B 13 5.763 -10.183 -9.330 1.00 0.00 H new ATOM 0 H3' DG B 13 6.558 -7.898 -8.025 1.00 0.00 H new ATOM 0 H2' DG B 13 5.486 -8.193 -5.896 1.00 0.00 H new ATOM 0 H2'' DG B 13 4.167 -7.451 -6.779 1.00 0.00 H new ATOM 0 H1' DG B 13 3.120 -9.491 -7.238 1.00 0.00 H new ATOM 0 H8 DG B 13 5.773 -10.134 -4.515 1.00 0.00 H new ATOM 0 H1 DG B 13 -0.412 -11.409 -3.117 1.00 0.00 H new ATOM 0 H21 DG B 13 -0.980 -10.422 -6.370 1.00 0.00 H new ATOM 0 H22 DG B 13 -1.649 -11.009 -4.844 1.00 0.00 H new ATOM 404 P DT B 14 4.426 -6.445 -9.286 1.00 0.00 P ATOM 405 OP1 DT B 14 4.736 -5.996 -10.662 1.00 0.00 O ATOM 406 OP2 DT B 14 5.216 -5.648 -8.321 1.00 0.00 O ATOM 407 O5' DT B 14 2.860 -6.459 -8.963 1.00 0.00 O ATOM 408 C5' DT B 14 1.941 -7.233 -9.757 1.00 0.00 C ATOM 409 C4' DT B 14 0.539 -7.084 -9.216 1.00 0.00 C ATOM 410 O4' DT B 14 0.450 -7.724 -7.913 1.00 0.00 O ATOM 411 C3' DT B 14 0.072 -5.657 -8.952 1.00 0.00 C ATOM 412 O3' DT B 14 -1.271 -5.539 -9.428 1.00 0.00 O ATOM 413 C2' DT B 14 0.054 -5.452 -7.442 1.00 0.00 C ATOM 414 C1' DT B 14 -0.171 -6.875 -6.958 1.00 0.00 C ATOM 415 N1 DT B 14 0.451 -7.134 -5.663 1.00 0.00 N ATOM 416 C2 DT B 14 -0.328 -7.639 -4.641 1.00 0.00 C ATOM 417 O2 DT B 14 -1.518 -7.885 -4.756 1.00 0.00 O ATOM 418 N3 DT B 14 0.335 -7.856 -3.450 1.00 0.00 N ATOM 419 C4 DT B 14 1.671 -7.614 -3.208 1.00 0.00 C ATOM 420 O4 DT B 14 2.143 -7.854 -2.087 1.00 0.00 O ATOM 421 C5 DT B 14 2.417 -7.091 -4.312 1.00 0.00 C ATOM 422 C7 DT B 14 3.877 -6.809 -4.110 1.00 0.00 C ATOM 423 C6 DT B 14 1.779 -6.880 -5.471 1.00 0.00 C ATOM 0 H5' DT B 14 2.234 -8.283 -9.747 1.00 0.00 H new ATOM 0 H5'' DT B 14 1.976 -6.902 -10.795 1.00 0.00 H new ATOM 0 H4' DT B 14 -0.079 -7.522 -10.000 1.00 0.00 H new ATOM 0 H3' DT B 14 0.722 -4.932 -9.441 1.00 0.00 H new ATOM 0 H2' DT B 14 0.990 -5.034 -7.072 1.00 0.00 H new ATOM 0 H2'' DT B 14 -0.743 -4.778 -7.127 1.00 0.00 H new ATOM 0 H1' DT B 14 -1.242 -7.046 -6.848 1.00 0.00 H new ATOM 0 H3 DT B 14 -0.215 -8.230 -2.677 1.00 0.00 H new ATOM 0 H71 DT B 14 4.055 -6.542 -3.068 1.00 0.00 H new ATOM 0 H72 DT B 14 4.457 -7.697 -4.361 1.00 0.00 H new ATOM 0 H73 DT B 14 4.180 -5.983 -4.753 1.00 0.00 H new ATOM 0 H6 DT B 14 2.347 -6.487 -6.301 1.00 0.00 H new ATOM 436 P DA B 15 -2.001 -4.118 -9.514 1.00 0.00 P ATOM 437 OP1 DA B 15 -2.407 -3.852 -10.912 1.00 0.00 O ATOM 438 OP2 DA B 15 -1.075 -3.056 -9.064 1.00 0.00 O ATOM 439 O5' DA B 15 -3.240 -4.339 -8.526 1.00 0.00 O ATOM 440 C5' DA B 15 -4.319 -5.228 -8.870 1.00 0.00 C ATOM 441 C4' DA B 15 -5.413 -5.137 -7.833 1.00 0.00 C ATOM 442 O4' DA B 15 -4.885 -5.512 -6.530 1.00 0.00 O ATOM 443 C3' DA B 15 -5.994 -3.748 -7.591 1.00 0.00 C ATOM 444 O3' DA B 15 -7.322 -3.891 -7.082 1.00 0.00 O ATOM 445 C2' DA B 15 -5.113 -3.161 -6.495 1.00 0.00 C ATOM 446 C1' DA B 15 -4.818 -4.395 -5.656 1.00 0.00 C ATOM 447 N9 DA B 15 -3.479 -4.368 -5.075 1.00 0.00 N ATOM 448 C8 DA B 15 -2.346 -3.812 -5.582 1.00 0.00 C ATOM 449 N7 DA B 15 -1.289 -3.969 -4.791 1.00 0.00 N ATOM 450 C5 DA B 15 -1.781 -4.671 -3.710 1.00 0.00 C ATOM 451 C6 DA B 15 -1.168 -5.147 -2.534 1.00 0.00 C ATOM 452 N6 DA B 15 0.121 -4.970 -2.256 1.00 0.00 N ATOM 453 N1 DA B 15 -1.957 -5.817 -1.652 1.00 0.00 N ATOM 454 C2 DA B 15 -3.282 -5.988 -1.956 1.00 0.00 C ATOM 455 N3 DA B 15 -3.940 -5.593 -3.005 1.00 0.00 N ATOM 456 C4 DA B 15 -3.128 -4.932 -3.857 1.00 0.00 C ATOM 0 H5' DA B 15 -3.951 -6.252 -8.934 1.00 0.00 H new ATOM 0 H5'' DA B 15 -4.715 -4.970 -9.852 1.00 0.00 H new ATOM 0 H4' DA B 15 -6.189 -5.788 -8.237 1.00 0.00 H new ATOM 0 H3' DA B 15 -6.024 -3.134 -8.491 1.00 0.00 H new ATOM 0 H2' DA B 15 -4.205 -2.709 -6.895 1.00 0.00 H new ATOM 0 H2'' DA B 15 -5.628 -2.389 -5.923 1.00 0.00 H new ATOM 0 H1' DA B 15 -5.537 -4.441 -4.838 1.00 0.00 H new ATOM 0 H8 DA B 15 -2.309 -3.296 -6.530 1.00 0.00 H new ATOM 0 H61 DA B 15 0.511 -5.337 -1.388 1.00 0.00 H new ATOM 0 H62 DA B 15 0.720 -4.467 -2.911 1.00 0.00 H new ATOM 0 H2 DA B 15 -3.861 -6.527 -1.221 1.00 0.00 H new ATOM 468 P DG B 16 -8.245 -2.616 -6.794 1.00 0.00 P ATOM 469 OP1 DG B 16 -9.628 -2.892 -7.245 1.00 0.00 O ATOM 470 OP2 DG B 16 -7.714 -1.444 -7.526 1.00 0.00 O ATOM 471 O5' DG B 16 -8.112 -2.482 -5.205 1.00 0.00 O ATOM 472 C5' DG B 16 -8.718 -3.445 -4.322 1.00 0.00 C ATOM 473 C4' DG B 16 -8.324 -3.155 -2.894 1.00 0.00 C ATOM 474 O4' DG B 16 -6.907 -3.443 -2.723 1.00 0.00 O ATOM 475 C3' DG B 16 -8.501 -1.709 -2.443 1.00 0.00 C ATOM 476 O3' DG B 16 -9.519 -1.672 -1.441 1.00 0.00 O ATOM 477 C2' DG B 16 -7.175 -1.324 -1.794 1.00 0.00 C ATOM 478 C1' DG B 16 -6.391 -2.621 -1.686 1.00 0.00 C ATOM 479 N9 DG B 16 -4.960 -2.445 -1.917 1.00 0.00 N ATOM 480 C8 DG B 16 -4.375 -2.010 -3.029 1.00 0.00 C ATOM 481 N7 DG B 16 -3.056 -1.980 -2.866 1.00 0.00 N ATOM 482 C5 DG B 16 -2.773 -2.417 -1.589 1.00 0.00 C ATOM 483 C6 DG B 16 -1.568 -2.596 -0.859 1.00 0.00 C ATOM 484 O6 DG B 16 -0.410 -2.391 -1.220 1.00 0.00 O ATOM 485 N1 DG B 16 -1.832 -3.069 0.421 1.00 0.00 N ATOM 486 C2 DG B 16 -3.066 -3.332 0.930 1.00 0.00 C ATOM 487 N2 DG B 16 -3.093 -3.784 2.191 1.00 0.00 N ATOM 488 N3 DG B 16 -4.182 -3.163 0.246 1.00 0.00 N ATOM 489 C4 DG B 16 -3.970 -2.708 -0.991 1.00 0.00 C ATOM 0 H5' DG B 16 -8.404 -4.452 -4.597 1.00 0.00 H new ATOM 0 H5'' DG B 16 -9.803 -3.411 -4.423 1.00 0.00 H new ATOM 0 H4' DG B 16 -8.990 -3.779 -2.298 1.00 0.00 H new ATOM 0 H3' DG B 16 -8.771 -1.046 -3.265 1.00 0.00 H new ATOM 0 H2' DG B 16 -6.640 -0.590 -2.397 1.00 0.00 H new ATOM 0 H2'' DG B 16 -7.332 -0.877 -0.813 1.00 0.00 H new ATOM 0 H1' DG B 16 -6.496 -3.034 -0.683 1.00 0.00 H new ATOM 0 H8 DG B 16 -4.895 -1.723 -3.931 1.00 0.00 H new ATOM 0 H1 DG B 16 -1.031 -3.233 1.031 1.00 0.00 H new ATOM 0 H21 DG B 16 -3.985 -4.002 2.636 1.00 0.00 H new ATOM 0 H22 DG B 16 -2.222 -3.911 2.706 1.00 0.00 H new ATOM 501 P DC B 17 -10.275 -0.310 -1.074 1.00 0.00 P ATOM 502 OP1 DC B 17 -11.544 -0.618 -0.376 1.00 0.00 O ATOM 503 OP2 DC B 17 -10.569 0.444 -2.312 1.00 0.00 O ATOM 504 O5' DC B 17 -9.197 0.408 -0.136 1.00 0.00 O ATOM 505 C5' DC B 17 -8.868 -0.120 1.163 1.00 0.00 C ATOM 506 C4' DC B 17 -7.690 0.628 1.742 1.00 0.00 C ATOM 507 O4' DC B 17 -6.668 0.787 0.719 1.00 0.00 O ATOM 508 C3' DC B 17 -7.974 2.051 2.213 1.00 0.00 C ATOM 509 O3' DC B 17 -7.450 2.187 3.536 1.00 0.00 O ATOM 510 C2' DC B 17 -7.199 2.999 1.304 1.00 0.00 C ATOM 511 C1' DC B 17 -6.109 2.092 0.759 1.00 0.00 C ATOM 512 N1 DC B 17 -5.706 2.447 -0.599 1.00 0.00 N ATOM 513 C2 DC B 17 -5.134 1.511 -1.422 1.00 0.00 C ATOM 514 O2 DC B 17 -4.953 0.336 -1.004 1.00 0.00 O ATOM 515 N3 DC B 17 -4.761 1.799 -2.645 1.00 0.00 N ATOM 516 C4 DC B 17 -4.953 3.073 -3.111 1.00 0.00 C ATOM 517 N4 DC B 17 -4.565 3.336 -4.356 1.00 0.00 N ATOM 518 C5 DC B 17 -5.544 4.086 -2.293 1.00 0.00 C ATOM 519 C6 DC B 17 -5.902 3.716 -1.046 1.00 0.00 C ATOM 0 H5' DC B 17 -8.632 -1.181 1.084 1.00 0.00 H new ATOM 0 H5'' DC B 17 -9.727 -0.033 1.828 1.00 0.00 H new ATOM 0 H4' DC B 17 -7.399 0.024 2.601 1.00 0.00 H new ATOM 0 H3' DC B 17 -9.042 2.268 2.192 1.00 0.00 H new ATOM 0 H2' DC B 17 -7.825 3.407 0.511 1.00 0.00 H new ATOM 0 H2'' DC B 17 -6.788 3.846 1.853 1.00 0.00 H new ATOM 0 H1' DC B 17 -5.226 2.175 1.393 1.00 0.00 H new ATOM 0 H41 DC B 17 -4.690 4.272 -4.742 1.00 0.00 H new ATOM 0 H42 DC B 17 -4.143 2.602 -4.924 1.00 0.00 H new ATOM 0 H5 DC B 17 -5.696 5.093 -2.654 1.00 0.00 H new ATOM 0 H6 DC B 17 -6.354 4.444 -0.388 1.00 0.00 H new ATOM 531 P DG B 18 -7.913 3.381 4.496 1.00 0.00 P ATOM 532 OP1 DG B 18 -8.960 2.896 5.421 1.00 0.00 O ATOM 533 OP2 DG B 18 -8.454 4.491 3.680 1.00 0.00 O ATOM 534 O5' DG B 18 -6.539 3.747 5.230 1.00 0.00 O ATOM 535 C5' DG B 18 -6.263 3.288 6.567 1.00 0.00 C ATOM 536 C4' DG B 18 -4.889 3.744 6.996 1.00 0.00 C ATOM 537 O4' DG B 18 -3.891 3.222 6.075 1.00 0.00 O ATOM 538 C3' DG B 18 -4.644 5.249 6.966 1.00 0.00 C ATOM 539 O3' DG B 18 -3.731 5.572 8.019 1.00 0.00 O ATOM 540 C2' DG B 18 -3.956 5.540 5.636 1.00 0.00 C ATOM 541 C1' DG B 18 -3.152 4.264 5.454 1.00 0.00 C ATOM 542 N9 DG B 18 -2.982 3.905 4.048 1.00 0.00 N ATOM 543 C8 DG B 18 -3.941 3.732 3.143 1.00 0.00 C ATOM 544 N7 DG B 18 -3.404 3.412 1.969 1.00 0.00 N ATOM 545 C5 DG B 18 -2.034 3.376 2.121 1.00 0.00 C ATOM 546 C6 DG B 18 -0.957 3.100 1.238 1.00 0.00 C ATOM 547 O6 DG B 18 -0.995 2.806 0.044 1.00 0.00 O ATOM 548 N1 DG B 18 0.262 3.198 1.899 1.00 0.00 N ATOM 549 C2 DG B 18 0.428 3.515 3.211 1.00 0.00 C ATOM 550 N2 DG B 18 1.694 3.555 3.647 1.00 0.00 N ATOM 551 N3 DG B 18 -0.578 3.771 4.027 1.00 0.00 N ATOM 552 C4 DG B 18 -1.768 3.687 3.429 1.00 0.00 C ATOM 0 H5' DG B 18 -6.323 2.200 6.607 1.00 0.00 H new ATOM 0 H5'' DG B 18 -7.015 3.674 7.255 1.00 0.00 H new ATOM 0 H4' DG B 18 -4.819 3.386 8.023 1.00 0.00 H new ATOM 0 H3' DG B 18 -5.568 5.816 7.082 1.00 0.00 H new ATOM 0 H2' DG B 18 -4.669 5.700 4.827 1.00 0.00 H new ATOM 0 H2'' DG B 18 -3.323 6.426 5.682 1.00 0.00 H new ATOM 0 H1' DG B 18 -2.161 4.412 5.884 1.00 0.00 H new ATOM 0 H8 DG B 18 -4.999 3.836 3.333 1.00 0.00 H new ATOM 0 H1 DG B 18 1.104 3.017 1.353 1.00 0.00 H new ATOM 0 H21 DG B 18 1.891 3.786 4.621 1.00 0.00 H new ATOM 0 H22 DG B 18 2.461 3.354 3.005 1.00 0.00 H new ATOM 564 P DA B 19 -3.393 7.092 8.390 1.00 0.00 P ATOM 565 OP1 DA B 19 -3.650 7.321 9.829 1.00 0.00 O ATOM 566 OP2 DA B 19 -4.247 7.999 7.590 1.00 0.00 O ATOM 567 O5' DA B 19 -1.843 7.175 8.002 1.00 0.00 O ATOM 568 C5' DA B 19 -0.838 6.528 8.805 1.00 0.00 C ATOM 569 C4' DA B 19 0.539 6.892 8.301 1.00 0.00 C ATOM 570 O4' DA B 19 0.724 6.362 6.960 1.00 0.00 O ATOM 571 C3' DA B 19 0.819 8.382 8.134 1.00 0.00 C ATOM 572 O3' DA B 19 2.187 8.616 8.477 1.00 0.00 O ATOM 573 C2' DA B 19 0.643 8.699 6.652 1.00 0.00 C ATOM 574 C1' DA B 19 1.077 7.380 6.035 1.00 0.00 C ATOM 575 N9 DA B 19 0.388 7.095 4.780 1.00 0.00 N ATOM 576 C8 DA B 19 -0.945 7.146 4.515 1.00 0.00 C ATOM 577 N7 DA B 19 -1.240 6.825 3.258 1.00 0.00 N ATOM 578 C5 DA B 19 -0.014 6.553 2.687 1.00 0.00 C ATOM 579 C6 DA B 19 0.354 6.157 1.385 1.00 0.00 C ATOM 580 N6 DA B 19 -0.520 5.965 0.401 1.00 0.00 N ATOM 581 N1 DA B 19 1.679 5.968 1.148 1.00 0.00 N ATOM 582 C2 DA B 19 2.565 6.170 2.173 1.00 0.00 C ATOM 583 N3 DA B 19 2.331 6.532 3.399 1.00 0.00 N ATOM 584 C4 DA B 19 1.008 6.711 3.600 1.00 0.00 C ATOM 0 H5' DA B 19 -0.973 5.447 8.770 1.00 0.00 H new ATOM 0 H5'' DA B 19 -0.944 6.829 9.847 1.00 0.00 H new ATOM 0 H4' DA B 19 1.198 6.484 9.067 1.00 0.00 H new ATOM 0 H3' DA B 19 0.161 8.988 8.756 1.00 0.00 H new ATOM 0 H2' DA B 19 -0.387 8.955 6.402 1.00 0.00 H new ATOM 0 H2'' DA B 19 1.266 9.533 6.329 1.00 0.00 H new ATOM 0 H1' DA B 19 2.146 7.427 5.825 1.00 0.00 H new ATOM 0 H8 DA B 19 -1.688 7.419 5.250 1.00 0.00 H new ATOM 0 H61 DA B 19 -0.194 5.678 -0.522 1.00 0.00 H new ATOM 0 H62 DA B 19 -1.516 6.105 0.569 1.00 0.00 H new ATOM 0 H2 DA B 19 3.604 6.005 1.928 1.00 0.00 H new ATOM 596 P DT B 20 2.784 10.099 8.548 1.00 0.00 P ATOM 597 OP1 DT B 20 3.667 10.222 9.729 1.00 0.00 O ATOM 598 OP2 DT B 20 1.678 11.075 8.659 1.00 0.00 O ATOM 599 O5' DT B 20 3.571 10.189 7.158 1.00 0.00 O ATOM 600 C5' DT B 20 4.617 9.255 6.830 1.00 0.00 C ATOM 601 C4' DT B 20 5.038 9.435 5.392 1.00 0.00 C ATOM 602 O4' DT B 20 4.001 8.899 4.523 1.00 0.00 O ATOM 603 C3' DT B 20 5.244 10.878 4.944 1.00 0.00 C ATOM 604 O3' DT B 20 6.643 11.103 4.756 1.00 0.00 O ATOM 605 C2' DT B 20 4.553 10.948 3.585 1.00 0.00 C ATOM 606 C1' DT B 20 4.111 9.532 3.256 1.00 0.00 C ATOM 607 N1 DT B 20 2.807 9.475 2.603 1.00 0.00 N ATOM 608 C2 DT B 20 2.742 9.073 1.284 1.00 0.00 C ATOM 609 O2 DT B 20 3.719 8.758 0.625 1.00 0.00 O ATOM 610 N3 DT B 20 1.474 9.047 0.740 1.00 0.00 N ATOM 611 C4 DT B 20 0.304 9.380 1.390 1.00 0.00 C ATOM 612 O4 DT B 20 -0.774 9.312 0.781 1.00 0.00 O ATOM 613 C5 DT B 20 0.447 9.787 2.753 1.00 0.00 C ATOM 614 C7 DT B 20 -0.791 10.163 3.514 1.00 0.00 C ATOM 615 C6 DT B 20 1.675 9.815 3.287 1.00 0.00 C ATOM 0 H5' DT B 20 4.268 8.235 6.990 1.00 0.00 H new ATOM 0 H5'' DT B 20 5.471 9.407 7.489 1.00 0.00 H new ATOM 0 H4' DT B 20 5.997 8.921 5.323 1.00 0.00 H new ATOM 0 H3' DT B 20 4.861 11.607 5.658 1.00 0.00 H new ATOM 0 H2' DT B 20 3.699 11.624 3.618 1.00 0.00 H new ATOM 0 H2'' DT B 20 5.232 11.330 2.823 1.00 0.00 H new ATOM 0 H1' DT B 20 4.818 9.067 2.569 1.00 0.00 H new ATOM 0 H3 DT B 20 1.395 8.754 -0.234 1.00 0.00 H new ATOM 0 H71 DT B 20 -0.652 9.934 4.571 1.00 0.00 H new ATOM 0 H72 DT B 20 -0.981 11.230 3.396 1.00 0.00 H new ATOM 0 H73 DT B 20 -1.640 9.598 3.129 1.00 0.00 H new ATOM 0 H6 DT B 20 1.776 10.124 4.317 1.00 0.00 H new ATOM 628 P DG B 21 7.229 12.580 4.568 1.00 0.00 P ATOM 629 OP1 DG B 21 8.654 12.603 4.972 1.00 0.00 O ATOM 630 OP2 DG B 21 6.466 13.528 5.409 1.00 0.00 O ATOM 631 O5' DG B 21 7.013 12.809 3.000 1.00 0.00 O ATOM 632 C5' DG B 21 7.749 12.046 2.025 1.00 0.00 C ATOM 633 C4' DG B 21 7.299 12.415 0.633 1.00 0.00 C ATOM 634 O4' DG B 21 6.009 11.797 0.368 1.00 0.00 O ATOM 635 C3' DG B 21 7.089 13.905 0.381 1.00 0.00 C ATOM 636 O3' DG B 21 8.029 14.328 -0.610 1.00 0.00 O ATOM 637 C2' DG B 21 5.686 14.034 -0.205 1.00 0.00 C ATOM 638 C1' DG B 21 5.275 12.608 -0.536 1.00 0.00 C ATOM 639 N9 DG B 21 3.854 12.361 -0.316 1.00 0.00 N ATOM 640 C8 DG B 21 3.181 12.504 0.822 1.00 0.00 C ATOM 641 N7 DG B 21 1.902 12.185 0.638 1.00 0.00 N ATOM 642 C5 DG B 21 1.740 11.818 -0.682 1.00 0.00 C ATOM 643 C6 DG B 21 0.626 11.387 -1.449 1.00 0.00 C ATOM 644 O6 DG B 21 -0.541 11.229 -1.091 1.00 0.00 O ATOM 645 N1 DG B 21 0.998 11.136 -2.764 1.00 0.00 N ATOM 646 C2 DG B 21 2.253 11.275 -3.272 1.00 0.00 C ATOM 647 N2 DG B 21 2.392 10.978 -4.571 1.00 0.00 N ATOM 648 N3 DG B 21 3.284 11.676 -2.553 1.00 0.00 N ATOM 649 C4 DG B 21 2.967 11.928 -1.282 1.00 0.00 C ATOM 0 H5' DG B 21 7.596 10.980 2.195 1.00 0.00 H new ATOM 0 H5'' DG B 21 8.817 12.236 2.133 1.00 0.00 H new ATOM 0 H4' DG B 21 8.110 12.072 -0.009 1.00 0.00 H new ATOM 0 H3' DG B 21 7.213 14.498 1.287 1.00 0.00 H new ATOM 0 H2' DG B 21 4.999 14.489 0.508 1.00 0.00 H new ATOM 0 H2'' DG B 21 5.685 14.664 -1.095 1.00 0.00 H new ATOM 0 H1' DG B 21 5.470 12.402 -1.588 1.00 0.00 H new ATOM 0 H8 DG B 21 3.609 12.831 1.758 1.00 0.00 H new ATOM 0 H1 DG B 21 0.268 10.821 -3.403 1.00 0.00 H new ATOM 0 H21 DG B 21 3.305 11.060 -5.018 1.00 0.00 H new ATOM 0 H22 DG B 21 1.585 10.670 -5.113 1.00 0.00 H new ATOM 661 P DG B 22 8.245 15.878 -0.943 1.00 0.00 P ATOM 662 OP1 DG B 22 9.585 16.076 -1.537 1.00 0.00 O ATOM 663 OP2 DG B 22 8.139 16.672 0.302 1.00 0.00 O ATOM 664 O5' DG B 22 7.050 16.150 -1.971 1.00 0.00 O ATOM 665 C5' DG B 22 7.058 15.579 -3.292 1.00 0.00 C ATOM 666 C4' DG B 22 5.909 16.133 -4.101 1.00 0.00 C ATOM 667 O4' DG B 22 4.688 15.420 -3.759 1.00 0.00 O ATOM 668 C3' DG B 22 5.568 17.598 -3.856 1.00 0.00 C ATOM 669 O3' DG B 22 5.458 18.242 -5.128 1.00 0.00 O ATOM 670 C2' DG B 22 4.197 17.647 -3.188 1.00 0.00 C ATOM 671 C1' DG B 22 3.597 16.318 -3.617 1.00 0.00 C ATOM 672 N9 DG B 22 2.689 15.761 -2.618 1.00 0.00 N ATOM 673 C8 DG B 22 2.872 15.720 -1.302 1.00 0.00 C ATOM 674 N7 DG B 22 1.831 15.138 -0.715 1.00 0.00 N ATOM 675 C5 DG B 22 0.929 14.786 -1.698 1.00 0.00 C ATOM 676 C6 DG B 22 -0.340 14.148 -1.682 1.00 0.00 C ATOM 677 O6 DG B 22 -0.979 13.731 -0.718 1.00 0.00 O ATOM 678 N1 DG B 22 -0.847 14.025 -2.969 1.00 0.00 N ATOM 679 C2 DG B 22 -0.233 14.448 -4.107 1.00 0.00 C ATOM 680 N2 DG B 22 -0.902 14.229 -5.247 1.00 0.00 N ATOM 681 N3 DG B 22 0.947 15.040 -4.116 1.00 0.00 N ATOM 682 C4 DG B 22 1.469 15.178 -2.895 1.00 0.00 C ATOM 0 H5' DG B 22 6.979 14.494 -3.229 1.00 0.00 H new ATOM 0 H5'' DG B 22 8.003 15.801 -3.788 1.00 0.00 H new ATOM 0 H4' DG B 22 6.244 16.017 -5.132 1.00 0.00 H new ATOM 0 H3' DG B 22 6.326 18.081 -3.239 1.00 0.00 H new ATOM 0 H2' DG B 22 4.273 17.731 -2.104 1.00 0.00 H new ATOM 0 H2'' DG B 22 3.604 18.494 -3.533 1.00 0.00 H new ATOM 0 HO3' DG B 22 5.237 19.188 -4.998 1.00 0.00 H new ATOM 0 H1' DG B 22 3.025 16.465 -4.533 1.00 0.00 H new ATOM 0 H8 DG B 22 3.739 16.103 -0.785 1.00 0.00 H new ATOM 0 H1 DG B 22 -1.759 13.579 -3.070 1.00 0.00 H new ATOM 0 H21 DG B 22 -0.500 14.521 -6.138 1.00 0.00 H new ATOM 0 H22 DG B 22 -1.813 13.771 -5.224 1.00 0.00 H new TER 694 DG B 22 HETATM 695 N PIQ A 23 2.187 0.482 2.762 1.00 0.00 N HETATM 696 C2 PIQ A 23 0.810 0.190 2.671 1.00 0.00 C HETATM 697 N1 PIQ A 23 0.101 -0.305 3.703 1.00 0.00 N HETATM 698 C7A PIQ A 23 -1.194 -0.459 3.236 1.00 0.00 C HETATM 699 C7 PIQ A 23 -2.367 -0.926 3.840 1.00 0.00 C HETATM 700 C6 PIQ A 23 -3.546 -0.948 3.052 1.00 0.00 C HETATM 701 C1' PIQ A 23 -4.876 -1.443 3.626 1.00 0.00 C HETATM 702 C2' PIQ A 23 -5.129 -1.418 5.020 1.00 0.00 C HETATM 703 C3' PIQ A 23 -6.348 -1.869 5.558 1.00 0.00 C HETATM 704 C4' PIQ A 23 -7.352 -2.360 4.714 1.00 0.00 C HETATM 705 C5' PIQ A 23 -7.131 -2.396 3.333 1.00 0.00 C HETATM 706 C6' PIQ A 23 -5.910 -1.944 2.798 1.00 0.00 C HETATM 707 N3 PIQ A 23 0.066 0.367 1.575 1.00 0.00 N HETATM 708 CM PIQ A 23 0.611 -0.612 5.033 1.00 0.00 C HETATM 709 C3A PIQ A 23 -1.209 -0.045 1.932 1.00 0.00 C HETATM 710 N4 PIQ A 23 -2.286 -0.046 1.151 1.00 0.00 N HETATM 711 C5 PIQ A 23 -3.426 -0.494 1.717 1.00 0.00 C HETATM 0 HM3 PIQ A 23 1.399 -1.361 4.957 1.00 0.00 H new HETATM 0 HM2 PIQ A 23 1.014 0.294 5.486 1.00 0.00 H new HETATM 0 HM1 PIQ A 23 -0.198 -0.998 5.653 1.00 0.00 H new HETATM 0 H7 PIQ A 23 -2.374 -1.260 4.877 1.00 0.00 H new HETATM 0 H6' PIQ A 23 -5.756 -1.980 1.719 1.00 0.00 H new HETATM 0 H5' PIQ A 23 -7.907 -2.776 2.669 1.00 0.00 H new HETATM 0 H5 PIQ A 23 -4.323 -0.507 1.098 1.00 0.00 H new HETATM 0 H4' PIQ A 23 -8.297 -2.711 5.129 1.00 0.00 H new HETATM 0 H3' PIQ A 23 -6.512 -1.836 6.635 1.00 0.00 H new HETATM 0 H2' PIQ A 23 -4.359 -1.040 5.693 1.00 0.00 H new