USER MOD reduce.3.24.130724 H: found=0, std=0, add=261, rem=0, adj=6 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 Single : A 1 DC O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.32 (180deg=-1.32) USER MOD Single : A 8 DT C7 :methyl -30:sc= -2.84! (180deg=-4.41!) 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= -3.28! (180deg=-5.07!) USER MOD Single : B 20 DT C7 :methyl 150:sc= -0.531 (180deg=-0.531) USER MOD Single : B 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -10.295 13.893 -6.089 1.00 0.00 O ATOM 2 C5' DC A 1 -9.007 14.270 -5.565 1.00 0.00 C ATOM 3 C4' DC A 1 -7.948 14.103 -6.629 1.00 0.00 C ATOM 4 O4' DC A 1 -6.658 14.520 -6.103 1.00 0.00 O ATOM 5 C3' DC A 1 -7.694 12.676 -7.102 1.00 0.00 C ATOM 6 O3' DC A 1 -7.141 12.722 -8.420 1.00 0.00 O ATOM 7 C2' DC A 1 -6.626 12.160 -6.144 1.00 0.00 C ATOM 8 C1' DC A 1 -5.793 13.410 -5.914 1.00 0.00 C ATOM 9 N1 DC A 1 -5.265 13.489 -4.555 1.00 0.00 N ATOM 10 C2 DC A 1 -3.959 13.848 -4.336 1.00 0.00 C ATOM 11 O2 DC A 1 -3.210 14.112 -5.313 1.00 0.00 O ATOM 12 N3 DC A 1 -3.457 13.927 -3.129 1.00 0.00 N ATOM 13 C4 DC A 1 -4.262 13.643 -2.056 1.00 0.00 C ATOM 14 N4 DC A 1 -3.723 13.732 -0.843 1.00 0.00 N ATOM 15 C5 DC A 1 -5.629 13.263 -2.231 1.00 0.00 C ATOM 16 C6 DC A 1 -6.077 13.203 -3.503 1.00 0.00 C ATOM 0 H5' DC A 1 -8.764 13.655 -4.698 1.00 0.00 H new ATOM 0 H5'' DC A 1 -9.032 15.305 -5.225 1.00 0.00 H new ATOM 0 H4' DC A 1 -8.335 14.694 -7.459 1.00 0.00 H new ATOM 0 H3' DC A 1 -8.594 12.061 -7.119 1.00 0.00 H new ATOM 0 H2' DC A 1 -7.056 11.778 -5.218 1.00 0.00 H new ATOM 0 H2'' DC A 1 -6.040 11.351 -6.581 1.00 0.00 H new ATOM 0 HO5' DC A 1 -10.976 14.002 -5.393 1.00 0.00 H new ATOM 0 H1' DC A 1 -4.947 13.396 -6.601 1.00 0.00 H new ATOM 0 H41 DC A 1 -4.287 13.529 -0.018 1.00 0.00 H new ATOM 0 H42 DC A 1 -2.745 14.003 -0.738 1.00 0.00 H new ATOM 0 H5 DC A 1 -6.269 13.036 -1.391 1.00 0.00 H new ATOM 0 H6 DC A 1 -7.103 12.922 -3.689 1.00 0.00 H new ATOM 29 P DC A 2 -6.742 11.385 -9.203 1.00 0.00 P ATOM 30 OP1 DC A 2 -7.213 11.470 -10.604 1.00 0.00 O ATOM 31 OP2 DC A 2 -7.372 10.218 -8.544 1.00 0.00 O ATOM 32 O5' DC A 2 -5.148 11.403 -9.067 1.00 0.00 O ATOM 33 C5' DC A 2 -4.358 12.433 -9.692 1.00 0.00 C ATOM 34 C4' DC A 2 -2.895 12.064 -9.640 1.00 0.00 C ATOM 35 O4' DC A 2 -2.381 12.293 -8.298 1.00 0.00 O ATOM 36 C3' DC A 2 -2.563 10.599 -9.900 1.00 0.00 C ATOM 37 O3' DC A 2 -1.319 10.546 -10.604 1.00 0.00 O ATOM 38 C2' DC A 2 -2.364 9.945 -8.537 1.00 0.00 C ATOM 39 C1' DC A 2 -1.802 11.117 -7.750 1.00 0.00 C ATOM 40 N1 DC A 2 -2.162 11.065 -6.335 1.00 0.00 N ATOM 41 C2 DC A 2 -1.214 11.273 -5.367 1.00 0.00 C ATOM 42 O2 DC A 2 -0.022 11.511 -5.700 1.00 0.00 O ATOM 43 N3 DC A 2 -1.506 11.233 -4.091 1.00 0.00 N ATOM 44 C4 DC A 2 -2.799 10.976 -3.716 1.00 0.00 C ATOM 45 N4 DC A 2 -3.065 10.941 -2.414 1.00 0.00 N ATOM 46 C5 DC A 2 -3.826 10.752 -4.686 1.00 0.00 C ATOM 47 C6 DC A 2 -3.450 10.808 -5.982 1.00 0.00 C ATOM 0 H5' DC A 2 -4.520 13.385 -9.186 1.00 0.00 H new ATOM 0 H5'' DC A 2 -4.672 12.566 -10.727 1.00 0.00 H new ATOM 0 H4' DC A 2 -2.458 12.678 -10.427 1.00 0.00 H new ATOM 0 H3' DC A 2 -3.347 10.103 -10.473 1.00 0.00 H new ATOM 0 H2' DC A 2 -3.297 9.572 -8.116 1.00 0.00 H new ATOM 0 H2'' DC A 2 -1.673 9.103 -8.578 1.00 0.00 H new ATOM 0 H1' DC A 2 -0.714 11.095 -7.819 1.00 0.00 H new ATOM 0 H41 DC A 2 -4.015 10.753 -2.092 1.00 0.00 H new ATOM 0 H42 DC A 2 -2.320 11.102 -1.737 1.00 0.00 H new ATOM 0 H5 DC A 2 -4.847 10.549 -4.398 1.00 0.00 H new ATOM 0 H6 DC A 2 -4.187 10.645 -6.754 1.00 0.00 H new ATOM 59 P DA A 3 -0.667 9.149 -11.033 1.00 0.00 P ATOM 60 OP1 DA A 3 -0.227 9.220 -12.445 1.00 0.00 O ATOM 61 OP2 DA A 3 -1.665 8.067 -10.884 1.00 0.00 O ATOM 62 O5' DA A 3 0.548 9.036 -9.997 1.00 0.00 O ATOM 63 C5' DA A 3 1.596 10.023 -9.965 1.00 0.00 C ATOM 64 C4' DA A 3 2.692 9.584 -9.024 1.00 0.00 C ATOM 65 O4' DA A 3 2.269 9.804 -7.649 1.00 0.00 O ATOM 66 C3' DA A 3 3.048 8.102 -9.060 1.00 0.00 C ATOM 67 O3' DA A 3 4.472 7.992 -8.988 1.00 0.00 O ATOM 68 C2' DA A 3 2.465 7.462 -7.805 1.00 0.00 C ATOM 69 C1' DA A 3 2.468 8.646 -6.851 1.00 0.00 C ATOM 70 N9 DA A 3 1.382 8.586 -5.878 1.00 0.00 N ATOM 71 C8 DA A 3 0.052 8.405 -6.103 1.00 0.00 C ATOM 72 N7 DA A 3 -0.670 8.401 -4.986 1.00 0.00 N ATOM 73 C5 DA A 3 0.261 8.591 -3.985 1.00 0.00 C ATOM 74 C6 DA A 3 0.139 8.682 -2.585 1.00 0.00 C ATOM 75 N6 DA A 3 -1.022 8.587 -1.943 1.00 0.00 N ATOM 76 N1 DA A 3 1.281 8.877 -1.873 1.00 0.00 N ATOM 77 C2 DA A 3 2.468 8.972 -2.551 1.00 0.00 C ATOM 78 N3 DA A 3 2.688 8.902 -3.831 1.00 0.00 N ATOM 79 C4 DA A 3 1.535 8.708 -4.504 1.00 0.00 C ATOM 0 H5' DA A 3 1.193 10.983 -9.643 1.00 0.00 H new ATOM 0 H5'' DA A 3 2.002 10.167 -10.966 1.00 0.00 H new ATOM 0 H4' DA A 3 3.553 10.167 -9.352 1.00 0.00 H new ATOM 0 H3' DA A 3 2.666 7.624 -9.962 1.00 0.00 H new ATOM 0 H2' DA A 3 1.462 7.068 -7.970 1.00 0.00 H new ATOM 0 H2'' DA A 3 3.076 6.636 -7.440 1.00 0.00 H new ATOM 0 H1' DA A 3 3.407 8.651 -6.297 1.00 0.00 H new ATOM 0 H8 DA A 3 -0.373 8.278 -7.087 1.00 0.00 H new ATOM 0 H61 DA A 3 -1.050 8.661 -0.926 1.00 0.00 H new ATOM 0 H62 DA A 3 -1.884 8.441 -2.468 1.00 0.00 H new ATOM 0 H2 DA A 3 3.343 9.127 -1.937 1.00 0.00 H new ATOM 91 P DT A 4 5.194 6.564 -8.950 1.00 0.00 P ATOM 92 OP1 DT A 4 6.299 6.540 -9.934 1.00 0.00 O ATOM 93 OP2 DT A 4 4.217 5.504 -9.285 1.00 0.00 O ATOM 94 O5' DT A 4 5.698 6.504 -7.432 1.00 0.00 O ATOM 95 C5' DT A 4 6.574 7.513 -6.897 1.00 0.00 C ATOM 96 C4' DT A 4 6.905 7.199 -5.458 1.00 0.00 C ATOM 97 O4' DT A 4 5.713 7.369 -4.640 1.00 0.00 O ATOM 98 C3' DT A 4 7.358 5.770 -5.179 1.00 0.00 C ATOM 99 O3' DT A 4 8.591 5.833 -4.456 1.00 0.00 O ATOM 100 C2' DT A 4 6.316 5.130 -4.268 1.00 0.00 C ATOM 101 C1' DT A 4 5.627 6.342 -3.661 1.00 0.00 C ATOM 102 N1 DT A 4 4.213 6.109 -3.383 1.00 0.00 N ATOM 103 C2 DT A 4 3.771 6.193 -2.078 1.00 0.00 C ATOM 104 O2 DT A 4 4.497 6.454 -1.133 1.00 0.00 O ATOM 105 N3 DT A 4 2.423 5.958 -1.899 1.00 0.00 N ATOM 106 C4 DT A 4 1.512 5.657 -2.890 1.00 0.00 C ATOM 107 O4 DT A 4 0.323 5.468 -2.591 1.00 0.00 O ATOM 108 C5 DT A 4 2.040 5.587 -4.217 1.00 0.00 C ATOM 109 C7 DT A 4 1.098 5.262 -5.339 1.00 0.00 C ATOM 110 C6 DT A 4 3.348 5.812 -4.398 1.00 0.00 C ATOM 0 H5' DT A 4 6.099 8.492 -6.964 1.00 0.00 H new ATOM 0 H5'' DT A 4 7.489 7.562 -7.487 1.00 0.00 H new ATOM 0 H4' DT A 4 7.726 7.878 -5.227 1.00 0.00 H new ATOM 0 H3' DT A 4 7.477 5.205 -6.104 1.00 0.00 H new ATOM 0 H2' DT A 4 5.620 4.503 -4.825 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.774 4.499 -3.506 1.00 0.00 H new ATOM 0 H1' DT A 4 6.107 6.589 -2.714 1.00 0.00 H new ATOM 0 H3 DT A 4 2.067 6.012 -0.945 1.00 0.00 H new ATOM 0 H71 DT A 4 1.446 5.738 -6.256 1.00 0.00 H new ATOM 0 H72 DT A 4 1.061 4.182 -5.482 1.00 0.00 H new ATOM 0 H73 DT A 4 0.101 5.630 -5.095 1.00 0.00 H new ATOM 0 H6 DT A 4 3.741 5.755 -5.402 1.00 0.00 H new ATOM 123 P DC A 5 9.463 4.519 -4.184 1.00 0.00 P ATOM 124 OP1 DC A 5 10.896 4.880 -4.114 1.00 0.00 O ATOM 125 OP2 DC A 5 9.254 3.548 -5.282 1.00 0.00 O ATOM 126 O5' DC A 5 8.866 4.028 -2.783 1.00 0.00 O ATOM 127 C5' DC A 5 9.212 4.690 -1.552 1.00 0.00 C ATOM 128 C4' DC A 5 8.400 4.120 -0.413 1.00 0.00 C ATOM 129 O4' DC A 5 6.992 4.402 -0.651 1.00 0.00 O ATOM 130 C3' DC A 5 8.499 2.609 -0.230 1.00 0.00 C ATOM 131 O3' DC A 5 9.435 2.321 0.812 1.00 0.00 O ATOM 132 C2' DC A 5 7.092 2.276 0.254 1.00 0.00 C ATOM 133 C1' DC A 5 6.244 3.536 0.191 1.00 0.00 C ATOM 134 N1 DC A 5 4.935 3.320 -0.417 1.00 0.00 N ATOM 135 C2 DC A 5 3.800 3.338 0.353 1.00 0.00 C ATOM 136 O2 DC A 5 3.887 3.541 1.593 1.00 0.00 O ATOM 137 N3 DC A 5 2.611 3.147 -0.164 1.00 0.00 N ATOM 138 C4 DC A 5 2.502 2.925 -1.511 1.00 0.00 C ATOM 139 N4 DC A 5 1.281 2.736 -2.006 1.00 0.00 N ATOM 140 C5 DC A 5 3.654 2.897 -2.357 1.00 0.00 C ATOM 141 C6 DC A 5 4.845 3.101 -1.755 1.00 0.00 C ATOM 0 H5' DC A 5 9.027 5.761 -1.641 1.00 0.00 H new ATOM 0 H5'' DC A 5 10.276 4.566 -1.349 1.00 0.00 H new ATOM 0 H4' DC A 5 8.809 4.590 0.481 1.00 0.00 H new ATOM 0 H3' DC A 5 8.818 2.062 -1.117 1.00 0.00 H new ATOM 0 H2' DC A 5 6.654 1.494 -0.367 1.00 0.00 H new ATOM 0 H2'' DC A 5 7.124 1.893 1.274 1.00 0.00 H new ATOM 0 H1' DC A 5 6.050 3.917 1.194 1.00 0.00 H new ATOM 0 H41 DC A 5 1.156 2.567 -3.004 1.00 0.00 H new ATOM 0 H42 DC A 5 0.471 2.760 -1.387 1.00 0.00 H new ATOM 0 H5 DC A 5 3.576 2.722 -3.420 1.00 0.00 H new ATOM 0 H6 DC A 5 5.746 3.090 -2.350 1.00 0.00 H new ATOM 153 P DG A 6 10.170 0.904 0.901 1.00 0.00 P ATOM 154 OP1 DG A 6 11.526 1.080 1.469 1.00 0.00 O ATOM 155 OP2 DG A 6 10.279 0.314 -0.452 1.00 0.00 O ATOM 156 O5' DG A 6 9.181 0.095 1.866 1.00 0.00 O ATOM 157 C5' DG A 6 9.236 0.258 3.295 1.00 0.00 C ATOM 158 C4' DG A 6 7.909 -0.118 3.909 1.00 0.00 C ATOM 159 O4' DG A 6 6.829 0.417 3.093 1.00 0.00 O ATOM 160 C3' DG A 6 7.610 -1.611 3.988 1.00 0.00 C ATOM 161 O3' DG A 6 7.156 -1.898 5.313 1.00 0.00 O ATOM 162 C2' DG A 6 6.463 -1.903 3.027 1.00 0.00 C ATOM 163 C1' DG A 6 5.797 -0.541 2.919 1.00 0.00 C ATOM 164 N9 DG A 6 5.192 -0.312 1.611 1.00 0.00 N ATOM 165 C8 DG A 6 3.990 0.197 1.365 1.00 0.00 C ATOM 166 N7 DG A 6 3.783 0.256 0.052 1.00 0.00 N ATOM 167 C5 DG A 6 4.904 -0.240 -0.579 1.00 0.00 C ATOM 168 C6 DG A 6 5.260 -0.425 -1.942 1.00 0.00 C ATOM 169 O6 DG A 6 4.606 -0.168 -2.951 1.00 0.00 O ATOM 170 N1 DG A 6 6.532 -0.975 -2.050 1.00 0.00 N ATOM 171 C2 DG A 6 7.345 -1.299 -1.010 1.00 0.00 C ATOM 172 N2 DG A 6 8.536 -1.818 -1.339 1.00 0.00 N ATOM 173 N3 DG A 6 7.009 -1.125 0.255 1.00 0.00 N ATOM 174 C4 DG A 6 5.791 -0.598 0.401 1.00 0.00 C ATOM 0 H5' DG A 6 9.481 1.291 3.542 1.00 0.00 H new ATOM 0 H5'' DG A 6 10.028 -0.365 3.710 1.00 0.00 H new ATOM 0 H4' DG A 6 7.974 0.283 4.921 1.00 0.00 H new ATOM 0 H3' DG A 6 8.491 -2.203 3.741 1.00 0.00 H new ATOM 0 H2' DG A 6 6.819 -2.262 2.061 1.00 0.00 H new ATOM 0 H2'' DG A 6 5.784 -2.661 3.418 1.00 0.00 H new ATOM 0 H1' DG A 6 5.003 -0.473 3.662 1.00 0.00 H new ATOM 0 H8 DG A 6 3.285 0.516 2.119 1.00 0.00 H new ATOM 0 H1 DG A 6 6.886 -1.151 -2.990 1.00 0.00 H new ATOM 0 H21 DG A 6 9.196 -2.084 -0.608 1.00 0.00 H new ATOM 0 H22 DG A 6 8.782 -1.947 -2.320 1.00 0.00 H new ATOM 185 P DC A 7 6.958 -3.403 5.816 1.00 0.00 P ATOM 186 OP1 DC A 7 7.630 -3.584 7.123 1.00 0.00 O ATOM 187 OP2 DC A 7 7.545 -4.338 4.830 1.00 0.00 O ATOM 188 O5' DC A 7 5.364 -3.500 5.906 1.00 0.00 O ATOM 189 C5' DC A 7 4.625 -2.742 6.883 1.00 0.00 C ATOM 190 C4' DC A 7 3.251 -3.338 7.069 1.00 0.00 C ATOM 191 O4' DC A 7 2.379 -2.906 5.988 1.00 0.00 O ATOM 192 C3' DC A 7 3.166 -4.860 7.002 1.00 0.00 C ATOM 193 O3' DC A 7 2.082 -5.285 7.834 1.00 0.00 O ATOM 194 C2' DC A 7 2.816 -5.186 5.555 1.00 0.00 C ATOM 195 C1' DC A 7 1.928 -4.002 5.206 1.00 0.00 C ATOM 196 N1 DC A 7 2.037 -3.617 3.802 1.00 0.00 N ATOM 197 C2 DC A 7 0.919 -3.556 3.009 1.00 0.00 C ATOM 198 O2 DC A 7 -0.210 -3.833 3.495 1.00 0.00 O ATOM 199 N3 DC A 7 0.984 -3.213 1.747 1.00 0.00 N ATOM 200 C4 DC A 7 2.205 -2.909 1.205 1.00 0.00 C ATOM 201 N4 DC A 7 2.239 -2.565 -0.079 1.00 0.00 N ATOM 202 C5 DC A 7 3.401 -2.958 1.988 1.00 0.00 C ATOM 203 C6 DC A 7 3.257 -3.319 3.281 1.00 0.00 C ATOM 0 H5' DC A 7 4.539 -1.704 6.561 1.00 0.00 H new ATOM 0 H5'' DC A 7 5.160 -2.738 7.833 1.00 0.00 H new ATOM 0 H4' DC A 7 2.971 -3.003 8.068 1.00 0.00 H new ATOM 0 H3' DC A 7 4.089 -5.342 7.323 1.00 0.00 H new ATOM 0 H2' DC A 7 3.699 -5.243 4.918 1.00 0.00 H new ATOM 0 H2'' DC A 7 2.293 -6.138 5.460 1.00 0.00 H new ATOM 0 H1' DC A 7 0.891 -4.275 5.399 1.00 0.00 H new ATOM 0 H41 DC A 7 3.128 -2.331 -0.521 1.00 0.00 H new ATOM 0 H42 DC A 7 1.376 -2.535 -0.622 1.00 0.00 H new ATOM 0 H5 DC A 7 4.367 -2.719 1.568 1.00 0.00 H new ATOM 0 H6 DC A 7 4.130 -3.372 3.915 1.00 0.00 H new ATOM 215 P DT A 8 1.740 -6.837 8.022 1.00 0.00 P ATOM 216 OP1 DT A 8 1.553 -7.133 9.460 1.00 0.00 O ATOM 217 OP2 DT A 8 2.851 -7.658 7.493 1.00 0.00 O ATOM 218 O5' DT A 8 0.393 -6.969 7.169 1.00 0.00 O ATOM 219 C5' DT A 8 -0.762 -6.163 7.468 1.00 0.00 C ATOM 220 C4' DT A 8 -1.957 -6.665 6.694 1.00 0.00 C ATOM 221 O4' DT A 8 -1.870 -6.213 5.314 1.00 0.00 O ATOM 222 C3' DT A 8 -2.084 -8.180 6.569 1.00 0.00 C ATOM 223 O3' DT A 8 -3.466 -8.519 6.714 1.00 0.00 O ATOM 224 C2' DT A 8 -1.655 -8.555 5.154 1.00 0.00 C ATOM 225 C1' DT A 8 -2.031 -7.288 4.400 1.00 0.00 C ATOM 226 N1 DT A 8 -1.155 -7.035 3.259 1.00 0.00 N ATOM 227 C2 DT A 8 -1.726 -6.843 2.016 1.00 0.00 C ATOM 228 O2 DT A 8 -2.928 -6.872 1.812 1.00 0.00 O ATOM 229 N3 DT A 8 -0.831 -6.610 0.991 1.00 0.00 N ATOM 230 C4 DT A 8 0.542 -6.555 1.108 1.00 0.00 C ATOM 231 O4 DT A 8 1.232 -6.335 0.101 1.00 0.00 O ATOM 232 C5 DT A 8 1.062 -6.762 2.424 1.00 0.00 C ATOM 233 C7 DT A 8 2.549 -6.714 2.614 1.00 0.00 C ATOM 234 C6 DT A 8 0.199 -6.990 3.424 1.00 0.00 C ATOM 0 H5' DT A 8 -0.565 -5.122 7.213 1.00 0.00 H new ATOM 0 H5'' DT A 8 -0.971 -6.195 8.537 1.00 0.00 H new ATOM 0 H4' DT A 8 -2.802 -6.280 7.264 1.00 0.00 H new ATOM 0 H3' DT A 8 -1.479 -8.693 7.317 1.00 0.00 H new ATOM 0 H2' DT A 8 -0.589 -8.774 5.089 1.00 0.00 H new ATOM 0 H2'' DT A 8 -2.184 -9.432 4.780 1.00 0.00 H new ATOM 0 H1' DT A 8 -3.048 -7.391 4.021 1.00 0.00 H new ATOM 0 H3 DT A 8 -1.222 -6.465 0.060 1.00 0.00 H new ATOM 0 H71 DT A 8 3.043 -7.046 1.701 1.00 0.00 H new ATOM 0 H72 DT A 8 2.854 -5.692 2.841 1.00 0.00 H new ATOM 0 H73 DT A 8 2.832 -7.369 3.438 1.00 0.00 H new ATOM 0 H6 DT A 8 0.597 -7.147 4.416 1.00 0.00 H new ATOM 247 P DA A 9 -3.934 -10.037 6.898 1.00 0.00 P ATOM 248 OP1 DA A 9 -4.771 -10.155 8.113 1.00 0.00 O ATOM 249 OP2 DA A 9 -2.747 -10.910 7.034 1.00 0.00 O ATOM 250 O5' DA A 9 -4.749 -10.284 5.543 1.00 0.00 O ATOM 251 C5' DA A 9 -6.069 -9.743 5.357 1.00 0.00 C ATOM 252 C4' DA A 9 -6.559 -10.041 3.960 1.00 0.00 C ATOM 253 O4' DA A 9 -5.559 -9.618 2.991 1.00 0.00 O ATOM 254 C3' DA A 9 -6.774 -11.513 3.625 1.00 0.00 C ATOM 255 O3' DA A 9 -7.844 -11.604 2.680 1.00 0.00 O ATOM 256 C2' DA A 9 -5.493 -11.978 2.942 1.00 0.00 C ATOM 257 C1' DA A 9 -5.090 -10.708 2.210 1.00 0.00 C ATOM 258 N9 DA A 9 -3.642 -10.570 2.084 1.00 0.00 N ATOM 259 C8 DA A 9 -2.680 -10.873 2.997 1.00 0.00 C ATOM 260 N7 DA A 9 -1.450 -10.625 2.560 1.00 0.00 N ATOM 261 C5 DA A 9 -1.641 -10.131 1.286 1.00 0.00 C ATOM 262 C6 DA A 9 -0.739 -9.685 0.299 1.00 0.00 C ATOM 263 N6 DA A 9 0.581 -9.670 0.464 1.00 0.00 N ATOM 264 N1 DA A 9 -1.270 -9.251 -0.875 1.00 0.00 N ATOM 265 C2 DA A 9 -2.631 -9.273 -1.028 1.00 0.00 C ATOM 266 N3 DA A 9 -3.544 -9.662 -0.189 1.00 0.00 N ATOM 267 C4 DA A 9 -2.983 -10.085 0.965 1.00 0.00 C ATOM 0 H5' DA A 9 -6.056 -8.666 5.524 1.00 0.00 H new ATOM 0 H5'' DA A 9 -6.753 -10.171 6.090 1.00 0.00 H new ATOM 0 H4' DA A 9 -7.514 -9.517 3.917 1.00 0.00 H new ATOM 0 H3' DA A 9 -7.006 -12.107 4.509 1.00 0.00 H new ATOM 0 H2' DA A 9 -4.737 -12.302 3.657 1.00 0.00 H new ATOM 0 H2'' DA A 9 -5.666 -12.811 2.261 1.00 0.00 H new ATOM 0 H1' DA A 9 -5.512 -10.736 1.205 1.00 0.00 H new ATOM 0 H8 DA A 9 -2.894 -11.274 3.977 1.00 0.00 H new ATOM 0 H61 DA A 9 1.185 -9.336 -0.287 1.00 0.00 H new ATOM 0 H62 DA A 9 0.989 -9.993 1.341 1.00 0.00 H new ATOM 0 H2 DA A 9 -2.997 -8.917 -1.980 1.00 0.00 H new ATOM 279 P DC A 10 -8.423 -13.021 2.215 1.00 0.00 P ATOM 280 OP1 DC A 10 -9.836 -13.143 2.640 1.00 0.00 O ATOM 281 OP2 DC A 10 -7.629 -14.108 2.830 1.00 0.00 O ATOM 282 O5' DC A 10 -8.247 -12.929 0.628 1.00 0.00 O ATOM 283 C5' DC A 10 -8.840 -11.856 -0.128 1.00 0.00 C ATOM 284 C4' DC A 10 -8.308 -11.864 -1.542 1.00 0.00 C ATOM 285 O4' DC A 10 -6.895 -11.518 -1.533 1.00 0.00 O ATOM 286 C3' DC A 10 -8.343 -13.208 -2.262 1.00 0.00 C ATOM 287 O3' DC A 10 -8.694 -12.966 -3.627 1.00 0.00 O ATOM 288 C2' DC A 10 -6.925 -13.770 -2.235 1.00 0.00 C ATOM 289 C1' DC A 10 -6.115 -12.483 -2.224 1.00 0.00 C ATOM 290 N1 DC A 10 -4.849 -12.622 -1.512 1.00 0.00 N ATOM 291 C2 DC A 10 -3.663 -12.333 -2.137 1.00 0.00 C ATOM 292 O2 DC A 10 -3.665 -11.943 -3.335 1.00 0.00 O ATOM 293 N3 DC A 10 -2.511 -12.448 -1.524 1.00 0.00 N ATOM 294 C4 DC A 10 -2.494 -12.871 -0.221 1.00 0.00 C ATOM 295 N4 DC A 10 -1.309 -12.979 0.374 1.00 0.00 N ATOM 296 C5 DC A 10 -3.702 -13.187 0.476 1.00 0.00 C ATOM 297 C6 DC A 10 -4.850 -13.045 -0.219 1.00 0.00 C ATOM 0 H5' DC A 10 -8.619 -10.900 0.347 1.00 0.00 H new ATOM 0 H5'' DC A 10 -9.925 -11.964 -0.138 1.00 0.00 H new ATOM 0 H4' DC A 10 -8.963 -11.163 -2.059 1.00 0.00 H new ATOM 0 H3' DC A 10 -9.052 -13.892 -1.796 1.00 0.00 H new ATOM 0 H2' DC A 10 -6.739 -14.384 -1.354 1.00 0.00 H new ATOM 0 H2'' DC A 10 -6.708 -14.389 -3.106 1.00 0.00 H new ATOM 0 H1' DC A 10 -5.887 -12.204 -3.253 1.00 0.00 H new ATOM 0 H41 DC A 10 -1.252 -13.291 1.344 1.00 0.00 H new ATOM 0 H42 DC A 10 -0.458 -12.750 -0.139 1.00 0.00 H new ATOM 0 H5 DC A 10 -3.696 -13.521 1.503 1.00 0.00 H new ATOM 0 H6 DC A 10 -5.790 -13.272 0.262 1.00 0.00 H new ATOM 309 P DC A 11 -8.926 -14.173 -4.651 1.00 0.00 P ATOM 310 OP1 DC A 11 -10.190 -13.962 -5.390 1.00 0.00 O ATOM 311 OP2 DC A 11 -9.001 -15.450 -3.906 1.00 0.00 O ATOM 312 O5' DC A 11 -7.625 -14.058 -5.576 1.00 0.00 O ATOM 313 C5' DC A 11 -7.456 -12.958 -6.491 1.00 0.00 C ATOM 314 C4' DC A 11 -6.179 -13.132 -7.277 1.00 0.00 C ATOM 315 O4' DC A 11 -5.040 -13.083 -6.373 1.00 0.00 O ATOM 316 C3' DC A 11 -6.014 -14.467 -7.997 1.00 0.00 C ATOM 317 O3' DC A 11 -5.482 -14.202 -9.297 1.00 0.00 O ATOM 318 C2' DC A 11 -4.979 -15.278 -7.225 1.00 0.00 C ATOM 319 C1' DC A 11 -4.152 -14.169 -6.598 1.00 0.00 C ATOM 320 N1 DC A 11 -3.584 -14.551 -5.308 1.00 0.00 N ATOM 321 C2 DC A 11 -2.232 -14.478 -5.093 1.00 0.00 C ATOM 322 O2 DC A 11 -1.472 -14.077 -6.015 1.00 0.00 O ATOM 323 N3 DC A 11 -1.694 -14.815 -3.947 1.00 0.00 N ATOM 324 C4 DC A 11 -2.508 -15.252 -2.936 1.00 0.00 C ATOM 325 N4 DC A 11 -1.932 -15.586 -1.785 1.00 0.00 N ATOM 326 C5 DC A 11 -3.924 -15.347 -3.108 1.00 0.00 C ATOM 327 C6 DC A 11 -4.408 -14.984 -4.316 1.00 0.00 C ATOM 0 H5' DC A 11 -7.429 -12.017 -5.941 1.00 0.00 H new ATOM 0 H5'' DC A 11 -8.307 -12.905 -7.170 1.00 0.00 H new ATOM 0 H4' DC A 11 -6.229 -12.332 -8.015 1.00 0.00 H new ATOM 0 H3' DC A 11 -6.963 -14.999 -8.066 1.00 0.00 H new ATOM 0 H2' DC A 11 -5.437 -15.925 -6.477 1.00 0.00 H new ATOM 0 H2'' DC A 11 -4.385 -15.917 -7.878 1.00 0.00 H new ATOM 0 HO3' DC A 11 -5.365 -15.046 -9.781 1.00 0.00 H new ATOM 0 H1' DC A 11 -3.324 -13.928 -7.265 1.00 0.00 H new ATOM 0 H41 DC A 11 -2.502 -15.916 -1.006 1.00 0.00 H new ATOM 0 H42 DC A 11 -0.920 -15.512 -1.681 1.00 0.00 H new ATOM 0 H5 DC A 11 -4.572 -15.690 -2.315 1.00 0.00 H new ATOM 0 H6 DC A 11 -5.471 -15.039 -4.498 1.00 0.00 H new TER 339 DC A 11 ATOM 340 O5' DG B 12 10.217 -15.946 -2.503 1.00 0.00 O ATOM 341 C5' DG B 12 8.809 -16.150 -2.729 1.00 0.00 C ATOM 342 C4' DG B 12 8.379 -15.440 -3.990 1.00 0.00 C ATOM 343 O4' DG B 12 6.956 -15.645 -4.206 1.00 0.00 O ATOM 344 C3' DG B 12 8.522 -13.922 -3.985 1.00 0.00 C ATOM 345 O3' DG B 12 8.639 -13.470 -5.337 1.00 0.00 O ATOM 346 C2' DG B 12 7.192 -13.431 -3.421 1.00 0.00 C ATOM 347 C1' DG B 12 6.222 -14.446 -4.004 1.00 0.00 C ATOM 348 N9 DG B 12 5.119 -14.750 -3.098 1.00 0.00 N ATOM 349 C8 DG B 12 5.206 -15.112 -1.821 1.00 0.00 C ATOM 350 N7 DG B 12 3.988 -15.305 -1.320 1.00 0.00 N ATOM 351 C5 DG B 12 3.071 -15.055 -2.320 1.00 0.00 C ATOM 352 C6 DG B 12 1.653 -15.096 -2.380 1.00 0.00 C ATOM 353 O6 DG B 12 0.852 -15.382 -1.490 1.00 0.00 O ATOM 354 N1 DG B 12 1.203 -14.751 -3.648 1.00 0.00 N ATOM 355 C2 DG B 12 1.991 -14.416 -4.704 1.00 0.00 C ATOM 356 N2 DG B 12 1.347 -14.118 -5.841 1.00 0.00 N ATOM 357 N3 DG B 12 3.309 -14.381 -4.643 1.00 0.00 N ATOM 358 C4 DG B 12 3.781 -14.707 -3.438 1.00 0.00 C ATOM 0 H5' DG B 12 8.238 -15.776 -1.879 1.00 0.00 H new ATOM 0 H5'' DG B 12 8.596 -17.216 -2.812 1.00 0.00 H new ATOM 0 H4' DG B 12 9.039 -15.862 -4.748 1.00 0.00 H new ATOM 0 H3' DG B 12 9.386 -13.572 -3.419 1.00 0.00 H new ATOM 0 H2' DG B 12 7.183 -13.434 -2.331 1.00 0.00 H new ATOM 0 H2'' DG B 12 6.962 -12.414 -3.739 1.00 0.00 H new ATOM 0 HO5' DG B 12 10.487 -16.408 -1.682 1.00 0.00 H new ATOM 0 H1' DG B 12 5.798 -14.037 -4.921 1.00 0.00 H new ATOM 0 H8 DG B 12 6.128 -15.232 -1.272 1.00 0.00 H new ATOM 0 H1 DG B 12 0.194 -14.749 -3.800 1.00 0.00 H new ATOM 0 H21 DG B 12 1.876 -13.858 -6.673 1.00 0.00 H new ATOM 0 H22 DG B 12 0.328 -14.151 -5.874 1.00 0.00 H new ATOM 371 P DG B 13 8.738 -11.911 -5.687 1.00 0.00 P ATOM 372 OP1 DG B 13 9.758 -11.701 -6.737 1.00 0.00 O ATOM 373 OP2 DG B 13 9.119 -11.154 -4.473 1.00 0.00 O ATOM 374 O5' DG B 13 7.247 -11.604 -6.182 1.00 0.00 O ATOM 375 C5' DG B 13 6.691 -12.268 -7.331 1.00 0.00 C ATOM 376 C4' DG B 13 5.388 -11.616 -7.725 1.00 0.00 C ATOM 377 O4' DG B 13 4.341 -12.019 -6.800 1.00 0.00 O ATOM 378 C3' DG B 13 5.355 -10.093 -7.659 1.00 0.00 C ATOM 379 O3' DG B 13 4.570 -9.619 -8.757 1.00 0.00 O ATOM 380 C2' DG B 13 4.632 -9.718 -6.369 1.00 0.00 C ATOM 381 C1' DG B 13 3.680 -10.897 -6.233 1.00 0.00 C ATOM 382 N9 DG B 13 3.381 -11.217 -4.840 1.00 0.00 N ATOM 383 C8 DG B 13 4.253 -11.389 -3.851 1.00 0.00 C ATOM 384 N7 DG B 13 3.609 -11.669 -2.721 1.00 0.00 N ATOM 385 C5 DG B 13 2.257 -11.678 -2.992 1.00 0.00 C ATOM 386 C6 DG B 13 1.100 -11.911 -2.200 1.00 0.00 C ATOM 387 O6 DG B 13 1.028 -12.177 -1.002 1.00 0.00 O ATOM 388 N1 DG B 13 -0.053 -11.802 -2.967 1.00 0.00 N ATOM 389 C2 DG B 13 -0.097 -11.514 -4.296 1.00 0.00 C ATOM 390 N2 DG B 13 -1.320 -11.457 -4.841 1.00 0.00 N ATOM 391 N3 DG B 13 0.982 -11.298 -5.026 1.00 0.00 N ATOM 392 C4 DG B 13 2.113 -11.395 -4.324 1.00 0.00 C ATOM 0 H5' DG B 13 6.527 -13.322 -7.108 1.00 0.00 H new ATOM 0 H5'' DG B 13 7.395 -12.224 -8.162 1.00 0.00 H new ATOM 0 H4' DG B 13 5.254 -11.934 -8.759 1.00 0.00 H new ATOM 0 H3' DG B 13 6.359 -9.670 -7.694 1.00 0.00 H new ATOM 0 H2' DG B 13 5.312 -9.634 -5.522 1.00 0.00 H new ATOM 0 H2'' DG B 13 4.106 -8.767 -6.450 1.00 0.00 H new ATOM 0 H1' DG B 13 2.740 -10.649 -6.726 1.00 0.00 H new ATOM 0 H8 DG B 13 5.326 -11.313 -3.950 1.00 0.00 H new ATOM 0 H1 DG B 13 -0.944 -11.951 -2.493 1.00 0.00 H new ATOM 0 H21 DG B 13 -1.427 -11.246 -5.833 1.00 0.00 H new ATOM 0 H22 DG B 13 -2.144 -11.625 -4.264 1.00 0.00 H new ATOM 404 P DT B 14 4.399 -8.055 -9.044 1.00 0.00 P ATOM 405 OP1 DT B 14 4.798 -7.760 -10.438 1.00 0.00 O ATOM 406 OP2 DT B 14 5.256 -7.284 -8.116 1.00 0.00 O ATOM 407 O5' DT B 14 2.835 -7.853 -8.776 1.00 0.00 O ATOM 408 C5' DT B 14 1.856 -8.708 -9.396 1.00 0.00 C ATOM 409 C4' DT B 14 0.476 -8.370 -8.884 1.00 0.00 C ATOM 410 O4' DT B 14 0.331 -8.854 -7.520 1.00 0.00 O ATOM 411 C3' DT B 14 0.149 -6.884 -8.776 1.00 0.00 C ATOM 412 O3' DT B 14 -1.193 -6.696 -9.233 1.00 0.00 O ATOM 413 C2' DT B 14 0.196 -6.512 -7.298 1.00 0.00 C ATOM 414 C1' DT B 14 -0.168 -7.843 -6.658 1.00 0.00 C ATOM 415 N1 DT B 14 0.454 -8.025 -5.350 1.00 0.00 N ATOM 416 C2 DT B 14 -0.344 -8.363 -4.276 1.00 0.00 C ATOM 417 O2 DT B 14 -1.551 -8.518 -4.353 1.00 0.00 O ATOM 418 N3 DT B 14 0.321 -8.517 -3.076 1.00 0.00 N ATOM 419 C4 DT B 14 1.678 -8.366 -2.874 1.00 0.00 C ATOM 420 O4 DT B 14 2.149 -8.535 -1.740 1.00 0.00 O ATOM 421 C5 DT B 14 2.442 -8.016 -4.031 1.00 0.00 C ATOM 422 C7 DT B 14 3.924 -7.839 -3.875 1.00 0.00 C ATOM 423 C6 DT B 14 1.803 -7.865 -5.198 1.00 0.00 C ATOM 0 H5' DT B 14 2.086 -9.752 -9.183 1.00 0.00 H new ATOM 0 H5'' DT B 14 1.890 -8.588 -10.479 1.00 0.00 H new ATOM 0 H4' DT B 14 -0.184 -8.829 -9.620 1.00 0.00 H new ATOM 0 H3' DT B 14 0.846 -6.282 -9.358 1.00 0.00 H new ATOM 0 H2' DT B 14 1.181 -6.162 -6.991 1.00 0.00 H new ATOM 0 H2'' DT B 14 -0.515 -5.725 -7.047 1.00 0.00 H new ATOM 0 H1' DT B 14 -1.248 -7.883 -6.518 1.00 0.00 H new ATOM 0 H3 DT B 14 -0.243 -8.765 -2.263 1.00 0.00 H new ATOM 0 H71 DT B 14 4.144 -7.489 -2.867 1.00 0.00 H new ATOM 0 H72 DT B 14 4.424 -8.792 -4.046 1.00 0.00 H new ATOM 0 H73 DT B 14 4.281 -7.107 -4.599 1.00 0.00 H new ATOM 0 H6 DT B 14 2.386 -7.602 -6.068 1.00 0.00 H new ATOM 436 P DA B 15 -1.764 -5.237 -9.554 1.00 0.00 P ATOM 437 OP1 DA B 15 -1.927 -5.076 -11.017 1.00 0.00 O ATOM 438 OP2 DA B 15 -0.822 -4.213 -9.050 1.00 0.00 O ATOM 439 O5' DA B 15 -3.155 -5.261 -8.763 1.00 0.00 O ATOM 440 C5' DA B 15 -4.183 -6.215 -9.089 1.00 0.00 C ATOM 441 C4' DA B 15 -5.279 -6.169 -8.052 1.00 0.00 C ATOM 442 O4' DA B 15 -4.722 -6.454 -6.738 1.00 0.00 O ATOM 443 C3' DA B 15 -5.962 -4.819 -7.858 1.00 0.00 C ATOM 444 O3' DA B 15 -7.285 -5.047 -7.367 1.00 0.00 O ATOM 445 C2' DA B 15 -5.153 -4.131 -6.764 1.00 0.00 C ATOM 446 C1' DA B 15 -4.779 -5.317 -5.889 1.00 0.00 C ATOM 447 N9 DA B 15 -3.466 -5.163 -5.270 1.00 0.00 N ATOM 448 C8 DA B 15 -2.337 -4.625 -5.804 1.00 0.00 C ATOM 449 N7 DA B 15 -1.305 -4.639 -4.964 1.00 0.00 N ATOM 450 C5 DA B 15 -1.811 -5.226 -3.822 1.00 0.00 C ATOM 451 C6 DA B 15 -1.227 -5.528 -2.576 1.00 0.00 C ATOM 452 N6 DA B 15 0.042 -5.266 -2.279 1.00 0.00 N ATOM 453 N1 DA B 15 -2.022 -6.120 -1.646 1.00 0.00 N ATOM 454 C2 DA B 15 -3.327 -6.383 -1.971 1.00 0.00 C ATOM 455 N3 DA B 15 -3.959 -6.146 -3.082 1.00 0.00 N ATOM 456 C4 DA B 15 -3.141 -5.560 -3.981 1.00 0.00 C ATOM 0 H5' DA B 15 -3.758 -7.218 -9.136 1.00 0.00 H new ATOM 0 H5'' DA B 15 -4.594 -5.996 -10.074 1.00 0.00 H new ATOM 0 H4' DA B 15 -6.004 -6.891 -8.428 1.00 0.00 H new ATOM 0 H3' DA B 15 -6.014 -4.235 -8.777 1.00 0.00 H new ATOM 0 H2' DA B 15 -4.276 -3.618 -7.160 1.00 0.00 H new ATOM 0 H2'' DA B 15 -5.739 -3.388 -6.223 1.00 0.00 H new ATOM 0 H1' DA B 15 -5.517 -5.407 -5.092 1.00 0.00 H new ATOM 0 H8 DA B 15 -2.283 -4.227 -6.807 1.00 0.00 H new ATOM 0 H61 DA B 15 0.411 -5.507 -1.359 1.00 0.00 H new ATOM 0 H62 DA B 15 0.647 -4.824 -2.971 1.00 0.00 H new ATOM 0 H2 DA B 15 -3.913 -6.853 -1.195 1.00 0.00 H new ATOM 468 P DG B 16 -8.288 -3.832 -7.084 1.00 0.00 P ATOM 469 OP1 DG B 16 -9.682 -4.276 -7.306 1.00 0.00 O ATOM 470 OP2 DG B 16 -7.979 -2.710 -7.998 1.00 0.00 O ATOM 471 O5' DG B 16 -7.964 -3.507 -5.551 1.00 0.00 O ATOM 472 C5' DG B 16 -8.337 -4.419 -4.500 1.00 0.00 C ATOM 473 C4' DG B 16 -7.869 -3.889 -3.167 1.00 0.00 C ATOM 474 O4' DG B 16 -6.428 -4.067 -3.067 1.00 0.00 O ATOM 475 C3' DG B 16 -8.124 -2.405 -2.924 1.00 0.00 C ATOM 476 O3' DG B 16 -9.286 -2.258 -2.104 1.00 0.00 O ATOM 477 C2' DG B 16 -6.891 -2.009 -2.121 1.00 0.00 C ATOM 478 C1' DG B 16 -5.970 -3.214 -2.029 1.00 0.00 C ATOM 479 N9 DG B 16 -4.570 -2.890 -2.283 1.00 0.00 N ATOM 480 C8 DG B 16 -4.047 -2.416 -3.410 1.00 0.00 C ATOM 481 N7 DG B 16 -2.736 -2.243 -3.267 1.00 0.00 N ATOM 482 C5 DG B 16 -2.394 -2.623 -1.985 1.00 0.00 C ATOM 483 C6 DG B 16 -1.168 -2.661 -1.270 1.00 0.00 C ATOM 484 O6 DG B 16 -0.043 -2.340 -1.650 1.00 0.00 O ATOM 485 N1 DG B 16 -1.364 -3.136 0.022 1.00 0.00 N ATOM 486 C2 DG B 16 -2.557 -3.520 0.552 1.00 0.00 C ATOM 487 N2 DG B 16 -2.520 -3.948 1.820 1.00 0.00 N ATOM 488 N3 DG B 16 -3.693 -3.482 -0.119 1.00 0.00 N ATOM 489 C4 DG B 16 -3.546 -3.030 -1.366 1.00 0.00 C ATOM 0 H5' DG B 16 -7.898 -5.399 -4.685 1.00 0.00 H new ATOM 0 H5'' DG B 16 -9.419 -4.551 -4.489 1.00 0.00 H new ATOM 0 H4' DG B 16 -8.445 -4.450 -2.431 1.00 0.00 H new ATOM 0 H3' DG B 16 -8.281 -1.818 -3.829 1.00 0.00 H new ATOM 0 H2' DG B 16 -6.378 -1.175 -2.601 1.00 0.00 H new ATOM 0 H2'' DG B 16 -7.179 -1.675 -1.124 1.00 0.00 H new ATOM 0 H1' DG B 16 -6.002 -3.643 -1.028 1.00 0.00 H new ATOM 0 H8 DG B 16 -4.605 -2.203 -4.310 1.00 0.00 H new ATOM 0 H1 DG B 16 -0.543 -3.202 0.624 1.00 0.00 H new ATOM 0 H21 DG B 16 -3.378 -4.251 2.281 1.00 0.00 H new ATOM 0 H22 DG B 16 -1.634 -3.971 2.325 1.00 0.00 H new ATOM 501 P DC B 17 -9.976 -0.830 -1.888 1.00 0.00 P ATOM 502 OP1 DC B 17 -11.376 -1.016 -1.448 1.00 0.00 O ATOM 503 OP2 DC B 17 -9.958 -0.073 -3.159 1.00 0.00 O ATOM 504 O5' DC B 17 -9.037 -0.193 -0.760 1.00 0.00 O ATOM 505 C5' DC B 17 -8.948 -0.777 0.554 1.00 0.00 C ATOM 506 C4' DC B 17 -7.839 -0.119 1.338 1.00 0.00 C ATOM 507 O4' DC B 17 -6.683 0.076 0.476 1.00 0.00 O ATOM 508 C3' DC B 17 -8.136 1.278 1.871 1.00 0.00 C ATOM 509 O3' DC B 17 -7.668 1.342 3.221 1.00 0.00 O ATOM 510 C2' DC B 17 -7.320 2.269 1.047 1.00 0.00 C ATOM 511 C1' DC B 17 -6.163 1.392 0.594 1.00 0.00 C ATOM 512 N1 DC B 17 -5.639 1.782 -0.711 1.00 0.00 N ATOM 513 C2 DC B 17 -4.977 0.873 -1.495 1.00 0.00 C ATOM 514 O2 DC B 17 -4.821 -0.310 -1.088 1.00 0.00 O ATOM 515 N3 DC B 17 -4.495 1.193 -2.671 1.00 0.00 N ATOM 516 C4 DC B 17 -4.658 2.475 -3.126 1.00 0.00 C ATOM 517 N4 DC B 17 -4.158 2.770 -4.322 1.00 0.00 N ATOM 518 C5 DC B 17 -5.339 3.462 -2.346 1.00 0.00 C ATOM 519 C6 DC B 17 -5.809 3.059 -1.146 1.00 0.00 C ATOM 0 H5' DC B 17 -8.761 -1.848 0.473 1.00 0.00 H new ATOM 0 H5'' DC B 17 -9.896 -0.658 1.079 1.00 0.00 H new ATOM 0 H4' DC B 17 -7.690 -0.797 2.179 1.00 0.00 H new ATOM 0 H3' DC B 17 -9.201 1.502 1.816 1.00 0.00 H new ATOM 0 H2' DC B 17 -7.886 2.670 0.206 1.00 0.00 H new ATOM 0 H2'' DC B 17 -6.984 3.120 1.640 1.00 0.00 H new ATOM 0 H1' DC B 17 -5.349 1.480 1.314 1.00 0.00 H new ATOM 0 H41 DC B 17 -4.258 3.713 -4.698 1.00 0.00 H new ATOM 0 H42 DC B 17 -3.675 2.053 -4.864 1.00 0.00 H new ATOM 0 H5 DC B 17 -5.470 4.475 -2.698 1.00 0.00 H new ATOM 0 H6 DC B 17 -6.331 3.766 -0.518 1.00 0.00 H new ATOM 531 P DG B 18 -8.124 2.518 4.204 1.00 0.00 P ATOM 532 OP1 DG B 18 -9.214 2.038 5.082 1.00 0.00 O ATOM 533 OP2 DG B 18 -8.606 3.671 3.411 1.00 0.00 O ATOM 534 O5' DG B 18 -6.764 2.818 4.992 1.00 0.00 O ATOM 535 C5' DG B 18 -6.372 2.028 6.131 1.00 0.00 C ATOM 536 C4' DG B 18 -4.996 2.441 6.596 1.00 0.00 C ATOM 537 O4' DG B 18 -4.013 2.099 5.580 1.00 0.00 O ATOM 538 C3' DG B 18 -4.781 3.935 6.808 1.00 0.00 C ATOM 539 O3' DG B 18 -3.895 4.102 7.919 1.00 0.00 O ATOM 540 C2' DG B 18 -4.077 4.457 5.561 1.00 0.00 C ATOM 541 C1' DG B 18 -3.264 3.234 5.171 1.00 0.00 C ATOM 542 N9 DG B 18 -3.061 3.133 3.728 1.00 0.00 N ATOM 543 C8 DG B 18 -3.999 3.013 2.793 1.00 0.00 C ATOM 544 N7 DG B 18 -3.436 2.948 1.590 1.00 0.00 N ATOM 545 C5 DG B 18 -2.069 3.033 1.754 1.00 0.00 C ATOM 546 C6 DG B 18 -0.972 3.020 0.853 1.00 0.00 C ATOM 547 O6 DG B 18 -0.982 2.925 -0.373 1.00 0.00 O ATOM 548 N1 DG B 18 0.233 3.136 1.539 1.00 0.00 N ATOM 549 C2 DG B 18 0.367 3.247 2.887 1.00 0.00 C ATOM 550 N2 DG B 18 1.624 3.347 3.341 1.00 0.00 N ATOM 551 N3 DG B 18 -0.657 3.258 3.720 1.00 0.00 N ATOM 552 C4 DG B 18 -1.833 3.149 3.099 1.00 0.00 C ATOM 0 H5' DG B 18 -6.374 0.970 5.868 1.00 0.00 H new ATOM 0 H5'' DG B 18 -7.092 2.157 6.939 1.00 0.00 H new ATOM 0 H4' DG B 18 -4.892 1.923 7.549 1.00 0.00 H new ATOM 0 H3' DG B 18 -5.721 4.456 6.989 1.00 0.00 H new ATOM 0 H2' DG B 18 -4.779 4.754 4.782 1.00 0.00 H new ATOM 0 H2'' DG B 18 -3.449 5.323 5.771 1.00 0.00 H new ATOM 0 H1' DG B 18 -2.283 3.301 5.642 1.00 0.00 H new ATOM 0 H8 DG B 18 -5.061 2.974 2.983 1.00 0.00 H new ATOM 0 H1 DG B 18 1.088 3.138 0.983 1.00 0.00 H new ATOM 0 H21 DG B 18 1.799 3.433 4.342 1.00 0.00 H new ATOM 0 H22 DG B 18 2.405 3.337 2.685 1.00 0.00 H new ATOM 564 P DA B 19 -3.699 5.527 8.620 1.00 0.00 P ATOM 565 OP1 DA B 19 -3.813 5.378 10.088 1.00 0.00 O ATOM 566 OP2 DA B 19 -4.740 6.463 8.140 1.00 0.00 O ATOM 567 O5' DA B 19 -2.226 5.917 8.135 1.00 0.00 O ATOM 568 C5' DA B 19 -1.066 5.233 8.646 1.00 0.00 C ATOM 569 C4' DA B 19 0.190 5.841 8.070 1.00 0.00 C ATOM 570 O4' DA B 19 0.287 5.505 6.658 1.00 0.00 O ATOM 571 C3' DA B 19 0.264 7.364 8.094 1.00 0.00 C ATOM 572 O3' DA B 19 1.551 7.732 8.598 1.00 0.00 O ATOM 573 C2' DA B 19 0.169 7.853 6.652 1.00 0.00 C ATOM 574 C1' DA B 19 0.658 6.636 5.884 1.00 0.00 C ATOM 575 N9 DA B 19 0.028 6.506 4.573 1.00 0.00 N ATOM 576 C8 DA B 19 -1.297 6.503 4.268 1.00 0.00 C ATOM 577 N7 DA B 19 -1.531 6.365 2.966 1.00 0.00 N ATOM 578 C5 DA B 19 -0.274 6.276 2.407 1.00 0.00 C ATOM 579 C6 DA B 19 0.160 6.120 1.075 1.00 0.00 C ATOM 580 N6 DA B 19 -0.669 6.025 0.040 1.00 0.00 N ATOM 581 N1 DA B 19 1.502 6.067 0.863 1.00 0.00 N ATOM 582 C2 DA B 19 2.341 6.166 1.941 1.00 0.00 C ATOM 583 N3 DA B 19 2.047 6.311 3.200 1.00 0.00 N ATOM 584 C4 DA B 19 0.709 6.360 3.373 1.00 0.00 C ATOM 0 H5' DA B 19 -1.117 4.174 8.391 1.00 0.00 H new ATOM 0 H5'' DA B 19 -1.045 5.299 9.734 1.00 0.00 H new ATOM 0 H4' DA B 19 0.981 5.438 8.703 1.00 0.00 H new ATOM 0 H3' DA B 19 -0.531 7.788 8.707 1.00 0.00 H new ATOM 0 H2' DA B 19 -0.850 8.128 6.379 1.00 0.00 H new ATOM 0 H2'' DA B 19 0.794 8.728 6.474 1.00 0.00 H new ATOM 0 H1' DA B 19 1.732 6.726 5.722 1.00 0.00 H new ATOM 0 H8 DA B 19 -2.079 6.602 5.007 1.00 0.00 H new ATOM 0 H61 DA B 19 -0.297 5.913 -0.903 1.00 0.00 H new ATOM 0 H62 DA B 19 -1.677 6.064 0.189 1.00 0.00 H new ATOM 0 H2 DA B 19 3.396 6.117 1.714 1.00 0.00 H new ATOM 596 P DT B 20 1.942 9.266 8.835 1.00 0.00 P ATOM 597 OP1 DT B 20 2.652 9.402 10.127 1.00 0.00 O ATOM 598 OP2 DT B 20 0.716 10.093 8.859 1.00 0.00 O ATOM 599 O5' DT B 20 2.875 9.553 7.567 1.00 0.00 O ATOM 600 C5' DT B 20 3.967 8.676 7.230 1.00 0.00 C ATOM 601 C4' DT B 20 4.462 8.981 5.836 1.00 0.00 C ATOM 602 O4' DT B 20 3.463 8.544 4.873 1.00 0.00 O ATOM 603 C3' DT B 20 4.709 10.456 5.536 1.00 0.00 C ATOM 604 O3' DT B 20 6.120 10.680 5.474 1.00 0.00 O ATOM 605 C2' DT B 20 4.124 10.642 4.140 1.00 0.00 C ATOM 606 C1' DT B 20 3.667 9.271 3.670 1.00 0.00 C ATOM 607 N1 DT B 20 2.405 9.306 2.936 1.00 0.00 N ATOM 608 C2 DT B 20 2.427 9.116 1.569 1.00 0.00 C ATOM 609 O2 DT B 20 3.447 8.916 0.930 1.00 0.00 O ATOM 610 N3 DT B 20 1.194 9.164 0.951 1.00 0.00 N ATOM 611 C4 DT B 20 -0.019 9.381 1.572 1.00 0.00 C ATOM 612 O4 DT B 20 -1.057 9.400 0.893 1.00 0.00 O ATOM 613 C5 DT B 20 0.035 9.571 2.988 1.00 0.00 C ATOM 614 C7 DT B 20 -1.252 9.811 3.720 1.00 0.00 C ATOM 615 C6 DT B 20 1.228 9.525 3.594 1.00 0.00 C ATOM 0 H5' DT B 20 3.642 7.637 7.290 1.00 0.00 H new ATOM 0 H5'' DT B 20 4.778 8.799 7.948 1.00 0.00 H new ATOM 0 H4' DT B 20 5.417 8.460 5.764 1.00 0.00 H new ATOM 0 H3' DT B 20 4.279 11.127 6.279 1.00 0.00 H new ATOM 0 H2' DT B 20 3.289 11.342 4.161 1.00 0.00 H new ATOM 0 H2'' DT B 20 4.869 11.055 3.460 1.00 0.00 H new ATOM 0 H1' DT B 20 4.402 8.840 2.990 1.00 0.00 H new ATOM 0 H3 DT B 20 1.178 9.026 -0.060 1.00 0.00 H new ATOM 0 H71 DT B 20 -1.172 9.421 4.735 1.00 0.00 H new ATOM 0 H72 DT B 20 -1.455 10.881 3.758 1.00 0.00 H new ATOM 0 H73 DT B 20 -2.066 9.305 3.200 1.00 0.00 H new ATOM 0 H6 DT B 20 1.262 9.669 4.664 1.00 0.00 H new ATOM 628 P DG B 21 6.728 12.160 5.506 1.00 0.00 P ATOM 629 OP1 DG B 21 8.140 12.108 5.947 1.00 0.00 O ATOM 630 OP2 DG B 21 5.952 12.996 6.448 1.00 0.00 O ATOM 631 O5' DG B 21 6.559 12.604 3.979 1.00 0.00 O ATOM 632 C5' DG B 21 7.344 11.999 2.935 1.00 0.00 C ATOM 633 C4' DG B 21 6.863 12.474 1.585 1.00 0.00 C ATOM 634 O4' DG B 21 5.578 11.855 1.296 1.00 0.00 O ATOM 635 C3' DG B 21 6.635 13.977 1.461 1.00 0.00 C ATOM 636 O3' DG B 21 7.687 14.537 0.671 1.00 0.00 O ATOM 637 C2' DG B 21 5.330 14.074 0.679 1.00 0.00 C ATOM 638 C1' DG B 21 4.917 12.654 0.326 1.00 0.00 C ATOM 639 N9 DG B 21 3.480 12.427 0.446 1.00 0.00 N ATOM 640 C8 DG B 21 2.763 12.398 1.566 1.00 0.00 C ATOM 641 N7 DG B 21 1.485 12.164 1.282 1.00 0.00 N ATOM 642 C5 DG B 21 1.369 12.036 -0.087 1.00 0.00 C ATOM 643 C6 DG B 21 0.276 11.786 -0.959 1.00 0.00 C ATOM 644 O6 DG B 21 -0.909 11.613 -0.678 1.00 0.00 O ATOM 645 N1 DG B 21 0.698 11.750 -2.283 1.00 0.00 N ATOM 646 C2 DG B 21 1.976 11.926 -2.711 1.00 0.00 C ATOM 647 N2 DG B 21 2.163 11.852 -4.036 1.00 0.00 N ATOM 648 N3 DG B 21 2.988 12.159 -1.896 1.00 0.00 N ATOM 649 C4 DG B 21 2.624 12.201 -0.613 1.00 0.00 C ATOM 0 H5' DG B 21 7.269 10.913 2.995 1.00 0.00 H new ATOM 0 H5'' DG B 21 8.396 12.254 3.066 1.00 0.00 H new ATOM 0 H4' DG B 21 7.663 12.199 0.897 1.00 0.00 H new ATOM 0 H3' DG B 21 6.607 14.494 2.420 1.00 0.00 H new ATOM 0 H2' DG B 21 4.559 14.563 1.274 1.00 0.00 H new ATOM 0 H2'' DG B 21 5.464 14.672 -0.222 1.00 0.00 H new ATOM 0 H1' DG B 21 5.174 12.430 -0.709 1.00 0.00 H new ATOM 0 H8 DG B 21 3.160 12.543 2.560 1.00 0.00 H new ATOM 0 H1 DG B 21 -0.012 11.577 -2.994 1.00 0.00 H new ATOM 0 H21 DG B 21 3.097 11.975 -4.427 1.00 0.00 H new ATOM 0 H22 DG B 21 1.371 11.673 -4.654 1.00 0.00 H new ATOM 661 P DG B 22 7.895 16.121 0.566 1.00 0.00 P ATOM 662 OP1 DG B 22 9.327 16.418 0.338 1.00 0.00 O ATOM 663 OP2 DG B 22 7.456 16.763 1.824 1.00 0.00 O ATOM 664 O5' DG B 22 6.967 16.480 -0.686 1.00 0.00 O ATOM 665 C5' DG B 22 7.261 15.976 -2.003 1.00 0.00 C ATOM 666 C4' DG B 22 6.280 16.539 -3.003 1.00 0.00 C ATOM 667 O4' DG B 22 5.011 15.837 -2.889 1.00 0.00 O ATOM 668 C3' DG B 22 5.901 18.003 -2.814 1.00 0.00 C ATOM 669 O3' DG B 22 5.858 18.616 -4.106 1.00 0.00 O ATOM 670 C2' DG B 22 4.491 18.039 -2.234 1.00 0.00 C ATOM 671 C1' DG B 22 3.922 16.742 -2.786 1.00 0.00 C ATOM 672 N9 DG B 22 2.929 16.143 -1.900 1.00 0.00 N ATOM 673 C8 DG B 22 3.052 15.913 -0.596 1.00 0.00 C ATOM 674 N7 DG B 22 1.940 15.353 -0.126 1.00 0.00 N ATOM 675 C5 DG B 22 1.055 15.215 -1.176 1.00 0.00 C ATOM 676 C6 DG B 22 -0.262 14.696 -1.285 1.00 0.00 C ATOM 677 O6 DG B 22 -0.975 14.213 -0.406 1.00 0.00 O ATOM 678 N1 DG B 22 -0.721 14.787 -2.593 1.00 0.00 N ATOM 679 C2 DG B 22 -0.026 15.299 -3.643 1.00 0.00 C ATOM 680 N2 DG B 22 -0.661 15.291 -4.824 1.00 0.00 N ATOM 681 N3 DG B 22 1.198 15.781 -3.535 1.00 0.00 N ATOM 682 C4 DG B 22 1.677 15.711 -2.291 1.00 0.00 C ATOM 0 H5' DG B 22 7.210 14.887 -2.004 1.00 0.00 H new ATOM 0 H5'' DG B 22 8.278 16.247 -2.286 1.00 0.00 H new ATOM 0 H4' DG B 22 6.799 16.423 -3.955 1.00 0.00 H new ATOM 0 H3' DG B 22 6.611 18.514 -2.164 1.00 0.00 H new ATOM 0 H2' DG B 22 4.493 18.059 -1.144 1.00 0.00 H new ATOM 0 H2'' DG B 22 3.929 18.912 -2.567 1.00 0.00 H new ATOM 0 HO3' DG B 22 5.614 19.560 -4.012 1.00 0.00 H new ATOM 0 H1' DG B 22 3.433 16.948 -3.738 1.00 0.00 H new ATOM 0 H8 DG B 22 3.926 16.146 -0.005 1.00 0.00 H new ATOM 0 H1 DG B 22 -1.661 14.439 -2.782 1.00 0.00 H new ATOM 0 H21 DG B 22 -0.198 15.660 -5.654 1.00 0.00 H new ATOM 0 H22 DG B 22 -1.607 14.916 -4.892 1.00 0.00 H new TER 694 DG B 22 HETATM 695 N PIQ A 23 3.071 0.617 2.349 1.00 0.00 N HETATM 696 C2 PIQ A 23 1.708 0.268 2.263 1.00 0.00 C HETATM 697 N1 PIQ A 23 1.016 -0.228 3.306 1.00 0.00 N HETATM 698 C7A PIQ A 23 -0.271 -0.444 2.841 1.00 0.00 C HETATM 699 C7 PIQ A 23 -1.426 -0.941 3.454 1.00 0.00 C HETATM 700 C6 PIQ A 23 -2.602 -1.031 2.664 1.00 0.00 C HETATM 701 C1' PIQ A 23 -3.914 -1.562 3.248 1.00 0.00 C HETATM 702 C2' PIQ A 23 -4.117 -1.637 4.648 1.00 0.00 C HETATM 703 C3' PIQ A 23 -5.318 -2.123 5.195 1.00 0.00 C HETATM 704 C4' PIQ A 23 -6.355 -2.550 4.355 1.00 0.00 C HETATM 705 C5' PIQ A 23 -6.181 -2.487 2.966 1.00 0.00 C HETATM 706 C6' PIQ A 23 -4.979 -2.001 2.423 1.00 0.00 C HETATM 707 N3 PIQ A 23 0.961 0.388 1.161 1.00 0.00 N HETATM 708 CM PIQ A 23 1.533 -0.481 4.645 1.00 0.00 C HETATM 709 C3A PIQ A 23 -0.298 -0.065 1.526 1.00 0.00 C HETATM 710 N4 PIQ A 23 -1.372 -0.129 0.742 1.00 0.00 N HETATM 711 C5 PIQ A 23 -2.496 -0.605 1.319 1.00 0.00 C HETATM 0 HN1 PIQ A 23 3.574 0.497 3.228 1.00 0.00 H new HETATM 0 HM3 PIQ A 23 2.350 -1.200 4.590 1.00 0.00 H new HETATM 0 HM2 PIQ A 23 1.899 0.451 5.076 1.00 0.00 H new HETATM 0 HM1 PIQ A 23 0.737 -0.883 5.272 1.00 0.00 H new HETATM 0 H7 PIQ A 23 -1.423 -1.248 4.500 1.00 0.00 H new HETATM 0 H6' PIQ A 23 -4.863 -1.961 1.340 1.00 0.00 H new HETATM 0 H5' PIQ A 23 -6.981 -2.816 2.304 1.00 0.00 H new HETATM 0 H5 PIQ A 23 -3.391 -0.666 0.700 1.00 0.00 H new HETATM 0 H4' PIQ A 23 -7.287 -2.927 4.777 1.00 0.00 H new HETATM 0 H3' PIQ A 23 -5.443 -2.168 6.277 1.00 0.00 H new HETATM 0 H2' PIQ A 23 -3.322 -1.310 5.318 1.00 0.00 H new