USER MOD reduce.3.24.130724 H: found=0, std=0, add=281, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 285 hydrogens (14 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 DC O5' : rot 180:sc= -0.407 USER MOD Single : A 3 DT C7 :methyl 150:sc= -0.0113 (180deg=-0.0113) USER MOD Single : A 10 DT C7 :methyl -30:sc= 0 (180deg=-0.00126) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : B 13 DG O5' : rot 180:sc= -0.0844 USER MOD Single : B 20 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -11.385 -14.004 -6.120 1.00 0.59 O ATOM 2 C5' DC A 1 -12.786 -13.749 -5.985 1.00 0.55 C ATOM 3 C4' DC A 1 -13.028 -12.381 -5.384 1.00 0.42 C ATOM 4 O4' DC A 1 -13.260 -12.561 -3.971 1.00 0.49 O ATOM 5 C3' DC A 1 -11.858 -11.399 -5.509 1.00 0.30 C ATOM 6 O3' DC A 1 -12.187 -10.348 -6.426 1.00 0.26 O ATOM 7 C2' DC A 1 -11.683 -10.825 -4.108 1.00 0.30 C ATOM 8 C1' DC A 1 -12.771 -11.449 -3.254 1.00 0.36 C ATOM 9 N1 DC A 1 -12.295 -11.929 -1.951 1.00 0.43 N ATOM 10 C2 DC A 1 -13.066 -11.698 -0.807 1.00 0.43 C ATOM 11 O2 DC A 1 -14.144 -11.096 -0.919 1.00 0.38 O ATOM 12 N3 DC A 1 -12.616 -12.136 0.392 1.00 0.50 N ATOM 13 C4 DC A 1 -11.449 -12.779 0.470 1.00 0.60 C ATOM 14 N4 DC A 1 -11.043 -13.190 1.672 1.00 0.69 N ATOM 15 C5 DC A 1 -10.646 -13.030 -0.681 1.00 0.61 C ATOM 16 C6 DC A 1 -11.107 -12.592 -1.860 1.00 0.51 C ATOM 0 H5' DC A 1 -13.240 -14.514 -5.355 1.00 0.55 H new ATOM 0 H5'' DC A 1 -13.268 -13.813 -6.961 1.00 0.55 H new ATOM 0 H4' DC A 1 -13.867 -11.955 -5.934 1.00 0.42 H new ATOM 0 H3' DC A 1 -10.954 -11.882 -5.880 1.00 0.30 H new ATOM 0 H2' DC A 1 -10.695 -11.060 -3.712 1.00 0.30 H new ATOM 0 H2'' DC A 1 -11.772 -9.739 -4.119 1.00 0.30 H new ATOM 0 HO5' DC A 1 -11.250 -14.894 -6.509 1.00 0.59 H new ATOM 0 H1' DC A 1 -13.524 -10.686 -3.055 1.00 0.36 H new ATOM 0 H41 DC A 1 -10.156 -13.685 1.769 1.00 0.69 H new ATOM 0 H42 DC A 1 -11.619 -13.010 2.494 1.00 0.69 H new ATOM 0 H5 DC A 1 -9.704 -13.552 -0.605 1.00 0.61 H new ATOM 0 H6 DC A 1 -10.527 -12.767 -2.754 1.00 0.51 H new ATOM 29 P DC A 2 -11.171 -9.115 -6.629 1.00 0.37 P ATOM 30 OP1 DC A 2 -11.363 -8.608 -8.011 1.00 0.60 O ATOM 31 OP2 DC A 2 -9.818 -9.535 -6.183 1.00 0.51 O ATOM 32 O5' DC A 2 -11.702 -8.002 -5.618 1.00 0.24 O ATOM 33 C5' DC A 2 -13.098 -7.728 -5.497 1.00 0.33 C ATOM 34 C4' DC A 2 -13.325 -6.488 -4.663 1.00 0.23 C ATOM 35 O4' DC A 2 -13.324 -6.871 -3.270 1.00 0.25 O ATOM 36 C3' DC A 2 -12.285 -5.377 -4.816 1.00 0.16 C ATOM 37 O3' DC A 2 -12.923 -4.095 -4.869 1.00 0.12 O ATOM 38 C2' DC A 2 -11.431 -5.489 -3.566 1.00 0.13 C ATOM 39 C1' DC A 2 -12.318 -6.187 -2.549 1.00 0.18 C ATOM 40 N1 DC A 2 -11.595 -7.176 -1.743 1.00 0.19 N ATOM 41 C2 DC A 2 -11.809 -7.235 -0.364 1.00 0.20 C ATOM 42 O2 DC A 2 -12.623 -6.457 0.152 1.00 0.19 O ATOM 43 N3 DC A 2 -11.120 -8.139 0.371 1.00 0.21 N ATOM 44 C4 DC A 2 -10.243 -8.951 -0.225 1.00 0.22 C ATOM 45 N4 DC A 2 -9.577 -9.819 0.539 1.00 0.24 N ATOM 46 C5 DC A 2 -10.010 -8.908 -1.630 1.00 0.22 C ATOM 47 C6 DC A 2 -10.713 -8.024 -2.343 1.00 0.21 C ATOM 0 H5' DC A 2 -13.603 -8.579 -5.039 1.00 0.33 H new ATOM 0 H5'' DC A 2 -13.535 -7.593 -6.486 1.00 0.33 H new ATOM 0 H4' DC A 2 -14.271 -6.079 -5.019 1.00 0.23 H new ATOM 0 H3' DC A 2 -11.703 -5.475 -5.733 1.00 0.16 H new ATOM 0 H2' DC A 2 -10.523 -6.061 -3.757 1.00 0.13 H new ATOM 0 H2'' DC A 2 -11.120 -4.507 -3.211 1.00 0.13 H new ATOM 0 H1' DC A 2 -12.713 -5.432 -1.869 1.00 0.18 H new ATOM 0 H41 DC A 2 -8.900 -10.454 0.117 1.00 0.24 H new ATOM 0 H42 DC A 2 -9.745 -9.847 1.545 1.00 0.24 H new ATOM 0 H5 DC A 2 -9.293 -9.565 -2.100 1.00 0.22 H new ATOM 0 H6 DC A 2 -10.580 -7.981 -3.414 1.00 0.21 H new ATOM 59 P DT A 3 -12.031 -2.753 -4.837 1.00 0.14 P ATOM 60 OP1 DT A 3 -12.805 -1.669 -5.492 1.00 0.19 O ATOM 61 OP2 DT A 3 -10.677 -3.095 -5.342 1.00 0.18 O ATOM 62 O5' DT A 3 -11.910 -2.413 -3.284 1.00 0.16 O ATOM 63 C5' DT A 3 -13.073 -2.369 -2.457 1.00 0.17 C ATOM 64 C4' DT A 3 -12.851 -1.467 -1.264 1.00 0.21 C ATOM 65 O4' DT A 3 -12.407 -2.273 -0.149 1.00 0.22 O ATOM 66 C3' DT A 3 -11.808 -0.360 -1.431 1.00 0.23 C ATOM 67 O3' DT A 3 -12.290 0.832 -0.779 1.00 0.27 O ATOM 68 C2' DT A 3 -10.567 -0.950 -0.781 1.00 0.22 C ATOM 69 C1' DT A 3 -11.137 -1.841 0.305 1.00 0.22 C ATOM 70 N1 DT A 3 -10.336 -3.036 0.580 1.00 0.21 N ATOM 71 C2 DT A 3 -10.165 -3.443 1.881 1.00 0.22 C ATOM 72 O2 DT A 3 -10.642 -2.851 2.834 1.00 0.24 O ATOM 73 N3 DT A 3 -9.408 -4.571 2.029 1.00 0.21 N ATOM 74 C4 DT A 3 -8.806 -5.306 1.033 1.00 0.19 C ATOM 75 O4 DT A 3 -8.152 -6.304 1.322 1.00 0.19 O ATOM 76 C5 DT A 3 -9.011 -4.811 -0.311 1.00 0.18 C ATOM 77 C7 DT A 3 -8.225 -5.424 -1.426 1.00 0.17 C ATOM 78 C6 DT A 3 -9.778 -3.721 -0.471 1.00 0.19 C ATOM 0 H5' DT A 3 -13.321 -3.374 -2.117 1.00 0.17 H new ATOM 0 H5'' DT A 3 -13.923 -2.010 -3.037 1.00 0.17 H new ATOM 0 H4' DT A 3 -13.813 -0.975 -1.119 1.00 0.21 H new ATOM 0 H3' DT A 3 -11.600 -0.064 -2.459 1.00 0.23 H new ATOM 0 H2' DT A 3 -9.969 -1.517 -1.495 1.00 0.22 H new ATOM 0 H2'' DT A 3 -9.921 -0.175 -0.369 1.00 0.22 H new ATOM 0 H1' DT A 3 -11.165 -1.262 1.228 1.00 0.22 H new ATOM 0 H3 DT A 3 -9.274 -4.905 2.983 1.00 0.21 H new ATOM 0 H71 DT A 3 -8.804 -5.375 -2.349 1.00 0.17 H new ATOM 0 H72 DT A 3 -7.290 -4.879 -1.555 1.00 0.17 H new ATOM 0 H73 DT A 3 -8.008 -6.465 -1.188 1.00 0.17 H new ATOM 0 H6 DT A 3 -9.965 -3.366 -1.474 1.00 0.19 H new ATOM 91 P DC A 4 -11.293 1.758 0.087 1.00 0.44 P ATOM 92 OP1 DC A 4 -12.041 2.984 0.466 1.00 0.58 O ATOM 93 OP2 DC A 4 -10.012 1.886 -0.655 1.00 0.41 O ATOM 94 O5' DC A 4 -11.037 0.912 1.414 1.00 0.52 O ATOM 95 C5' DC A 4 -12.039 0.816 2.433 1.00 0.48 C ATOM 96 C4' DC A 4 -11.447 1.137 3.786 1.00 0.41 C ATOM 97 O4' DC A 4 -10.566 0.060 4.185 1.00 0.38 O ATOM 98 C3' DC A 4 -10.588 2.398 3.836 1.00 0.34 C ATOM 99 O3' DC A 4 -10.614 2.971 5.148 1.00 0.30 O ATOM 100 C2' DC A 4 -9.205 1.869 3.506 1.00 0.28 C ATOM 101 C1' DC A 4 -9.212 0.495 4.178 1.00 0.28 C ATOM 102 N1 DC A 4 -8.416 -0.554 3.510 1.00 0.25 N ATOM 103 C2 DC A 4 -7.840 -1.565 4.291 1.00 0.25 C ATOM 104 O2 DC A 4 -7.974 -1.526 5.523 1.00 0.26 O ATOM 105 N3 DC A 4 -7.150 -2.558 3.682 1.00 0.23 N ATOM 106 C4 DC A 4 -7.018 -2.560 2.354 1.00 0.22 C ATOM 107 N4 DC A 4 -6.329 -3.553 1.792 1.00 0.21 N ATOM 108 C5 DC A 4 -7.584 -1.540 1.538 1.00 0.23 C ATOM 109 C6 DC A 4 -8.261 -0.562 2.152 1.00 0.25 C ATOM 0 H5' DC A 4 -12.461 -0.189 2.443 1.00 0.48 H new ATOM 0 H5'' DC A 4 -12.856 1.503 2.214 1.00 0.48 H new ATOM 0 H4' DC A 4 -12.310 1.281 4.436 1.00 0.41 H new ATOM 0 H3' DC A 4 -10.924 3.184 3.160 1.00 0.34 H new ATOM 0 H2' DC A 4 -9.044 1.795 2.431 1.00 0.28 H new ATOM 0 H2'' DC A 4 -8.419 2.511 3.902 1.00 0.28 H new ATOM 0 H1' DC A 4 -8.759 0.626 5.161 1.00 0.28 H new ATOM 0 H41 DC A 4 -6.211 -3.582 0.779 1.00 0.21 H new ATOM 0 H42 DC A 4 -5.920 -4.284 2.375 1.00 0.21 H new ATOM 0 H5 DC A 4 -7.471 -1.555 0.464 1.00 0.23 H new ATOM 0 H6 DC A 4 -8.692 0.235 1.564 1.00 0.25 H new ATOM 121 P DA A 5 -9.857 4.362 5.428 1.00 0.20 P ATOM 122 OP1 DA A 5 -10.557 5.030 6.555 1.00 0.20 O ATOM 123 OP2 DA A 5 -9.693 5.080 4.138 1.00 0.24 O ATOM 124 O5' DA A 5 -8.412 3.920 5.934 1.00 0.21 O ATOM 125 C5' DA A 5 -8.264 2.986 7.005 1.00 0.18 C ATOM 126 C4' DA A 5 -6.801 2.688 7.243 1.00 0.14 C ATOM 127 O4' DA A 5 -6.430 1.536 6.467 1.00 0.12 O ATOM 128 C3' DA A 5 -5.812 3.788 6.847 1.00 0.12 C ATOM 129 O3' DA A 5 -5.378 4.483 8.026 1.00 0.11 O ATOM 130 C2' DA A 5 -4.654 3.035 6.194 1.00 0.11 C ATOM 131 C1' DA A 5 -5.033 1.564 6.299 1.00 0.11 C ATOM 132 N9 DA A 5 -4.720 0.800 5.100 1.00 0.11 N ATOM 133 C8 DA A 5 -5.009 1.192 3.830 1.00 0.12 C ATOM 134 N7 DA A 5 -4.655 0.325 2.912 1.00 0.11 N ATOM 135 C5 DA A 5 -4.080 -0.708 3.640 1.00 0.10 C ATOM 136 C6 DA A 5 -3.496 -1.928 3.259 1.00 0.10 C ATOM 137 N6 DA A 5 -3.401 -2.345 1.997 1.00 0.10 N ATOM 138 N1 DA A 5 -3.005 -2.720 4.236 1.00 0.09 N ATOM 139 C2 DA A 5 -3.110 -2.310 5.507 1.00 0.10 C ATOM 140 N3 DA A 5 -3.637 -1.189 5.988 1.00 0.10 N ATOM 141 C4 DA A 5 -4.108 -0.423 4.992 1.00 0.10 C ATOM 0 H5' DA A 5 -8.796 2.064 6.769 1.00 0.18 H new ATOM 0 H5'' DA A 5 -8.712 3.389 7.913 1.00 0.18 H new ATOM 0 H4' DA A 5 -6.729 2.559 8.323 1.00 0.14 H new ATOM 0 H3' DA A 5 -6.238 4.535 6.177 1.00 0.12 H new ATOM 0 H2' DA A 5 -4.523 3.336 5.155 1.00 0.11 H new ATOM 0 H2'' DA A 5 -3.713 3.238 6.705 1.00 0.11 H new ATOM 0 H1' DA A 5 -4.472 1.117 7.120 1.00 0.11 H new ATOM 0 H8 DA A 5 -5.487 2.132 3.599 1.00 0.12 H new ATOM 0 H61 DA A 5 -2.965 -3.243 1.788 1.00 0.10 H new ATOM 0 H62 DA A 5 -3.765 -1.766 1.240 1.00 0.10 H new ATOM 0 H2 DA A 5 -2.709 -2.987 6.246 1.00 0.10 H new ATOM 153 P DG A 6 -3.982 5.285 8.022 1.00 0.08 P ATOM 154 OP1 DG A 6 -3.949 6.121 9.248 1.00 0.08 O ATOM 155 OP2 DG A 6 -3.805 5.925 6.693 1.00 0.08 O ATOM 156 O5' DG A 6 -2.883 4.140 8.173 1.00 0.08 O ATOM 157 C5' DG A 6 -2.930 3.210 9.259 1.00 0.08 C ATOM 158 C4' DG A 6 -1.761 2.256 9.182 1.00 0.06 C ATOM 159 O4' DG A 6 -1.834 1.493 7.950 1.00 0.06 O ATOM 160 C3' DG A 6 -0.384 2.934 9.180 1.00 0.06 C ATOM 161 O3' DG A 6 0.430 2.402 10.232 1.00 0.06 O ATOM 162 C2' DG A 6 0.206 2.586 7.821 1.00 0.05 C ATOM 163 C1' DG A 6 -0.522 1.314 7.459 1.00 0.05 C ATOM 164 N9 DG A 6 -0.595 1.040 6.028 1.00 0.05 N ATOM 165 C8 DG A 6 -1.079 1.867 5.045 1.00 0.05 C ATOM 166 N7 DG A 6 -1.008 1.347 3.851 1.00 0.06 N ATOM 167 C5 DG A 6 -0.450 0.094 4.060 1.00 0.05 C ATOM 168 C6 DG A 6 -0.121 -0.919 3.134 1.00 0.05 C ATOM 169 O6 DG A 6 -0.296 -0.926 1.911 1.00 0.05 O ATOM 170 N1 DG A 6 0.465 -2.012 3.759 1.00 0.05 N ATOM 171 C2 DG A 6 0.691 -2.121 5.109 1.00 0.06 C ATOM 172 N2 DG A 6 1.258 -3.258 5.523 1.00 0.06 N ATOM 173 N3 DG A 6 0.381 -1.183 5.987 1.00 0.05 N ATOM 174 C4 DG A 6 -0.178 -0.107 5.395 1.00 0.05 C ATOM 0 H5' DG A 6 -3.866 2.652 9.229 1.00 0.08 H new ATOM 0 H5'' DG A 6 -2.909 3.746 10.208 1.00 0.08 H new ATOM 0 H4' DG A 6 -1.843 1.642 10.079 1.00 0.06 H new ATOM 0 H3' DG A 6 -0.445 4.010 9.343 1.00 0.06 H new ATOM 0 H2' DG A 6 0.031 3.375 7.090 1.00 0.05 H new ATOM 0 H2'' DG A 6 1.284 2.434 7.874 1.00 0.05 H new ATOM 0 H1' DG A 6 0.016 0.467 7.885 1.00 0.05 H new ATOM 0 H8 DG A 6 -1.479 2.851 5.241 1.00 0.05 H new ATOM 0 H1 DG A 6 0.750 -2.794 3.170 1.00 0.05 H new ATOM 0 H21 DG A 6 1.452 -3.400 6.514 1.00 0.06 H new ATOM 0 H22 DG A 6 1.497 -3.984 4.848 1.00 0.06 H new ATOM 186 P DG A 7 1.964 2.866 10.369 1.00 0.06 P ATOM 187 OP1 DG A 7 2.585 2.108 11.485 1.00 0.08 O ATOM 188 OP2 DG A 7 1.975 4.350 10.396 1.00 0.07 O ATOM 189 O5' DG A 7 2.633 2.396 9.001 1.00 0.05 O ATOM 190 C5' DG A 7 3.131 1.066 8.840 1.00 0.07 C ATOM 191 C4' DG A 7 4.215 1.038 7.787 1.00 0.08 C ATOM 192 O4' DG A 7 3.636 0.627 6.526 1.00 0.06 O ATOM 193 C3' DG A 7 4.901 2.385 7.526 1.00 0.08 C ATOM 194 O3' DG A 7 6.315 2.263 7.717 1.00 0.11 O ATOM 195 C2' DG A 7 4.583 2.700 6.071 1.00 0.07 C ATOM 196 C1' DG A 7 4.270 1.336 5.485 1.00 0.07 C ATOM 197 N9 DG A 7 3.384 1.315 4.321 1.00 0.06 N ATOM 198 C8 DG A 7 2.236 2.045 4.112 1.00 0.05 C ATOM 199 N7 DG A 7 1.667 1.795 2.964 1.00 0.06 N ATOM 200 C5 DG A 7 2.488 0.840 2.378 1.00 0.05 C ATOM 201 C6 DG A 7 2.384 0.178 1.124 1.00 0.06 C ATOM 202 O6 DG A 7 1.519 0.315 0.251 1.00 0.06 O ATOM 203 N1 DG A 7 3.428 -0.720 0.931 1.00 0.06 N ATOM 204 C2 DG A 7 4.445 -0.950 1.825 1.00 0.06 C ATOM 205 N2 DG A 7 5.366 -1.847 1.462 1.00 0.06 N ATOM 206 N3 DG A 7 4.555 -0.342 2.992 1.00 0.06 N ATOM 207 C4 DG A 7 3.550 0.533 3.203 1.00 0.05 C ATOM 0 H5' DG A 7 2.319 0.398 8.554 1.00 0.07 H new ATOM 0 H5'' DG A 7 3.525 0.700 9.788 1.00 0.07 H new ATOM 0 H4' DG A 7 4.967 0.350 8.174 1.00 0.08 H new ATOM 0 H3' DG A 7 4.558 3.168 8.202 1.00 0.08 H new ATOM 0 H2' DG A 7 3.737 3.381 5.982 1.00 0.07 H new ATOM 0 H2'' DG A 7 5.427 3.172 5.567 1.00 0.07 H new ATOM 0 H1' DG A 7 5.207 0.914 5.122 1.00 0.07 H new ATOM 0 H8 DG A 7 1.845 2.754 4.827 1.00 0.05 H new ATOM 0 H1 DG A 7 3.439 -1.248 0.059 1.00 0.06 H new ATOM 0 H21 DG A 7 6.145 -2.059 2.085 1.00 0.06 H new ATOM 0 H22 DG A 7 5.290 -2.320 0.561 1.00 0.06 H new ATOM 219 P DC A 8 7.223 3.585 7.840 1.00 0.14 P ATOM 220 OP1 DC A 8 7.649 3.727 9.256 1.00 0.17 O ATOM 221 OP2 DC A 8 6.498 4.699 7.177 1.00 0.14 O ATOM 222 O5' DC A 8 8.508 3.248 6.959 1.00 0.16 O ATOM 223 C5' DC A 8 9.421 2.223 7.355 1.00 0.19 C ATOM 224 C4' DC A 8 10.051 1.581 6.141 1.00 0.16 C ATOM 225 O4' DC A 8 9.031 1.375 5.133 1.00 0.15 O ATOM 226 C3' DC A 8 11.158 2.402 5.473 1.00 0.15 C ATOM 227 O3' DC A 8 12.273 1.554 5.171 1.00 0.14 O ATOM 228 C2' DC A 8 10.514 2.929 4.199 1.00 0.12 C ATOM 229 C1' DC A 8 9.464 1.880 3.884 1.00 0.11 C ATOM 230 N1 DC A 8 8.282 2.398 3.178 1.00 0.10 N ATOM 231 C2 DC A 8 7.950 1.879 1.921 1.00 0.10 C ATOM 232 O2 DC A 8 8.673 1.006 1.419 1.00 0.10 O ATOM 233 N3 DC A 8 6.849 2.342 1.287 1.00 0.10 N ATOM 234 C4 DC A 8 6.096 3.282 1.860 1.00 0.10 C ATOM 235 N4 DC A 8 5.017 3.704 1.203 1.00 0.09 N ATOM 236 C5 DC A 8 6.415 3.833 3.134 1.00 0.10 C ATOM 237 C6 DC A 8 7.509 3.369 3.749 1.00 0.10 C ATOM 0 H5' DC A 8 8.898 1.469 7.943 1.00 0.19 H new ATOM 0 H5'' DC A 8 10.196 2.645 7.995 1.00 0.19 H new ATOM 0 H4' DC A 8 10.499 0.659 6.511 1.00 0.16 H new ATOM 0 H3' DC A 8 11.537 3.207 6.103 1.00 0.15 H new ATOM 0 H2' DC A 8 10.069 3.912 4.350 1.00 0.12 H new ATOM 0 H2'' DC A 8 11.240 3.028 3.392 1.00 0.12 H new ATOM 0 H1' DC A 8 9.915 1.138 3.225 1.00 0.11 H new ATOM 0 H41 DC A 8 4.419 4.422 1.612 1.00 0.09 H new ATOM 0 H42 DC A 8 4.789 3.309 0.291 1.00 0.09 H new ATOM 0 H5 DC A 8 5.798 4.596 3.586 1.00 0.10 H new ATOM 0 H6 DC A 8 7.786 3.769 4.713 1.00 0.10 H new ATOM 249 P DC A 9 13.549 2.152 4.395 1.00 0.14 P ATOM 250 OP1 DC A 9 14.745 1.367 4.795 1.00 0.16 O ATOM 251 OP2 DC A 9 13.545 3.627 4.578 1.00 0.16 O ATOM 252 O5' DC A 9 13.239 1.846 2.863 1.00 0.12 O ATOM 253 C5' DC A 9 12.717 0.578 2.457 1.00 0.12 C ATOM 254 C4' DC A 9 12.717 0.472 0.950 1.00 0.12 C ATOM 255 O4' DC A 9 11.444 0.950 0.449 1.00 0.11 O ATOM 256 C3' DC A 9 13.797 1.302 0.253 1.00 0.12 C ATOM 257 O3' DC A 9 14.439 0.521 -0.761 1.00 0.15 O ATOM 258 C2' DC A 9 13.032 2.471 -0.347 1.00 0.11 C ATOM 259 C1' DC A 9 11.647 1.896 -0.583 1.00 0.10 C ATOM 260 N1 DC A 9 10.537 2.866 -0.528 1.00 0.10 N ATOM 261 C2 DC A 9 9.635 2.924 -1.599 1.00 0.10 C ATOM 262 O2 DC A 9 9.809 2.179 -2.576 1.00 0.10 O ATOM 263 N3 DC A 9 8.598 3.790 -1.543 1.00 0.11 N ATOM 264 C4 DC A 9 8.445 4.578 -0.477 1.00 0.14 C ATOM 265 N4 DC A 9 7.411 5.418 -0.468 1.00 0.16 N ATOM 266 C5 DC A 9 9.346 4.541 0.626 1.00 0.14 C ATOM 267 C6 DC A 9 10.374 3.686 0.554 1.00 0.12 C ATOM 0 H5' DC A 9 11.703 0.455 2.837 1.00 0.12 H new ATOM 0 H5'' DC A 9 13.317 -0.225 2.885 1.00 0.12 H new ATOM 0 H4' DC A 9 12.909 -0.578 0.731 1.00 0.12 H new ATOM 0 H3' DC A 9 14.588 1.634 0.926 1.00 0.12 H new ATOM 0 H2' DC A 9 13.004 3.324 0.331 1.00 0.11 H new ATOM 0 H2'' DC A 9 13.488 2.817 -1.275 1.00 0.11 H new ATOM 0 H1' DC A 9 11.629 1.492 -1.595 1.00 0.10 H new ATOM 0 H41 DC A 9 7.262 6.035 0.330 1.00 0.16 H new ATOM 0 H42 DC A 9 6.768 5.444 -1.259 1.00 0.16 H new ATOM 0 H5 DC A 9 9.205 5.178 1.487 1.00 0.14 H new ATOM 0 H6 DC A 9 11.087 3.643 1.364 1.00 0.12 H new ATOM 279 P DT A 10 15.675 1.138 -1.585 1.00 0.19 P ATOM 280 OP1 DT A 10 16.662 0.056 -1.824 1.00 0.22 O ATOM 281 OP2 DT A 10 16.104 2.386 -0.903 1.00 0.19 O ATOM 282 O5' DT A 10 15.025 1.540 -2.982 1.00 0.21 O ATOM 283 C5' DT A 10 13.864 0.865 -3.469 1.00 0.19 C ATOM 284 C4' DT A 10 13.251 1.639 -4.612 1.00 0.20 C ATOM 285 O4' DT A 10 12.181 2.466 -4.108 1.00 0.14 O ATOM 286 C3' DT A 10 14.207 2.593 -5.334 1.00 0.24 C ATOM 287 O3' DT A 10 14.520 2.080 -6.635 1.00 0.30 O ATOM 288 C2' DT A 10 13.428 3.900 -5.443 1.00 0.20 C ATOM 289 C1' DT A 10 12.025 3.532 -5.012 1.00 0.15 C ATOM 290 N1 DT A 10 11.302 4.620 -4.334 1.00 0.13 N ATOM 291 C2 DT A 10 10.127 5.063 -4.891 1.00 0.12 C ATOM 292 O2 DT A 10 9.642 4.573 -5.896 1.00 0.11 O ATOM 293 N3 DT A 10 9.538 6.104 -4.229 1.00 0.14 N ATOM 294 C4 DT A 10 9.996 6.735 -3.093 1.00 0.17 C ATOM 295 O4 DT A 10 9.355 7.665 -2.614 1.00 0.21 O ATOM 296 C5 DT A 10 11.236 6.219 -2.555 1.00 0.16 C ATOM 297 C7 DT A 10 11.873 6.937 -1.406 1.00 0.20 C ATOM 298 C6 DT A 10 11.815 5.182 -3.186 1.00 0.14 C ATOM 0 H5' DT A 10 13.136 0.752 -2.665 1.00 0.19 H new ATOM 0 H5'' DT A 10 14.130 -0.138 -3.801 1.00 0.19 H new ATOM 0 H4' DT A 10 12.929 0.876 -5.320 1.00 0.20 H new ATOM 0 H3' DT A 10 15.154 2.721 -4.809 1.00 0.24 H new ATOM 0 H2' DT A 10 13.853 4.672 -4.801 1.00 0.20 H new ATOM 0 H2'' DT A 10 13.443 4.289 -6.461 1.00 0.20 H new ATOM 0 H1' DT A 10 11.435 3.290 -5.896 1.00 0.15 H new ATOM 0 H3 DT A 10 8.662 6.452 -4.619 1.00 0.14 H new ATOM 0 H71 DT A 10 11.630 7.998 -1.460 1.00 0.20 H new ATOM 0 H72 DT A 10 11.499 6.527 -0.468 1.00 0.20 H new ATOM 0 H73 DT A 10 12.955 6.810 -1.452 1.00 0.20 H new ATOM 0 H6 DT A 10 12.724 4.771 -2.773 1.00 0.14 H new ATOM 311 P DC A 11 15.351 2.984 -7.675 1.00 0.36 P ATOM 312 OP1 DC A 11 15.931 2.069 -8.691 1.00 0.44 O ATOM 313 OP2 DC A 11 16.246 3.888 -6.907 1.00 0.39 O ATOM 314 O5' DC A 11 14.237 3.873 -8.388 1.00 0.32 O ATOM 315 C5' DC A 11 13.115 3.267 -9.032 1.00 0.28 C ATOM 316 C4' DC A 11 12.384 4.282 -9.879 1.00 0.24 C ATOM 317 O4' DC A 11 11.587 5.122 -9.011 1.00 0.24 O ATOM 318 C3' DC A 11 13.281 5.224 -10.686 1.00 0.23 C ATOM 319 O3' DC A 11 12.741 5.403 -12.001 1.00 0.39 O ATOM 320 C2' DC A 11 13.241 6.531 -9.906 1.00 0.36 C ATOM 321 C1' DC A 11 11.890 6.488 -9.220 1.00 0.29 C ATOM 322 N1 DC A 11 11.858 7.158 -7.914 1.00 0.24 N ATOM 323 C2 DC A 11 10.780 7.985 -7.598 1.00 0.21 C ATOM 324 O2 DC A 11 9.877 8.137 -8.431 1.00 0.20 O ATOM 325 N3 DC A 11 10.750 8.598 -6.392 1.00 0.20 N ATOM 326 C4 DC A 11 11.743 8.405 -5.523 1.00 0.21 C ATOM 327 N4 DC A 11 11.666 9.026 -4.344 1.00 0.23 N ATOM 328 C5 DC A 11 12.857 7.567 -5.824 1.00 0.23 C ATOM 329 C6 DC A 11 12.869 6.969 -7.021 1.00 0.25 C ATOM 0 H5' DC A 11 12.438 2.853 -8.285 1.00 0.28 H new ATOM 0 H5'' DC A 11 13.449 2.437 -9.655 1.00 0.28 H new ATOM 0 H4' DC A 11 11.802 3.695 -10.589 1.00 0.24 H new ATOM 0 H3' DC A 11 14.296 4.846 -10.811 1.00 0.23 H new ATOM 0 H2' DC A 11 14.056 6.594 -9.185 1.00 0.36 H new ATOM 0 H2'' DC A 11 13.330 7.395 -10.564 1.00 0.36 H new ATOM 0 H1' DC A 11 11.177 7.011 -9.857 1.00 0.29 H new ATOM 0 H41 DC A 11 12.406 8.903 -3.653 1.00 0.23 H new ATOM 0 H42 DC A 11 10.867 9.624 -4.134 1.00 0.23 H new ATOM 0 H5 DC A 11 13.658 7.421 -5.115 1.00 0.23 H new ATOM 0 H6 DC A 11 13.695 6.325 -7.284 1.00 0.25 H new ATOM 341 P DC A 12 13.436 6.436 -13.019 1.00 0.17 P ATOM 342 OP1 DC A 12 13.140 5.992 -14.404 1.00 0.19 O ATOM 343 OP2 DC A 12 14.847 6.615 -12.592 1.00 0.20 O ATOM 344 O5' DC A 12 12.668 7.807 -12.757 1.00 0.33 O ATOM 345 C5' DC A 12 11.265 7.922 -13.002 1.00 0.24 C ATOM 346 C4' DC A 12 10.827 9.364 -12.875 1.00 0.29 C ATOM 347 O4' DC A 12 10.372 9.604 -11.528 1.00 0.24 O ATOM 348 C3' DC A 12 11.912 10.411 -13.106 1.00 0.40 C ATOM 349 O3' DC A 12 12.013 10.734 -14.495 1.00 0.51 O ATOM 350 C2' DC A 12 11.400 11.603 -12.313 1.00 0.40 C ATOM 351 C1' DC A 12 10.563 10.974 -11.196 1.00 0.27 C ATOM 352 N1 DC A 12 11.187 11.032 -9.865 1.00 0.19 N ATOM 353 C2 DC A 12 10.647 11.887 -8.901 1.00 0.17 C ATOM 354 O2 DC A 12 9.660 12.575 -9.195 1.00 0.27 O ATOM 355 N3 DC A 12 11.213 11.943 -7.675 1.00 0.19 N ATOM 356 C4 DC A 12 12.277 11.187 -7.398 1.00 0.30 C ATOM 357 N4 DC A 12 12.802 11.277 -6.175 1.00 0.42 N ATOM 358 C5 DC A 12 12.849 10.306 -8.362 1.00 0.35 C ATOM 359 C6 DC A 12 12.276 10.262 -9.571 1.00 0.26 C ATOM 0 H5' DC A 12 10.713 7.303 -12.294 1.00 0.24 H new ATOM 0 H5'' DC A 12 11.031 7.550 -14.000 1.00 0.24 H new ATOM 0 H4' DC A 12 10.068 9.475 -13.649 1.00 0.29 H new ATOM 0 H3' DC A 12 12.906 10.082 -12.802 1.00 0.40 H new ATOM 0 H2' DC A 12 12.221 12.197 -11.911 1.00 0.40 H new ATOM 0 H2'' DC A 12 10.800 12.268 -12.935 1.00 0.40 H new ATOM 0 HO3' DC A 12 12.712 11.408 -14.624 1.00 0.51 H new ATOM 0 H1' DC A 12 9.635 11.543 -11.131 1.00 0.27 H new ATOM 0 H41 DC A 12 13.616 10.714 -5.927 1.00 0.42 H new ATOM 0 H42 DC A 12 12.390 11.908 -5.488 1.00 0.42 H new ATOM 0 H5 DC A 12 13.710 9.698 -8.126 1.00 0.35 H new ATOM 0 H6 DC A 12 12.682 9.606 -10.327 1.00 0.26 H new TER 372 DC A 12 ATOM 373 O5' DG B 13 5.640 16.828 -0.180 1.00 1.25 O ATOM 374 C5' DG B 13 6.031 18.163 -0.520 1.00 1.15 C ATOM 375 C4' DG B 13 5.846 18.424 -1.997 1.00 0.77 C ATOM 376 O4' DG B 13 7.102 18.160 -2.667 1.00 0.47 O ATOM 377 C3' DG B 13 4.795 17.545 -2.679 1.00 0.58 C ATOM 378 O3' DG B 13 4.011 18.313 -3.596 1.00 0.39 O ATOM 379 C2' DG B 13 5.612 16.506 -3.428 1.00 0.66 C ATOM 380 C1' DG B 13 6.944 17.177 -3.675 1.00 0.47 C ATOM 381 N9 DG B 13 8.082 16.266 -3.600 1.00 0.29 N ATOM 382 C8 DG B 13 8.899 16.051 -2.520 1.00 0.25 C ATOM 383 N7 DG B 13 9.837 15.173 -2.749 1.00 0.25 N ATOM 384 C5 DG B 13 9.622 14.781 -4.064 1.00 0.17 C ATOM 385 C6 DG B 13 10.322 13.848 -4.872 1.00 0.18 C ATOM 386 O6 DG B 13 11.304 13.157 -4.578 1.00 0.33 O ATOM 387 N1 DG B 13 9.769 13.759 -6.145 1.00 0.10 N ATOM 388 C2 DG B 13 8.681 14.472 -6.583 1.00 0.23 C ATOM 389 N2 DG B 13 8.292 14.245 -7.842 1.00 0.34 N ATOM 390 N3 DG B 13 8.021 15.343 -5.842 1.00 0.31 N ATOM 391 C4 DG B 13 8.542 15.448 -4.603 1.00 0.22 C ATOM 0 H5' DG B 13 7.075 18.320 -0.248 1.00 1.15 H new ATOM 0 H5'' DG B 13 5.440 18.876 0.055 1.00 1.15 H new ATOM 0 H4' DG B 13 5.509 19.458 -2.074 1.00 0.77 H new ATOM 0 H3' DG B 13 4.097 17.104 -1.968 1.00 0.58 H new ATOM 0 H2' DG B 13 5.729 15.595 -2.841 1.00 0.66 H new ATOM 0 H2'' DG B 13 5.131 16.222 -4.364 1.00 0.66 H new ATOM 0 HO5' DG B 13 5.771 16.683 0.780 1.00 1.25 H new ATOM 0 H1' DG B 13 6.933 17.585 -4.686 1.00 0.47 H new ATOM 0 H8 DG B 13 8.778 16.558 -1.574 1.00 0.25 H new ATOM 0 H1 DG B 13 10.206 13.114 -6.804 1.00 0.10 H new ATOM 0 H21 DG B 13 7.490 14.744 -8.226 1.00 0.34 H new ATOM 0 H22 DG B 13 8.798 13.573 -8.419 1.00 0.34 H new ATOM 404 P DG B 14 2.652 17.694 -4.193 1.00 0.26 P ATOM 405 OP1 DG B 14 2.117 18.645 -5.200 1.00 0.27 O ATOM 406 OP2 DG B 14 1.802 17.292 -3.043 1.00 0.40 O ATOM 407 O5' DG B 14 3.121 16.372 -4.948 1.00 0.35 O ATOM 408 C5' DG B 14 3.443 16.397 -6.339 1.00 0.30 C ATOM 409 C4' DG B 14 3.422 14.997 -6.908 1.00 0.33 C ATOM 410 O4' DG B 14 4.671 14.336 -6.586 1.00 0.35 O ATOM 411 C3' DG B 14 2.322 14.077 -6.367 1.00 0.32 C ATOM 412 O3' DG B 14 1.820 13.265 -7.439 1.00 0.33 O ATOM 413 C2' DG B 14 3.053 13.251 -5.328 1.00 0.35 C ATOM 414 C1' DG B 14 4.377 13.070 -6.028 1.00 0.36 C ATOM 415 N9 DG B 14 5.487 12.679 -5.169 1.00 0.38 N ATOM 416 C8 DG B 14 5.728 13.085 -3.881 1.00 0.46 C ATOM 417 N7 DG B 14 6.821 12.578 -3.379 1.00 0.45 N ATOM 418 C5 DG B 14 7.323 11.778 -4.397 1.00 0.37 C ATOM 419 C6 DG B 14 8.485 10.966 -4.445 1.00 0.33 C ATOM 420 O6 DG B 14 9.340 10.789 -3.570 1.00 0.35 O ATOM 421 N1 DG B 14 8.603 10.317 -5.669 1.00 0.26 N ATOM 422 C2 DG B 14 7.723 10.441 -6.716 1.00 0.23 C ATOM 423 N2 DG B 14 8.004 9.746 -7.821 1.00 0.19 N ATOM 424 N3 DG B 14 6.643 11.193 -6.684 1.00 0.26 N ATOM 425 C4 DG B 14 6.505 11.828 -5.504 1.00 0.33 C ATOM 0 H5' DG B 14 4.428 16.841 -6.483 1.00 0.30 H new ATOM 0 H5'' DG B 14 2.730 17.025 -6.873 1.00 0.30 H new ATOM 0 H4' DG B 14 3.245 15.143 -7.974 1.00 0.33 H new ATOM 0 H3' DG B 14 1.460 14.595 -5.947 1.00 0.32 H new ATOM 0 H2' DG B 14 3.152 13.771 -4.375 1.00 0.35 H new ATOM 0 H2'' DG B 14 2.556 12.303 -5.123 1.00 0.35 H new ATOM 0 H1' DG B 14 4.277 12.256 -6.746 1.00 0.36 H new ATOM 0 H8 DG B 14 5.079 13.756 -3.338 1.00 0.46 H new ATOM 0 H1 DG B 14 9.405 9.701 -5.799 1.00 0.26 H new ATOM 0 H21 DG B 14 7.384 9.801 -8.629 1.00 0.19 H new ATOM 0 H22 DG B 14 8.838 9.160 -7.857 1.00 0.19 H new ATOM 437 P DA B 15 0.600 12.246 -7.186 1.00 0.33 P ATOM 438 OP1 DA B 15 -0.595 12.787 -7.882 1.00 0.35 O ATOM 439 OP2 DA B 15 0.523 11.937 -5.735 1.00 0.34 O ATOM 440 O5' DA B 15 1.056 10.921 -7.947 1.00 0.34 O ATOM 441 C5' DA B 15 1.868 10.991 -9.124 1.00 0.32 C ATOM 442 C4' DA B 15 2.055 9.613 -9.723 1.00 0.27 C ATOM 443 O4' DA B 15 3.311 9.063 -9.260 1.00 0.24 O ATOM 444 C3' DA B 15 1.007 8.573 -9.337 1.00 0.27 C ATOM 445 O3' DA B 15 0.915 7.567 -10.355 1.00 0.24 O ATOM 446 C2' DA B 15 1.576 7.993 -8.054 1.00 0.25 C ATOM 447 C1' DA B 15 3.080 8.029 -8.307 1.00 0.22 C ATOM 448 N9 DA B 15 3.877 8.338 -7.121 1.00 0.23 N ATOM 449 C8 DA B 15 3.630 9.344 -6.226 1.00 0.28 C ATOM 450 N7 DA B 15 4.527 9.440 -5.274 1.00 0.28 N ATOM 451 C5 DA B 15 5.418 8.412 -5.552 1.00 0.23 C ATOM 452 C6 DA B 15 6.597 7.981 -4.915 1.00 0.21 C ATOM 453 N6 DA B 15 7.122 8.573 -3.842 1.00 0.23 N ATOM 454 N1 DA B 15 7.240 6.916 -5.436 1.00 0.16 N ATOM 455 C2 DA B 15 6.733 6.334 -6.528 1.00 0.14 C ATOM 456 N3 DA B 15 5.647 6.658 -7.231 1.00 0.16 N ATOM 457 C4 DA B 15 5.024 7.717 -6.682 1.00 0.20 C ATOM 0 H5' DA B 15 2.839 11.422 -8.878 1.00 0.32 H new ATOM 0 H5'' DA B 15 1.402 11.652 -9.855 1.00 0.32 H new ATOM 0 H4' DA B 15 1.991 9.781 -10.798 1.00 0.27 H new ATOM 0 H3' DA B 15 0.002 8.978 -9.218 1.00 0.27 H new ATOM 0 H2' DA B 15 1.298 8.586 -7.183 1.00 0.25 H new ATOM 0 H2'' DA B 15 1.220 6.978 -7.875 1.00 0.25 H new ATOM 0 H1' DA B 15 3.383 7.037 -8.642 1.00 0.22 H new ATOM 0 H8 DA B 15 2.774 9.999 -6.297 1.00 0.28 H new ATOM 0 H61 DA B 15 7.980 8.210 -3.428 1.00 0.23 H new ATOM 0 H62 DA B 15 6.665 9.389 -3.435 1.00 0.23 H new ATOM 0 H2 DA B 15 7.282 5.479 -6.893 1.00 0.14 H new ATOM 469 P DG B 16 0.068 6.224 -10.084 1.00 0.24 P ATOM 470 OP1 DG B 16 -0.521 5.784 -11.375 1.00 0.23 O ATOM 471 OP2 DG B 16 -0.823 6.473 -8.921 1.00 0.27 O ATOM 472 O5' DG B 16 1.166 5.154 -9.647 1.00 0.20 O ATOM 473 C5' DG B 16 2.043 4.569 -10.612 1.00 0.15 C ATOM 474 C4' DG B 16 2.919 3.521 -9.965 1.00 0.14 C ATOM 475 O4' DG B 16 3.620 4.117 -8.847 1.00 0.15 O ATOM 476 C3' DG B 16 2.179 2.299 -9.402 1.00 0.15 C ATOM 477 O3' DG B 16 2.746 1.100 -9.952 1.00 0.15 O ATOM 478 C2' DG B 16 2.422 2.376 -7.898 1.00 0.14 C ATOM 479 C1' DG B 16 3.713 3.157 -7.819 1.00 0.15 C ATOM 480 N9 DG B 16 3.935 3.857 -6.558 1.00 0.15 N ATOM 481 C8 DG B 16 3.116 4.787 -5.969 1.00 0.18 C ATOM 482 N7 DG B 16 3.586 5.252 -4.846 1.00 0.18 N ATOM 483 C5 DG B 16 4.786 4.578 -4.675 1.00 0.15 C ATOM 484 C6 DG B 16 5.737 4.653 -3.631 1.00 0.14 C ATOM 485 O6 DG B 16 5.712 5.361 -2.620 1.00 0.16 O ATOM 486 N1 DG B 16 6.805 3.791 -3.849 1.00 0.12 N ATOM 487 C2 DG B 16 6.941 2.962 -4.932 1.00 0.11 C ATOM 488 N2 DG B 16 8.038 2.200 -4.958 1.00 0.11 N ATOM 489 N3 DG B 16 6.063 2.884 -5.917 1.00 0.12 N ATOM 490 C4 DG B 16 5.016 3.712 -5.723 1.00 0.14 C ATOM 0 H5' DG B 16 2.664 5.342 -11.063 1.00 0.15 H new ATOM 0 H5'' DG B 16 1.460 4.119 -11.416 1.00 0.15 H new ATOM 0 H4' DG B 16 3.570 3.172 -10.767 1.00 0.14 H new ATOM 0 H3' DG B 16 1.116 2.287 -9.644 1.00 0.15 H new ATOM 0 H2' DG B 16 1.608 2.883 -7.380 1.00 0.14 H new ATOM 0 H2'' DG B 16 2.517 1.387 -7.450 1.00 0.14 H new ATOM 0 H1' DG B 16 4.546 2.459 -7.908 1.00 0.15 H new ATOM 0 H8 DG B 16 2.175 5.103 -6.394 1.00 0.18 H new ATOM 0 H1 DG B 16 7.546 3.774 -3.148 1.00 0.12 H new ATOM 0 H21 DG B 16 8.197 1.562 -5.737 1.00 0.11 H new ATOM 0 H22 DG B 16 8.716 2.257 -4.198 1.00 0.11 H new ATOM 502 P DG B 17 2.422 -0.329 -9.282 1.00 0.16 P ATOM 503 OP1 DG B 17 2.523 -1.349 -10.356 1.00 0.18 O ATOM 504 OP2 DG B 17 1.170 -0.220 -8.491 1.00 0.17 O ATOM 505 O5' DG B 17 3.636 -0.559 -8.274 1.00 0.15 O ATOM 506 C5' DG B 17 4.977 -0.239 -8.655 1.00 0.15 C ATOM 507 C4' DG B 17 5.953 -1.188 -7.999 1.00 0.13 C ATOM 508 O4' DG B 17 6.465 -0.570 -6.795 1.00 0.12 O ATOM 509 C3' DG B 17 5.368 -2.537 -7.581 1.00 0.13 C ATOM 510 O3' DG B 17 6.299 -3.589 -7.850 1.00 0.12 O ATOM 511 C2' DG B 17 5.144 -2.405 -6.083 1.00 0.11 C ATOM 512 C1' DG B 17 6.074 -1.284 -5.634 1.00 0.11 C ATOM 513 N9 DG B 17 5.455 -0.333 -4.716 1.00 0.11 N ATOM 514 C8 DG B 17 4.260 0.317 -4.892 1.00 0.11 C ATOM 515 N7 DG B 17 3.959 1.120 -3.909 1.00 0.11 N ATOM 516 C5 DG B 17 5.022 0.991 -3.025 1.00 0.11 C ATOM 517 C6 DG B 17 5.251 1.611 -1.772 1.00 0.10 C ATOM 518 O6 DG B 17 4.538 2.424 -1.175 1.00 0.10 O ATOM 519 N1 DG B 17 6.453 1.197 -1.206 1.00 0.10 N ATOM 520 C2 DG B 17 7.323 0.300 -1.776 1.00 0.10 C ATOM 521 N2 DG B 17 8.447 0.043 -1.091 1.00 0.10 N ATOM 522 N3 DG B 17 7.113 -0.299 -2.938 1.00 0.11 N ATOM 523 C4 DG B 17 5.953 0.094 -3.505 1.00 0.11 C ATOM 0 H5' DG B 17 5.208 0.787 -8.367 1.00 0.15 H new ATOM 0 H5'' DG B 17 5.077 -0.296 -9.739 1.00 0.15 H new ATOM 0 H4' DG B 17 6.713 -1.383 -8.756 1.00 0.13 H new ATOM 0 H3' DG B 17 4.453 -2.778 -8.122 1.00 0.13 H new ATOM 0 H2' DG B 17 4.104 -2.166 -5.860 1.00 0.11 H new ATOM 0 H2'' DG B 17 5.374 -3.337 -5.567 1.00 0.11 H new ATOM 0 H1' DG B 17 6.907 -1.745 -5.102 1.00 0.11 H new ATOM 0 H8 DG B 17 3.631 0.178 -5.759 1.00 0.11 H new ATOM 0 H1 DG B 17 6.707 1.589 -0.299 1.00 0.10 H new ATOM 0 H21 DG B 17 9.132 -0.615 -1.463 1.00 0.10 H new ATOM 0 H22 DG B 17 8.617 0.505 -0.198 1.00 0.10 H new ATOM 535 P DC B 18 5.802 -5.119 -7.826 1.00 0.13 P ATOM 536 OP1 DC B 18 6.748 -5.898 -8.664 1.00 0.14 O ATOM 537 OP2 DC B 18 4.349 -5.155 -8.135 1.00 0.14 O ATOM 538 O5' DC B 18 6.003 -5.565 -6.310 1.00 0.11 O ATOM 539 C5' DC B 18 7.310 -5.784 -5.778 1.00 0.12 C ATOM 540 C4' DC B 18 7.290 -5.670 -4.272 1.00 0.11 C ATOM 541 O4' DC B 18 6.504 -4.512 -3.902 1.00 0.10 O ATOM 542 C3' DC B 18 6.667 -6.864 -3.538 1.00 0.10 C ATOM 543 O3' DC B 18 7.583 -7.372 -2.559 1.00 0.10 O ATOM 544 C2' DC B 18 5.433 -6.289 -2.859 1.00 0.08 C ATOM 545 C1' DC B 18 5.770 -4.818 -2.740 1.00 0.09 C ATOM 546 N1 DC B 18 4.616 -3.904 -2.675 1.00 0.08 N ATOM 547 C2 DC B 18 4.471 -3.095 -1.548 1.00 0.08 C ATOM 548 O2 DC B 18 5.309 -3.179 -0.643 1.00 0.07 O ATOM 549 N3 DC B 18 3.424 -2.243 -1.472 1.00 0.07 N ATOM 550 C4 DC B 18 2.540 -2.185 -2.470 1.00 0.08 C ATOM 551 N4 DC B 18 1.524 -1.328 -2.352 1.00 0.08 N ATOM 552 C5 DC B 18 2.659 -3.002 -3.632 1.00 0.09 C ATOM 553 C6 DC B 18 3.704 -3.840 -3.691 1.00 0.09 C ATOM 0 H5' DC B 18 8.006 -5.056 -6.195 1.00 0.12 H new ATOM 0 H5'' DC B 18 7.668 -6.771 -6.070 1.00 0.12 H new ATOM 0 H4' DC B 18 8.338 -5.610 -3.978 1.00 0.11 H new ATOM 0 H3' DC B 18 6.426 -7.690 -4.208 1.00 0.10 H new ATOM 0 H2' DC B 18 4.533 -6.451 -3.452 1.00 0.08 H new ATOM 0 H2'' DC B 18 5.259 -6.744 -1.884 1.00 0.08 H new ATOM 0 H1' DC B 18 6.300 -4.671 -1.799 1.00 0.09 H new ATOM 0 H41 DC B 18 0.829 -1.256 -3.095 1.00 0.08 H new ATOM 0 H42 DC B 18 1.443 -0.745 -1.519 1.00 0.08 H new ATOM 0 H5 DC B 18 1.936 -2.948 -4.433 1.00 0.09 H new ATOM 0 H6 DC B 18 3.827 -4.475 -4.556 1.00 0.09 H new ATOM 565 P DC B 19 7.161 -8.624 -1.641 1.00 0.10 P ATOM 566 OP1 DC B 19 8.411 -9.213 -1.096 1.00 0.11 O ATOM 567 OP2 DC B 19 6.224 -9.479 -2.413 1.00 0.11 O ATOM 568 O5' DC B 19 6.351 -7.964 -0.436 1.00 0.09 O ATOM 569 C5' DC B 19 7.019 -7.202 0.571 1.00 0.08 C ATOM 570 C4' DC B 19 6.164 -7.110 1.817 1.00 0.08 C ATOM 571 O4' DC B 19 5.273 -5.975 1.708 1.00 0.07 O ATOM 572 C3' DC B 19 5.278 -8.328 2.092 1.00 0.09 C ATOM 573 O3' DC B 19 5.592 -8.847 3.391 1.00 0.11 O ATOM 574 C2' DC B 19 3.853 -7.791 2.040 1.00 0.08 C ATOM 575 C1' DC B 19 4.016 -6.303 2.264 1.00 0.07 C ATOM 576 N1 DC B 19 3.012 -5.437 1.622 1.00 0.06 N ATOM 577 C2 DC B 19 2.332 -4.505 2.409 1.00 0.06 C ATOM 578 O2 DC B 19 2.553 -4.470 3.628 1.00 0.07 O ATOM 579 N3 DC B 19 1.451 -3.665 1.824 1.00 0.05 N ATOM 580 C4 DC B 19 1.229 -3.739 0.511 1.00 0.06 C ATOM 581 N4 DC B 19 0.350 -2.890 -0.021 1.00 0.06 N ATOM 582 C5 DC B 19 1.898 -4.688 -0.314 1.00 0.06 C ATOM 583 C6 DC B 19 2.767 -5.515 0.279 1.00 0.06 C ATOM 0 H5' DC B 19 7.235 -6.202 0.196 1.00 0.08 H new ATOM 0 H5'' DC B 19 7.976 -7.665 0.812 1.00 0.08 H new ATOM 0 H4' DC B 19 6.880 -7.028 2.635 1.00 0.08 H new ATOM 0 H3' DC B 19 5.420 -9.139 1.378 1.00 0.09 H new ATOM 0 H2' DC B 19 3.382 -8.001 1.080 1.00 0.08 H new ATOM 0 H2'' DC B 19 3.227 -8.244 2.808 1.00 0.08 H new ATOM 0 H1' DC B 19 3.906 -6.124 3.334 1.00 0.07 H new ATOM 0 H41 DC B 19 0.155 -2.918 -1.022 1.00 0.06 H new ATOM 0 H42 DC B 19 -0.128 -2.212 0.573 1.00 0.06 H new ATOM 0 H5 DC B 19 1.711 -4.738 -1.377 1.00 0.06 H new ATOM 0 H6 DC B 19 3.283 -6.256 -0.313 1.00 0.06 H new ATOM 595 P DT B 20 4.653 -9.969 4.056 1.00 0.12 P ATOM 596 OP1 DT B 20 5.372 -10.505 5.240 1.00 0.15 O ATOM 597 OP2 DT B 20 4.205 -10.898 2.988 1.00 0.12 O ATOM 598 O5' DT B 20 3.387 -9.149 4.568 1.00 0.11 O ATOM 599 C5' DT B 20 3.492 -8.223 5.654 1.00 0.11 C ATOM 600 C4' DT B 20 2.151 -8.075 6.338 1.00 0.11 C ATOM 601 O4' DT B 20 1.370 -7.069 5.642 1.00 0.10 O ATOM 602 C3' DT B 20 1.270 -9.331 6.360 1.00 0.13 C ATOM 603 O3' DT B 20 0.597 -9.434 7.621 1.00 0.15 O ATOM 604 C2' DT B 20 0.278 -9.071 5.242 1.00 0.13 C ATOM 605 C1' DT B 20 0.070 -7.582 5.425 1.00 0.11 C ATOM 606 N1 DT B 20 -0.537 -6.839 4.294 1.00 0.10 N ATOM 607 C2 DT B 20 -1.182 -5.660 4.599 1.00 0.09 C ATOM 608 O2 DT B 20 -1.270 -5.226 5.735 1.00 0.10 O ATOM 609 N3 DT B 20 -1.723 -5.006 3.524 1.00 0.09 N ATOM 610 C4 DT B 20 -1.686 -5.398 2.205 1.00 0.09 C ATOM 611 O4 DT B 20 -2.214 -4.697 1.347 1.00 0.09 O ATOM 612 C5 DT B 20 -0.996 -6.644 1.952 1.00 0.09 C ATOM 613 C7 DT B 20 -0.946 -7.172 0.552 1.00 0.10 C ATOM 614 C6 DT B 20 -0.460 -7.298 2.992 1.00 0.10 C ATOM 0 H5' DT B 20 3.831 -7.255 5.286 1.00 0.11 H new ATOM 0 H5'' DT B 20 4.238 -8.571 6.369 1.00 0.11 H new ATOM 0 H4' DT B 20 2.404 -7.824 7.368 1.00 0.11 H new ATOM 0 H3' DT B 20 1.826 -10.260 6.230 1.00 0.13 H new ATOM 0 H2' DT B 20 0.681 -9.319 4.260 1.00 0.13 H new ATOM 0 H2'' DT B 20 -0.644 -9.640 5.361 1.00 0.13 H new ATOM 0 H1' DT B 20 -0.648 -7.450 6.235 1.00 0.11 H new ATOM 0 H3 DT B 20 -2.207 -4.131 3.723 1.00 0.09 H new ATOM 0 H71 DT B 20 -0.029 -7.744 0.411 1.00 0.10 H new ATOM 0 H72 DT B 20 -1.807 -7.817 0.375 1.00 0.10 H new ATOM 0 H73 DT B 20 -0.966 -6.340 -0.152 1.00 0.10 H new ATOM 0 H6 DT B 20 0.057 -8.228 2.804 1.00 0.10 H new ATOM 627 P DG B 21 -0.137 -10.805 8.030 1.00 0.19 P ATOM 628 OP1 DG B 21 0.661 -11.424 9.119 1.00 0.24 O ATOM 629 OP2 DG B 21 -0.417 -11.581 6.795 1.00 0.19 O ATOM 630 O5' DG B 21 -1.529 -10.328 8.643 1.00 0.20 O ATOM 631 C5' DG B 21 -1.585 -9.641 9.895 1.00 0.21 C ATOM 632 C4' DG B 21 -2.909 -8.926 10.046 1.00 0.21 C ATOM 633 O4' DG B 21 -3.139 -8.089 8.883 1.00 0.19 O ATOM 634 C3' DG B 21 -4.137 -9.840 10.166 1.00 0.23 C ATOM 635 O3' DG B 21 -4.856 -9.500 11.359 1.00 0.21 O ATOM 636 C2' DG B 21 -4.947 -9.549 8.909 1.00 0.23 C ATOM 637 C1' DG B 21 -4.503 -8.161 8.516 1.00 0.21 C ATOM 638 N9 DG B 21 -4.608 -7.856 7.092 1.00 0.20 N ATOM 639 C8 DG B 21 -4.207 -8.645 6.042 1.00 0.21 C ATOM 640 N7 DG B 21 -4.380 -8.082 4.878 1.00 0.21 N ATOM 641 C5 DG B 21 -4.960 -6.856 5.175 1.00 0.21 C ATOM 642 C6 DG B 21 -5.395 -5.817 4.315 1.00 0.21 C ATOM 643 O6 DG B 21 -5.339 -5.764 3.083 1.00 0.21 O ATOM 644 N1 DG B 21 -5.941 -4.757 5.030 1.00 0.20 N ATOM 645 C2 DG B 21 -6.056 -4.706 6.397 1.00 0.20 C ATOM 646 N2 DG B 21 -6.619 -3.600 6.898 1.00 0.20 N ATOM 647 N3 DG B 21 -5.652 -5.667 7.211 1.00 0.20 N ATOM 648 C4 DG B 21 -5.118 -6.706 6.536 1.00 0.20 C ATOM 0 H5' DG B 21 -0.767 -8.923 9.960 1.00 0.21 H new ATOM 0 H5'' DG B 21 -1.452 -10.350 10.712 1.00 0.21 H new ATOM 0 H4' DG B 21 -2.815 -8.369 10.978 1.00 0.21 H new ATOM 0 H3' DG B 21 -3.895 -10.900 10.240 1.00 0.23 H new ATOM 0 H2' DG B 21 -4.741 -10.274 8.122 1.00 0.23 H new ATOM 0 H2'' DG B 21 -6.019 -9.587 9.104 1.00 0.23 H new ATOM 0 H1' DG B 21 -5.155 -7.442 9.012 1.00 0.21 H new ATOM 0 H8 DG B 21 -3.790 -9.633 6.167 1.00 0.21 H new ATOM 0 H1 DG B 21 -6.282 -3.956 4.498 1.00 0.20 H new ATOM 0 H21 DG B 21 -6.734 -3.498 7.906 1.00 0.20 H new ATOM 0 H22 DG B 21 -6.933 -2.859 6.271 1.00 0.20 H new ATOM 660 P DA B 22 -6.346 -10.060 11.598 1.00 0.34 P ATOM 661 OP1 DA B 22 -6.451 -10.467 13.022 1.00 0.38 O ATOM 662 OP2 DA B 22 -6.668 -11.044 10.531 1.00 0.41 O ATOM 663 O5' DA B 22 -7.262 -8.774 11.386 1.00 0.35 O ATOM 664 C5' DA B 22 -6.758 -7.462 11.654 1.00 0.29 C ATOM 665 C4' DA B 22 -7.880 -6.451 11.599 1.00 0.34 C ATOM 666 O4' DA B 22 -7.971 -5.920 10.256 1.00 0.37 O ATOM 667 C3' DA B 22 -9.266 -7.016 11.890 1.00 0.41 C ATOM 668 O3' DA B 22 -10.128 -5.982 12.375 1.00 0.48 O ATOM 669 C2' DA B 22 -9.696 -7.511 10.523 1.00 0.40 C ATOM 670 C1' DA B 22 -9.134 -6.431 9.612 1.00 0.36 C ATOM 671 N9 DA B 22 -8.739 -6.909 8.289 1.00 0.32 N ATOM 672 C8 DA B 22 -8.057 -8.061 8.002 1.00 0.31 C ATOM 673 N7 DA B 22 -7.810 -8.227 6.726 1.00 0.27 N ATOM 674 C5 DA B 22 -8.381 -7.111 6.130 1.00 0.25 C ATOM 675 C6 DA B 22 -8.470 -6.696 4.791 1.00 0.22 C ATOM 676 N6 DA B 22 -7.958 -7.381 3.769 1.00 0.20 N ATOM 677 N1 DA B 22 -9.112 -5.537 4.535 1.00 0.21 N ATOM 678 C2 DA B 22 -9.626 -4.848 5.562 1.00 0.24 C ATOM 679 N3 DA B 22 -9.609 -5.136 6.861 1.00 0.28 N ATOM 680 C4 DA B 22 -8.963 -6.294 7.081 1.00 0.28 C ATOM 0 H5' DA B 22 -5.990 -7.204 10.925 1.00 0.29 H new ATOM 0 H5'' DA B 22 -6.286 -7.439 12.636 1.00 0.29 H new ATOM 0 H4' DA B 22 -7.629 -5.717 12.364 1.00 0.34 H new ATOM 0 H3' DA B 22 -9.289 -7.793 12.654 1.00 0.41 H new ATOM 0 H2' DA B 22 -9.283 -8.494 10.295 1.00 0.40 H new ATOM 0 H2'' DA B 22 -10.780 -7.593 10.440 1.00 0.40 H new ATOM 0 H1' DA B 22 -9.917 -5.690 9.453 1.00 0.36 H new ATOM 0 H8 DA B 22 -7.751 -8.768 8.758 1.00 0.31 H new ATOM 0 H61 DA B 22 -8.056 -7.027 2.818 1.00 0.20 H new ATOM 0 H62 DA B 22 -7.468 -8.260 3.938 1.00 0.20 H new ATOM 0 H2 DA B 22 -10.125 -3.927 5.298 1.00 0.24 H new ATOM 692 P DG B 23 -11.590 -6.355 12.925 1.00 0.57 P ATOM 693 OP1 DG B 23 -12.186 -5.114 13.481 1.00 0.65 O ATOM 694 OP2 DG B 23 -11.475 -7.562 13.784 1.00 0.64 O ATOM 695 O5' DG B 23 -12.398 -6.751 11.612 1.00 0.48 O ATOM 696 C5' DG B 23 -12.733 -5.770 10.630 1.00 0.41 C ATOM 697 C4' DG B 23 -13.595 -6.386 9.553 1.00 0.34 C ATOM 698 O4' DG B 23 -12.758 -6.770 8.438 1.00 0.31 O ATOM 699 C3' DG B 23 -14.341 -7.657 9.978 1.00 0.38 C ATOM 700 O3' DG B 23 -15.755 -7.442 9.950 1.00 0.38 O ATOM 701 C2' DG B 23 -13.946 -8.695 8.938 1.00 0.37 C ATOM 702 C1' DG B 23 -13.385 -7.861 7.809 1.00 0.31 C ATOM 703 N9 DG B 23 -12.404 -8.543 6.972 1.00 0.30 N ATOM 704 C8 DG B 23 -11.514 -9.514 7.358 1.00 0.32 C ATOM 705 N7 DG B 23 -10.786 -9.967 6.373 1.00 0.30 N ATOM 706 C5 DG B 23 -11.220 -9.244 5.270 1.00 0.27 C ATOM 707 C6 DG B 23 -10.807 -9.296 3.912 1.00 0.25 C ATOM 708 O6 DG B 23 -9.944 -10.014 3.395 1.00 0.25 O ATOM 709 N1 DG B 23 -11.513 -8.390 3.128 1.00 0.22 N ATOM 710 C2 DG B 23 -12.486 -7.540 3.590 1.00 0.22 C ATOM 711 N2 DG B 23 -13.052 -6.737 2.683 1.00 0.20 N ATOM 712 N3 DG B 23 -12.878 -7.479 4.849 1.00 0.24 N ATOM 713 C4 DG B 23 -12.211 -8.354 5.627 1.00 0.27 C ATOM 0 H5' DG B 23 -11.824 -5.360 10.189 1.00 0.41 H new ATOM 0 H5'' DG B 23 -13.262 -4.940 11.099 1.00 0.41 H new ATOM 0 H4' DG B 23 -14.333 -5.622 9.309 1.00 0.34 H new ATOM 0 H3' DG B 23 -14.090 -7.964 10.993 1.00 0.38 H new ATOM 0 H2' DG B 23 -13.206 -9.394 9.328 1.00 0.37 H new ATOM 0 H2'' DG B 23 -14.803 -9.286 8.614 1.00 0.37 H new ATOM 0 H1' DG B 23 -14.198 -7.596 7.134 1.00 0.31 H new ATOM 0 H8 DG B 23 -11.425 -9.868 8.374 1.00 0.32 H new ATOM 0 H1 DG B 23 -11.290 -8.355 2.133 1.00 0.22 H new ATOM 0 H21 DG B 23 -13.782 -6.083 2.966 1.00 0.20 H new ATOM 0 H22 DG B 23 -12.754 -6.779 1.708 1.00 0.20 H new ATOM 725 P DG B 24 -16.747 -8.571 10.524 1.00 0.37 P ATOM 726 OP1 DG B 24 -17.658 -7.909 11.493 1.00 0.36 O ATOM 727 OP2 DG B 24 -15.937 -9.738 10.959 1.00 0.57 O ATOM 728 O5' DG B 24 -17.608 -9.010 9.257 1.00 0.36 O ATOM 729 C5' DG B 24 -18.493 -8.090 8.614 1.00 0.31 C ATOM 730 C4' DG B 24 -18.866 -8.595 7.239 1.00 0.42 C ATOM 731 O4' DG B 24 -17.657 -8.964 6.536 1.00 0.42 O ATOM 732 C3' DG B 24 -19.770 -9.834 7.225 1.00 0.63 C ATOM 733 O3' DG B 24 -20.909 -9.601 6.392 1.00 0.71 O ATOM 734 C2' DG B 24 -18.900 -10.932 6.628 1.00 0.65 C ATOM 735 C1' DG B 24 -17.880 -10.159 5.819 1.00 0.53 C ATOM 736 N9 DG B 24 -16.590 -10.821 5.639 1.00 0.55 N ATOM 737 C8 DG B 24 -15.798 -11.385 6.610 1.00 0.62 C ATOM 738 N7 DG B 24 -14.695 -11.901 6.139 1.00 0.66 N ATOM 739 C5 DG B 24 -14.762 -11.662 4.773 1.00 0.60 C ATOM 740 C6 DG B 24 -13.850 -11.989 3.737 1.00 0.62 C ATOM 741 O6 DG B 24 -12.765 -12.576 3.821 1.00 0.70 O ATOM 742 N1 DG B 24 -14.309 -11.561 2.496 1.00 0.54 N ATOM 743 C2 DG B 24 -15.494 -10.903 2.279 1.00 0.49 C ATOM 744 N2 DG B 24 -15.764 -10.576 1.011 1.00 0.46 N ATOM 745 N3 DG B 24 -16.352 -10.590 3.234 1.00 0.49 N ATOM 746 C4 DG B 24 -15.926 -10.997 4.448 1.00 0.54 C ATOM 0 H5' DG B 24 -18.017 -7.113 8.533 1.00 0.31 H new ATOM 0 H5'' DG B 24 -19.392 -7.958 9.217 1.00 0.31 H new ATOM 0 H4' DG B 24 -19.419 -7.778 6.775 1.00 0.42 H new ATOM 0 H3' DG B 24 -20.144 -10.090 8.216 1.00 0.63 H new ATOM 0 H2' DG B 24 -18.427 -11.537 7.402 1.00 0.65 H new ATOM 0 H2'' DG B 24 -19.480 -11.611 6.003 1.00 0.65 H new ATOM 0 HO3' DG B 24 -21.480 -10.398 6.388 1.00 0.71 H new ATOM 0 H1' DG B 24 -18.282 -10.031 4.814 1.00 0.53 H new ATOM 0 H8 DG B 24 -16.061 -11.400 7.657 1.00 0.62 H new ATOM 0 H1 DG B 24 -13.720 -11.751 1.685 1.00 0.54 H new ATOM 0 H21 DG B 24 -16.629 -10.086 0.784 1.00 0.46 H new ATOM 0 H22 DG B 24 -15.105 -10.817 0.271 1.00 0.46 H new TER 759 DG B 24 HETATM 760 PT 1PT A 77 -0.159 2.405 2.370 1.00 0.06 PT HETATM 761 N1 1PT A 77 -1.958 3.070 1.718 1.00 0.08 N HETATM 762 N2 1PT A 77 0.621 3.505 0.859 1.00 0.09 N HETATM 763 C1 1PT A 77 -1.719 4.269 0.777 1.00 0.11 C HETATM 764 C2 1PT A 77 -0.525 3.913 -0.090 1.00 0.12 C HETATM 765 C3 1PT A 77 -0.152 5.054 -0.992 1.00 0.16 C HETATM 766 C4 1PT A 77 -1.317 5.441 -1.872 1.00 0.19 C HETATM 767 C5 1PT A 77 -2.613 5.825 -0.998 1.00 0.18 C HETATM 768 C6 1PT A 77 -2.910 4.599 -0.060 1.00 0.14 C HETATM 0 H62 1PT A 77 -3.187 3.734 -0.662 1.00 0.14 H new HETATM 0 H61 1PT A 77 -3.760 4.826 0.583 1.00 0.14 H new HETATM 0 H52 1PT A 77 -2.430 6.725 -0.411 1.00 0.18 H new HETATM 0 H51 1PT A 77 -3.466 6.033 -1.643 1.00 0.18 H new HETATM 0 H42 1PT A 77 -1.036 6.287 -2.499 1.00 0.19 H new HETATM 0 H41 1PT A 77 -1.559 4.615 -2.541 1.00 0.19 H new HETATM 0 H32 1PT A 77 0.159 5.911 -0.394 1.00 0.16 H new HETATM 0 H31 1PT A 77 0.700 4.772 -1.611 1.00 0.16 H new HETATM 0 H2 1PT A 77 -0.758 3.082 -0.756 1.00 0.12 H new HETATM 0 H1 1PT A 77 -1.531 5.165 1.369 1.00 0.11 H new