USER MOD reduce.3.24.130724 H: found=0, std=0, add=264, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 264 hydrogens (15 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 6 DG H21 : A 6 DG N2 : A 25 BPJ C1 :(H bumps) USER MOD NoAdj-H: A 25 BPJH12A : A 25 BPJ C1 : A 6 DG N2 :(H bumps) USER MOD Single : A 1 DC O5' : rot 180:sc= -0.0654 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.22 (180deg=-1.22) USER MOD Single : A 8 DT C7 :methyl -30:sc= -1.11 (180deg=-1.46) USER MOD Single : A 11 DC O3' : rot 180:sc= 0 USER MOD Single : A 25 BPJ O2 : rot 180:sc= 0 USER MOD Single : A 25 BPJ O3 : rot 119:sc= -0.966 USER MOD Single : A 25 BPJ O4 : rot -150:sc= -0.131 USER MOD Single : B 12 DG O5' : rot 180:sc= 0 USER MOD Single : B 14 DT C7 :methyl 150:sc= -0.537 (180deg=-0.537) USER MOD Single : B 20 DT C7 :methyl 150:sc= -0.941 (180deg=-0.941) USER MOD Single : B 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 13.443 -16.663 3.154 1.00 0.14 O ATOM 2 C5' DC A 1 13.032 -17.606 2.156 1.00 0.12 C ATOM 3 C4' DC A 1 11.617 -17.339 1.656 1.00 0.09 C ATOM 4 O4' DC A 1 10.679 -17.460 2.722 1.00 0.10 O ATOM 5 C3' DC A 1 11.486 -15.924 1.113 1.00 0.09 C ATOM 6 O3' DC A 1 11.744 -15.795 -0.304 1.00 0.08 O ATOM 7 C2' DC A 1 10.040 -15.670 1.387 1.00 0.09 C ATOM 8 C1' DC A 1 9.513 -16.765 2.284 1.00 0.11 C ATOM 9 N1 DC A 1 8.840 -16.241 3.474 1.00 0.10 N ATOM 10 C2 DC A 1 7.540 -16.611 3.765 1.00 0.12 C ATOM 11 O2 DC A 1 6.898 -17.372 3.049 1.00 0.15 O ATOM 12 N3 DC A 1 6.969 -16.102 4.882 1.00 0.12 N ATOM 13 C4 DC A 1 7.639 -15.266 5.678 1.00 0.11 C ATOM 14 N4 DC A 1 7.016 -14.814 6.759 1.00 0.13 N ATOM 15 C5 DC A 1 8.986 -14.877 5.375 1.00 0.09 C ATOM 16 C6 DC A 1 9.530 -15.397 4.268 1.00 0.09 C ATOM 0 H5' DC A 1 13.085 -18.614 2.568 1.00 0.12 H new ATOM 0 H5'' DC A 1 13.725 -17.568 1.316 1.00 0.12 H new ATOM 0 H4' DC A 1 11.416 -18.069 0.872 1.00 0.09 H new ATOM 0 H3' DC A 1 12.205 -15.239 1.562 1.00 0.09 H new ATOM 0 H2' DC A 1 9.912 -14.698 1.863 1.00 0.09 H new ATOM 0 H2'' DC A 1 9.478 -15.644 0.453 1.00 0.09 H new ATOM 0 HO5' DC A 1 14.354 -16.873 3.447 1.00 0.14 H new ATOM 0 H1' DC A 1 8.789 -17.375 1.745 1.00 0.11 H new ATOM 0 H41 DC A 1 7.494 -14.173 7.393 1.00 0.13 H new ATOM 0 H42 DC A 1 6.059 -15.107 6.956 1.00 0.13 H new ATOM 0 H5 DC A 1 9.535 -14.197 6.010 1.00 0.09 H new ATOM 0 H6 DC A 1 10.544 -15.135 4.005 1.00 0.09 H new ATOM 29 P DC A 2 11.079 -16.707 -1.484 1.00 0.07 P ATOM 30 OP1 DC A 2 11.441 -18.117 -1.215 1.00 0.08 O ATOM 31 OP2 DC A 2 11.437 -16.092 -2.781 1.00 0.12 O ATOM 32 O5' DC A 2 9.480 -16.531 -1.269 1.00 0.10 O ATOM 33 C5' DC A 2 8.539 -17.594 -1.527 1.00 0.12 C ATOM 34 C4' DC A 2 7.078 -17.198 -1.262 1.00 0.13 C ATOM 35 O4' DC A 2 6.855 -16.818 0.109 1.00 0.14 O ATOM 36 C3' DC A 2 6.602 -16.014 -2.130 1.00 0.13 C ATOM 37 O3' DC A 2 5.692 -16.372 -3.187 1.00 0.15 O ATOM 38 C2' DC A 2 5.965 -15.092 -1.125 1.00 0.14 C ATOM 39 C1' DC A 2 5.721 -15.934 0.128 1.00 0.14 C ATOM 40 N1 DC A 2 5.792 -15.090 1.320 1.00 0.13 N ATOM 41 C2 DC A 2 4.790 -15.048 2.283 1.00 0.15 C ATOM 42 O2 DC A 2 3.764 -15.713 2.201 1.00 0.17 O ATOM 43 N3 DC A 2 4.968 -14.226 3.351 1.00 0.14 N ATOM 44 C4 DC A 2 6.074 -13.482 3.463 1.00 0.12 C ATOM 45 N4 DC A 2 6.207 -12.691 4.521 1.00 0.12 N ATOM 46 C5 DC A 2 7.084 -13.548 2.457 1.00 0.11 C ATOM 47 C6 DC A 2 6.889 -14.351 1.436 1.00 0.11 C ATOM 0 H5' DC A 2 8.793 -18.452 -0.905 1.00 0.12 H new ATOM 0 H5'' DC A 2 8.638 -17.912 -2.565 1.00 0.12 H new ATOM 0 H4' DC A 2 6.513 -18.095 -1.514 1.00 0.13 H new ATOM 0 H3' DC A 2 7.430 -15.567 -2.680 1.00 0.13 H new ATOM 0 H2' DC A 2 6.616 -14.246 -0.905 1.00 0.14 H new ATOM 0 H2'' DC A 2 5.030 -14.684 -1.508 1.00 0.14 H new ATOM 0 H1' DC A 2 4.752 -16.433 0.145 1.00 0.14 H new ATOM 0 H41 DC A 2 7.043 -12.115 4.626 1.00 0.12 H new ATOM 0 H42 DC A 2 5.474 -12.659 5.229 1.00 0.12 H new ATOM 0 H5 DC A 2 7.983 -12.955 2.533 1.00 0.11 H new ATOM 0 H6 DC A 2 7.645 -14.412 0.667 1.00 0.11 H new ATOM 59 P DA A 3 4.285 -17.165 -2.998 1.00 0.15 P ATOM 60 OP1 DA A 3 4.486 -18.241 -1.999 1.00 0.18 O ATOM 61 OP2 DA A 3 3.790 -17.514 -4.348 1.00 0.17 O ATOM 62 O5' DA A 3 3.258 -16.089 -2.358 1.00 0.15 O ATOM 63 C5' DA A 3 1.925 -16.502 -2.001 1.00 0.15 C ATOM 64 C4' DA A 3 1.089 -15.444 -1.311 1.00 0.15 C ATOM 65 O4' DA A 3 1.675 -15.011 -0.065 1.00 0.16 O ATOM 66 C3' DA A 3 0.807 -14.195 -2.145 1.00 0.14 C ATOM 67 O3' DA A 3 -0.537 -14.186 -2.657 1.00 0.14 O ATOM 68 C2' DA A 3 1.089 -13.105 -1.143 1.00 0.14 C ATOM 69 C1' DA A 3 1.102 -13.732 0.229 1.00 0.15 C ATOM 70 N9 DA A 3 1.965 -12.981 1.165 1.00 0.14 N ATOM 71 C8 DA A 3 3.205 -12.484 0.931 1.00 0.15 C ATOM 72 N7 DA A 3 3.760 -11.863 1.986 1.00 0.13 N ATOM 73 C5 DA A 3 2.806 -11.978 2.942 1.00 0.13 C ATOM 74 C6 DA A 3 2.761 -11.542 4.267 1.00 0.12 C ATOM 75 N6 DA A 3 3.766 -10.892 4.845 1.00 0.13 N ATOM 76 N1 DA A 3 1.656 -11.809 4.970 1.00 0.12 N ATOM 77 C2 DA A 3 0.655 -12.469 4.403 1.00 0.13 C ATOM 78 N3 DA A 3 0.577 -12.933 3.163 1.00 0.13 N ATOM 79 C4 DA A 3 1.704 -12.649 2.473 1.00 0.13 C ATOM 0 H5' DA A 3 1.993 -17.372 -1.348 1.00 0.15 H new ATOM 0 H5'' DA A 3 1.406 -16.821 -2.905 1.00 0.15 H new ATOM 0 H4' DA A 3 0.142 -15.957 -1.142 1.00 0.15 H new ATOM 0 H3' DA A 3 1.404 -14.102 -3.052 1.00 0.14 H new ATOM 0 H2' DA A 3 2.047 -12.630 -1.355 1.00 0.14 H new ATOM 0 H2'' DA A 3 0.328 -12.327 -1.200 1.00 0.14 H new ATOM 0 H1' DA A 3 0.125 -13.763 0.711 1.00 0.15 H new ATOM 0 H8 DA A 3 3.704 -12.579 -0.022 1.00 0.15 H new ATOM 0 H61 DA A 3 3.688 -10.592 5.817 1.00 0.13 H new ATOM 0 H62 DA A 3 4.615 -10.693 4.317 1.00 0.13 H new ATOM 0 H2 DA A 3 -0.205 -12.652 5.030 1.00 0.13 H new ATOM 91 P DT A 4 -1.255 -12.901 -3.332 1.00 0.14 P ATOM 92 OP1 DT A 4 -2.249 -13.384 -4.317 1.00 0.17 O ATOM 93 OP2 DT A 4 -0.209 -11.939 -3.753 1.00 0.18 O ATOM 94 O5' DT A 4 -2.043 -12.258 -2.079 1.00 0.15 O ATOM 95 C5' DT A 4 -3.149 -12.936 -1.455 1.00 0.14 C ATOM 96 C4' DT A 4 -3.804 -12.112 -0.343 1.00 0.11 C ATOM 97 O4' DT A 4 -2.860 -11.824 0.713 1.00 0.12 O ATOM 98 C3' DT A 4 -4.354 -10.770 -0.847 1.00 0.12 C ATOM 99 O3' DT A 4 -5.503 -10.343 -0.096 1.00 0.14 O ATOM 100 C2' DT A 4 -3.162 -9.901 -0.534 1.00 0.12 C ATOM 101 C1' DT A 4 -2.753 -10.402 0.844 1.00 0.10 C ATOM 102 N1 DT A 4 -1.386 -10.034 1.284 1.00 0.10 N ATOM 103 C2 DT A 4 -1.192 -9.718 2.623 1.00 0.09 C ATOM 104 O2 DT A 4 -2.087 -9.712 3.462 1.00 0.11 O ATOM 105 N3 DT A 4 0.092 -9.394 2.988 1.00 0.10 N ATOM 106 C4 DT A 4 1.186 -9.358 2.152 1.00 0.11 C ATOM 107 O4 DT A 4 2.284 -9.058 2.601 1.00 0.13 O ATOM 108 C5 DT A 4 0.893 -9.699 0.781 1.00 0.12 C ATOM 109 C7 DT A 4 1.967 -9.714 -0.297 1.00 0.13 C ATOM 110 C6 DT A 4 -0.342 -10.015 0.403 1.00 0.11 C ATOM 0 H5' DT A 4 -2.801 -13.883 -1.042 1.00 0.14 H new ATOM 0 H5'' DT A 4 -3.896 -13.174 -2.212 1.00 0.14 H new ATOM 0 H4' DT A 4 -4.628 -12.722 0.026 1.00 0.11 H new ATOM 0 H3' DT A 4 -4.696 -10.769 -1.882 1.00 0.12 H new ATOM 0 H2' DT A 4 -2.364 -10.025 -1.266 1.00 0.12 H new ATOM 0 H2'' DT A 4 -3.422 -8.842 -0.522 1.00 0.12 H new ATOM 0 H1' DT A 4 -3.385 -9.948 1.608 1.00 0.10 H new ATOM 0 H3 DT A 4 0.250 -9.159 3.968 1.00 0.10 H new ATOM 0 H71 DT A 4 1.712 -10.455 -1.055 1.00 0.13 H new ATOM 0 H72 DT A 4 2.032 -8.729 -0.760 1.00 0.13 H new ATOM 0 H73 DT A 4 2.928 -9.969 0.150 1.00 0.13 H new ATOM 0 H6 DT A 4 -0.525 -10.264 -0.632 1.00 0.11 H new ATOM 123 P DC A 5 -6.216 -8.907 -0.328 1.00 0.15 P ATOM 124 OP1 DC A 5 -6.956 -8.979 -1.609 1.00 0.17 O ATOM 125 OP2 DC A 5 -5.219 -7.831 -0.123 1.00 0.18 O ATOM 126 O5' DC A 5 -7.306 -8.832 0.861 1.00 0.17 O ATOM 127 C5' DC A 5 -7.092 -9.091 2.263 1.00 0.16 C ATOM 128 C4' DC A 5 -6.270 -8.045 3.036 1.00 0.11 C ATOM 129 O4' DC A 5 -4.847 -8.043 2.783 1.00 0.12 O ATOM 130 C3' DC A 5 -6.763 -6.603 2.842 1.00 0.09 C ATOM 131 O3' DC A 5 -7.408 -6.100 4.023 1.00 0.10 O ATOM 132 C2' DC A 5 -5.460 -5.886 2.461 1.00 0.11 C ATOM 133 C1' DC A 5 -4.346 -6.722 3.079 1.00 0.10 C ATOM 134 N1 DC A 5 -2.980 -6.579 2.501 1.00 0.09 N ATOM 135 C2 DC A 5 -1.895 -6.317 3.342 1.00 0.10 C ATOM 136 O2 DC A 5 -2.020 -6.134 4.551 1.00 0.11 O ATOM 137 N3 DC A 5 -0.655 -6.239 2.792 1.00 0.11 N ATOM 138 C4 DC A 5 -0.470 -6.408 1.480 1.00 0.10 C ATOM 139 N4 DC A 5 0.766 -6.332 0.995 1.00 0.12 N ATOM 140 C5 DC A 5 -1.570 -6.671 0.609 1.00 0.10 C ATOM 141 C6 DC A 5 -2.792 -6.744 1.165 1.00 0.10 C ATOM 0 H5' DC A 5 -6.594 -10.056 2.360 1.00 0.16 H new ATOM 0 H5'' DC A 5 -8.065 -9.185 2.745 1.00 0.16 H new ATOM 0 H4' DC A 5 -6.435 -8.377 4.061 1.00 0.11 H new ATOM 0 H3' DC A 5 -7.539 -6.472 2.088 1.00 0.09 H new ATOM 0 H2' DC A 5 -5.349 -5.821 1.379 1.00 0.11 H new ATOM 0 H2'' DC A 5 -5.446 -4.866 2.845 1.00 0.11 H new ATOM 0 H1' DC A 5 -4.178 -6.440 4.118 1.00 0.10 H new ATOM 0 H41 DC A 5 0.931 -6.458 -0.004 1.00 0.12 H new ATOM 0 H42 DC A 5 1.549 -6.148 1.622 1.00 0.12 H new ATOM 0 H5 DC A 5 -1.427 -6.806 -0.453 1.00 0.10 H new ATOM 0 H6 DC A 5 -3.646 -6.939 0.534 1.00 0.10 H new ATOM 153 P DG A 6 -8.105 -4.643 4.071 1.00 0.09 P ATOM 154 OP1 DG A 6 -9.001 -4.592 5.252 1.00 0.14 O ATOM 155 OP2 DG A 6 -8.643 -4.331 2.728 1.00 0.14 O ATOM 156 O5' DG A 6 -6.835 -3.694 4.344 1.00 0.09 O ATOM 157 C5' DG A 6 -6.225 -3.616 5.642 1.00 0.09 C ATOM 158 C4' DG A 6 -4.936 -2.800 5.636 1.00 0.09 C ATOM 159 O4' DG A 6 -3.885 -3.379 4.848 1.00 0.10 O ATOM 160 C3' DG A 6 -5.151 -1.408 5.044 1.00 0.09 C ATOM 161 O3' DG A 6 -5.592 -0.480 6.043 1.00 0.13 O ATOM 162 C2' DG A 6 -3.770 -1.107 4.469 1.00 0.10 C ATOM 163 C1' DG A 6 -2.913 -2.328 4.797 1.00 0.09 C ATOM 164 N9 DG A 6 -1.891 -2.627 3.772 1.00 0.08 N ATOM 165 C8 DG A 6 -2.042 -3.152 2.522 1.00 0.09 C ATOM 166 N7 DG A 6 -0.874 -3.298 1.858 1.00 0.10 N ATOM 167 C5 DG A 6 0.053 -2.841 2.743 1.00 0.08 C ATOM 168 C6 DG A 6 1.468 -2.742 2.621 1.00 0.08 C ATOM 169 O6 DG A 6 2.197 -3.030 1.676 1.00 0.11 O ATOM 170 N1 DG A 6 2.049 -2.220 3.756 1.00 0.09 N ATOM 171 C2 DG A 6 1.374 -1.830 4.888 1.00 0.08 C ATOM 172 N2 DG A 6 2.119 -1.309 5.866 1.00 0.09 N ATOM 173 N3 DG A 6 0.049 -1.920 5.008 1.00 0.08 N ATOM 174 C4 DG A 6 -0.545 -2.430 3.908 1.00 0.07 C ATOM 0 H5' DG A 6 -6.012 -4.623 6.000 1.00 0.09 H new ATOM 0 H5'' DG A 6 -6.929 -3.171 6.344 1.00 0.09 H new ATOM 0 H4' DG A 6 -4.650 -2.769 6.687 1.00 0.09 H new ATOM 0 H3' DG A 6 -5.936 -1.338 4.291 1.00 0.09 H new ATOM 0 H2' DG A 6 -3.821 -0.942 3.393 1.00 0.10 H new ATOM 0 H2'' DG A 6 -3.350 -0.203 4.911 1.00 0.10 H new ATOM 0 H1' DG A 6 -2.338 -2.185 5.712 1.00 0.09 H new ATOM 0 H8 DG A 6 -3.000 -3.424 2.104 1.00 0.09 H new ATOM 0 H1 DG A 6 3.064 -2.114 3.756 1.00 0.09 H new ATOM 0 H22 DG A 6 3.128 -1.220 5.746 1.00 0.09 H new ATOM 185 P DC A 7 -6.735 0.632 5.776 1.00 0.15 P ATOM 186 OP1 DC A 7 -7.803 0.463 6.789 1.00 0.24 O ATOM 187 OP2 DC A 7 -7.089 0.616 4.338 1.00 0.17 O ATOM 188 O5' DC A 7 -5.967 2.021 6.074 1.00 0.20 O ATOM 189 C5' DC A 7 -5.433 2.388 7.356 1.00 0.22 C ATOM 190 C4' DC A 7 -4.283 1.477 7.824 1.00 0.16 C ATOM 191 O4' DC A 7 -3.281 1.299 6.823 1.00 0.15 O ATOM 192 C3' DC A 7 -3.615 1.989 9.078 1.00 0.17 C ATOM 193 O3' DC A 7 -2.985 0.991 9.889 1.00 0.17 O ATOM 194 C2' DC A 7 -2.585 2.856 8.407 1.00 0.15 C ATOM 195 C1' DC A 7 -2.150 2.112 7.157 1.00 0.12 C ATOM 196 N1 DC A 7 -1.762 2.900 5.945 1.00 0.13 N ATOM 197 C2 DC A 7 -0.568 3.624 5.907 1.00 0.13 C ATOM 198 O2 DC A 7 0.207 3.686 6.858 1.00 0.14 O ATOM 199 N3 DC A 7 -0.259 4.293 4.762 1.00 0.13 N ATOM 200 C4 DC A 7 -1.072 4.266 3.700 1.00 0.15 C ATOM 201 N4 DC A 7 -0.727 4.925 2.600 1.00 0.18 N ATOM 202 C5 DC A 7 -2.294 3.537 3.722 1.00 0.18 C ATOM 203 C6 DC A 7 -2.594 2.877 4.855 1.00 0.17 C ATOM 0 H5' DC A 7 -6.233 2.360 8.096 1.00 0.22 H new ATOM 0 H5'' DC A 7 -5.076 3.417 7.311 1.00 0.22 H new ATOM 0 H4' DC A 7 -4.756 0.517 8.032 1.00 0.16 H new ATOM 0 H3' DC A 7 -4.299 2.450 9.790 1.00 0.17 H new ATOM 0 H2' DC A 7 -3.003 3.831 8.154 1.00 0.15 H new ATOM 0 H2'' DC A 7 -1.737 3.035 9.068 1.00 0.15 H new ATOM 0 H1' DC A 7 -1.220 1.601 7.407 1.00 0.12 H new ATOM 0 H41 DC A 7 -1.339 4.911 1.784 1.00 0.18 H new ATOM 0 H42 DC A 7 0.150 5.445 2.571 1.00 0.18 H new ATOM 0 H5 DC A 7 -2.952 3.515 2.866 1.00 0.18 H new ATOM 0 H6 DC A 7 -3.514 2.314 4.908 1.00 0.17 H new ATOM 215 P DT A 8 -2.466 1.348 11.377 1.00 0.18 P ATOM 216 OP1 DT A 8 -1.337 0.444 11.697 1.00 0.23 O ATOM 217 OP2 DT A 8 -3.640 1.417 12.279 1.00 0.27 O ATOM 218 O5' DT A 8 -1.895 2.853 11.183 1.00 0.18 O ATOM 219 C5' DT A 8 -0.639 3.307 11.698 1.00 0.15 C ATOM 220 C4' DT A 8 -0.272 4.706 11.249 1.00 0.13 C ATOM 221 O4' DT A 8 -0.131 4.772 9.819 1.00 0.14 O ATOM 222 C3' DT A 8 -1.311 5.731 11.670 1.00 0.14 C ATOM 223 O3' DT A 8 -0.938 6.340 12.930 1.00 0.14 O ATOM 224 C2' DT A 8 -1.249 6.658 10.495 1.00 0.12 C ATOM 225 C1' DT A 8 -0.137 6.174 9.554 1.00 0.12 C ATOM 226 N1 DT A 8 -0.538 6.461 8.170 1.00 0.09 N ATOM 227 C2 DT A 8 0.315 7.106 7.310 1.00 0.10 C ATOM 228 O2 DT A 8 1.457 7.447 7.601 1.00 0.12 O ATOM 229 N3 DT A 8 -0.194 7.359 6.062 1.00 0.10 N ATOM 230 C4 DT A 8 -1.446 7.039 5.597 1.00 0.11 C ATOM 231 O4 DT A 8 -1.740 7.324 4.440 1.00 0.15 O ATOM 232 C5 DT A 8 -2.268 6.364 6.577 1.00 0.11 C ATOM 233 C7 DT A 8 -3.712 5.967 6.294 1.00 0.17 C ATOM 234 C6 DT A 8 -1.778 6.106 7.792 1.00 0.11 C ATOM 0 H5' DT A 8 0.144 2.616 11.385 1.00 0.15 H new ATOM 0 H5'' DT A 8 -0.671 3.280 12.787 1.00 0.15 H new ATOM 0 H4' DT A 8 0.678 4.939 11.731 1.00 0.13 H new ATOM 0 H3' DT A 8 -2.316 5.358 11.866 1.00 0.14 H new ATOM 0 H2' DT A 8 -2.206 6.674 9.974 1.00 0.12 H new ATOM 0 H2'' DT A 8 -1.049 7.677 10.826 1.00 0.12 H new ATOM 0 H1' DT A 8 0.839 6.638 9.695 1.00 0.12 H new ATOM 0 H3 DT A 8 0.425 7.837 5.407 1.00 0.10 H new ATOM 0 H71 DT A 8 -4.151 6.671 5.587 1.00 0.17 H new ATOM 0 H72 DT A 8 -3.737 4.964 5.869 1.00 0.17 H new ATOM 0 H73 DT A 8 -4.282 5.982 7.223 1.00 0.17 H new ATOM 0 H6 DT A 8 -2.406 5.589 8.503 1.00 0.11 H new ATOM 247 P DA A 9 -1.012 7.912 13.353 1.00 0.12 P ATOM 248 OP1 DA A 9 -0.706 8.008 14.798 1.00 0.21 O ATOM 249 OP2 DA A 9 -2.281 8.476 12.840 1.00 0.19 O ATOM 250 O5' DA A 9 0.211 8.602 12.532 1.00 0.14 O ATOM 251 C5' DA A 9 1.570 8.218 12.805 1.00 0.16 C ATOM 252 C4' DA A 9 2.652 9.098 12.179 1.00 0.15 C ATOM 253 O4' DA A 9 2.635 9.103 10.747 1.00 0.16 O ATOM 254 C3' DA A 9 2.604 10.505 12.685 1.00 0.15 C ATOM 255 O3' DA A 9 3.912 10.999 13.000 1.00 0.17 O ATOM 256 C2' DA A 9 1.934 11.139 11.555 1.00 0.16 C ATOM 257 C1' DA A 9 2.412 10.447 10.325 1.00 0.13 C ATOM 258 N9 DA A 9 1.384 10.365 9.285 1.00 0.12 N ATOM 259 C8 DA A 9 0.095 10.019 9.461 1.00 0.12 C ATOM 260 N7 DA A 9 -0.627 9.972 8.326 1.00 0.11 N ATOM 261 C5 DA A 9 0.287 10.319 7.383 1.00 0.10 C ATOM 262 C6 DA A 9 0.188 10.462 5.998 1.00 0.13 C ATOM 263 N6 DA A 9 -0.947 10.229 5.351 1.00 0.15 N ATOM 264 N1 DA A 9 1.291 10.827 5.328 1.00 0.15 N ATOM 265 C2 DA A 9 2.422 11.033 5.999 1.00 0.15 C ATOM 266 N3 DA A 9 2.640 10.930 7.298 1.00 0.14 N ATOM 267 C4 DA A 9 1.515 10.564 7.940 1.00 0.11 C ATOM 0 H5' DA A 9 1.715 7.195 12.457 1.00 0.16 H new ATOM 0 H5'' DA A 9 1.715 8.211 13.885 1.00 0.16 H new ATOM 0 H4' DA A 9 3.589 8.639 12.493 1.00 0.15 H new ATOM 0 H3' DA A 9 2.090 10.676 13.631 1.00 0.15 H new ATOM 0 H2' DA A 9 0.852 11.053 11.650 1.00 0.16 H new ATOM 0 H2'' DA A 9 2.167 12.203 11.515 1.00 0.16 H new ATOM 0 H1' DA A 9 3.272 10.977 9.917 1.00 0.13 H new ATOM 0 H8 DA A 9 -0.325 9.798 10.431 1.00 0.12 H new ATOM 0 H61 DA A 9 -0.989 10.342 4.338 1.00 0.15 H new ATOM 0 H62 DA A 9 -1.777 9.937 5.867 1.00 0.15 H new ATOM 0 H2 DA A 9 3.274 11.323 5.402 1.00 0.15 H new ATOM 279 P DC A 10 4.159 12.488 13.561 1.00 0.17 P ATOM 280 OP1 DC A 10 5.523 12.547 14.134 1.00 0.25 O ATOM 281 OP2 DC A 10 2.995 12.885 14.388 1.00 0.24 O ATOM 282 O5' DC A 10 4.128 13.342 12.194 1.00 0.17 O ATOM 283 C5' DC A 10 5.251 13.364 11.296 1.00 0.12 C ATOM 284 C4' DC A 10 4.969 14.193 10.051 1.00 0.14 C ATOM 285 O4' DC A 10 3.967 13.562 9.271 1.00 0.13 O ATOM 286 C3' DC A 10 4.482 15.593 10.427 1.00 0.13 C ATOM 287 O3' DC A 10 5.455 16.646 10.287 1.00 0.14 O ATOM 288 C2' DC A 10 3.318 15.740 9.517 1.00 0.11 C ATOM 289 C1' DC A 10 3.363 14.621 8.536 1.00 0.14 C ATOM 290 N1 DC A 10 2.015 14.141 8.254 1.00 0.11 N ATOM 291 C2 DC A 10 1.498 14.098 6.979 1.00 0.12 C ATOM 292 O2 DC A 10 2.126 14.496 6.004 1.00 0.14 O ATOM 293 N3 DC A 10 0.246 13.604 6.830 1.00 0.14 N ATOM 294 C4 DC A 10 -0.459 13.176 7.881 1.00 0.14 C ATOM 295 N4 DC A 10 -1.671 12.706 7.625 1.00 0.14 N ATOM 296 C5 DC A 10 0.087 13.226 9.211 1.00 0.11 C ATOM 297 C6 DC A 10 1.319 13.719 9.321 1.00 0.10 C ATOM 0 H5' DC A 10 5.501 12.344 11.004 1.00 0.12 H new ATOM 0 H5'' DC A 10 6.121 13.770 11.813 1.00 0.12 H new ATOM 0 H4' DC A 10 5.896 14.275 9.484 1.00 0.14 H new ATOM 0 H3' DC A 10 4.249 15.688 11.488 1.00 0.13 H new ATOM 0 H2' DC A 10 2.386 15.716 10.082 1.00 0.11 H new ATOM 0 H2'' DC A 10 3.354 16.700 9.003 1.00 0.11 H new ATOM 0 H1' DC A 10 3.861 14.923 7.614 1.00 0.14 H new ATOM 0 H41 DC A 10 -2.257 12.365 8.387 1.00 0.14 H new ATOM 0 H42 DC A 10 -2.018 12.686 6.666 1.00 0.14 H new ATOM 0 H5 DC A 10 -0.470 12.883 10.070 1.00 0.11 H new ATOM 0 H6 DC A 10 1.772 13.781 10.299 1.00 0.10 H new ATOM 309 P DC A 11 6.282 17.000 8.936 1.00 0.10 P ATOM 310 OP1 DC A 11 6.858 15.749 8.395 1.00 0.23 O ATOM 311 OP2 DC A 11 7.168 18.147 9.235 1.00 0.23 O ATOM 312 O5' DC A 11 5.147 17.514 7.909 1.00 0.16 O ATOM 313 C5' DC A 11 5.474 18.027 6.605 1.00 0.23 C ATOM 314 C4' DC A 11 4.242 18.596 5.900 1.00 0.23 C ATOM 315 O4' DC A 11 3.204 17.625 5.715 1.00 0.19 O ATOM 316 C3' DC A 11 3.589 19.678 6.731 1.00 0.25 C ATOM 317 O3' DC A 11 4.227 20.956 6.707 1.00 0.34 O ATOM 318 C2' DC A 11 2.167 19.671 6.220 1.00 0.24 C ATOM 319 C1' DC A 11 2.012 18.378 5.428 1.00 0.20 C ATOM 320 N1 DC A 11 0.846 17.644 5.939 1.00 0.15 N ATOM 321 C2 DC A 11 -0.227 17.321 5.127 1.00 0.15 C ATOM 322 O2 DC A 11 -0.265 17.614 3.936 1.00 0.19 O ATOM 323 N3 DC A 11 -1.264 16.650 5.689 1.00 0.12 N ATOM 324 C4 DC A 11 -1.249 16.307 6.983 1.00 0.11 C ATOM 325 N4 DC A 11 -2.305 15.665 7.467 1.00 0.16 N ATOM 326 C5 DC A 11 -0.133 16.640 7.817 1.00 0.12 C ATOM 327 C6 DC A 11 0.867 17.303 7.240 1.00 0.13 C ATOM 0 H5' DC A 11 5.906 17.232 5.998 1.00 0.23 H new ATOM 0 H5'' DC A 11 6.232 18.805 6.699 1.00 0.23 H new ATOM 0 H4' DC A 11 4.622 18.958 4.945 1.00 0.23 H new ATOM 0 H3' DC A 11 3.663 19.472 7.799 1.00 0.25 H new ATOM 0 H2' DC A 11 1.456 19.711 7.045 1.00 0.24 H new ATOM 0 H2'' DC A 11 1.974 20.540 5.591 1.00 0.24 H new ATOM 0 HO3' DC A 11 3.728 21.582 7.272 1.00 0.34 H new ATOM 0 H1' DC A 11 1.875 18.553 4.361 1.00 0.20 H new ATOM 0 H41 DC A 11 -2.328 15.388 8.448 1.00 0.16 H new ATOM 0 H42 DC A 11 -3.094 15.448 6.857 1.00 0.16 H new ATOM 0 H5 DC A 11 -0.104 16.367 8.862 1.00 0.12 H new ATOM 0 H6 DC A 11 1.724 17.576 7.837 1.00 0.13 H new TER 340 DC A 11 ATOM 341 O5' DG B 12 -9.497 12.835 -0.715 1.00 0.17 O ATOM 342 C5' DG B 12 -9.015 13.520 -1.873 1.00 0.19 C ATOM 343 C4' DG B 12 -7.525 13.802 -1.781 1.00 0.18 C ATOM 344 O4' DG B 12 -7.241 14.613 -0.616 1.00 0.16 O ATOM 345 C3' DG B 12 -6.719 12.482 -1.682 1.00 0.17 C ATOM 346 O3' DG B 12 -5.536 12.291 -2.486 1.00 0.21 O ATOM 347 C2' DG B 12 -6.333 12.584 -0.233 1.00 0.15 C ATOM 348 C1' DG B 12 -6.077 14.060 -0.007 1.00 0.15 C ATOM 349 N9 DG B 12 -5.949 14.316 1.437 1.00 0.12 N ATOM 350 C8 DG B 12 -6.807 13.965 2.423 1.00 0.10 C ATOM 351 N7 DG B 12 -6.386 14.306 3.660 1.00 0.09 N ATOM 352 C5 DG B 12 -5.190 14.908 3.426 1.00 0.09 C ATOM 353 C6 DG B 12 -4.258 15.484 4.339 1.00 0.09 C ATOM 354 O6 DG B 12 -4.296 15.564 5.564 1.00 0.10 O ATOM 355 N1 DG B 12 -3.160 15.997 3.690 1.00 0.12 N ATOM 356 C2 DG B 12 -2.965 15.970 2.334 1.00 0.14 C ATOM 357 N2 DG B 12 -1.851 16.501 1.869 1.00 0.16 N ATOM 358 N3 DG B 12 -3.817 15.440 1.467 1.00 0.14 N ATOM 359 C4 DG B 12 -4.906 14.928 2.079 1.00 0.11 C ATOM 0 H5' DG B 12 -9.556 14.459 -1.992 1.00 0.19 H new ATOM 0 H5'' DG B 12 -9.218 12.921 -2.761 1.00 0.19 H new ATOM 0 H4' DG B 12 -7.229 14.335 -2.684 1.00 0.18 H new ATOM 0 H3' DG B 12 -7.312 11.643 -2.047 1.00 0.17 H new ATOM 0 H2' DG B 12 -7.128 12.216 0.416 1.00 0.15 H new ATOM 0 H2'' DG B 12 -5.445 11.990 -0.017 1.00 0.15 H new ATOM 0 HO5' DG B 12 -10.459 12.672 -0.808 1.00 0.17 H new ATOM 0 H1' DG B 12 -5.160 14.481 -0.420 1.00 0.15 H new ATOM 0 H8 DG B 12 -7.743 13.459 2.238 1.00 0.10 H new ATOM 0 H1 DG B 12 -2.435 16.431 4.262 1.00 0.12 H new ATOM 0 H21 DG B 12 -1.666 16.502 0.866 1.00 0.16 H new ATOM 0 H22 DG B 12 -1.174 16.911 2.513 1.00 0.16 H new ATOM 372 P DG B 13 -4.955 13.241 -3.655 1.00 0.21 P ATOM 373 OP1 DG B 13 -6.084 13.707 -4.493 1.00 0.20 O ATOM 374 OP2 DG B 13 -3.801 12.552 -4.277 1.00 0.26 O ATOM 375 O5' DG B 13 -4.411 14.480 -2.778 1.00 0.25 O ATOM 376 C5' DG B 13 -3.450 15.454 -3.216 1.00 0.21 C ATOM 377 C4' DG B 13 -2.013 15.145 -2.765 1.00 0.15 C ATOM 378 O4' DG B 13 -1.891 15.112 -1.331 1.00 0.18 O ATOM 379 C3' DG B 13 -1.362 13.894 -3.332 1.00 0.15 C ATOM 380 O3' DG B 13 -0.050 14.168 -3.862 1.00 0.15 O ATOM 381 C2' DG B 13 -1.313 13.052 -2.140 1.00 0.17 C ATOM 382 C1' DG B 13 -1.089 13.976 -0.992 1.00 0.17 C ATOM 383 N9 DG B 13 -1.552 13.451 0.298 1.00 0.14 N ATOM 384 C8 DG B 13 -2.645 12.696 0.558 1.00 0.13 C ATOM 385 N7 DG B 13 -2.821 12.429 1.871 1.00 0.11 N ATOM 386 C5 DG B 13 -1.766 13.055 2.457 1.00 0.11 C ATOM 387 C6 DG B 13 -1.398 13.137 3.828 1.00 0.10 C ATOM 388 O6 DG B 13 -1.956 12.684 4.823 1.00 0.14 O ATOM 389 N1 DG B 13 -0.247 13.866 4.002 1.00 0.12 N ATOM 390 C2 DG B 13 0.477 14.456 2.996 1.00 0.14 C ATOM 391 N2 DG B 13 1.566 15.115 3.338 1.00 0.17 N ATOM 392 N3 DG B 13 0.149 14.396 1.712 1.00 0.15 N ATOM 393 C4 DG B 13 -0.981 13.681 1.516 1.00 0.13 C ATOM 0 H5' DG B 13 -3.739 16.434 -2.836 1.00 0.21 H new ATOM 0 H5'' DG B 13 -3.476 15.514 -4.304 1.00 0.21 H new ATOM 0 H4' DG B 13 -1.465 15.984 -3.194 1.00 0.15 H new ATOM 0 H3' DG B 13 -1.890 13.447 -4.174 1.00 0.15 H new ATOM 0 H2' DG B 13 -2.242 12.496 -2.017 1.00 0.17 H new ATOM 0 H2'' DG B 13 -0.510 12.319 -2.213 1.00 0.17 H new ATOM 0 H1' DG B 13 -0.024 14.167 -0.859 1.00 0.17 H new ATOM 0 H8 DG B 13 -3.314 12.340 -0.212 1.00 0.13 H new ATOM 0 H1 DG B 13 0.098 13.978 4.956 1.00 0.12 H new ATOM 0 H21 DG B 13 2.134 15.569 2.622 1.00 0.17 H new ATOM 0 H22 DG B 13 1.841 15.171 4.319 1.00 0.17 H new ATOM 405 P DT B 14 0.968 13.034 -4.415 1.00 0.15 P ATOM 406 OP1 DT B 14 0.536 12.677 -5.786 1.00 0.20 O ATOM 407 OP2 DT B 14 1.099 11.969 -3.394 1.00 0.18 O ATOM 408 O5' DT B 14 2.383 13.815 -4.541 1.00 0.13 O ATOM 409 C5' DT B 14 3.093 14.531 -3.505 1.00 0.15 C ATOM 410 C4' DT B 14 3.507 13.701 -2.277 1.00 0.12 C ATOM 411 O4' DT B 14 2.469 13.395 -1.330 1.00 0.16 O ATOM 412 C3' DT B 14 4.267 12.440 -2.606 1.00 0.11 C ATOM 413 O3' DT B 14 5.666 12.756 -2.497 1.00 0.14 O ATOM 414 C2' DT B 14 3.725 11.541 -1.517 1.00 0.14 C ATOM 415 C1' DT B 14 3.068 12.409 -0.477 1.00 0.13 C ATOM 416 N1 DT B 14 2.051 11.752 0.360 1.00 0.10 N ATOM 417 C2 DT B 14 2.123 11.802 1.747 1.00 0.12 C ATOM 418 O2 DT B 14 3.021 12.358 2.370 1.00 0.15 O ATOM 419 N3 DT B 14 1.096 11.174 2.417 1.00 0.13 N ATOM 420 C4 DT B 14 0.031 10.521 1.838 1.00 0.12 C ATOM 421 O4 DT B 14 -0.826 10.017 2.556 1.00 0.14 O ATOM 422 C5 DT B 14 0.062 10.531 0.391 1.00 0.12 C ATOM 423 C7 DT B 14 -1.004 9.892 -0.471 1.00 0.16 C ATOM 424 C6 DT B 14 1.043 11.127 -0.264 1.00 0.11 C ATOM 0 H5' DT B 14 2.467 15.357 -3.167 1.00 0.15 H new ATOM 0 H5'' DT B 14 3.990 14.969 -3.942 1.00 0.15 H new ATOM 0 H4' DT B 14 4.179 14.404 -1.784 1.00 0.12 H new ATOM 0 H3' DT B 14 4.159 11.991 -3.593 1.00 0.11 H new ATOM 0 H2' DT B 14 3.007 10.833 -1.930 1.00 0.14 H new ATOM 0 H2'' DT B 14 4.529 10.956 -1.071 1.00 0.14 H new ATOM 0 H1' DT B 14 3.774 12.761 0.275 1.00 0.13 H new ATOM 0 H3 DT B 14 1.127 11.195 3.436 1.00 0.13 H new ATOM 0 H71 DT B 14 -1.085 10.436 -1.412 1.00 0.16 H new ATOM 0 H72 DT B 14 -0.735 8.855 -0.673 1.00 0.16 H new ATOM 0 H73 DT B 14 -1.961 9.924 0.050 1.00 0.16 H new ATOM 0 H6 DT B 14 1.032 11.110 -1.344 1.00 0.11 H new ATOM 437 P DA B 15 6.874 11.706 -2.686 1.00 0.13 P ATOM 438 OP1 DA B 15 8.111 12.467 -2.980 1.00 0.19 O ATOM 439 OP2 DA B 15 6.425 10.640 -3.611 1.00 0.20 O ATOM 440 O5' DA B 15 6.993 11.084 -1.205 1.00 0.14 O ATOM 441 C5' DA B 15 7.494 11.834 -0.081 1.00 0.11 C ATOM 442 C4' DA B 15 7.499 10.976 1.186 1.00 0.09 C ATOM 443 O4' DA B 15 6.177 10.621 1.613 1.00 0.12 O ATOM 444 C3' DA B 15 8.298 9.699 0.974 1.00 0.11 C ATOM 445 O3' DA B 15 9.322 9.627 1.974 1.00 0.10 O ATOM 446 C2' DA B 15 7.208 8.671 1.054 1.00 0.13 C ATOM 447 C1' DA B 15 6.183 9.241 1.983 1.00 0.10 C ATOM 448 N9 DA B 15 4.824 8.779 1.729 1.00 0.09 N ATOM 449 C8 DA B 15 4.215 8.581 0.540 1.00 0.11 C ATOM 450 N7 DA B 15 2.921 8.202 0.658 1.00 0.12 N ATOM 451 C5 DA B 15 2.734 8.165 2.006 1.00 0.10 C ATOM 452 C6 DA B 15 1.627 7.851 2.808 1.00 0.12 C ATOM 453 N6 DA B 15 0.437 7.506 2.328 1.00 0.15 N ATOM 454 N1 DA B 15 1.796 7.916 4.134 1.00 0.11 N ATOM 455 C2 DA B 15 2.967 8.265 4.649 1.00 0.10 C ATOM 456 N3 DA B 15 4.071 8.584 4.005 1.00 0.09 N ATOM 457 C4 DA B 15 3.880 8.511 2.670 1.00 0.08 C ATOM 0 H5' DA B 15 6.877 12.719 0.076 1.00 0.11 H new ATOM 0 H5'' DA B 15 8.504 12.184 -0.293 1.00 0.11 H new ATOM 0 H4' DA B 15 7.962 11.586 1.962 1.00 0.09 H new ATOM 0 H3' DA B 15 8.858 9.590 0.045 1.00 0.11 H new ATOM 0 H2' DA B 15 6.780 8.476 0.071 1.00 0.13 H new ATOM 0 H2'' DA B 15 7.591 7.722 1.428 1.00 0.13 H new ATOM 0 H1' DA B 15 6.428 8.979 3.012 1.00 0.10 H new ATOM 0 H8 DA B 15 4.711 8.712 -0.410 1.00 0.11 H new ATOM 0 H61 DA B 15 -0.328 7.290 2.967 1.00 0.15 H new ATOM 0 H62 DA B 15 0.288 7.458 1.320 1.00 0.15 H new ATOM 0 H2 DA B 15 3.022 8.291 5.727 1.00 0.10 H new ATOM 469 P DG B 16 10.754 8.920 1.743 1.00 0.11 P ATOM 470 OP1 DG B 16 11.803 9.782 2.337 1.00 0.18 O ATOM 471 OP2 DG B 16 10.861 8.502 0.326 1.00 0.14 O ATOM 472 O5' DG B 16 10.599 7.602 2.651 1.00 0.12 O ATOM 473 C5' DG B 16 10.570 7.652 4.090 1.00 0.11 C ATOM 474 C4' DG B 16 9.600 6.628 4.659 1.00 0.10 C ATOM 475 O4' DG B 16 8.242 6.894 4.278 1.00 0.12 O ATOM 476 C3' DG B 16 9.931 5.248 4.128 1.00 0.11 C ATOM 477 O3' DG B 16 10.946 4.614 4.927 1.00 0.10 O ATOM 478 C2' DG B 16 8.558 4.607 4.265 1.00 0.10 C ATOM 479 C1' DG B 16 7.556 5.689 4.627 1.00 0.12 C ATOM 480 N9 DG B 16 6.336 5.539 3.835 1.00 0.11 N ATOM 481 C8 DG B 16 6.263 5.526 2.496 1.00 0.11 C ATOM 482 N7 DG B 16 5.019 5.353 2.011 1.00 0.12 N ATOM 483 C5 DG B 16 4.272 5.249 3.141 1.00 0.12 C ATOM 484 C6 DG B 16 2.880 5.049 3.286 1.00 0.14 C ATOM 485 O6 DG B 16 2.014 4.932 2.424 1.00 0.15 O ATOM 486 N1 DG B 16 2.508 4.989 4.603 1.00 0.14 N ATOM 487 C2 DG B 16 3.344 5.109 5.678 1.00 0.13 C ATOM 488 N2 DG B 16 2.790 5.010 6.876 1.00 0.14 N ATOM 489 N3 DG B 16 4.657 5.303 5.567 1.00 0.12 N ATOM 490 C4 DG B 16 5.052 5.361 4.270 1.00 0.11 C ATOM 0 H5' DG B 16 10.280 8.651 4.416 1.00 0.11 H new ATOM 0 H5'' DG B 16 11.570 7.467 4.483 1.00 0.11 H new ATOM 0 H4' DG B 16 9.698 6.685 5.743 1.00 0.10 H new ATOM 0 H3' DG B 16 10.350 5.199 3.123 1.00 0.11 H new ATOM 0 H2' DG B 16 8.271 4.122 3.332 1.00 0.10 H new ATOM 0 H2'' DG B 16 8.576 3.834 5.034 1.00 0.10 H new ATOM 0 H1' DG B 16 7.245 5.661 5.671 1.00 0.12 H new ATOM 0 H8 DG B 16 7.128 5.644 1.861 1.00 0.11 H new ATOM 0 H1 DG B 16 1.518 4.841 4.799 1.00 0.14 H new ATOM 0 H21 DG B 16 3.367 5.092 7.713 1.00 0.14 H new ATOM 0 H22 DG B 16 1.786 4.852 6.962 1.00 0.14 H new ATOM 502 P DC B 17 11.761 3.278 4.490 1.00 0.10 P ATOM 503 OP1 DC B 17 12.926 3.129 5.392 1.00 0.15 O ATOM 504 OP2 DC B 17 11.969 3.319 3.024 1.00 0.14 O ATOM 505 O5' DC B 17 10.717 2.090 4.815 1.00 0.09 O ATOM 506 C5' DC B 17 10.137 1.960 6.122 1.00 0.08 C ATOM 507 C4' DC B 17 9.120 0.829 6.216 1.00 0.06 C ATOM 508 O4' DC B 17 8.107 0.892 5.195 1.00 0.07 O ATOM 509 C3' DC B 17 9.761 -0.546 6.068 1.00 0.06 C ATOM 510 O3' DC B 17 10.258 -0.967 7.356 1.00 0.06 O ATOM 511 C2' DC B 17 8.613 -1.355 5.471 1.00 0.08 C ATOM 512 C1' DC B 17 7.455 -0.385 5.254 1.00 0.06 C ATOM 513 N1 DC B 17 6.669 -0.675 4.024 1.00 0.07 N ATOM 514 C2 DC B 17 5.466 -1.367 4.154 1.00 0.07 C ATOM 515 O2 DC B 17 5.013 -1.706 5.240 1.00 0.09 O ATOM 516 N3 DC B 17 4.754 -1.654 3.041 1.00 0.08 N ATOM 517 C4 DC B 17 5.184 -1.286 1.836 1.00 0.10 C ATOM 518 N4 DC B 17 4.431 -1.608 0.790 1.00 0.11 N ATOM 519 C5 DC B 17 6.415 -0.569 1.672 1.00 0.12 C ATOM 520 C6 DC B 17 7.120 -0.287 2.790 1.00 0.10 C ATOM 0 H5' DC B 17 9.654 2.899 6.393 1.00 0.08 H new ATOM 0 H5'' DC B 17 10.930 1.788 6.849 1.00 0.08 H new ATOM 0 H4' DC B 17 8.682 0.961 7.205 1.00 0.06 H new ATOM 0 H3' DC B 17 10.642 -0.631 5.432 1.00 0.06 H new ATOM 0 H2' DC B 17 8.913 -1.815 4.530 1.00 0.08 H new ATOM 0 H2'' DC B 17 8.320 -2.163 6.142 1.00 0.08 H new ATOM 0 H1' DC B 17 6.708 -0.450 6.045 1.00 0.06 H new ATOM 0 H41 DC B 17 4.725 -1.344 -0.150 1.00 0.11 H new ATOM 0 H42 DC B 17 3.559 -2.119 0.927 1.00 0.11 H new ATOM 0 H5 DC B 17 6.764 -0.267 0.696 1.00 0.12 H new ATOM 0 H6 DC B 17 8.052 0.252 2.709 1.00 0.10 H new ATOM 532 P DG B 18 10.129 -2.433 8.032 1.00 0.07 P ATOM 533 OP1 DG B 18 10.690 -2.366 9.400 1.00 0.11 O ATOM 534 OP2 DG B 18 10.637 -3.442 7.074 1.00 0.11 O ATOM 535 O5' DG B 18 8.526 -2.600 8.148 1.00 0.08 O ATOM 536 C5' DG B 18 7.696 -1.591 8.753 1.00 0.07 C ATOM 537 C4' DG B 18 6.275 -2.042 8.978 1.00 0.08 C ATOM 538 O4' DG B 18 5.558 -2.370 7.781 1.00 0.08 O ATOM 539 C3' DG B 18 6.243 -3.273 9.888 1.00 0.11 C ATOM 540 O3' DG B 18 5.411 -3.079 11.049 1.00 0.15 O ATOM 541 C2' DG B 18 5.754 -4.292 8.913 1.00 0.09 C ATOM 542 C1' DG B 18 4.763 -3.522 8.085 1.00 0.09 C ATOM 543 N9 DG B 18 4.452 -4.205 6.830 1.00 0.06 N ATOM 544 C8 DG B 18 5.374 -4.648 5.963 1.00 0.06 C ATOM 545 N7 DG B 18 4.863 -5.207 4.850 1.00 0.07 N ATOM 546 C5 DG B 18 3.522 -5.105 5.050 1.00 0.07 C ATOM 547 C6 DG B 18 2.454 -5.527 4.217 1.00 0.08 C ATOM 548 O6 DG B 18 2.490 -6.063 3.115 1.00 0.10 O ATOM 549 N1 DG B 18 1.232 -5.253 4.774 1.00 0.08 N ATOM 550 C2 DG B 18 1.030 -4.645 5.986 1.00 0.08 C ATOM 551 N2 DG B 18 -0.232 -4.485 6.349 1.00 0.10 N ATOM 552 N3 DG B 18 2.017 -4.233 6.786 1.00 0.08 N ATOM 553 C4 DG B 18 3.238 -4.497 6.254 1.00 0.07 C ATOM 0 H5' DG B 18 7.692 -0.705 8.118 1.00 0.07 H new ATOM 0 H5'' DG B 18 8.132 -1.297 9.708 1.00 0.07 H new ATOM 0 H4' DG B 18 5.782 -1.184 9.434 1.00 0.08 H new ATOM 0 H3' DG B 18 7.187 -3.546 10.360 1.00 0.11 H new ATOM 0 H2' DG B 18 6.566 -4.690 8.304 1.00 0.09 H new ATOM 0 H2'' DG B 18 5.288 -5.140 9.415 1.00 0.09 H new ATOM 0 H1' DG B 18 3.807 -3.355 8.581 1.00 0.09 H new ATOM 0 H8 DG B 18 6.436 -4.564 6.142 1.00 0.06 H new ATOM 0 H1 DG B 18 0.404 -5.524 4.243 1.00 0.08 H new ATOM 0 H21 DG B 18 -0.454 -4.040 7.239 1.00 0.10 H new ATOM 0 H22 DG B 18 -0.983 -4.807 5.738 1.00 0.10 H new ATOM 565 P DA B 19 4.854 -4.266 11.999 1.00 0.17 P ATOM 566 OP1 DA B 19 4.744 -3.734 13.377 1.00 0.26 O ATOM 567 OP2 DA B 19 5.648 -5.491 11.744 1.00 0.19 O ATOM 568 O5' DA B 19 3.359 -4.511 11.430 1.00 0.15 O ATOM 569 C5' DA B 19 2.236 -3.686 11.801 1.00 0.17 C ATOM 570 C4' DA B 19 0.909 -4.464 11.762 1.00 0.14 C ATOM 571 O4' DA B 19 0.552 -4.882 10.435 1.00 0.12 O ATOM 572 C3' DA B 19 0.902 -5.676 12.673 1.00 0.11 C ATOM 573 O3' DA B 19 -0.362 -5.911 13.316 1.00 0.11 O ATOM 574 C2' DA B 19 1.273 -6.697 11.677 1.00 0.10 C ATOM 575 C1' DA B 19 0.547 -6.313 10.412 1.00 0.11 C ATOM 576 N9 DA B 19 1.322 -6.716 9.229 1.00 0.09 N ATOM 577 C8 DA B 19 2.632 -6.458 9.017 1.00 0.09 C ATOM 578 N7 DA B 19 3.106 -6.920 7.848 1.00 0.07 N ATOM 579 C5 DA B 19 2.015 -7.504 7.295 1.00 0.06 C ATOM 580 C6 DA B 19 1.838 -8.168 6.084 1.00 0.07 C ATOM 581 N6 DA B 19 2.836 -8.310 5.225 1.00 0.08 N ATOM 582 N1 DA B 19 0.622 -8.653 5.801 1.00 0.10 N ATOM 583 C2 DA B 19 -0.363 -8.484 6.681 1.00 0.10 C ATOM 584 N3 DA B 19 -0.324 -7.874 7.858 1.00 0.08 N ATOM 585 C4 DA B 19 0.915 -7.398 8.110 1.00 0.06 C ATOM 0 H5' DA B 19 2.175 -2.832 11.126 1.00 0.17 H new ATOM 0 H5'' DA B 19 2.394 -3.289 12.804 1.00 0.17 H new ATOM 0 H4' DA B 19 0.167 -3.752 12.124 1.00 0.14 H new ATOM 0 H3' DA B 19 1.556 -5.616 13.543 1.00 0.11 H new ATOM 0 H2' DA B 19 2.351 -6.717 11.519 1.00 0.10 H new ATOM 0 H2'' DA B 19 0.981 -7.693 12.009 1.00 0.10 H new ATOM 0 H1' DA B 19 -0.440 -6.773 10.363 1.00 0.11 H new ATOM 0 H8 DA B 19 3.246 -5.925 9.728 1.00 0.09 H new ATOM 0 H61 DA B 19 2.684 -8.800 4.343 1.00 0.08 H new ATOM 0 H62 DA B 19 3.756 -7.929 5.445 1.00 0.08 H new ATOM 0 H2 DA B 19 -1.320 -8.898 6.399 1.00 0.10 H new ATOM 597 P DT B 20 -0.627 -7.154 14.319 1.00 0.11 P ATOM 598 OP1 DT B 20 -1.748 -6.783 15.210 1.00 0.11 O ATOM 599 OP2 DT B 20 0.668 -7.567 14.910 1.00 0.16 O ATOM 600 O5' DT B 20 -1.126 -8.325 13.329 1.00 0.10 O ATOM 601 C5' DT B 20 -2.431 -8.292 12.722 1.00 0.08 C ATOM 602 C4' DT B 20 -2.646 -9.456 11.756 1.00 0.09 C ATOM 603 O4' DT B 20 -1.751 -9.401 10.630 1.00 0.11 O ATOM 604 C3' DT B 20 -2.539 -10.815 12.426 1.00 0.12 C ATOM 605 O3' DT B 20 -3.708 -11.605 12.180 1.00 0.16 O ATOM 606 C2' DT B 20 -1.274 -11.319 11.763 1.00 0.10 C ATOM 607 C1' DT B 20 -1.320 -10.733 10.352 1.00 0.09 C ATOM 608 N1 DT B 20 -0.019 -10.658 9.643 1.00 0.07 N ATOM 609 C2 DT B 20 0.068 -11.119 8.342 1.00 0.09 C ATOM 610 O2 DT B 20 -0.871 -11.610 7.724 1.00 0.12 O ATOM 611 N3 DT B 20 1.301 -10.998 7.745 1.00 0.09 N ATOM 612 C4 DT B 20 2.439 -10.473 8.305 1.00 0.07 C ATOM 613 O4 DT B 20 3.462 -10.433 7.631 1.00 0.08 O ATOM 614 C5 DT B 20 2.255 -10.019 9.663 1.00 0.07 C ATOM 615 C7 DT B 20 3.377 -9.399 10.481 1.00 0.10 C ATOM 616 C6 DT B 20 1.071 -10.125 10.261 1.00 0.07 C ATOM 0 H5' DT B 20 -2.558 -7.350 12.188 1.00 0.08 H new ATOM 0 H5'' DT B 20 -3.193 -8.322 13.501 1.00 0.08 H new ATOM 0 H4' DT B 20 -3.669 -9.340 11.398 1.00 0.09 H new ATOM 0 H3' DT B 20 -2.486 -10.826 13.515 1.00 0.12 H new ATOM 0 H2' DT B 20 -0.385 -10.988 12.301 1.00 0.10 H new ATOM 0 H2'' DT B 20 -1.246 -12.408 11.739 1.00 0.10 H new ATOM 0 H1' DT B 20 -1.939 -11.347 9.698 1.00 0.09 H new ATOM 0 H3 DT B 20 1.378 -11.334 6.785 1.00 0.09 H new ATOM 0 H71 DT B 20 2.958 -8.685 11.191 1.00 0.10 H new ATOM 0 H72 DT B 20 3.907 -10.182 11.023 1.00 0.10 H new ATOM 0 H73 DT B 20 4.071 -8.885 9.816 1.00 0.10 H new ATOM 0 H6 DT B 20 0.971 -9.774 11.277 1.00 0.07 H new ATOM 629 P DG B 21 -3.903 -13.050 12.868 1.00 0.17 P ATOM 630 OP1 DG B 21 -5.347 -13.379 12.858 1.00 0.24 O ATOM 631 OP2 DG B 21 -3.150 -13.076 14.143 1.00 0.22 O ATOM 632 O5' DG B 21 -3.141 -13.992 11.808 1.00 0.12 O ATOM 633 C5' DG B 21 -3.772 -14.402 10.586 1.00 0.11 C ATOM 634 C4' DG B 21 -2.839 -15.194 9.681 1.00 0.07 C ATOM 635 O4' DG B 21 -1.785 -14.437 9.077 1.00 0.06 O ATOM 636 C3' DG B 21 -2.188 -16.369 10.412 1.00 0.07 C ATOM 637 O3' DG B 21 -2.899 -17.596 10.150 1.00 0.13 O ATOM 638 C2' DG B 21 -0.755 -16.260 9.910 1.00 0.06 C ATOM 639 C1' DG B 21 -0.820 -15.419 8.676 1.00 0.05 C ATOM 640 N9 DG B 21 0.454 -14.748 8.419 1.00 0.05 N ATOM 641 C8 DG B 21 1.134 -13.968 9.278 1.00 0.06 C ATOM 642 N7 DG B 21 2.290 -13.481 8.773 1.00 0.08 N ATOM 643 C5 DG B 21 2.317 -13.999 7.514 1.00 0.08 C ATOM 644 C6 DG B 21 3.284 -13.848 6.481 1.00 0.10 C ATOM 645 O6 DG B 21 4.333 -13.210 6.467 1.00 0.13 O ATOM 646 N1 DG B 21 2.932 -14.544 5.346 1.00 0.11 N ATOM 647 C2 DG B 21 1.795 -15.296 5.203 1.00 0.10 C ATOM 648 N2 DG B 21 1.622 -15.907 4.046 1.00 0.11 N ATOM 649 N3 DG B 21 0.881 -15.450 6.153 1.00 0.08 N ATOM 650 C4 DG B 21 1.205 -14.775 7.279 1.00 0.07 C ATOM 0 H5' DG B 21 -4.128 -13.521 10.052 1.00 0.11 H new ATOM 0 H5'' DG B 21 -4.647 -15.009 10.819 1.00 0.11 H new ATOM 0 H4' DG B 21 -3.507 -15.536 8.890 1.00 0.07 H new ATOM 0 H3' DG B 21 -2.213 -16.357 11.502 1.00 0.07 H new ATOM 0 H2' DG B 21 -0.111 -15.803 10.661 1.00 0.06 H new ATOM 0 H2'' DG B 21 -0.341 -17.244 9.691 1.00 0.06 H new ATOM 0 H1' DG B 21 -1.055 -15.983 7.773 1.00 0.05 H new ATOM 0 H8 DG B 21 0.789 -13.751 10.278 1.00 0.06 H new ATOM 0 H1 DG B 21 3.567 -14.496 4.549 1.00 0.11 H new ATOM 0 H21 DG B 21 0.792 -16.479 3.890 1.00 0.11 H new ATOM 0 H22 DG B 21 2.319 -15.808 3.308 1.00 0.11 H new ATOM 662 P DG B 22 -2.253 -19.056 9.895 1.00 0.14 P ATOM 663 OP1 DG B 22 -3.324 -20.071 10.015 1.00 0.20 O ATOM 664 OP2 DG B 22 -1.021 -19.186 10.706 1.00 0.16 O ATOM 665 O5' DG B 22 -1.812 -18.968 8.340 1.00 0.11 O ATOM 666 C5' DG B 22 -2.767 -18.869 7.266 1.00 0.11 C ATOM 667 C4' DG B 22 -2.293 -19.563 5.975 1.00 0.09 C ATOM 668 O4' DG B 22 -1.131 -18.956 5.382 1.00 0.08 O ATOM 669 C3' DG B 22 -1.974 -21.018 6.151 1.00 0.10 C ATOM 670 O3' DG B 22 -2.069 -21.678 4.890 1.00 0.12 O ATOM 671 C2' DG B 22 -0.561 -20.882 6.548 1.00 0.08 C ATOM 672 C1' DG B 22 -0.009 -19.818 5.632 1.00 0.08 C ATOM 673 N9 DG B 22 1.039 -19.017 6.278 1.00 0.07 N ATOM 674 C8 DG B 22 1.056 -18.544 7.549 1.00 0.06 C ATOM 675 N7 DG B 22 2.146 -17.809 7.842 1.00 0.07 N ATOM 676 C5 DG B 22 2.850 -17.830 6.680 1.00 0.08 C ATOM 677 C6 DG B 22 4.095 -17.227 6.369 1.00 0.10 C ATOM 678 O6 DG B 22 4.823 -16.529 7.066 1.00 0.11 O ATOM 679 N1 DG B 22 4.476 -17.484 5.075 1.00 0.13 N ATOM 680 C2 DG B 22 3.765 -18.228 4.167 1.00 0.14 C ATOM 681 N2 DG B 22 4.289 -18.376 2.964 1.00 0.17 N ATOM 682 N3 DG B 22 2.595 -18.799 4.438 1.00 0.12 N ATOM 683 C4 DG B 22 2.198 -18.560 5.713 1.00 0.08 C ATOM 0 H5' DG B 22 -2.962 -17.817 7.056 1.00 0.11 H new ATOM 0 H5'' DG B 22 -3.711 -19.311 7.584 1.00 0.11 H new ATOM 0 H4' DG B 22 -3.155 -19.445 5.318 1.00 0.09 H new ATOM 0 H3' DG B 22 -2.610 -21.579 6.836 1.00 0.10 H new ATOM 0 H2' DG B 22 -0.470 -20.591 7.594 1.00 0.08 H new ATOM 0 H2'' DG B 22 -0.024 -21.823 6.431 1.00 0.08 H new ATOM 0 HO3' DG B 22 -1.859 -22.629 5.002 1.00 0.12 H new ATOM 0 H1' DG B 22 0.433 -20.267 4.742 1.00 0.08 H new ATOM 0 H8 DG B 22 0.268 -18.739 8.261 1.00 0.06 H new ATOM 0 H1 DG B 22 5.363 -17.088 4.762 1.00 0.13 H new ATOM 0 H21 DG B 22 3.796 -18.921 2.257 1.00 0.17 H new ATOM 0 H22 DG B 22 5.187 -17.945 2.742 1.00 0.17 H new TER 696 DG B 22 HETATM 697 C1 BPJ A 25 1.633 -0.443 6.769 1.00 0.11 C HETATM 698 C2 BPJ A 25 1.397 -1.073 8.173 1.00 0.13 C HETATM 699 O2 BPJ A 25 0.267 -1.938 8.337 1.00 0.14 O HETATM 700 C3 BPJ A 25 1.306 0.082 9.216 1.00 0.13 C HETATM 701 O3 BPJ A 25 0.375 1.137 8.898 1.00 0.15 O HETATM 702 C4 BPJ A 25 2.736 0.680 9.289 1.00 0.12 C HETATM 703 O4 BPJ A 25 3.571 -0.264 9.959 1.00 0.13 O HETATM 704 C5 BPJ A 25 4.498 1.729 7.984 1.00 0.10 C HETATM 705 C6 BPJ A 25 5.084 2.122 6.780 1.00 0.10 C HETATM 706 C7 BPJ A 25 5.112 2.216 4.441 1.00 0.11 C HETATM 707 C8 BPJ A 25 4.578 1.975 3.163 1.00 0.12 C HETATM 708 C9 BPJ A 25 2.652 1.497 1.770 1.00 0.14 C HETATM 709 C10 BPJ A 25 1.270 1.271 1.639 1.00 0.16 C HETATM 710 C11 BPJ A 25 0.486 1.120 2.796 1.00 0.15 C HETATM 711 C12 BPJ A 25 1.090 1.165 4.064 1.00 0.13 C HETATM 712 C13 BPJ A 25 2.642 0.618 6.749 1.00 0.10 C HETATM 713 C14 BPJ A 25 3.296 0.976 7.986 1.00 0.09 C HETATM 714 C15 BPJ A 25 4.415 1.854 5.586 1.00 0.10 C HETATM 715 C16 BPJ A 25 3.146 1.224 5.532 1.00 0.11 C HETATM 716 C17 BPJ A 25 2.491 1.311 4.252 1.00 0.12 C HETATM 717 C18 BPJ A 25 3.236 1.560 3.054 1.00 0.12 C HETATM 0 H11A BPJ A 25 0.690 -0.039 6.401 1.00 0.11 H new HETATM 0 HO4 BPJ A 25 4.284 0.210 10.435 1.00 0.13 H new HETATM 0 HO3 BPJ A 25 -0.312 1.188 9.595 1.00 0.15 H new HETATM 0 HO2 BPJ A 25 0.236 -2.265 9.260 1.00 0.14 H new HETATM 0 H9 BPJ A 25 3.271 1.623 0.882 1.00 0.14 H new HETATM 0 H8 BPJ A 25 5.192 2.107 2.272 1.00 0.12 H new HETATM 0 H7 BPJ A 25 6.087 2.694 4.534 1.00 0.11 H new HETATM 0 H6 BPJ A 25 6.048 2.630 6.773 1.00 0.10 H new HETATM 0 H5 BPJ A 25 4.967 2.003 8.929 1.00 0.10 H new HETATM 0 H4 BPJ A 25 2.680 1.627 9.825 1.00 0.12 H new HETATM 0 H3 BPJ A 25 0.934 -0.335 10.152 1.00 0.13 H new HETATM 0 H2 BPJ A 25 2.249 -1.737 8.318 1.00 0.13 H new HETATM 0 H12 BPJ A 25 0.454 1.084 4.945 1.00 0.13 H new HETATM 0 H11 BPJ A 25 -0.590 0.968 2.710 1.00 0.15 H new HETATM 0 H10 BPJ A 25 0.812 1.214 0.652 1.00 0.16 H new