USER MOD reduce.3.24.130724 H: found=0, std=0, add=264, rem=0, adj=7 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 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.05 (180deg=-1.05) USER MOD Single : A 8 DT C7 :methyl 150:sc= -0.503 (180deg=-0.503) USER MOD Single : A 11 DC O3' : rot 180:sc= 0 USER MOD Single : A 25 BPJ O2 : rot 145:sc= 0.908 USER MOD Single : A 25 BPJ O3 : rot 180:sc= -0.197 USER MOD Single : A 25 BPJ O4 : rot -150:sc= -0.268 USER MOD Single : B 12 DG O5' : rot 180:sc= 0 USER MOD Single : B 14 DT C7 :methyl 150:sc= -1.52 (180deg=-1.52) USER MOD Single : B 20 DT C7 :methyl 150:sc= -1.07 (180deg=-1.07) USER MOD Single : B 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 11.582 -19.384 5.489 1.00 0.15 O ATOM 2 C5' DC A 1 11.027 -20.364 4.603 1.00 0.13 C ATOM 3 C4' DC A 1 9.749 -19.879 3.930 1.00 0.12 C ATOM 4 O4' DC A 1 8.737 -19.626 4.902 1.00 0.15 O ATOM 5 C3' DC A 1 9.987 -18.595 3.170 1.00 0.11 C ATOM 6 O3' DC A 1 10.341 -18.930 1.810 1.00 0.10 O ATOM 7 C2' DC A 1 8.621 -17.997 3.265 1.00 0.11 C ATOM 8 C1' DC A 1 7.795 -18.782 4.245 1.00 0.14 C ATOM 9 N1 DC A 1 7.169 -17.934 5.256 1.00 0.12 N ATOM 10 C2 DC A 1 5.802 -17.968 5.440 1.00 0.13 C ATOM 11 O2 DC A 1 5.077 -18.678 4.754 1.00 0.17 O ATOM 12 N3 DC A 1 5.265 -17.180 6.401 1.00 0.12 N ATOM 13 C4 DC A 1 6.038 -16.387 7.147 1.00 0.10 C ATOM 14 N4 DC A 1 5.439 -15.653 8.076 1.00 0.11 N ATOM 15 C5 DC A 1 7.461 -16.348 6.949 1.00 0.10 C ATOM 16 C6 DC A 1 7.963 -17.141 5.996 1.00 0.10 C ATOM 0 H5' DC A 1 10.817 -21.277 5.160 1.00 0.13 H new ATOM 0 H5'' DC A 1 11.763 -20.618 3.840 1.00 0.13 H new ATOM 0 H4' DC A 1 9.432 -20.664 3.243 1.00 0.12 H new ATOM 0 H3' DC A 1 10.781 -17.941 3.530 1.00 0.11 H new ATOM 0 H2' DC A 1 8.690 -16.957 3.583 1.00 0.11 H new ATOM 0 H2'' DC A 1 8.142 -18.000 2.286 1.00 0.11 H new ATOM 0 HO5' DC A 1 12.398 -19.739 5.899 1.00 0.15 H new ATOM 0 H1' DC A 1 6.991 -19.307 3.730 1.00 0.14 H new ATOM 0 H41 DC A 1 5.990 -15.033 8.669 1.00 0.11 H new ATOM 0 H42 DC A 1 4.428 -15.709 8.197 1.00 0.11 H new ATOM 0 H5 DC A 1 8.096 -15.707 7.543 1.00 0.10 H new ATOM 0 H6 DC A 1 9.028 -17.144 5.817 1.00 0.10 H new ATOM 29 P DC A 2 9.987 -18.069 0.476 1.00 0.12 P ATOM 30 OP1 DC A 2 10.519 -18.805 -0.694 1.00 0.16 O ATOM 31 OP2 DC A 2 10.409 -16.670 0.717 1.00 0.14 O ATOM 32 O5' DC A 2 8.366 -18.103 0.410 1.00 0.15 O ATOM 33 C5' DC A 2 7.551 -19.237 0.039 1.00 0.16 C ATOM 34 C4' DC A 2 6.056 -18.861 0.027 1.00 0.15 C ATOM 35 O4' DC A 2 5.595 -18.431 1.329 1.00 0.16 O ATOM 36 C3' DC A 2 5.776 -17.719 -0.965 1.00 0.16 C ATOM 37 O3' DC A 2 4.838 -18.120 -1.981 1.00 0.18 O ATOM 38 C2' DC A 2 5.266 -16.630 -0.074 1.00 0.14 C ATOM 39 C1' DC A 2 4.696 -17.321 1.160 1.00 0.12 C ATOM 40 N1 DC A 2 4.813 -16.426 2.309 1.00 0.11 N ATOM 41 C2 DC A 2 3.735 -16.078 3.116 1.00 0.12 C ATOM 42 O2 DC A 2 2.601 -16.508 2.930 1.00 0.15 O ATOM 43 N3 DC A 2 3.963 -15.223 4.151 1.00 0.10 N ATOM 44 C4 DC A 2 5.188 -14.737 4.374 1.00 0.10 C ATOM 45 N4 DC A 2 5.376 -13.904 5.389 1.00 0.11 N ATOM 46 C5 DC A 2 6.271 -15.113 3.527 1.00 0.10 C ATOM 47 C6 DC A 2 6.029 -15.940 2.538 1.00 0.10 C ATOM 0 H5' DC A 2 7.719 -20.055 0.740 1.00 0.16 H new ATOM 0 H5'' DC A 2 7.848 -19.596 -0.947 1.00 0.16 H new ATOM 0 H4' DC A 2 5.524 -19.764 -0.271 1.00 0.15 H new ATOM 0 H3' DC A 2 6.647 -17.404 -1.540 1.00 0.16 H new ATOM 0 H2' DC A 2 6.067 -15.944 0.200 1.00 0.14 H new ATOM 0 H2'' DC A 2 4.500 -16.041 -0.579 1.00 0.14 H new ATOM 0 H1' DC A 2 3.648 -17.607 1.068 1.00 0.12 H new ATOM 0 H41 DC A 2 6.305 -13.525 5.572 1.00 0.11 H new ATOM 0 H42 DC A 2 4.592 -13.643 5.986 1.00 0.11 H new ATOM 0 H5 DC A 2 7.265 -14.727 3.695 1.00 0.10 H new ATOM 0 H6 DC A 2 6.842 -16.235 1.891 1.00 0.10 H new ATOM 59 P DA A 3 4.222 -17.124 -3.099 1.00 0.19 P ATOM 60 OP1 DA A 3 3.590 -17.955 -4.151 1.00 0.26 O ATOM 61 OP2 DA A 3 5.267 -16.143 -3.471 1.00 0.23 O ATOM 62 O5' DA A 3 3.055 -16.333 -2.299 1.00 0.17 O ATOM 63 C5' DA A 3 1.751 -16.887 -2.037 1.00 0.14 C ATOM 64 C4' DA A 3 0.827 -15.922 -1.320 1.00 0.11 C ATOM 65 O4' DA A 3 1.299 -15.577 0.003 1.00 0.12 O ATOM 66 C3' DA A 3 0.612 -14.625 -2.098 1.00 0.09 C ATOM 67 O3' DA A 3 -0.734 -14.487 -2.584 1.00 0.12 O ATOM 68 C2' DA A 3 0.982 -13.611 -1.055 1.00 0.09 C ATOM 69 C1' DA A 3 0.794 -14.266 0.288 1.00 0.09 C ATOM 70 N9 DA A 3 1.618 -13.603 1.323 1.00 0.07 N ATOM 71 C8 DA A 3 2.937 -13.331 1.237 1.00 0.08 C ATOM 72 N7 DA A 3 3.460 -12.743 2.328 1.00 0.09 N ATOM 73 C5 DA A 3 2.390 -12.638 3.153 1.00 0.07 C ATOM 74 C6 DA A 3 2.260 -12.114 4.444 1.00 0.08 C ATOM 75 N6 DA A 3 3.290 -11.603 5.111 1.00 0.11 N ATOM 76 N1 DA A 3 1.050 -12.147 5.014 1.00 0.10 N ATOM 77 C2 DA A 3 0.028 -12.670 4.345 1.00 0.10 C ATOM 78 N3 DA A 3 0.021 -13.196 3.126 1.00 0.09 N ATOM 79 C4 DA A 3 1.254 -13.148 2.573 1.00 0.07 C ATOM 0 H5' DA A 3 1.861 -17.790 -1.436 1.00 0.14 H new ATOM 0 H5'' DA A 3 1.294 -17.185 -2.980 1.00 0.14 H new ATOM 0 H4' DA A 3 -0.118 -16.458 -1.240 1.00 0.11 H new ATOM 0 H3' DA A 3 1.194 -14.543 -3.016 1.00 0.09 H new ATOM 0 H2' DA A 3 2.014 -13.286 -1.183 1.00 0.09 H new ATOM 0 H2'' DA A 3 0.355 -12.723 -1.142 1.00 0.09 H new ATOM 0 H1' DA A 3 -0.225 -14.235 0.674 1.00 0.09 H new ATOM 0 H8 DA A 3 3.525 -13.566 0.363 1.00 0.08 H new ATOM 0 H61 DA A 3 3.155 -11.230 6.051 1.00 0.11 H new ATOM 0 H62 DA A 3 4.216 -11.584 4.683 1.00 0.11 H new ATOM 0 H2 DA A 3 -0.921 -12.667 4.860 1.00 0.10 H new ATOM 91 P DT A 4 -1.277 -13.162 -3.344 1.00 0.12 P ATOM 92 OP1 DT A 4 -2.311 -13.577 -4.320 1.00 0.19 O ATOM 93 OP2 DT A 4 -0.114 -12.365 -3.799 1.00 0.13 O ATOM 94 O5' DT A 4 -1.996 -12.351 -2.150 1.00 0.12 O ATOM 95 C5' DT A 4 -3.216 -12.824 -1.552 1.00 0.13 C ATOM 96 C4' DT A 4 -3.788 -11.844 -0.528 1.00 0.13 C ATOM 97 O4' DT A 4 -2.865 -11.649 0.563 1.00 0.12 O ATOM 98 C3' DT A 4 -4.095 -10.470 -1.140 1.00 0.12 C ATOM 99 O3' DT A 4 -5.250 -9.859 -0.541 1.00 0.15 O ATOM 100 C2' DT A 4 -2.828 -9.747 -0.748 1.00 0.12 C ATOM 101 C1' DT A 4 -2.577 -10.251 0.668 1.00 0.12 C ATOM 102 N1 DT A 4 -1.197 -10.071 1.185 1.00 0.09 N ATOM 103 C2 DT A 4 -1.039 -9.700 2.512 1.00 0.09 C ATOM 104 O2 DT A 4 -1.972 -9.496 3.281 1.00 0.12 O ATOM 105 N3 DT A 4 0.256 -9.557 2.949 1.00 0.09 N ATOM 106 C4 DT A 4 1.392 -9.747 2.197 1.00 0.09 C ATOM 107 O4 DT A 4 2.489 -9.587 2.715 1.00 0.09 O ATOM 108 C5 DT A 4 1.135 -10.129 0.832 1.00 0.09 C ATOM 109 C7 DT A 4 2.259 -10.383 -0.162 1.00 0.10 C ATOM 110 C6 DT A 4 -0.110 -10.274 0.385 1.00 0.10 C ATOM 0 H5' DT A 4 -3.031 -13.783 -1.068 1.00 0.13 H new ATOM 0 H5'' DT A 4 -3.955 -12.999 -2.334 1.00 0.13 H new ATOM 0 H4' DT A 4 -4.717 -12.288 -0.172 1.00 0.13 H new ATOM 0 H3' DT A 4 -4.328 -10.479 -2.205 1.00 0.12 H new ATOM 0 H2' DT A 4 -2.001 -9.988 -1.416 1.00 0.12 H new ATOM 0 H2'' DT A 4 -2.955 -8.665 -0.776 1.00 0.12 H new ATOM 0 H1' DT A 4 -3.185 -9.685 1.374 1.00 0.12 H new ATOM 0 H3 DT A 4 0.387 -9.284 3.923 1.00 0.09 H new ATOM 0 H71 DT A 4 1.937 -11.124 -0.894 1.00 0.10 H new ATOM 0 H72 DT A 4 2.510 -9.454 -0.673 1.00 0.10 H new ATOM 0 H73 DT A 4 3.137 -10.753 0.368 1.00 0.10 H new ATOM 0 H6 DT A 4 -0.265 -10.562 -0.644 1.00 0.10 H new ATOM 123 P DC A 5 -5.812 -8.408 -0.993 1.00 0.16 P ATOM 124 OP1 DC A 5 -6.409 -8.564 -2.340 1.00 0.18 O ATOM 125 OP2 DC A 5 -4.756 -7.394 -0.779 1.00 0.19 O ATOM 126 O5' DC A 5 -7.017 -8.122 0.044 1.00 0.21 O ATOM 127 C5' DC A 5 -7.006 -8.335 1.471 1.00 0.23 C ATOM 128 C4' DC A 5 -6.142 -7.374 2.306 1.00 0.24 C ATOM 129 O4' DC A 5 -4.714 -7.561 2.182 1.00 0.22 O ATOM 130 C3' DC A 5 -6.430 -5.885 2.058 1.00 0.27 C ATOM 131 O3' DC A 5 -7.099 -5.285 3.179 1.00 0.35 O ATOM 132 C2' DC A 5 -5.019 -5.343 1.792 1.00 0.23 C ATOM 133 C1' DC A 5 -4.075 -6.308 2.502 1.00 0.20 C ATOM 134 N1 DC A 5 -2.667 -6.349 2.021 1.00 0.17 N ATOM 135 C2 DC A 5 -1.618 -6.203 2.931 1.00 0.15 C ATOM 136 O2 DC A 5 -1.801 -5.978 4.125 1.00 0.17 O ATOM 137 N3 DC A 5 -0.343 -6.289 2.471 1.00 0.14 N ATOM 138 C4 DC A 5 -0.092 -6.507 1.177 1.00 0.14 C ATOM 139 N4 DC A 5 1.172 -6.592 0.773 1.00 0.14 N ATOM 140 C5 DC A 5 -1.154 -6.655 0.234 1.00 0.15 C ATOM 141 C6 DC A 5 -2.410 -6.566 0.704 1.00 0.15 C ATOM 0 H5' DC A 5 -6.664 -9.352 1.661 1.00 0.23 H new ATOM 0 H5'' DC A 5 -8.032 -8.271 1.833 1.00 0.23 H new ATOM 0 H4' DC A 5 -6.447 -7.649 3.316 1.00 0.24 H new ATOM 0 H3' DC A 5 -7.115 -5.673 1.237 1.00 0.27 H new ATOM 0 H2' DC A 5 -4.809 -5.302 0.723 1.00 0.23 H new ATOM 0 H2'' DC A 5 -4.908 -4.330 2.178 1.00 0.23 H new ATOM 0 H1' DC A 5 -3.955 -6.035 3.550 1.00 0.20 H new ATOM 0 H41 DC A 5 1.383 -6.758 -0.211 1.00 0.14 H new ATOM 0 H42 DC A 5 1.931 -6.491 1.447 1.00 0.14 H new ATOM 0 H5 DC A 5 -0.956 -6.831 -0.813 1.00 0.15 H new ATOM 0 H6 DC A 5 -3.237 -6.670 0.017 1.00 0.15 H new ATOM 153 P DG A 6 -7.763 -3.810 3.126 1.00 0.41 P ATOM 154 OP1 DG A 6 -8.832 -3.748 4.149 1.00 0.54 O ATOM 155 OP2 DG A 6 -8.081 -3.486 1.715 1.00 0.48 O ATOM 156 O5' DG A 6 -6.551 -2.860 3.597 1.00 0.29 O ATOM 157 C5' DG A 6 -6.161 -2.782 4.976 1.00 0.24 C ATOM 158 C4' DG A 6 -4.773 -2.186 5.140 1.00 0.13 C ATOM 159 O4' DG A 6 -3.778 -2.992 4.475 1.00 0.12 O ATOM 160 C3' DG A 6 -4.650 -0.771 4.543 1.00 0.11 C ATOM 161 O3' DG A 6 -4.652 0.267 5.524 1.00 0.12 O ATOM 162 C2' DG A 6 -3.281 -0.840 3.904 1.00 0.14 C ATOM 163 C1' DG A 6 -2.651 -2.118 4.429 1.00 0.09 C ATOM 164 N9 DG A 6 -1.591 -2.551 3.508 1.00 0.09 N ATOM 165 C8 DG A 6 -1.681 -3.054 2.243 1.00 0.11 C ATOM 166 N7 DG A 6 -0.476 -3.299 1.683 1.00 0.12 N ATOM 167 C5 DG A 6 0.402 -2.931 2.653 1.00 0.10 C ATOM 168 C6 DG A 6 1.818 -2.958 2.652 1.00 0.10 C ATOM 169 O6 DG A 6 2.585 -3.308 1.762 1.00 0.13 O ATOM 170 N1 DG A 6 2.342 -2.497 3.840 1.00 0.08 N ATOM 171 C2 DG A 6 1.615 -2.057 4.921 1.00 0.07 C ATOM 172 N2 DG A 6 2.320 -1.630 5.978 1.00 0.07 N ATOM 173 N3 DG A 6 0.281 -2.029 4.928 1.00 0.07 N ATOM 174 C4 DG A 6 -0.253 -2.478 3.769 1.00 0.08 C ATOM 0 H5' DG A 6 -6.182 -3.779 5.416 1.00 0.24 H new ATOM 0 H5'' DG A 6 -6.883 -2.176 5.524 1.00 0.24 H new ATOM 0 H4' DG A 6 -4.611 -2.149 6.217 1.00 0.13 H new ATOM 0 H3' DG A 6 -5.484 -0.531 3.883 1.00 0.11 H new ATOM 0 H2' DG A 6 -3.356 -0.858 2.817 1.00 0.14 H new ATOM 0 H2'' DG A 6 -2.681 0.031 4.168 1.00 0.14 H new ATOM 0 H1' DG A 6 -2.154 -2.051 5.397 1.00 0.09 H new ATOM 0 H8 DG A 6 -2.619 -3.238 1.741 1.00 0.11 H new ATOM 0 H1 DG A 6 3.358 -2.481 3.925 1.00 0.08 H new ATOM 0 H22 DG A 6 3.340 -1.644 5.950 1.00 0.07 H new ATOM 185 P DC A 7 -5.956 1.101 5.978 1.00 0.11 P ATOM 186 OP1 DC A 7 -7.041 0.158 6.336 1.00 0.15 O ATOM 187 OP2 DC A 7 -6.195 2.172 4.982 1.00 0.13 O ATOM 188 O5' DC A 7 -5.356 1.772 7.323 1.00 0.12 O ATOM 189 C5' DC A 7 -5.025 0.965 8.467 1.00 0.11 C ATOM 190 C4' DC A 7 -3.727 1.382 9.167 1.00 0.10 C ATOM 191 O4' DC A 7 -2.560 1.230 8.336 1.00 0.13 O ATOM 192 C3' DC A 7 -3.827 2.800 9.693 1.00 0.10 C ATOM 193 O3' DC A 7 -4.064 2.733 11.108 1.00 0.10 O ATOM 194 C2' DC A 7 -2.424 3.278 9.452 1.00 0.10 C ATOM 195 C1' DC A 7 -1.860 2.478 8.300 1.00 0.11 C ATOM 196 N1 DC A 7 -1.694 2.979 6.913 1.00 0.08 N ATOM 197 C2 DC A 7 -0.563 3.726 6.600 1.00 0.08 C ATOM 198 O2 DC A 7 0.269 4.039 7.446 1.00 0.12 O ATOM 199 N3 DC A 7 -0.383 4.126 5.320 1.00 0.09 N ATOM 200 C4 DC A 7 -1.271 3.818 4.372 1.00 0.10 C ATOM 201 N4 DC A 7 -1.026 4.228 3.132 1.00 0.12 N ATOM 202 C5 DC A 7 -2.445 3.059 4.672 1.00 0.09 C ATOM 203 C6 DC A 7 -2.608 2.665 5.953 1.00 0.08 C ATOM 0 H5' DC A 7 -4.939 -0.075 8.153 1.00 0.11 H new ATOM 0 H5'' DC A 7 -5.845 1.015 9.184 1.00 0.11 H new ATOM 0 H4' DC A 7 -3.601 0.699 10.007 1.00 0.10 H new ATOM 0 H3' DC A 7 -4.606 3.419 9.248 1.00 0.10 H new ATOM 0 H2' DC A 7 -2.417 4.343 9.218 1.00 0.10 H new ATOM 0 H2'' DC A 7 -1.815 3.144 10.346 1.00 0.10 H new ATOM 0 H1' DC A 7 -0.790 2.485 8.510 1.00 0.11 H new ATOM 0 H41 DC A 7 -1.684 4.010 2.383 1.00 0.12 H new ATOM 0 H42 DC A 7 -0.180 4.761 2.929 1.00 0.12 H new ATOM 0 H5 DC A 7 -3.168 2.812 3.909 1.00 0.09 H new ATOM 0 H6 DC A 7 -3.481 2.089 6.222 1.00 0.08 H new ATOM 215 P DT A 8 -4.520 4.001 11.992 1.00 0.10 P ATOM 216 OP1 DT A 8 -4.586 3.570 13.407 1.00 0.15 O ATOM 217 OP2 DT A 8 -5.712 4.600 11.350 1.00 0.18 O ATOM 218 O5' DT A 8 -3.286 5.028 11.825 1.00 0.15 O ATOM 219 C5' DT A 8 -2.080 5.029 12.616 1.00 0.13 C ATOM 220 C4' DT A 8 -1.177 6.182 12.171 1.00 0.13 C ATOM 221 O4' DT A 8 -0.740 5.987 10.814 1.00 0.15 O ATOM 222 C3' DT A 8 -1.949 7.495 12.254 1.00 0.13 C ATOM 223 O3' DT A 8 -1.420 8.336 13.302 1.00 0.14 O ATOM 224 C2' DT A 8 -1.822 8.002 10.847 1.00 0.13 C ATOM 225 C1' DT A 8 -0.629 7.276 10.208 1.00 0.12 C ATOM 226 N1 DT A 8 -0.865 7.118 8.756 1.00 0.10 N ATOM 227 C2 DT A 8 0.039 7.515 7.798 1.00 0.09 C ATOM 228 O2 DT A 8 1.138 7.998 8.049 1.00 0.14 O ATOM 229 N3 DT A 8 -0.369 7.314 6.494 1.00 0.08 N ATOM 230 C4 DT A 8 -1.566 6.763 6.077 1.00 0.09 C ATOM 231 O4 DT A 8 -1.779 6.657 4.873 1.00 0.12 O ATOM 232 C5 DT A 8 -2.434 6.376 7.170 1.00 0.11 C ATOM 233 C7 DT A 8 -3.813 5.727 7.017 1.00 0.12 C ATOM 234 C6 DT A 8 -2.038 6.574 8.414 1.00 0.10 C ATOM 0 H5' DT A 8 -1.557 4.079 12.502 1.00 0.13 H new ATOM 0 H5'' DT A 8 -2.326 5.133 13.673 1.00 0.13 H new ATOM 0 H4' DT A 8 -0.307 6.213 12.827 1.00 0.13 H new ATOM 0 H3' DT A 8 -2.997 7.430 12.545 1.00 0.13 H new ATOM 0 H2' DT A 8 -2.736 7.809 10.285 1.00 0.13 H new ATOM 0 H2'' DT A 8 -1.665 9.081 10.840 1.00 0.13 H new ATOM 0 H1' DT A 8 0.327 7.782 10.341 1.00 0.12 H new ATOM 0 H3 DT A 8 0.281 7.602 5.762 1.00 0.08 H new ATOM 0 H71 DT A 8 -4.009 5.083 7.874 1.00 0.12 H new ATOM 0 H72 DT A 8 -4.576 6.503 6.964 1.00 0.12 H new ATOM 0 H73 DT A 8 -3.836 5.132 6.104 1.00 0.12 H new ATOM 0 H6 DT A 8 -2.706 6.277 9.209 1.00 0.10 H new ATOM 247 P DA A 9 -1.273 9.952 13.298 1.00 0.12 P ATOM 248 OP1 DA A 9 -1.124 10.400 14.700 1.00 0.22 O ATOM 249 OP2 DA A 9 -2.350 10.524 12.458 1.00 0.24 O ATOM 250 O5' DA A 9 0.130 10.197 12.531 1.00 0.15 O ATOM 251 C5' DA A 9 1.384 9.728 13.060 1.00 0.15 C ATOM 252 C4' DA A 9 2.599 10.328 12.350 1.00 0.15 C ATOM 253 O4' DA A 9 2.629 10.007 10.954 1.00 0.15 O ATOM 254 C3' DA A 9 2.681 11.816 12.512 1.00 0.16 C ATOM 255 O3' DA A 9 4.035 12.258 12.676 1.00 0.19 O ATOM 256 C2' DA A 9 2.028 12.218 11.273 1.00 0.18 C ATOM 257 C1' DA A 9 2.436 11.227 10.242 1.00 0.17 C ATOM 258 N9 DA A 9 1.369 10.991 9.269 1.00 0.14 N ATOM 259 C8 DA A 9 0.065 10.778 9.531 1.00 0.16 C ATOM 260 N7 DA A 9 -0.692 10.554 8.440 1.00 0.17 N ATOM 261 C5 DA A 9 0.218 10.639 7.434 1.00 0.16 C ATOM 262 C6 DA A 9 0.100 10.507 6.051 1.00 0.20 C ATOM 263 N6 DA A 9 -1.055 10.243 5.446 1.00 0.24 N ATOM 264 N1 DA A 9 1.215 10.653 5.328 1.00 0.19 N ATOM 265 C2 DA A 9 2.373 10.912 5.924 1.00 0.18 C ATOM 266 N3 DA A 9 2.611 11.056 7.211 1.00 0.17 N ATOM 267 C4 DA A 9 1.475 10.905 7.916 1.00 0.14 C ATOM 0 H5' DA A 9 1.423 8.642 12.977 1.00 0.15 H new ATOM 0 H5'' DA A 9 1.436 9.969 14.122 1.00 0.15 H new ATOM 0 H4' DA A 9 3.464 9.875 12.834 1.00 0.15 H new ATOM 0 H3' DA A 9 2.217 12.246 13.400 1.00 0.16 H new ATOM 0 H2' DA A 9 0.945 12.231 11.392 1.00 0.18 H new ATOM 0 H2'' DA A 9 2.329 13.225 10.984 1.00 0.18 H new ATOM 0 H1' DA A 9 3.316 11.583 9.707 1.00 0.17 H new ATOM 0 H8 DA A 9 -0.340 10.786 10.532 1.00 0.16 H new ATOM 0 H61 DA A 9 -1.090 10.156 4.430 1.00 0.24 H new ATOM 0 H62 DA A 9 -1.905 10.128 5.998 1.00 0.24 H new ATOM 0 H2 DA A 9 3.227 11.018 5.271 1.00 0.18 H new ATOM 279 P DC A 10 4.417 13.813 12.855 1.00 0.18 P ATOM 280 OP1 DC A 10 5.811 13.892 13.346 1.00 0.25 O ATOM 281 OP2 DC A 10 3.333 14.484 13.608 1.00 0.24 O ATOM 282 O5' DC A 10 4.371 14.326 11.326 1.00 0.19 O ATOM 283 C5' DC A 10 5.460 14.076 10.422 1.00 0.19 C ATOM 284 C4' DC A 10 5.197 14.626 9.030 1.00 0.16 C ATOM 285 O4' DC A 10 4.134 13.912 8.421 1.00 0.19 O ATOM 286 C3' DC A 10 4.816 16.104 9.095 1.00 0.13 C ATOM 287 O3' DC A 10 5.844 17.023 8.672 1.00 0.14 O ATOM 288 C2' DC A 10 3.624 16.126 8.215 1.00 0.13 C ATOM 289 C1' DC A 10 3.576 14.829 7.486 1.00 0.15 C ATOM 290 N1 DC A 10 2.191 14.402 7.320 1.00 0.14 N ATOM 291 C2 DC A 10 1.639 14.158 6.083 1.00 0.16 C ATOM 292 O2 DC A 10 2.272 14.315 5.046 1.00 0.20 O ATOM 293 N3 DC A 10 0.350 13.744 6.042 1.00 0.18 N ATOM 294 C4 DC A 10 -0.357 13.581 7.164 1.00 0.16 C ATOM 295 N4 DC A 10 -1.610 13.171 7.017 1.00 0.19 N ATOM 296 C5 DC A 10 0.229 13.840 8.455 1.00 0.15 C ATOM 297 C6 DC A 10 1.497 14.246 8.455 1.00 0.15 C ATOM 0 H5' DC A 10 5.636 13.002 10.358 1.00 0.19 H new ATOM 0 H5'' DC A 10 6.370 14.525 10.821 1.00 0.19 H new ATOM 0 H4' DC A 10 6.110 14.513 8.445 1.00 0.16 H new ATOM 0 H3' DC A 10 4.643 16.450 10.114 1.00 0.13 H new ATOM 0 H2' DC A 10 2.717 16.268 8.803 1.00 0.13 H new ATOM 0 H2'' DC A 10 3.682 16.958 7.513 1.00 0.13 H new ATOM 0 H1' DC A 10 4.069 14.891 6.516 1.00 0.15 H new ATOM 0 H41 DC A 10 -2.200 13.029 7.837 1.00 0.19 H new ATOM 0 H42 DC A 10 -1.984 12.998 6.084 1.00 0.19 H new ATOM 0 H5 DC A 10 -0.329 13.712 9.371 1.00 0.15 H new ATOM 0 H6 DC A 10 1.980 14.456 9.398 1.00 0.15 H new ATOM 309 P DC A 11 6.575 17.016 7.222 1.00 0.16 P ATOM 310 OP1 DC A 11 6.970 15.626 6.900 1.00 0.22 O ATOM 311 OP2 DC A 11 7.599 18.084 7.229 1.00 0.21 O ATOM 312 O5' DC A 11 5.411 17.458 6.187 1.00 0.22 O ATOM 313 C5' DC A 11 5.681 17.696 4.792 1.00 0.26 C ATOM 314 C4' DC A 11 4.452 18.219 4.043 1.00 0.27 C ATOM 315 O4' DC A 11 3.348 17.304 4.075 1.00 0.27 O ATOM 316 C3' DC A 11 3.905 19.481 4.679 1.00 0.23 C ATOM 317 O3' DC A 11 4.578 20.698 4.358 1.00 0.31 O ATOM 318 C2' DC A 11 2.452 19.463 4.270 1.00 0.22 C ATOM 319 C1' DC A 11 2.182 18.069 3.720 1.00 0.23 C ATOM 320 N1 DC A 11 1.015 17.517 4.422 1.00 0.21 N ATOM 321 C2 DC A 11 -0.145 17.157 3.754 1.00 0.25 C ATOM 322 O2 DC A 11 -0.272 17.264 2.536 1.00 0.29 O ATOM 323 N3 DC A 11 -1.168 16.665 4.499 1.00 0.24 N ATOM 324 C4 DC A 11 -1.058 16.533 5.827 1.00 0.21 C ATOM 325 N4 DC A 11 -2.097 16.062 6.500 1.00 0.22 N ATOM 326 C5 DC A 11 0.140 16.903 6.506 1.00 0.19 C ATOM 327 C6 DC A 11 1.127 17.385 5.757 1.00 0.18 C ATOM 0 H5' DC A 11 6.020 16.771 4.327 1.00 0.26 H new ATOM 0 H5'' DC A 11 6.494 18.416 4.699 1.00 0.26 H new ATOM 0 H4' DC A 11 4.810 18.379 3.026 1.00 0.27 H new ATOM 0 H3' DC A 11 4.058 19.472 5.758 1.00 0.23 H new ATOM 0 H2' DC A 11 1.806 19.678 5.121 1.00 0.22 H new ATOM 0 H2'' DC A 11 2.250 20.224 3.517 1.00 0.22 H new ATOM 0 HO3' DC A 11 4.142 21.445 4.820 1.00 0.31 H new ATOM 0 H1' DC A 11 1.991 18.061 2.647 1.00 0.23 H new ATOM 0 H41 DC A 11 -2.041 15.951 7.512 1.00 0.22 H new ATOM 0 H42 DC A 11 -2.953 15.810 6.006 1.00 0.22 H new ATOM 0 H5 DC A 11 0.241 16.797 7.576 1.00 0.19 H new ATOM 0 H6 DC A 11 2.049 17.680 6.235 1.00 0.18 H new TER 340 DC A 11 ATOM 341 O5' DG B 12 -10.136 12.261 -0.350 1.00 0.37 O ATOM 342 C5' DG B 12 -9.889 12.888 -1.611 1.00 0.31 C ATOM 343 C4' DG B 12 -8.441 13.245 -1.805 1.00 0.20 C ATOM 344 O4' DG B 12 -7.977 14.158 -0.783 1.00 0.20 O ATOM 345 C3' DG B 12 -7.574 11.988 -1.791 1.00 0.17 C ATOM 346 O3' DG B 12 -6.800 11.960 -3.001 1.00 0.17 O ATOM 347 C2' DG B 12 -6.887 12.210 -0.457 1.00 0.16 C ATOM 348 C1' DG B 12 -6.688 13.698 -0.372 1.00 0.14 C ATOM 349 N9 DG B 12 -6.333 14.065 1.004 1.00 0.13 N ATOM 350 C8 DG B 12 -7.031 13.819 2.132 1.00 0.16 C ATOM 351 N7 DG B 12 -6.432 14.264 3.254 1.00 0.18 N ATOM 352 C5 DG B 12 -5.284 14.821 2.786 1.00 0.14 C ATOM 353 C6 DG B 12 -4.231 15.456 3.490 1.00 0.17 C ATOM 354 O6 DG B 12 -4.110 15.649 4.694 1.00 0.20 O ATOM 355 N1 DG B 12 -3.231 15.887 2.649 1.00 0.18 N ATOM 356 C2 DG B 12 -3.234 15.734 1.286 1.00 0.16 C ATOM 357 N2 DG B 12 -2.185 16.179 0.622 1.00 0.20 N ATOM 358 N3 DG B 12 -4.213 15.146 0.608 1.00 0.12 N ATOM 359 C4 DG B 12 -5.203 14.713 1.419 1.00 0.11 C ATOM 0 H5' DG B 12 -10.496 13.790 -1.689 1.00 0.31 H new ATOM 0 H5'' DG B 12 -10.206 12.221 -2.413 1.00 0.31 H new ATOM 0 H4' DG B 12 -8.356 13.738 -2.774 1.00 0.20 H new ATOM 0 H3' DG B 12 -8.018 10.993 -1.820 1.00 0.17 H new ATOM 0 H2' DG B 12 -7.498 11.845 0.368 1.00 0.16 H new ATOM 0 H2'' DG B 12 -5.936 11.680 -0.409 1.00 0.16 H new ATOM 0 HO5' DG B 12 -11.090 12.050 -0.271 1.00 0.37 H new ATOM 0 H1' DG B 12 -5.884 14.122 -0.974 1.00 0.14 H new ATOM 0 H8 DG B 12 -7.984 13.311 2.135 1.00 0.16 H new ATOM 0 H1 DG B 12 -2.428 16.355 3.070 1.00 0.18 H new ATOM 0 H21 DG B 12 -2.146 16.085 -0.393 1.00 0.20 H new ATOM 0 H22 DG B 12 -1.412 16.617 1.123 1.00 0.20 H new ATOM 372 P DG B 13 -5.218 11.704 -3.114 1.00 0.16 P ATOM 373 OP1 DG B 13 -4.878 11.507 -4.540 1.00 0.25 O ATOM 374 OP2 DG B 13 -4.817 10.691 -2.110 1.00 0.23 O ATOM 375 O5' DG B 13 -4.650 13.134 -2.630 1.00 0.22 O ATOM 376 C5' DG B 13 -4.222 14.183 -3.518 1.00 0.21 C ATOM 377 C4' DG B 13 -2.691 14.279 -3.536 1.00 0.18 C ATOM 378 O4' DG B 13 -2.206 14.595 -2.223 1.00 0.20 O ATOM 379 C3' DG B 13 -1.969 13.033 -4.034 1.00 0.16 C ATOM 380 O3' DG B 13 -0.877 13.232 -4.958 1.00 0.17 O ATOM 381 C2' DG B 13 -1.677 12.379 -2.755 1.00 0.15 C ATOM 382 C1' DG B 13 -1.430 13.483 -1.774 1.00 0.16 C ATOM 383 N9 DG B 13 -1.865 13.131 -0.413 1.00 0.14 N ATOM 384 C8 DG B 13 -3.027 12.537 -0.046 1.00 0.14 C ATOM 385 N7 DG B 13 -3.152 12.375 1.292 1.00 0.15 N ATOM 386 C5 DG B 13 -1.996 12.901 1.779 1.00 0.15 C ATOM 387 C6 DG B 13 -1.537 13.023 3.124 1.00 0.17 C ATOM 388 O6 DG B 13 -2.075 12.697 4.179 1.00 0.19 O ATOM 389 N1 DG B 13 -0.298 13.618 3.187 1.00 0.18 N ATOM 390 C2 DG B 13 0.426 14.050 2.105 1.00 0.18 C ATOM 391 N2 DG B 13 1.606 14.587 2.342 1.00 0.22 N ATOM 392 N3 DG B 13 0.015 13.948 0.847 1.00 0.17 N ATOM 393 C4 DG B 13 -1.200 13.365 0.757 1.00 0.14 C ATOM 0 H5' DG B 13 -4.648 15.134 -3.199 1.00 0.21 H new ATOM 0 H5'' DG B 13 -4.592 13.989 -4.525 1.00 0.21 H new ATOM 0 H4' DG B 13 -2.468 15.069 -4.254 1.00 0.18 H new ATOM 0 H3' DG B 13 -2.554 12.414 -4.714 1.00 0.16 H new ATOM 0 H2' DG B 13 -2.511 11.754 -2.437 1.00 0.15 H new ATOM 0 H2'' DG B 13 -0.806 11.729 -2.839 1.00 0.15 H new ATOM 0 H1' DG B 13 -0.362 13.694 -1.727 1.00 0.16 H new ATOM 0 H8 DG B 13 -3.781 12.223 -0.753 1.00 0.14 H new ATOM 0 H1 DG B 13 0.114 13.748 4.111 1.00 0.18 H new ATOM 0 H21 DG B 13 2.179 14.922 1.567 1.00 0.22 H new ATOM 0 H22 DG B 13 1.946 14.668 3.300 1.00 0.22 H new ATOM 405 P DT B 14 0.377 14.250 -4.810 1.00 0.17 P ATOM 406 OP1 DT B 14 -0.107 15.524 -4.230 1.00 0.15 O ATOM 407 OP2 DT B 14 1.103 14.265 -6.100 1.00 0.23 O ATOM 408 O5' DT B 14 1.317 13.527 -3.727 1.00 0.22 O ATOM 409 C5' DT B 14 2.498 14.149 -3.192 1.00 0.22 C ATOM 410 C4' DT B 14 3.143 13.255 -2.146 1.00 0.17 C ATOM 411 O4' DT B 14 2.221 12.990 -1.082 1.00 0.19 O ATOM 412 C3' DT B 14 3.658 11.950 -2.708 1.00 0.15 C ATOM 413 O3' DT B 14 5.071 12.131 -2.895 1.00 0.16 O ATOM 414 C2' DT B 14 3.229 11.017 -1.604 1.00 0.15 C ATOM 415 C1' DT B 14 2.764 11.850 -0.432 1.00 0.15 C ATOM 416 N1 DT B 14 1.727 11.241 0.406 1.00 0.13 N ATOM 417 C2 DT B 14 1.877 11.199 1.775 1.00 0.13 C ATOM 418 O2 DT B 14 2.853 11.637 2.377 1.00 0.16 O ATOM 419 N3 DT B 14 0.841 10.623 2.461 1.00 0.14 N ATOM 420 C4 DT B 14 -0.309 10.095 1.925 1.00 0.13 C ATOM 421 O4 DT B 14 -1.155 9.625 2.678 1.00 0.16 O ATOM 422 C5 DT B 14 -0.363 10.187 0.484 1.00 0.12 C ATOM 423 C7 DT B 14 -1.517 9.668 -0.347 1.00 0.13 C ATOM 424 C6 DT B 14 0.632 10.742 -0.192 1.00 0.12 C ATOM 0 H5' DT B 14 2.240 15.111 -2.748 1.00 0.22 H new ATOM 0 H5'' DT B 14 3.207 14.348 -3.996 1.00 0.22 H new ATOM 0 H4' DT B 14 4.007 13.802 -1.769 1.00 0.17 H new ATOM 0 H3' DT B 14 3.304 11.583 -3.671 1.00 0.15 H new ATOM 0 H2' DT B 14 2.426 10.365 -1.949 1.00 0.15 H new ATOM 0 H2'' DT B 14 4.057 10.374 -1.307 1.00 0.15 H new ATOM 0 H1' DT B 14 3.586 12.022 0.263 1.00 0.15 H new ATOM 0 H3 DT B 14 0.933 10.582 3.476 1.00 0.14 H new ATOM 0 H71 DT B 14 -1.615 10.271 -1.250 1.00 0.13 H new ATOM 0 H72 DT B 14 -1.329 8.630 -0.622 1.00 0.13 H new ATOM 0 H73 DT B 14 -2.439 9.729 0.232 1.00 0.13 H new ATOM 0 H6 DT B 14 0.560 10.796 -1.268 1.00 0.12 H new ATOM 437 P DA B 15 6.154 10.967 -3.153 1.00 0.18 P ATOM 438 OP1 DA B 15 7.415 11.590 -3.618 1.00 0.25 O ATOM 439 OP2 DA B 15 5.520 9.893 -3.952 1.00 0.23 O ATOM 440 O5' DA B 15 6.363 10.432 -1.650 1.00 0.19 O ATOM 441 C5' DA B 15 6.997 11.202 -0.610 1.00 0.16 C ATOM 442 C4' DA B 15 7.054 10.399 0.694 1.00 0.14 C ATOM 443 O4' DA B 15 5.739 10.144 1.232 1.00 0.17 O ATOM 444 C3' DA B 15 7.713 9.045 0.424 1.00 0.13 C ATOM 445 O3' DA B 15 8.751 8.708 1.351 1.00 0.14 O ATOM 446 C2' DA B 15 6.535 8.139 0.537 1.00 0.14 C ATOM 447 C1' DA B 15 5.671 8.760 1.590 1.00 0.11 C ATOM 448 N9 DA B 15 4.282 8.299 1.520 1.00 0.11 N ATOM 449 C8 DA B 15 3.558 8.009 0.417 1.00 0.12 C ATOM 450 N7 DA B 15 2.285 7.633 0.691 1.00 0.13 N ATOM 451 C5 DA B 15 2.232 7.695 2.052 1.00 0.10 C ATOM 452 C6 DA B 15 1.208 7.433 2.984 1.00 0.11 C ATOM 453 N6 DA B 15 -0.015 7.035 2.648 1.00 0.13 N ATOM 454 N1 DA B 15 1.500 7.598 4.284 1.00 0.12 N ATOM 455 C2 DA B 15 2.715 7.993 4.646 1.00 0.12 C ATOM 456 N3 DA B 15 3.748 8.268 3.873 1.00 0.12 N ATOM 457 C4 DA B 15 3.435 8.097 2.572 1.00 0.10 C ATOM 0 H5' DA B 15 6.447 12.129 -0.449 1.00 0.16 H new ATOM 0 H5'' DA B 15 8.005 11.479 -0.918 1.00 0.16 H new ATOM 0 H4' DA B 15 7.622 10.989 1.413 1.00 0.14 H new ATOM 0 H3' DA B 15 8.239 9.001 -0.530 1.00 0.13 H new ATOM 0 H2' DA B 15 6.005 8.059 -0.412 1.00 0.14 H new ATOM 0 H2'' DA B 15 6.838 7.130 0.819 1.00 0.14 H new ATOM 0 H1' DA B 15 5.998 8.520 2.602 1.00 0.11 H new ATOM 0 H8 DA B 15 3.955 8.071 -0.586 1.00 0.12 H new ATOM 0 H61 DA B 15 -0.712 6.862 3.372 1.00 0.13 H new ATOM 0 H62 DA B 15 -0.256 6.903 1.666 1.00 0.13 H new ATOM 0 H2 DA B 15 2.878 8.103 5.708 1.00 0.12 H new ATOM 469 P DG B 16 9.606 7.349 1.179 1.00 0.13 P ATOM 470 OP1 DG B 16 10.386 7.466 -0.074 1.00 0.15 O ATOM 471 OP2 DG B 16 8.705 6.187 1.370 1.00 0.16 O ATOM 472 O5' DG B 16 10.651 7.419 2.408 1.00 0.14 O ATOM 473 C5' DG B 16 10.357 7.587 3.810 1.00 0.14 C ATOM 474 C4' DG B 16 9.412 6.560 4.422 1.00 0.12 C ATOM 475 O4' DG B 16 8.038 6.738 4.065 1.00 0.12 O ATOM 476 C3' DG B 16 9.795 5.148 4.028 1.00 0.09 C ATOM 477 O3' DG B 16 10.830 4.612 4.871 1.00 0.10 O ATOM 478 C2' DG B 16 8.444 4.477 4.236 1.00 0.10 C ATOM 479 C1' DG B 16 7.422 5.547 4.566 1.00 0.10 C ATOM 480 N9 DG B 16 6.157 5.313 3.876 1.00 0.10 N ATOM 481 C8 DG B 16 5.989 5.194 2.552 1.00 0.11 C ATOM 482 N7 DG B 16 4.714 4.969 2.176 1.00 0.12 N ATOM 483 C5 DG B 16 4.054 4.945 3.364 1.00 0.10 C ATOM 484 C6 DG B 16 2.679 4.740 3.631 1.00 0.10 C ATOM 485 O6 DG B 16 1.747 4.547 2.856 1.00 0.12 O ATOM 486 N1 DG B 16 2.412 4.782 4.973 1.00 0.09 N ATOM 487 C2 DG B 16 3.328 4.997 5.968 1.00 0.10 C ATOM 488 N2 DG B 16 2.890 5.003 7.213 1.00 0.11 N ATOM 489 N3 DG B 16 4.621 5.195 5.742 1.00 0.10 N ATOM 490 C4 DG B 16 4.913 5.154 4.418 1.00 0.09 C ATOM 0 H5' DG B 16 9.927 8.578 3.955 1.00 0.14 H new ATOM 0 H5'' DG B 16 11.296 7.563 4.363 1.00 0.14 H new ATOM 0 H4' DG B 16 9.515 6.717 5.496 1.00 0.12 H new ATOM 0 H3' DG B 16 10.221 5.028 3.032 1.00 0.09 H new ATOM 0 H2' DG B 16 8.148 3.934 3.338 1.00 0.10 H new ATOM 0 H2'' DG B 16 8.503 3.748 5.044 1.00 0.10 H new ATOM 0 H1' DG B 16 7.179 5.582 5.628 1.00 0.10 H new ATOM 0 H8 DG B 16 6.804 5.272 1.847 1.00 0.11 H new ATOM 0 H1 DG B 16 1.443 4.640 5.258 1.00 0.09 H new ATOM 0 H21 DG B 16 3.541 5.160 7.982 1.00 0.11 H new ATOM 0 H22 DG B 16 1.900 4.851 7.406 1.00 0.11 H new ATOM 502 P DC B 17 11.713 3.303 4.490 1.00 0.08 P ATOM 503 OP1 DC B 17 12.863 3.237 5.419 1.00 0.12 O ATOM 504 OP2 DC B 17 11.951 3.317 3.028 1.00 0.11 O ATOM 505 O5' DC B 17 10.721 2.074 4.824 1.00 0.11 O ATOM 506 C5' DC B 17 10.167 1.900 6.138 1.00 0.10 C ATOM 507 C4' DC B 17 9.206 0.717 6.235 1.00 0.11 C ATOM 508 O4' DC B 17 8.174 0.765 5.235 1.00 0.11 O ATOM 509 C3' DC B 17 9.894 -0.633 6.046 1.00 0.11 C ATOM 510 O3' DC B 17 10.411 -1.073 7.318 1.00 0.12 O ATOM 511 C2' DC B 17 8.771 -1.472 5.432 1.00 0.11 C ATOM 512 C1' DC B 17 7.577 -0.539 5.260 1.00 0.11 C ATOM 513 N1 DC B 17 6.807 -0.816 4.022 1.00 0.09 N ATOM 514 C2 DC B 17 5.640 -1.566 4.129 1.00 0.08 C ATOM 515 O2 DC B 17 5.203 -1.968 5.203 1.00 0.09 O ATOM 516 N3 DC B 17 4.943 -1.845 3.007 1.00 0.09 N ATOM 517 C4 DC B 17 5.352 -1.414 1.817 1.00 0.09 C ATOM 518 N4 DC B 17 4.612 -1.736 0.766 1.00 0.11 N ATOM 519 C5 DC B 17 6.545 -0.635 1.675 1.00 0.09 C ATOM 520 C6 DC B 17 7.237 -0.360 2.801 1.00 0.09 C ATOM 0 H5' DC B 17 9.642 2.811 6.427 1.00 0.10 H new ATOM 0 H5'' DC B 17 10.979 1.760 6.852 1.00 0.10 H new ATOM 0 H4' DC B 17 8.794 0.804 7.240 1.00 0.11 H new ATOM 0 H3' DC B 17 10.773 -0.666 5.402 1.00 0.11 H new ATOM 0 H2' DC B 17 9.078 -1.889 4.473 1.00 0.11 H new ATOM 0 H2'' DC B 17 8.517 -2.312 6.078 1.00 0.11 H new ATOM 0 H1' DC B 17 6.843 -0.658 6.057 1.00 0.11 H new ATOM 0 H41 DC B 17 4.888 -1.427 -0.166 1.00 0.11 H new ATOM 0 H42 DC B 17 3.766 -2.293 0.889 1.00 0.11 H new ATOM 0 H5 DC B 17 6.877 -0.283 0.709 1.00 0.09 H new ATOM 0 H6 DC B 17 8.142 0.227 2.740 1.00 0.09 H new ATOM 532 P DG B 18 10.337 -2.566 7.938 1.00 0.11 P ATOM 533 OP1 DG B 18 10.898 -2.531 9.307 1.00 0.16 O ATOM 534 OP2 DG B 18 10.878 -3.521 6.943 1.00 0.17 O ATOM 535 O5' DG B 18 8.741 -2.794 8.050 1.00 0.10 O ATOM 536 C5' DG B 18 7.878 -1.834 8.693 1.00 0.10 C ATOM 537 C4' DG B 18 6.481 -2.346 8.928 1.00 0.09 C ATOM 538 O4' DG B 18 5.753 -2.672 7.735 1.00 0.10 O ATOM 539 C3' DG B 18 6.530 -3.600 9.806 1.00 0.10 C ATOM 540 O3' DG B 18 5.783 -3.459 11.029 1.00 0.12 O ATOM 541 C2' DG B 18 6.023 -4.614 8.825 1.00 0.11 C ATOM 542 C1' DG B 18 5.001 -3.858 8.015 1.00 0.10 C ATOM 543 N9 DG B 18 4.701 -4.513 6.736 1.00 0.09 N ATOM 544 C8 DG B 18 5.642 -4.941 5.881 1.00 0.10 C ATOM 545 N7 DG B 18 5.159 -5.474 4.745 1.00 0.11 N ATOM 546 C5 DG B 18 3.816 -5.374 4.910 1.00 0.10 C ATOM 547 C6 DG B 18 2.775 -5.776 4.035 1.00 0.10 C ATOM 548 O6 DG B 18 2.844 -6.297 2.927 1.00 0.13 O ATOM 549 N1 DG B 18 1.535 -5.511 4.556 1.00 0.08 N ATOM 550 C2 DG B 18 1.295 -4.931 5.772 1.00 0.08 C ATOM 551 N2 DG B 18 0.019 -4.786 6.096 1.00 0.10 N ATOM 552 N3 DG B 18 2.256 -4.537 6.615 1.00 0.08 N ATOM 553 C4 DG B 18 3.497 -4.791 6.120 1.00 0.08 C ATOM 0 H5' DG B 18 7.828 -0.934 8.080 1.00 0.10 H new ATOM 0 H5'' DG B 18 8.316 -1.546 9.648 1.00 0.10 H new ATOM 0 H4' DG B 18 5.954 -1.523 9.411 1.00 0.09 H new ATOM 0 H3' DG B 18 7.503 -3.863 10.220 1.00 0.10 H new ATOM 0 H2' DG B 18 6.826 -4.998 8.196 1.00 0.11 H new ATOM 0 H2'' DG B 18 5.577 -5.471 9.331 1.00 0.11 H new ATOM 0 H1' DG B 18 4.043 -3.743 8.523 1.00 0.10 H new ATOM 0 H8 DG B 18 6.699 -4.864 6.088 1.00 0.10 H new ATOM 0 H1 DG B 18 0.725 -5.767 3.991 1.00 0.08 H new ATOM 0 H21 DG B 18 -0.236 -4.361 6.988 1.00 0.10 H new ATOM 0 H22 DG B 18 -0.709 -5.099 5.454 1.00 0.10 H new ATOM 565 P DA B 19 5.240 -4.689 11.929 1.00 0.14 P ATOM 566 OP1 DA B 19 5.236 -4.265 13.348 1.00 0.18 O ATOM 567 OP2 DA B 19 5.946 -5.928 11.529 1.00 0.18 O ATOM 568 O5' DA B 19 3.715 -4.794 11.422 1.00 0.17 O ATOM 569 C5' DA B 19 2.764 -3.742 11.670 1.00 0.16 C ATOM 570 C4' DA B 19 1.324 -4.228 11.501 1.00 0.12 C ATOM 571 O4' DA B 19 1.042 -4.652 10.158 1.00 0.12 O ATOM 572 C3' DA B 19 0.986 -5.358 12.441 1.00 0.12 C ATOM 573 O3' DA B 19 -0.351 -5.240 12.945 1.00 0.14 O ATOM 574 C2' DA B 19 1.240 -6.495 11.531 1.00 0.10 C ATOM 575 C1' DA B 19 0.751 -6.051 10.179 1.00 0.09 C ATOM 576 N9 DA B 19 1.548 -6.661 9.100 1.00 0.08 N ATOM 577 C8 DA B 19 2.900 -6.694 9.023 1.00 0.10 C ATOM 578 N7 DA B 19 3.377 -7.296 7.921 1.00 0.10 N ATOM 579 C5 DA B 19 2.246 -7.662 7.268 1.00 0.08 C ATOM 580 C6 DA B 19 2.051 -8.326 6.059 1.00 0.09 C ATOM 581 N6 DA B 19 3.074 -8.721 5.312 1.00 0.09 N ATOM 582 N1 DA B 19 0.792 -8.553 5.662 1.00 0.09 N ATOM 583 C2 DA B 19 -0.215 -8.140 6.426 1.00 0.09 C ATOM 584 N3 DA B 19 -0.160 -7.503 7.587 1.00 0.08 N ATOM 585 C4 DA B 19 1.120 -7.290 7.958 1.00 0.08 C ATOM 0 H5' DA B 19 2.951 -2.914 10.986 1.00 0.16 H new ATOM 0 H5'' DA B 19 2.902 -3.358 12.681 1.00 0.16 H new ATOM 0 H4' DA B 19 0.704 -3.364 11.740 1.00 0.12 H new ATOM 0 H3' DA B 19 1.549 -5.423 13.372 1.00 0.12 H new ATOM 0 H2' DA B 19 2.301 -6.744 11.501 1.00 0.10 H new ATOM 0 H2'' DA B 19 0.712 -7.389 11.864 1.00 0.10 H new ATOM 0 H1' DA B 19 -0.296 -6.315 10.031 1.00 0.09 H new ATOM 0 H8 DA B 19 3.540 -6.272 9.783 1.00 0.10 H new ATOM 0 H61 DA B 19 2.905 -9.206 4.431 1.00 0.09 H new ATOM 0 H62 DA B 19 4.030 -8.540 5.619 1.00 0.09 H new ATOM 0 H2 DA B 19 -1.206 -8.351 6.052 1.00 0.09 H new ATOM 597 P DT B 20 -1.038 -6.349 13.890 1.00 0.15 P ATOM 598 OP1 DT B 20 -2.147 -5.697 14.624 1.00 0.18 O ATOM 599 OP2 DT B 20 0.025 -7.053 14.643 1.00 0.18 O ATOM 600 O5' DT B 20 -1.662 -7.366 12.807 1.00 0.13 O ATOM 601 C5' DT B 20 -2.809 -7.013 12.015 1.00 0.12 C ATOM 602 C4' DT B 20 -3.212 -8.134 11.057 1.00 0.10 C ATOM 603 O4' DT B 20 -2.208 -8.403 10.060 1.00 0.09 O ATOM 604 C3' DT B 20 -3.563 -9.422 11.780 1.00 0.12 C ATOM 605 O3' DT B 20 -4.851 -9.896 11.375 1.00 0.16 O ATOM 606 C2' DT B 20 -2.396 -10.278 11.334 1.00 0.11 C ATOM 607 C1' DT B 20 -2.118 -9.821 9.903 1.00 0.09 C ATOM 608 N1 DT B 20 -0.772 -10.139 9.362 1.00 0.07 N ATOM 609 C2 DT B 20 -0.654 -10.716 8.108 1.00 0.09 C ATOM 610 O2 DT B 20 -1.609 -11.018 7.402 1.00 0.11 O ATOM 611 N3 DT B 20 0.632 -10.949 7.671 1.00 0.09 N ATOM 612 C4 DT B 20 1.792 -10.665 8.354 1.00 0.09 C ATOM 613 O4 DT B 20 2.869 -10.923 7.828 1.00 0.11 O ATOM 614 C5 DT B 20 1.569 -10.070 9.651 1.00 0.09 C ATOM 615 C7 DT B 20 2.701 -9.665 10.588 1.00 0.12 C ATOM 616 C6 DT B 20 0.337 -9.839 10.089 1.00 0.09 C ATOM 0 H5' DT B 20 -2.591 -6.110 11.445 1.00 0.12 H new ATOM 0 H5'' DT B 20 -3.646 -6.781 12.673 1.00 0.12 H new ATOM 0 H4' DT B 20 -4.106 -7.764 10.554 1.00 0.10 H new ATOM 0 H3' DT B 20 -3.668 -9.373 12.864 1.00 0.12 H new ATOM 0 H2' DT B 20 -1.527 -10.130 11.975 1.00 0.11 H new ATOM 0 H2'' DT B 20 -2.643 -11.339 11.372 1.00 0.11 H new ATOM 0 H1' DT B 20 -2.796 -10.311 9.204 1.00 0.09 H new ATOM 0 H3 DT B 20 0.734 -11.374 6.750 1.00 0.09 H new ATOM 0 H71 DT B 20 2.384 -8.817 11.196 1.00 0.12 H new ATOM 0 H72 DT B 20 2.953 -10.503 11.237 1.00 0.12 H new ATOM 0 H73 DT B 20 3.576 -9.384 10.002 1.00 0.12 H new ATOM 0 H6 DT B 20 0.210 -9.394 11.065 1.00 0.09 H new ATOM 629 P DG B 21 -5.537 -11.157 12.106 1.00 0.20 P ATOM 630 OP1 DG B 21 -6.988 -11.128 11.815 1.00 0.28 O ATOM 631 OP2 DG B 21 -5.068 -11.203 13.510 1.00 0.25 O ATOM 632 O5' DG B 21 -4.860 -12.377 11.302 1.00 0.18 O ATOM 633 C5' DG B 21 -5.394 -12.840 10.053 1.00 0.18 C ATOM 634 C4' DG B 21 -4.545 -13.938 9.422 1.00 0.15 C ATOM 635 O4' DG B 21 -3.290 -13.516 8.879 1.00 0.15 O ATOM 636 C3' DG B 21 -4.247 -15.068 10.407 1.00 0.10 C ATOM 637 O3' DG B 21 -5.183 -16.153 10.254 1.00 0.11 O ATOM 638 C2' DG B 21 -2.783 -15.345 10.096 1.00 0.11 C ATOM 639 C1' DG B 21 -2.521 -14.722 8.760 1.00 0.12 C ATOM 640 N9 DG B 21 -1.113 -14.354 8.602 1.00 0.12 N ATOM 641 C8 DG B 21 -0.382 -13.630 9.469 1.00 0.13 C ATOM 642 N7 DG B 21 0.896 -13.436 9.078 1.00 0.12 N ATOM 643 C5 DG B 21 0.953 -14.086 7.884 1.00 0.11 C ATOM 644 C6 DG B 21 2.039 -14.240 6.979 1.00 0.12 C ATOM 645 O6 DG B 21 3.190 -13.820 7.052 1.00 0.14 O ATOM 646 N1 DG B 21 1.685 -14.974 5.871 1.00 0.11 N ATOM 647 C2 DG B 21 0.442 -15.507 5.641 1.00 0.11 C ATOM 648 N2 DG B 21 0.279 -16.194 4.524 1.00 0.12 N ATOM 649 N3 DG B 21 -0.587 -15.375 6.473 1.00 0.11 N ATOM 650 C4 DG B 21 -0.262 -14.655 7.572 1.00 0.11 C ATOM 0 H5' DG B 21 -5.469 -12.001 9.361 1.00 0.18 H new ATOM 0 H5'' DG B 21 -6.406 -13.214 10.211 1.00 0.18 H new ATOM 0 H4' DG B 21 -5.172 -14.274 8.596 1.00 0.15 H new ATOM 0 H3' DG B 21 -4.377 -14.851 11.467 1.00 0.10 H new ATOM 0 H2' DG B 21 -2.134 -14.917 10.860 1.00 0.11 H new ATOM 0 H2'' DG B 21 -2.585 -16.417 10.073 1.00 0.11 H new ATOM 0 H1' DG B 21 -2.764 -15.375 7.922 1.00 0.12 H new ATOM 0 H8 DG B 21 -0.781 -13.240 10.394 1.00 0.13 H new ATOM 0 H1 DG B 21 2.403 -15.135 5.165 1.00 0.11 H new ATOM 0 H21 DG B 21 -0.627 -16.610 4.309 1.00 0.12 H new ATOM 0 H22 DG B 21 1.059 -16.309 3.877 1.00 0.12 H new ATOM 662 P DG B 22 -4.852 -17.734 10.325 1.00 0.12 P ATOM 663 OP1 DG B 22 -6.127 -18.476 10.449 1.00 0.19 O ATOM 664 OP2 DG B 22 -3.770 -17.955 11.312 1.00 0.16 O ATOM 665 O5' DG B 22 -4.244 -18.019 8.855 1.00 0.10 O ATOM 666 C5' DG B 22 -5.032 -17.888 7.658 1.00 0.12 C ATOM 667 C4' DG B 22 -4.546 -18.802 6.520 1.00 0.11 C ATOM 668 O4' DG B 22 -3.224 -18.485 6.055 1.00 0.13 O ATOM 669 C3' DG B 22 -4.539 -20.262 6.866 1.00 0.12 C ATOM 670 O3' DG B 22 -4.585 -21.028 5.665 1.00 0.15 O ATOM 671 C2' DG B 22 -3.195 -20.337 7.463 1.00 0.13 C ATOM 672 C1' DG B 22 -2.334 -19.494 6.558 1.00 0.14 C ATOM 673 N9 DG B 22 -1.252 -18.815 7.282 1.00 0.13 N ATOM 674 C8 DG B 22 -1.297 -18.231 8.505 1.00 0.12 C ATOM 675 N7 DG B 22 -0.134 -17.660 8.880 1.00 0.14 N ATOM 676 C5 DG B 22 0.682 -17.908 7.822 1.00 0.13 C ATOM 677 C6 DG B 22 2.043 -17.555 7.620 1.00 0.13 C ATOM 678 O6 DG B 22 2.810 -16.923 8.342 1.00 0.14 O ATOM 679 N1 DG B 22 2.507 -18.000 6.404 1.00 0.14 N ATOM 680 C2 DG B 22 1.772 -18.699 5.479 1.00 0.14 C ATOM 681 N2 DG B 22 2.369 -19.054 4.356 1.00 0.16 N ATOM 682 N3 DG B 22 0.500 -19.036 5.649 1.00 0.13 N ATOM 683 C4 DG B 22 0.022 -18.610 6.839 1.00 0.13 C ATOM 0 H5' DG B 22 -5.004 -16.851 7.322 1.00 0.12 H new ATOM 0 H5'' DG B 22 -6.072 -18.121 7.886 1.00 0.12 H new ATOM 0 H4' DG B 22 -5.282 -18.611 5.739 1.00 0.11 H new ATOM 0 H3' DG B 22 -5.357 -20.621 7.490 1.00 0.12 H new ATOM 0 H2' DG B 22 -3.192 -19.954 8.484 1.00 0.13 H new ATOM 0 H2'' DG B 22 -2.837 -21.366 7.507 1.00 0.13 H new ATOM 0 HO3' DG B 22 -4.579 -21.983 5.886 1.00 0.15 H new ATOM 0 H1' DG B 22 -1.867 -20.116 5.794 1.00 0.14 H new ATOM 0 H8 DG B 22 -2.183 -18.224 9.122 1.00 0.12 H new ATOM 0 H1 DG B 22 3.478 -17.793 6.170 1.00 0.14 H new ATOM 0 H21 DG B 22 1.853 -19.574 3.647 1.00 0.16 H new ATOM 0 H22 DG B 22 3.346 -18.808 4.198 1.00 0.16 H new TER 696 DG B 22 HETATM 697 C1 BPJ A 25 1.839 -0.806 6.924 1.00 0.06 C HETATM 698 C2 BPJ A 25 1.687 -1.505 8.305 1.00 0.07 C HETATM 699 O2 BPJ A 25 0.588 -2.391 8.500 1.00 0.09 O HETATM 700 C3 BPJ A 25 1.555 -0.422 9.402 1.00 0.08 C HETATM 701 O3 BPJ A 25 0.554 0.557 9.109 1.00 0.10 O HETATM 702 C4 BPJ A 25 2.928 0.309 9.484 1.00 0.08 C HETATM 703 O4 BPJ A 25 3.913 -0.495 10.140 1.00 0.11 O HETATM 704 C5 BPJ A 25 4.621 1.472 8.154 1.00 0.08 C HETATM 705 C6 BPJ A 25 5.168 1.905 6.941 1.00 0.08 C HETATM 706 C7 BPJ A 25 5.104 1.991 4.575 1.00 0.09 C HETATM 707 C8 BPJ A 25 4.518 1.710 3.324 1.00 0.10 C HETATM 708 C9 BPJ A 25 2.487 1.243 2.042 1.00 0.11 C HETATM 709 C10 BPJ A 25 1.088 1.079 2.025 1.00 0.10 C HETATM 710 C11 BPJ A 25 0.378 1.009 3.238 1.00 0.09 C HETATM 711 C12 BPJ A 25 1.080 1.029 4.455 1.00 0.08 C HETATM 712 C13 BPJ A 25 2.785 0.305 6.948 1.00 0.06 C HETATM 713 C14 BPJ A 25 3.452 0.663 8.177 1.00 0.07 C HETATM 714 C15 BPJ A 25 4.477 1.634 5.760 1.00 0.07 C HETATM 715 C16 BPJ A 25 3.229 0.976 5.750 1.00 0.06 C HETATM 716 C17 BPJ A 25 2.497 1.101 4.523 1.00 0.07 C HETATM 717 C18 BPJ A 25 3.164 1.310 3.279 1.00 0.09 C HETATM 0 H11A BPJ A 25 0.865 -0.440 6.599 1.00 0.06 H new HETATM 0 HO4 BPJ A 25 4.558 0.085 10.595 1.00 0.11 H new HETATM 0 HO3 BPJ A 25 0.515 1.213 9.836 1.00 0.10 H new HETATM 0 HO2 BPJ A 25 0.862 -3.129 9.084 1.00 0.09 H new HETATM 0 H9 BPJ A 25 3.043 1.318 1.107 1.00 0.11 H new HETATM 0 H8 BPJ A 25 5.100 1.800 2.407 1.00 0.10 H new HETATM 0 H7 BPJ A 25 6.068 2.498 4.612 1.00 0.09 H new HETATM 0 H6 BPJ A 25 6.115 2.443 6.919 1.00 0.08 H new HETATM 0 H5 BPJ A 25 5.097 1.758 9.092 1.00 0.08 H new HETATM 0 H4 BPJ A 25 2.734 1.217 10.054 1.00 0.08 H new HETATM 0 H3 BPJ A 25 1.267 -0.912 10.332 1.00 0.08 H new HETATM 0 H2 BPJ A 25 2.581 -2.127 8.355 1.00 0.07 H new HETATM 0 H12 BPJ A 25 0.514 0.988 5.385 1.00 0.08 H new HETATM 0 H11 BPJ A 25 -0.710 0.940 3.233 1.00 0.09 H new HETATM 0 H10 BPJ A 25 0.557 1.007 1.076 1.00 0.10 H new