USER MOD reduce.3.24.130724 H: found=0, std=0, add=279, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 279 hydrogens (9 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 25 GIQH102 : A 25 GIQ N10 : A 4 DG C8 :(H bumps) USER MOD NoAdj-H: A 25 GIQH101 : A 25 GIQ N10 : A 4 DG C8 :(H bumps) USER MOD Single : A 1 DC O5' : rot 180:sc= -1.11! USER MOD Single : A 2 DT C7 :methyl 150:sc= -5.09! (180deg=-5.09!) USER MOD Single : A 11 DT C7 :methyl 150:sc= -3.82! (180deg=-3.82!) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : B 13 DG O5' : rot 180:sc= -0.261 USER MOD Single : B 15 DT C7 :methyl 150:sc= -2.32 (180deg=-2.32) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 5.563 -7.756 1.217 1.00 0.19 O ATOM 2 C5' DC A 1 5.743 -7.126 -0.060 1.00 0.21 C ATOM 3 C4' DC A 1 6.183 -5.699 0.026 1.00 0.20 C ATOM 4 O4' DC A 1 5.124 -4.778 -0.232 1.00 0.18 O ATOM 5 C3' DC A 1 6.571 -5.586 1.416 1.00 0.17 C ATOM 6 O3' DC A 1 7.983 -5.580 1.628 1.00 0.21 O ATOM 7 C2' DC A 1 5.832 -4.399 1.914 1.00 0.13 C ATOM 8 C1' DC A 1 5.335 -3.710 0.677 1.00 0.16 C ATOM 9 N1 DC A 1 4.019 -3.294 1.034 1.00 0.16 N ATOM 10 C2 DC A 1 3.612 -1.973 1.037 1.00 0.19 C ATOM 11 O2 DC A 1 4.373 -1.067 0.695 1.00 0.21 O ATOM 12 N3 DC A 1 2.332 -1.730 1.442 1.00 0.22 N ATOM 13 C4 DC A 1 1.525 -2.742 1.818 1.00 0.22 C ATOM 14 N4 DC A 1 0.279 -2.477 2.207 1.00 0.27 N ATOM 15 C5 DC A 1 1.994 -4.097 1.802 1.00 0.18 C ATOM 16 C6 DC A 1 3.222 -4.309 1.406 1.00 0.15 C ATOM 0 H5' DC A 1 4.805 -7.174 -0.614 1.00 0.21 H new ATOM 0 H5'' DC A 1 6.480 -7.690 -0.632 1.00 0.21 H new ATOM 0 H4' DC A 1 6.959 -5.466 -0.703 1.00 0.20 H new ATOM 0 H3' DC A 1 6.300 -6.469 1.995 1.00 0.17 H new ATOM 0 H2' DC A 1 5.006 -4.691 2.563 1.00 0.13 H new ATOM 0 H2'' DC A 1 6.480 -3.745 2.497 1.00 0.13 H new ATOM 0 HO5' DC A 1 5.275 -8.683 1.086 1.00 0.19 H new ATOM 0 H1' DC A 1 5.977 -2.913 0.301 1.00 0.16 H new ATOM 0 H41 DC A 1 -0.338 -3.237 2.493 1.00 0.27 H new ATOM 0 H42 DC A 1 -0.058 -1.514 2.219 1.00 0.27 H new ATOM 0 H5 DC A 1 1.356 -4.913 2.106 1.00 0.18 H new ATOM 0 H6 DC A 1 3.603 -5.319 1.378 1.00 0.15 H new ATOM 29 P DT A 2 8.620 -6.159 2.986 1.00 0.19 P ATOM 30 OP1 DT A 2 9.967 -6.688 2.678 1.00 0.25 O ATOM 31 OP2 DT A 2 7.616 -7.028 3.641 1.00 0.20 O ATOM 32 O5' DT A 2 8.788 -4.829 3.869 1.00 0.19 O ATOM 33 C5' DT A 2 9.738 -3.822 3.506 1.00 0.19 C ATOM 34 C4' DT A 2 9.310 -2.466 4.025 1.00 0.15 C ATOM 35 O4' DT A 2 7.963 -2.183 3.663 1.00 0.12 O ATOM 36 C3' DT A 2 9.353 -2.498 5.538 1.00 0.15 C ATOM 37 O3' DT A 2 10.360 -1.620 6.048 1.00 0.18 O ATOM 38 C2' DT A 2 7.976 -2.123 5.974 1.00 0.11 C ATOM 39 C1' DT A 2 7.360 -1.478 4.754 1.00 0.09 C ATOM 40 N1 DT A 2 5.948 -1.818 4.698 1.00 0.07 N ATOM 41 C2 DT A 2 4.973 -0.842 4.711 1.00 0.09 C ATOM 42 O2 DT A 2 5.229 0.357 4.754 1.00 0.11 O ATOM 43 N3 DT A 2 3.672 -1.312 4.663 1.00 0.12 N ATOM 44 C4 DT A 2 3.286 -2.647 4.605 1.00 0.13 C ATOM 45 O4 DT A 2 2.098 -2.955 4.570 1.00 0.17 O ATOM 46 C5 DT A 2 4.400 -3.574 4.588 1.00 0.10 C ATOM 47 C7 DT A 2 4.173 -5.079 4.510 1.00 0.12 C ATOM 48 C6 DT A 2 5.653 -3.131 4.632 1.00 0.08 C ATOM 0 H5' DT A 2 9.839 -3.786 2.421 1.00 0.19 H new ATOM 0 H5'' DT A 2 10.718 -4.078 3.909 1.00 0.19 H new ATOM 0 H4' DT A 2 9.976 -1.713 3.603 1.00 0.15 H new ATOM 0 H3' DT A 2 9.626 -3.479 5.926 1.00 0.15 H new ATOM 0 H2' DT A 2 7.408 -2.997 6.291 1.00 0.11 H new ATOM 0 H2'' DT A 2 8.000 -1.434 6.819 1.00 0.11 H new ATOM 0 H1' DT A 2 7.494 -0.396 4.747 1.00 0.09 H new ATOM 0 H3 DT A 2 2.927 -0.615 4.671 1.00 0.12 H new ATOM 0 H71 DT A 2 5.011 -5.547 3.994 1.00 0.12 H new ATOM 0 H72 DT A 2 4.093 -5.488 5.517 1.00 0.12 H new ATOM 0 H73 DT A 2 3.252 -5.280 3.963 1.00 0.12 H new ATOM 0 H6 DT A 2 6.461 -3.847 4.614 1.00 0.08 H new ATOM 61 P DC A 3 10.521 -1.384 7.630 1.00 0.20 P ATOM 62 OP1 DC A 3 11.889 -0.882 7.892 1.00 0.26 O ATOM 63 OP2 DC A 3 10.019 -2.581 8.341 1.00 0.24 O ATOM 64 O5' DC A 3 9.487 -0.184 7.865 1.00 0.18 O ATOM 65 C5' DC A 3 9.454 0.900 6.937 1.00 0.15 C ATOM 66 C4' DC A 3 8.084 1.564 6.892 1.00 0.11 C ATOM 67 O4' DC A 3 7.021 0.655 6.532 1.00 0.09 O ATOM 68 C3' DC A 3 7.728 2.106 8.278 1.00 0.12 C ATOM 69 O3' DC A 3 7.642 3.538 8.286 1.00 0.15 O ATOM 70 C2' DC A 3 6.397 1.472 8.592 1.00 0.11 C ATOM 71 C1' DC A 3 5.859 1.057 7.285 1.00 0.09 C ATOM 72 N1 DC A 3 4.912 -0.024 7.476 1.00 0.09 N ATOM 73 C2 DC A 3 3.552 0.238 7.414 1.00 0.10 C ATOM 74 O2 DC A 3 3.133 1.382 7.196 1.00 0.12 O ATOM 75 N3 DC A 3 2.703 -0.805 7.609 1.00 0.13 N ATOM 76 C4 DC A 3 3.173 -2.039 7.846 1.00 0.13 C ATOM 77 N4 DC A 3 2.314 -3.040 8.026 1.00 0.16 N ATOM 78 C5 DC A 3 4.584 -2.285 7.910 1.00 0.11 C ATOM 79 C6 DC A 3 5.397 -1.230 7.717 1.00 0.09 C ATOM 0 H5' DC A 3 9.714 0.536 5.943 1.00 0.15 H new ATOM 0 H5'' DC A 3 10.207 1.638 7.213 1.00 0.15 H new ATOM 0 H4' DC A 3 8.160 2.347 6.137 1.00 0.11 H new ATOM 0 H3' DC A 3 8.490 1.866 9.020 1.00 0.12 H new ATOM 0 H2' DC A 3 6.513 0.619 9.261 1.00 0.11 H new ATOM 0 H2'' DC A 3 5.730 2.177 9.088 1.00 0.11 H new ATOM 0 H1' DC A 3 5.312 1.841 6.761 1.00 0.09 H new ATOM 0 H41 DC A 3 2.660 -3.982 8.207 1.00 0.16 H new ATOM 0 H42 DC A 3 1.310 -2.864 7.983 1.00 0.16 H new ATOM 0 H5 DC A 3 4.977 -3.272 8.104 1.00 0.11 H new ATOM 0 H6 DC A 3 6.467 -1.371 7.760 1.00 0.09 H new ATOM 91 P DG A 4 6.913 4.318 9.498 1.00 0.16 P ATOM 92 OP1 DG A 4 5.457 4.315 9.228 1.00 0.20 O ATOM 93 OP2 DG A 4 7.618 5.601 9.709 1.00 0.23 O ATOM 94 O5' DG A 4 7.207 3.365 10.778 1.00 0.15 O ATOM 95 C5' DG A 4 6.148 2.693 11.490 1.00 0.13 C ATOM 96 C4' DG A 4 5.004 3.645 11.838 1.00 0.11 C ATOM 97 O4' DG A 4 3.722 3.150 11.329 1.00 0.14 O ATOM 98 C3' DG A 4 4.848 3.774 13.343 1.00 0.11 C ATOM 99 O3' DG A 4 4.387 5.106 13.725 1.00 0.12 O ATOM 100 C2' DG A 4 3.768 2.744 13.652 1.00 0.12 C ATOM 101 C1' DG A 4 2.862 2.810 12.456 1.00 0.11 C ATOM 102 N9 DG A 4 2.064 1.551 12.236 1.00 0.12 N ATOM 103 C8 DG A 4 0.845 1.356 11.593 1.00 0.12 C ATOM 104 N7 DG A 4 0.392 0.146 11.578 1.00 0.14 N ATOM 105 C5 DG A 4 1.380 -0.559 12.269 1.00 0.16 C ATOM 106 C6 DG A 4 1.449 -1.944 12.579 1.00 0.20 C ATOM 107 O6 DG A 4 0.642 -2.828 12.299 1.00 0.23 O ATOM 108 N1 DG A 4 2.601 -2.256 13.287 1.00 0.23 N ATOM 109 C2 DG A 4 3.577 -1.353 13.657 1.00 0.22 C ATOM 110 N2 DG A 4 4.618 -1.860 14.344 1.00 0.26 N ATOM 111 N3 DG A 4 3.518 -0.037 13.365 1.00 0.17 N ATOM 112 C4 DG A 4 2.401 0.287 12.674 1.00 0.14 C ATOM 0 H5' DG A 4 6.547 2.254 12.405 1.00 0.13 H new ATOM 0 H5'' DG A 4 5.766 1.872 10.883 1.00 0.13 H new ATOM 0 H4' DG A 4 5.255 4.603 11.383 1.00 0.11 H new ATOM 0 H3' DG A 4 5.785 3.620 13.878 1.00 0.11 H new ATOM 0 H2' DG A 4 4.190 1.747 13.780 1.00 0.12 H new ATOM 0 H2'' DG A 4 3.235 2.986 14.572 1.00 0.12 H new ATOM 0 H1' DG A 4 2.088 3.564 12.599 1.00 0.11 H new ATOM 0 H8 DG A 4 0.307 2.171 11.132 1.00 0.12 H new ATOM 0 H1 DG A 4 2.737 -3.231 13.555 1.00 0.23 H new ATOM 0 H21 DG A 4 5.375 -1.248 14.648 1.00 0.26 H new ATOM 0 H22 DG A 4 4.650 -2.856 14.560 1.00 0.26 H new ATOM 123 P DG A 5 4.580 6.431 12.791 1.00 0.14 P ATOM 124 OP1 DG A 5 4.020 6.146 11.451 1.00 0.22 O ATOM 125 OP2 DG A 5 5.983 6.885 12.920 1.00 0.23 O ATOM 126 O5' DG A 5 3.627 7.529 13.507 1.00 0.12 O ATOM 127 C5' DG A 5 2.794 8.435 12.747 1.00 0.12 C ATOM 128 C4' DG A 5 1.434 8.582 13.421 1.00 0.12 C ATOM 129 O4' DG A 5 0.833 7.316 13.378 1.00 0.11 O ATOM 130 C3' DG A 5 1.514 9.030 14.881 1.00 0.14 C ATOM 131 O3' DG A 5 0.506 10.011 15.174 1.00 0.19 O ATOM 132 C2' DG A 5 1.286 7.756 15.615 1.00 0.14 C ATOM 133 C1' DG A 5 0.384 6.993 14.663 1.00 0.13 C ATOM 134 N9 DG A 5 0.538 5.552 14.743 1.00 0.13 N ATOM 135 C8 DG A 5 1.694 4.851 14.865 1.00 0.14 C ATOM 136 N7 DG A 5 1.638 3.591 14.756 1.00 0.15 N ATOM 137 C5 DG A 5 0.294 3.385 14.526 1.00 0.14 C ATOM 138 C6 DG A 5 -0.363 2.181 14.321 1.00 0.15 C ATOM 139 O6 DG A 5 0.130 1.065 14.351 1.00 0.18 O ATOM 140 N1 DG A 5 -1.721 2.370 14.116 1.00 0.15 N ATOM 141 C2 DG A 5 -2.368 3.582 14.127 1.00 0.14 C ATOM 142 N2 DG A 5 -3.693 3.527 13.916 1.00 0.15 N ATOM 143 N3 DG A 5 -1.741 4.753 14.321 1.00 0.13 N ATOM 144 C4 DG A 5 -0.407 4.577 14.514 1.00 0.13 C ATOM 0 H5' DG A 5 2.667 8.060 11.731 1.00 0.12 H new ATOM 0 H5'' DG A 5 3.278 9.409 12.669 1.00 0.12 H new ATOM 0 H4' DG A 5 0.871 9.353 12.895 1.00 0.12 H new ATOM 0 H3' DG A 5 2.454 9.513 15.148 1.00 0.14 H new ATOM 0 H2' DG A 5 2.218 7.224 15.807 1.00 0.14 H new ATOM 0 H2'' DG A 5 0.810 7.923 16.581 1.00 0.14 H new ATOM 0 H1' DG A 5 -0.647 7.254 14.901 1.00 0.13 H new ATOM 0 H8 DG A 5 2.632 5.353 15.049 1.00 0.14 H new ATOM 0 H1 DG A 5 -2.287 1.540 13.942 1.00 0.15 H new ATOM 0 H21 DG A 5 -4.244 4.385 13.909 1.00 0.15 H new ATOM 0 H22 DG A 5 -4.148 2.627 13.762 1.00 0.15 H new ATOM 156 P DC A 6 0.241 10.519 16.682 1.00 0.22 P ATOM 157 OP1 DC A 6 -0.330 11.883 16.617 1.00 0.30 O ATOM 158 OP2 DC A 6 1.461 10.268 17.482 1.00 0.27 O ATOM 159 O5' DC A 6 -0.910 9.514 17.190 1.00 0.21 O ATOM 160 C5' DC A 6 -2.141 9.394 16.467 1.00 0.22 C ATOM 161 C4' DC A 6 -2.866 8.094 16.803 1.00 0.22 C ATOM 162 O4' DC A 6 -2.006 6.955 16.581 1.00 0.19 O ATOM 163 C3' DC A 6 -3.278 8.055 18.277 1.00 0.22 C ATOM 164 O3' DC A 6 -4.705 7.912 18.358 1.00 0.24 O ATOM 165 C2' DC A 6 -2.579 6.773 18.838 1.00 0.21 C ATOM 166 C1' DC A 6 -2.300 5.974 17.588 1.00 0.19 C ATOM 167 N1 DC A 6 -1.170 5.051 17.770 1.00 0.18 N ATOM 168 C2 DC A 6 -1.392 3.693 17.593 1.00 0.18 C ATOM 169 O2 DC A 6 -2.510 3.276 17.294 1.00 0.19 O ATOM 170 N3 DC A 6 -0.342 2.846 17.760 1.00 0.18 N ATOM 171 C4 DC A 6 0.872 3.311 18.084 1.00 0.18 C ATOM 172 N4 DC A 6 1.879 2.452 18.240 1.00 0.20 N ATOM 173 C5 DC A 6 1.096 4.713 18.265 1.00 0.19 C ATOM 174 C6 DC A 6 0.045 5.535 18.096 1.00 0.18 C ATOM 0 H5' DC A 6 -1.940 9.433 15.396 1.00 0.22 H new ATOM 0 H5'' DC A 6 -2.785 10.241 16.701 1.00 0.22 H new ATOM 0 H4' DC A 6 -3.744 8.053 16.158 1.00 0.22 H new ATOM 0 H3' DC A 6 -2.999 8.953 18.828 1.00 0.22 H new ATOM 0 H2' DC A 6 -1.663 7.014 19.377 1.00 0.21 H new ATOM 0 H2'' DC A 6 -3.223 6.231 19.530 1.00 0.21 H new ATOM 0 H1' DC A 6 -3.148 5.345 17.318 1.00 0.19 H new ATOM 0 H41 DC A 6 2.808 2.794 18.487 1.00 0.20 H new ATOM 0 H42 DC A 6 1.721 1.452 18.113 1.00 0.20 H new ATOM 0 H5 DC A 6 2.071 5.096 18.527 1.00 0.19 H new ATOM 0 H6 DC A 6 0.177 6.599 18.223 1.00 0.18 H new ATOM 186 P DG A 7 -5.451 7.713 19.772 1.00 0.28 P ATOM 187 OP1 DG A 7 -6.715 8.484 19.742 1.00 0.35 O ATOM 188 OP2 DG A 7 -4.472 7.944 20.859 1.00 0.34 O ATOM 189 O5' DG A 7 -5.815 6.144 19.746 1.00 0.21 O ATOM 190 C5' DG A 7 -6.751 5.633 18.790 1.00 0.21 C ATOM 191 C4' DG A 7 -6.960 4.129 18.948 1.00 0.17 C ATOM 192 O4' DG A 7 -5.740 3.399 18.683 1.00 0.17 O ATOM 193 C3' DG A 7 -7.381 3.780 20.372 1.00 0.18 C ATOM 194 O3' DG A 7 -8.499 2.879 20.377 1.00 0.19 O ATOM 195 C2' DG A 7 -6.156 3.157 20.951 1.00 0.17 C ATOM 196 C1' DG A 7 -5.506 2.516 19.793 1.00 0.16 C ATOM 197 N9 DG A 7 -4.070 2.378 20.007 1.00 0.16 N ATOM 198 C8 DG A 7 -3.167 3.358 20.154 1.00 0.17 C ATOM 199 N7 DG A 7 -1.931 3.019 20.317 1.00 0.17 N ATOM 200 C5 DG A 7 -2.017 1.621 20.273 1.00 0.16 C ATOM 201 C6 DG A 7 -0.998 0.638 20.391 1.00 0.18 C ATOM 202 O6 DG A 7 0.207 0.803 20.564 1.00 0.20 O ATOM 203 N1 DG A 7 -1.516 -0.647 20.290 1.00 0.20 N ATOM 204 C2 DG A 7 -2.849 -0.957 20.100 1.00 0.20 C ATOM 205 N2 DG A 7 -3.152 -2.252 20.027 1.00 0.23 N ATOM 206 N3 DG A 7 -3.813 -0.039 19.988 1.00 0.18 N ATOM 207 C4 DG A 7 -3.332 1.221 20.082 1.00 0.16 C ATOM 0 H5' DG A 7 -6.394 5.846 17.782 1.00 0.21 H new ATOM 0 H5'' DG A 7 -7.705 6.147 18.906 1.00 0.21 H new ATOM 0 H4' DG A 7 -7.736 3.852 18.235 1.00 0.17 H new ATOM 0 H3' DG A 7 -7.718 4.644 20.945 1.00 0.18 H new ATOM 0 H2' DG A 7 -5.508 3.902 21.412 1.00 0.17 H new ATOM 0 H2'' DG A 7 -6.404 2.429 21.724 1.00 0.17 H new ATOM 0 H1' DG A 7 -5.905 1.516 19.625 1.00 0.16 H new ATOM 0 H8 DG A 7 -3.463 4.397 20.137 1.00 0.17 H new ATOM 0 H1 DG A 7 -0.859 -1.424 20.362 1.00 0.20 H new ATOM 0 H21 DG A 7 -4.120 -2.542 19.887 1.00 0.23 H new ATOM 0 H22 DG A 7 -2.416 -2.953 20.111 1.00 0.23 H new ATOM 219 P DC A 8 -9.312 2.575 21.734 1.00 0.21 P ATOM 220 OP1 DC A 8 -10.745 2.430 21.391 1.00 0.26 O ATOM 221 OP2 DC A 8 -8.897 3.560 22.758 1.00 0.25 O ATOM 222 O5' DC A 8 -8.748 1.131 22.167 1.00 0.22 O ATOM 223 C5' DC A 8 -9.158 -0.062 21.485 1.00 0.22 C ATOM 224 C4' DC A 8 -8.305 -1.249 21.903 1.00 0.19 C ATOM 225 O4' DC A 8 -6.910 -0.980 21.684 1.00 0.18 O ATOM 226 C3' DC A 8 -8.465 -1.478 23.400 1.00 0.17 C ATOM 227 O3' DC A 8 -8.986 -2.792 23.647 1.00 0.17 O ATOM 228 C2' DC A 8 -7.068 -1.315 23.956 1.00 0.15 C ATOM 229 C1' DC A 8 -6.187 -1.545 22.787 1.00 0.15 C ATOM 230 N1 DC A 8 -4.920 -0.843 22.975 1.00 0.15 N ATOM 231 C2 DC A 8 -3.744 -1.570 23.081 1.00 0.15 C ATOM 232 O2 DC A 8 -3.759 -2.797 23.016 1.00 0.16 O ATOM 233 N3 DC A 8 -2.584 -0.879 23.257 1.00 0.16 N ATOM 234 C4 DC A 8 -2.591 0.461 23.325 1.00 0.15 C ATOM 235 N4 DC A 8 -1.440 1.113 23.498 1.00 0.17 N ATOM 236 C5 DC A 8 -3.817 1.192 23.215 1.00 0.15 C ATOM 237 C6 DC A 8 -4.936 0.500 23.043 1.00 0.16 C ATOM 0 H5' DC A 8 -9.080 0.085 20.408 1.00 0.22 H new ATOM 0 H5'' DC A 8 -10.206 -0.268 21.703 1.00 0.22 H new ATOM 0 H4' DC A 8 -8.626 -2.111 21.317 1.00 0.19 H new ATOM 0 H3' DC A 8 -9.166 -0.786 23.867 1.00 0.17 H new ATOM 0 H2' DC A 8 -6.920 -0.321 24.378 1.00 0.15 H new ATOM 0 H2'' DC A 8 -6.869 -2.032 24.753 1.00 0.15 H new ATOM 0 H1' DC A 8 -5.951 -2.598 22.635 1.00 0.15 H new ATOM 0 H41 DC A 8 -1.434 2.132 23.551 1.00 0.17 H new ATOM 0 H42 DC A 8 -0.566 0.593 23.577 1.00 0.17 H new ATOM 0 H5 DC A 8 -3.831 2.271 23.270 1.00 0.15 H new ATOM 0 H6 DC A 8 -5.876 1.024 22.956 1.00 0.16 H new ATOM 249 P DC A 9 -9.413 -3.266 25.125 1.00 0.16 P ATOM 250 OP1 DC A 9 -10.449 -4.314 24.994 1.00 0.21 O ATOM 251 OP2 DC A 9 -9.682 -2.061 25.942 1.00 0.21 O ATOM 252 O5' DC A 9 -8.065 -3.954 25.673 1.00 0.13 O ATOM 253 C5' DC A 9 -7.530 -5.133 25.054 1.00 0.15 C ATOM 254 C4' DC A 9 -6.226 -5.544 25.721 1.00 0.13 C ATOM 255 O4' DC A 9 -5.262 -4.521 25.484 1.00 0.12 O ATOM 256 C3' DC A 9 -6.427 -5.590 27.232 1.00 0.12 C ATOM 257 O3' DC A 9 -5.977 -6.863 27.715 1.00 0.13 O ATOM 258 C2' DC A 9 -5.560 -4.466 27.756 1.00 0.09 C ATOM 259 C1' DC A 9 -4.534 -4.301 26.697 1.00 0.10 C ATOM 260 N1 DC A 9 -4.000 -2.940 26.636 1.00 0.10 N ATOM 261 C2 DC A 9 -2.630 -2.761 26.722 1.00 0.11 C ATOM 262 O2 DC A 9 -1.884 -3.727 26.867 1.00 0.13 O ATOM 263 N3 DC A 9 -2.144 -1.497 26.627 1.00 0.12 N ATOM 264 C4 DC A 9 -2.966 -0.452 26.458 1.00 0.12 C ATOM 265 N4 DC A 9 -2.448 0.774 26.383 1.00 0.14 N ATOM 266 C5 DC A 9 -4.385 -0.640 26.363 1.00 0.11 C ATOM 267 C6 DC A 9 -4.852 -1.898 26.456 1.00 0.10 C ATOM 0 H5' DC A 9 -7.360 -4.948 23.993 1.00 0.15 H new ATOM 0 H5'' DC A 9 -8.252 -5.946 25.124 1.00 0.15 H new ATOM 0 H4' DC A 9 -5.910 -6.512 25.331 1.00 0.13 H new ATOM 0 H3' DC A 9 -7.464 -5.473 27.545 1.00 0.12 H new ATOM 0 H2' DC A 9 -6.134 -3.552 27.905 1.00 0.09 H new ATOM 0 H2'' DC A 9 -5.110 -4.720 28.716 1.00 0.09 H new ATOM 0 H1' DC A 9 -3.693 -4.971 26.873 1.00 0.10 H new ATOM 0 H41 DC A 9 -3.060 1.579 26.254 1.00 0.14 H new ATOM 0 H42 DC A 9 -1.439 0.907 26.454 1.00 0.14 H new ATOM 0 H5 DC A 9 -5.053 0.197 26.222 1.00 0.11 H new ATOM 0 H6 DC A 9 -5.914 -2.081 26.387 1.00 0.10 H new ATOM 279 P DA A 10 -5.907 -7.213 29.282 1.00 0.14 P ATOM 280 OP1 DA A 10 -6.381 -8.603 29.468 1.00 0.17 O ATOM 281 OP2 DA A 10 -6.538 -6.109 30.040 1.00 0.16 O ATOM 282 O5' DA A 10 -4.316 -7.179 29.563 1.00 0.12 O ATOM 283 C5' DA A 10 -3.400 -7.960 28.773 1.00 0.12 C ATOM 284 C4' DA A 10 -1.984 -7.870 29.301 1.00 0.11 C ATOM 285 O4' DA A 10 -1.335 -6.690 28.780 1.00 0.11 O ATOM 286 C3' DA A 10 -2.001 -7.771 30.790 1.00 0.11 C ATOM 287 O3' DA A 10 -1.156 -8.748 31.414 1.00 0.13 O ATOM 288 C2' DA A 10 -1.602 -6.387 31.055 1.00 0.10 C ATOM 289 C1' DA A 10 -0.726 -6.034 29.889 1.00 0.10 C ATOM 290 N9 DA A 10 -0.878 -4.617 29.718 1.00 0.10 N ATOM 291 C8 DA A 10 -2.047 -4.016 29.596 1.00 0.09 C ATOM 292 N7 DA A 10 -2.061 -2.732 29.474 1.00 0.11 N ATOM 293 C5 DA A 10 -0.687 -2.445 29.524 1.00 0.12 C ATOM 294 C6 DA A 10 0.037 -1.251 29.450 1.00 0.15 C ATOM 295 N6 DA A 10 -0.541 -0.059 29.297 1.00 0.17 N ATOM 296 N1 DA A 10 1.377 -1.335 29.535 1.00 0.17 N ATOM 297 C2 DA A 10 1.974 -2.522 29.685 1.00 0.18 C ATOM 298 N3 DA A 10 1.386 -3.715 29.765 1.00 0.16 N ATOM 299 C4 DA A 10 0.047 -3.603 29.676 1.00 0.12 C ATOM 0 H5' DA A 10 -3.425 -7.614 27.740 1.00 0.12 H new ATOM 0 H5'' DA A 10 -3.721 -9.002 28.769 1.00 0.12 H new ATOM 0 H4' DA A 10 -1.445 -8.764 28.988 1.00 0.11 H new ATOM 0 H3' DA A 10 -2.979 -7.992 31.218 1.00 0.11 H new ATOM 0 H2' DA A 10 -2.467 -5.727 31.119 1.00 0.10 H new ATOM 0 H2'' DA A 10 -1.064 -6.300 31.999 1.00 0.10 H new ATOM 0 H1' DA A 10 0.323 -6.308 30.002 1.00 0.10 H new ATOM 0 H8 DA A 10 -2.966 -4.583 29.598 1.00 0.09 H new ATOM 0 H61 DA A 10 0.032 0.783 29.249 1.00 0.17 H new ATOM 0 H62 DA A 10 -1.556 0.010 29.228 1.00 0.17 H new ATOM 0 H2 DA A 10 3.052 -2.513 29.748 1.00 0.18 H new ATOM 311 P DT A 11 -1.060 -8.877 33.018 1.00 0.16 P ATOM 312 OP1 DT A 11 -0.777 -10.290 33.353 1.00 0.23 O ATOM 313 OP2 DT A 11 -2.235 -8.200 33.613 1.00 0.18 O ATOM 314 O5' DT A 11 0.249 -8.005 33.361 1.00 0.16 O ATOM 315 C5' DT A 11 1.514 -8.313 32.762 1.00 0.15 C ATOM 316 C4' DT A 11 2.579 -7.304 33.172 1.00 0.14 C ATOM 317 O4' DT A 11 2.302 -6.043 32.557 1.00 0.15 O ATOM 318 C3' DT A 11 2.528 -7.064 34.685 1.00 0.13 C ATOM 319 O3' DT A 11 3.719 -7.525 35.336 1.00 0.16 O ATOM 320 C2' DT A 11 2.335 -5.581 34.829 1.00 0.12 C ATOM 321 C1' DT A 11 2.694 -5.023 33.476 1.00 0.13 C ATOM 322 N1 DT A 11 1.838 -3.880 33.225 1.00 0.14 N ATOM 323 C2 DT A 11 2.369 -2.619 33.023 1.00 0.17 C ATOM 324 O2 DT A 11 3.577 -2.391 33.047 1.00 0.19 O ATOM 325 N3 DT A 11 1.429 -1.621 32.789 1.00 0.17 N ATOM 326 C4 DT A 11 0.051 -1.803 32.748 1.00 0.16 C ATOM 327 O4 DT A 11 -0.708 -0.861 32.534 1.00 0.19 O ATOM 328 C5 DT A 11 -0.340 -3.172 32.978 1.00 0.14 C ATOM 329 C7 DT A 11 -1.744 -3.649 32.985 1.00 0.15 C ATOM 330 C6 DT A 11 0.505 -4.100 33.194 1.00 0.13 C ATOM 0 H5' DT A 11 1.413 -8.319 31.677 1.00 0.15 H new ATOM 0 H5'' DT A 11 1.825 -9.315 33.058 1.00 0.15 H new ATOM 0 H4' DT A 11 3.549 -7.698 32.870 1.00 0.14 H new ATOM 0 H3' DT A 11 1.723 -7.621 35.164 1.00 0.13 H new ATOM 0 H2' DT A 11 1.307 -5.338 35.099 1.00 0.12 H new ATOM 0 H2'' DT A 11 2.975 -5.171 35.610 1.00 0.12 H new ATOM 0 H1' DT A 11 3.744 -4.741 33.399 1.00 0.13 H new ATOM 0 H3 DT A 11 1.780 -0.676 32.634 1.00 0.17 H new ATOM 0 H71 DT A 11 -1.778 -4.686 32.651 1.00 0.15 H new ATOM 0 H72 DT A 11 -2.147 -3.580 33.996 1.00 0.15 H new ATOM 0 H73 DT A 11 -2.341 -3.032 32.313 1.00 0.15 H new ATOM 0 H6 DT A 11 0.142 -5.104 33.359 1.00 0.13 H new ATOM 343 P DC A 12 3.848 -7.507 36.943 1.00 0.18 P ATOM 344 OP1 DC A 12 5.027 -8.317 37.323 1.00 0.24 O ATOM 345 OP2 DC A 12 2.522 -7.820 37.520 1.00 0.21 O ATOM 346 O5' DC A 12 4.178 -5.961 37.252 1.00 0.17 O ATOM 347 C5' DC A 12 5.340 -5.335 36.697 1.00 0.19 C ATOM 348 C4' DC A 12 5.435 -3.907 37.056 1.00 0.17 C ATOM 349 O4' DC A 12 4.511 -3.203 36.246 1.00 0.16 O ATOM 350 C3' DC A 12 5.089 -3.612 38.508 1.00 0.17 C ATOM 351 O3' DC A 12 6.222 -3.253 39.304 1.00 0.21 O ATOM 352 C2' DC A 12 4.075 -2.545 38.416 1.00 0.16 C ATOM 353 C1' DC A 12 4.152 -2.077 36.989 1.00 0.15 C ATOM 354 N1 DC A 12 2.816 -1.704 36.587 1.00 0.15 N ATOM 355 C2 DC A 12 2.553 -0.452 36.063 1.00 0.19 C ATOM 356 O2 DC A 12 3.452 0.375 35.926 1.00 0.24 O ATOM 357 N3 DC A 12 1.267 -0.177 35.710 1.00 0.19 N ATOM 358 C4 DC A 12 0.295 -1.095 35.866 1.00 0.16 C ATOM 359 N4 DC A 12 -0.953 -0.789 35.510 1.00 0.18 N ATOM 360 C5 DC A 12 0.581 -2.392 36.411 1.00 0.13 C ATOM 361 C6 DC A 12 1.856 -2.646 36.756 1.00 0.12 C ATOM 0 H5' DC A 12 5.319 -5.433 35.612 1.00 0.19 H new ATOM 0 H5'' DC A 12 6.232 -5.855 37.047 1.00 0.19 H new ATOM 0 H4' DC A 12 6.471 -3.603 36.904 1.00 0.17 H new ATOM 0 H3' DC A 12 4.714 -4.494 39.028 1.00 0.17 H new ATOM 0 H2' DC A 12 3.081 -2.920 38.658 1.00 0.16 H new ATOM 0 H2'' DC A 12 4.288 -1.734 39.112 1.00 0.16 H new ATOM 0 HO3' DC A 12 5.933 -3.075 40.223 1.00 0.21 H new ATOM 0 H1' DC A 12 4.846 -1.247 36.855 1.00 0.15 H new ATOM 0 H41 DC A 12 -1.699 -1.476 35.623 1.00 0.18 H new ATOM 0 H42 DC A 12 -1.162 0.132 35.125 1.00 0.18 H new ATOM 0 H5 DC A 12 -0.195 -3.132 36.539 1.00 0.13 H new ATOM 0 H6 DC A 12 2.117 -3.608 37.171 1.00 0.12 H new TER 374 DC A 12 ATOM 375 O5' DG B 13 -2.131 9.698 34.307 1.00 0.33 O ATOM 376 C5' DG B 13 -1.439 10.519 35.251 1.00 0.30 C ATOM 377 C4' DG B 13 -0.029 10.086 35.451 1.00 0.24 C ATOM 378 O4' DG B 13 -0.002 8.772 36.050 1.00 0.22 O ATOM 379 C3' DG B 13 0.674 9.997 34.115 1.00 0.20 C ATOM 380 O3' DG B 13 2.039 10.429 34.204 1.00 0.19 O ATOM 381 C2' DG B 13 0.558 8.536 33.807 1.00 0.17 C ATOM 382 C1' DG B 13 0.667 7.891 35.141 1.00 0.17 C ATOM 383 N9 DG B 13 -0.001 6.600 35.157 1.00 0.18 N ATOM 384 C8 DG B 13 -1.310 6.382 35.105 1.00 0.21 C ATOM 385 N7 DG B 13 -1.727 5.162 35.146 1.00 0.22 N ATOM 386 C5 DG B 13 -0.517 4.462 35.241 1.00 0.22 C ATOM 387 C6 DG B 13 -0.274 3.066 35.323 1.00 0.25 C ATOM 388 O6 DG B 13 -1.090 2.146 35.324 1.00 0.27 O ATOM 389 N1 DG B 13 1.084 2.790 35.405 1.00 0.27 N ATOM 390 C2 DG B 13 2.091 3.737 35.406 1.00 0.25 C ATOM 391 N2 DG B 13 3.339 3.275 35.491 1.00 0.29 N ATOM 392 N3 DG B 13 1.871 5.054 35.329 1.00 0.20 N ATOM 393 C4 DG B 13 0.553 5.345 35.249 1.00 0.19 C ATOM 0 H5' DG B 13 -1.964 10.492 36.206 1.00 0.30 H new ATOM 0 H5'' DG B 13 -1.454 11.554 34.909 1.00 0.30 H new ATOM 0 H4' DG B 13 0.467 10.811 36.096 1.00 0.24 H new ATOM 0 H3' DG B 13 0.247 10.639 33.344 1.00 0.20 H new ATOM 0 H2' DG B 13 -0.391 8.302 33.324 1.00 0.17 H new ATOM 0 H2'' DG B 13 1.349 8.203 33.134 1.00 0.17 H new ATOM 0 HO5' DG B 13 -3.052 10.018 34.209 1.00 0.33 H new ATOM 0 H1' DG B 13 1.711 7.723 35.404 1.00 0.17 H new ATOM 0 H8 DG B 13 -2.007 7.204 35.030 1.00 0.21 H new ATOM 0 H1 DG B 13 1.361 1.810 35.470 1.00 0.27 H new ATOM 0 H21 DG B 13 4.124 3.926 35.496 1.00 0.29 H new ATOM 0 H22 DG B 13 3.508 2.271 35.551 1.00 0.29 H new ATOM 406 P DA B 14 2.925 10.635 32.876 1.00 0.19 P ATOM 407 OP1 DA B 14 3.931 11.686 33.150 1.00 0.24 O ATOM 408 OP2 DA B 14 2.009 10.776 31.721 1.00 0.24 O ATOM 409 O5' DA B 14 3.690 9.225 32.742 1.00 0.17 O ATOM 410 C5' DA B 14 4.789 8.901 33.601 1.00 0.14 C ATOM 411 C4' DA B 14 5.391 7.546 33.243 1.00 0.13 C ATOM 412 O4' DA B 14 4.479 6.466 33.587 1.00 0.15 O ATOM 413 C3' DA B 14 5.650 7.455 31.735 1.00 0.12 C ATOM 414 O3' DA B 14 6.966 6.946 31.475 1.00 0.14 O ATOM 415 C2' DA B 14 4.587 6.503 31.259 1.00 0.12 C ATOM 416 C1' DA B 14 4.374 5.605 32.445 1.00 0.13 C ATOM 417 N9 DA B 14 3.090 4.946 32.382 1.00 0.13 N ATOM 418 C8 DA B 14 1.925 5.518 32.283 1.00 0.14 C ATOM 419 N7 DA B 14 0.870 4.773 32.230 1.00 0.15 N ATOM 420 C5 DA B 14 1.447 3.500 32.309 1.00 0.15 C ATOM 421 C6 DA B 14 0.916 2.208 32.310 1.00 0.17 C ATOM 422 N6 DA B 14 -0.389 1.955 32.228 1.00 0.18 N ATOM 423 N1 DA B 14 1.785 1.184 32.401 1.00 0.21 N ATOM 424 C2 DA B 14 3.098 1.416 32.486 1.00 0.23 C ATOM 425 N3 DA B 14 3.705 2.596 32.494 1.00 0.20 N ATOM 426 C4 DA B 14 2.814 3.602 32.401 1.00 0.16 C ATOM 0 H5' DA B 14 4.452 8.889 34.638 1.00 0.14 H new ATOM 0 H5'' DA B 14 5.554 9.673 33.523 1.00 0.14 H new ATOM 0 H4' DA B 14 6.322 7.451 33.803 1.00 0.13 H new ATOM 0 H3' DA B 14 5.607 8.420 31.230 1.00 0.12 H new ATOM 0 H2' DA B 14 3.672 7.027 30.981 1.00 0.12 H new ATOM 0 H2'' DA B 14 4.912 5.942 30.383 1.00 0.12 H new ATOM 0 H1' DA B 14 5.106 4.799 32.485 1.00 0.13 H new ATOM 0 H8 DA B 14 1.841 6.594 32.246 1.00 0.14 H new ATOM 0 H61 DA B 14 -0.723 0.991 32.233 1.00 0.18 H new ATOM 0 H62 DA B 14 -1.054 2.725 32.160 1.00 0.18 H new ATOM 0 H2 DA B 14 3.736 0.547 32.556 1.00 0.23 H new ATOM 438 P DT B 15 7.657 7.106 30.027 1.00 0.17 P ATOM 439 OP1 DT B 15 9.020 7.649 30.223 1.00 0.25 O ATOM 440 OP2 DT B 15 6.708 7.802 29.130 1.00 0.21 O ATOM 441 O5' DT B 15 7.790 5.579 29.530 1.00 0.16 O ATOM 442 C5' DT B 15 8.639 4.650 30.217 1.00 0.16 C ATOM 443 C4' DT B 15 8.217 3.208 29.942 1.00 0.15 C ATOM 444 O4' DT B 15 6.837 3.009 30.307 1.00 0.14 O ATOM 445 C3' DT B 15 8.313 2.887 28.444 1.00 0.16 C ATOM 446 O3' DT B 15 9.239 1.813 28.212 1.00 0.17 O ATOM 447 C2' DT B 15 6.911 2.479 28.057 1.00 0.15 C ATOM 448 C1' DT B 15 6.273 2.105 29.351 1.00 0.14 C ATOM 449 N1 DT B 15 4.812 2.232 29.287 1.00 0.14 N ATOM 450 C2 DT B 15 4.048 1.080 29.328 1.00 0.16 C ATOM 451 O2 DT B 15 4.547 -0.041 29.416 1.00 0.19 O ATOM 452 N3 DT B 15 2.681 1.264 29.263 1.00 0.16 N ATOM 453 C4 DT B 15 2.028 2.482 29.163 1.00 0.16 C ATOM 454 O4 DT B 15 0.801 2.531 29.113 1.00 0.18 O ATOM 455 C5 DT B 15 2.920 3.623 29.129 1.00 0.14 C ATOM 456 C7 DT B 15 2.352 5.034 29.022 1.00 0.16 C ATOM 457 C6 DT B 15 4.252 3.457 29.191 1.00 0.13 C ATOM 0 H5' DT B 15 8.603 4.844 31.289 1.00 0.16 H new ATOM 0 H5'' DT B 15 9.672 4.796 29.902 1.00 0.16 H new ATOM 0 H4' DT B 15 8.880 2.568 30.524 1.00 0.15 H new ATOM 0 H3' DT B 15 8.675 3.733 27.860 1.00 0.16 H new ATOM 0 H2' DT B 15 6.378 3.296 27.571 1.00 0.15 H new ATOM 0 H2'' DT B 15 6.917 1.642 27.359 1.00 0.15 H new ATOM 0 H1' DT B 15 6.459 1.064 29.613 1.00 0.14 H new ATOM 0 H3 DT B 15 2.099 0.427 29.291 1.00 0.16 H new ATOM 0 H71 DT B 15 3.022 5.735 29.521 1.00 0.16 H new ATOM 0 H72 DT B 15 2.256 5.309 27.972 1.00 0.16 H new ATOM 0 H73 DT B 15 1.372 5.069 29.497 1.00 0.16 H new ATOM 0 H6 DT B 15 4.892 4.327 29.163 1.00 0.13 H new ATOM 470 P DG B 16 9.476 1.216 26.730 1.00 0.18 P ATOM 471 OP1 DG B 16 10.906 0.854 26.605 1.00 0.22 O ATOM 472 OP2 DG B 16 8.868 2.146 25.750 1.00 0.22 O ATOM 473 O5' DG B 16 8.610 -0.149 26.731 1.00 0.14 O ATOM 474 C5' DG B 16 8.900 -1.201 27.661 1.00 0.16 C ATOM 475 C4' DG B 16 8.054 -2.453 27.401 1.00 0.13 C ATOM 476 O4' DG B 16 6.652 -2.229 27.720 1.00 0.13 O ATOM 477 C3' DG B 16 8.124 -2.851 25.940 1.00 0.12 C ATOM 478 O3' DG B 16 8.253 -4.272 25.804 1.00 0.13 O ATOM 479 C2' DG B 16 6.819 -2.357 25.393 1.00 0.12 C ATOM 480 C1' DG B 16 5.867 -2.538 26.548 1.00 0.12 C ATOM 481 N9 DG B 16 4.725 -1.619 26.435 1.00 0.13 N ATOM 482 C8 DG B 16 4.733 -0.283 26.251 1.00 0.14 C ATOM 483 N7 DG B 16 3.595 0.324 26.191 1.00 0.15 N ATOM 484 C5 DG B 16 2.700 -0.738 26.356 1.00 0.15 C ATOM 485 C6 DG B 16 1.279 -0.737 26.386 1.00 0.17 C ATOM 486 O6 DG B 16 0.511 0.218 26.271 1.00 0.19 O ATOM 487 N1 DG B 16 0.774 -2.016 26.572 1.00 0.17 N ATOM 488 C2 DG B 16 1.534 -3.161 26.714 1.00 0.16 C ATOM 489 N2 DG B 16 0.861 -4.298 26.885 1.00 0.19 N ATOM 490 N3 DG B 16 2.870 -3.172 26.688 1.00 0.14 N ATOM 491 C4 DG B 16 3.387 -1.935 26.507 1.00 0.13 C ATOM 0 H5' DG B 16 8.719 -0.847 28.676 1.00 0.16 H new ATOM 0 H5'' DG B 16 9.957 -1.459 27.597 1.00 0.16 H new ATOM 0 H4' DG B 16 8.459 -3.238 28.039 1.00 0.13 H new ATOM 0 H3' DG B 16 8.984 -2.436 25.416 1.00 0.12 H new ATOM 0 H2' DG B 16 6.882 -1.314 25.083 1.00 0.12 H new ATOM 0 H2'' DG B 16 6.506 -2.930 24.520 1.00 0.12 H new ATOM 0 H1' DG B 16 5.449 -3.544 26.581 1.00 0.12 H new ATOM 0 H8 DG B 16 5.661 0.261 26.157 1.00 0.14 H new ATOM 0 H1 DG B 16 -0.240 -2.119 26.607 1.00 0.17 H new ATOM 0 H21 DG B 16 1.366 -5.178 26.996 1.00 0.19 H new ATOM 0 H22 DG B 16 -0.159 -4.289 26.905 1.00 0.19 H new ATOM 503 P DG B 17 8.484 -4.950 24.363 1.00 0.15 P ATOM 504 OP1 DG B 17 9.489 -6.027 24.514 1.00 0.19 O ATOM 505 OP2 DG B 17 8.702 -3.875 23.368 1.00 0.19 O ATOM 506 O5' DG B 17 7.056 -5.630 24.062 1.00 0.16 O ATOM 507 C5' DG B 17 6.650 -6.817 24.754 1.00 0.17 C ATOM 508 C4' DG B 17 5.324 -7.347 24.215 1.00 0.17 C ATOM 509 O4' DG B 17 4.233 -6.435 24.511 1.00 0.17 O ATOM 510 C3' DG B 17 5.391 -7.490 22.694 1.00 0.16 C ATOM 511 O3' DG B 17 4.890 -8.763 22.266 1.00 0.17 O ATOM 512 C2' DG B 17 4.572 -6.350 22.204 1.00 0.16 C ATOM 513 C1' DG B 17 3.542 -6.156 23.279 1.00 0.16 C ATOM 514 N9 DG B 17 3.119 -4.780 23.285 1.00 0.16 N ATOM 515 C8 DG B 17 3.921 -3.746 23.291 1.00 0.17 C ATOM 516 N7 DG B 17 3.401 -2.562 23.312 1.00 0.17 N ATOM 517 C5 DG B 17 2.032 -2.874 23.322 1.00 0.16 C ATOM 518 C6 DG B 17 0.896 -2.021 23.345 1.00 0.17 C ATOM 519 O6 DG B 17 0.861 -0.793 23.358 1.00 0.18 O ATOM 520 N1 DG B 17 -0.287 -2.750 23.348 1.00 0.17 N ATOM 521 C2 DG B 17 -0.373 -4.130 23.329 1.00 0.18 C ATOM 522 N2 DG B 17 -1.602 -4.647 23.336 1.00 0.22 N ATOM 523 N3 DG B 17 0.691 -4.939 23.307 1.00 0.17 N ATOM 524 C4 DG B 17 1.853 -4.249 23.305 1.00 0.16 C ATOM 0 H5' DG B 17 6.553 -6.605 25.819 1.00 0.17 H new ATOM 0 H5'' DG B 17 7.419 -7.582 24.650 1.00 0.17 H new ATOM 0 H4' DG B 17 5.148 -8.310 24.693 1.00 0.17 H new ATOM 0 H3' DG B 17 6.407 -7.460 22.300 1.00 0.16 H new ATOM 0 H2' DG B 17 5.177 -5.454 22.064 1.00 0.16 H new ATOM 0 H2'' DG B 17 4.109 -6.575 21.243 1.00 0.16 H new ATOM 0 H1' DG B 17 2.668 -6.791 23.135 1.00 0.16 H new ATOM 0 H8 DG B 17 4.993 -3.878 23.279 1.00 0.17 H new ATOM 0 H1 DG B 17 -1.162 -2.225 23.366 1.00 0.17 H new ATOM 0 H21 DG B 17 -1.730 -5.659 23.323 1.00 0.22 H new ATOM 0 H22 DG B 17 -2.414 -4.031 23.355 1.00 0.22 H new ATOM 536 P DC B 18 4.924 -9.197 20.716 1.00 0.19 P ATOM 537 OP1 DC B 18 4.865 -10.675 20.647 1.00 0.23 O ATOM 538 OP2 DC B 18 6.030 -8.472 20.052 1.00 0.22 O ATOM 539 O5' DC B 18 3.532 -8.609 20.164 1.00 0.15 O ATOM 540 C5' DC B 18 2.283 -9.222 20.506 1.00 0.14 C ATOM 541 C4' DC B 18 1.114 -8.425 19.939 1.00 0.12 C ATOM 542 O4' DC B 18 1.028 -7.131 20.548 1.00 0.12 O ATOM 543 C3' DC B 18 1.272 -8.220 18.440 1.00 0.11 C ATOM 544 O3' DC B 18 0.229 -8.920 17.742 1.00 0.12 O ATOM 545 C2' DC B 18 1.132 -6.711 18.254 1.00 0.11 C ATOM 546 C1' DC B 18 0.608 -6.207 19.544 1.00 0.11 C ATOM 547 N1 DC B 18 1.111 -4.854 19.800 1.00 0.12 N ATOM 548 C2 DC B 18 0.200 -3.818 19.939 1.00 0.13 C ATOM 549 O2 DC B 18 -1.008 -4.034 19.868 1.00 0.15 O ATOM 550 N3 DC B 18 0.686 -2.565 20.153 1.00 0.15 N ATOM 551 C4 DC B 18 2.006 -2.346 20.228 1.00 0.14 C ATOM 552 N4 DC B 18 2.453 -1.108 20.442 1.00 0.17 N ATOM 553 C5 DC B 18 2.937 -3.424 20.082 1.00 0.13 C ATOM 554 C6 DC B 18 2.447 -4.644 19.873 1.00 0.12 C ATOM 0 H5' DC B 18 2.191 -9.289 21.590 1.00 0.14 H new ATOM 0 H5'' DC B 18 2.255 -10.241 20.120 1.00 0.14 H new ATOM 0 H4' DC B 18 0.211 -8.999 20.149 1.00 0.12 H new ATOM 0 H3' DC B 18 2.218 -8.596 18.052 1.00 0.11 H new ATOM 0 H2' DC B 18 2.092 -6.253 18.013 1.00 0.11 H new ATOM 0 H2'' DC B 18 0.452 -6.477 17.435 1.00 0.11 H new ATOM 0 H1' DC B 18 -0.480 -6.136 19.537 1.00 0.11 H new ATOM 0 H41 DC B 18 3.456 -0.931 20.501 1.00 0.17 H new ATOM 0 H42 DC B 18 1.792 -0.338 20.547 1.00 0.17 H new ATOM 0 H5 DC B 18 4.002 -3.253 20.140 1.00 0.13 H new ATOM 0 H6 DC B 18 3.124 -5.478 19.760 1.00 0.12 H new ATOM 566 P DG B 19 0.052 -8.795 16.144 1.00 0.12 P ATOM 567 OP1 DG B 19 -0.423 -10.099 15.628 1.00 0.18 O ATOM 568 OP2 DG B 19 1.278 -8.183 15.582 1.00 0.17 O ATOM 569 O5' DG B 19 -1.150 -7.729 16.009 1.00 0.13 O ATOM 570 C5' DG B 19 -2.471 -8.055 16.463 1.00 0.17 C ATOM 571 C4' DG B 19 -3.432 -6.877 16.296 1.00 0.16 C ATOM 572 O4' DG B 19 -2.967 -5.722 17.048 1.00 0.15 O ATOM 573 C3' DG B 19 -3.524 -6.452 14.828 1.00 0.14 C ATOM 574 O3' DG B 19 -4.892 -6.246 14.435 1.00 0.17 O ATOM 575 C2' DG B 19 -2.740 -5.183 14.789 1.00 0.11 C ATOM 576 C1' DG B 19 -2.940 -4.590 16.158 1.00 0.12 C ATOM 577 N9 DG B 19 -1.818 -3.707 16.492 1.00 0.11 N ATOM 578 C8 DG B 19 -0.519 -4.029 16.632 1.00 0.12 C ATOM 579 N7 DG B 19 0.307 -3.085 16.935 1.00 0.14 N ATOM 580 C5 DG B 19 -0.547 -1.979 17.009 1.00 0.13 C ATOM 581 C6 DG B 19 -0.253 -0.624 17.306 1.00 0.16 C ATOM 582 O6 DG B 19 0.836 -0.119 17.569 1.00 0.18 O ATOM 583 N1 DG B 19 -1.397 0.163 17.276 1.00 0.16 N ATOM 584 C2 DG B 19 -2.670 -0.292 16.993 1.00 0.16 C ATOM 585 N2 DG B 19 -3.643 0.619 17.012 1.00 0.18 N ATOM 586 N3 DG B 19 -2.955 -1.568 16.712 1.00 0.14 N ATOM 587 C4 DG B 19 -1.855 -2.354 16.737 1.00 0.12 C ATOM 0 H5' DG B 19 -2.433 -8.348 17.512 1.00 0.17 H new ATOM 0 H5'' DG B 19 -2.846 -8.913 15.905 1.00 0.17 H new ATOM 0 H4' DG B 19 -4.405 -7.207 16.660 1.00 0.16 H new ATOM 0 H3' DG B 19 -3.141 -7.203 14.137 1.00 0.14 H new ATOM 0 H2' DG B 19 -1.686 -5.371 14.585 1.00 0.11 H new ATOM 0 H2'' DG B 19 -3.101 -4.514 14.008 1.00 0.11 H new ATOM 0 H1' DG B 19 -3.849 -3.993 16.224 1.00 0.12 H new ATOM 0 H8 DG B 19 -0.179 -5.045 16.495 1.00 0.12 H new ATOM 0 H1 DG B 19 -1.288 1.157 17.479 1.00 0.16 H new ATOM 0 H21 DG B 19 -4.604 0.343 16.811 1.00 0.18 H new ATOM 0 H22 DG B 19 -3.426 1.592 17.228 1.00 0.18 H new ATOM 599 P DC B 20 -5.282 -5.674 12.975 1.00 0.21 P ATOM 600 OP1 DC B 20 -6.147 -6.670 12.304 1.00 0.29 O ATOM 601 OP2 DC B 20 -4.049 -5.201 12.305 1.00 0.23 O ATOM 602 O5' DC B 20 -6.184 -4.385 13.336 1.00 0.19 O ATOM 603 C5' DC B 20 -7.420 -4.544 14.042 1.00 0.18 C ATOM 604 C4' DC B 20 -8.177 -3.223 14.206 1.00 0.16 C ATOM 605 O4' DC B 20 -7.468 -2.290 15.054 1.00 0.16 O ATOM 606 C3' DC B 20 -8.417 -2.541 12.869 1.00 0.14 C ATOM 607 O3' DC B 20 -9.792 -2.645 12.479 1.00 0.15 O ATOM 608 C2' DC B 20 -8.030 -1.150 13.044 1.00 0.14 C ATOM 609 C1' DC B 20 -7.263 -1.037 14.353 1.00 0.15 C ATOM 610 N1 DC B 20 -5.809 -0.852 14.121 1.00 0.15 N ATOM 611 C2 DC B 20 -5.174 0.397 14.243 1.00 0.14 C ATOM 612 O2 DC B 20 -5.799 1.427 14.508 1.00 0.14 O ATOM 613 N3 DC B 20 -3.818 0.423 14.075 1.00 0.15 N ATOM 614 C4 DC B 20 -3.140 -0.706 13.797 1.00 0.16 C ATOM 615 N4 DC B 20 -1.837 -0.679 13.602 1.00 0.18 N ATOM 616 C5 DC B 20 -3.800 -1.936 13.672 1.00 0.17 C ATOM 617 C6 DC B 20 -5.111 -1.948 13.841 1.00 0.16 C ATOM 0 H5' DC B 20 -7.220 -4.969 15.026 1.00 0.18 H new ATOM 0 H5'' DC B 20 -8.050 -5.256 13.509 1.00 0.18 H new ATOM 0 H4' DC B 20 -9.128 -3.489 14.667 1.00 0.16 H new ATOM 0 H3' DC B 20 -7.835 -3.014 12.078 1.00 0.14 H new ATOM 0 H2' DC B 20 -7.411 -0.819 12.210 1.00 0.14 H new ATOM 0 H2'' DC B 20 -8.911 -0.509 13.062 1.00 0.14 H new ATOM 0 H1' DC B 20 -7.617 -0.175 14.918 1.00 0.15 H new ATOM 0 H41 DC B 20 -1.335 -1.542 13.392 1.00 0.18 H new ATOM 0 H42 DC B 20 -1.331 0.205 13.661 1.00 0.18 H new ATOM 0 H5 DC B 20 -3.257 -2.842 13.446 1.00 0.17 H new ATOM 0 H6 DC B 20 -5.637 -2.887 13.748 1.00 0.16 H new ATOM 629 P DC B 21 -10.290 -3.828 11.502 1.00 0.17 P ATOM 630 OP1 DC B 21 -11.719 -4.090 11.785 1.00 0.22 O ATOM 631 OP2 DC B 21 -9.309 -4.935 11.570 1.00 0.20 O ATOM 632 O5' DC B 21 -10.182 -3.151 10.043 1.00 0.17 O ATOM 633 C5' DC B 21 -10.768 -1.869 9.788 1.00 0.16 C ATOM 634 C4' DC B 21 -9.750 -0.868 9.314 1.00 0.13 C ATOM 635 O4' DC B 21 -8.532 -0.939 10.090 1.00 0.13 O ATOM 636 C3' DC B 21 -9.357 -1.074 7.841 1.00 0.13 C ATOM 637 O3' DC B 21 -9.697 0.087 7.063 1.00 0.14 O ATOM 638 C2' DC B 21 -7.863 -1.277 7.880 1.00 0.14 C ATOM 639 C1' DC B 21 -7.457 -0.660 9.189 1.00 0.12 C ATOM 640 N1 DC B 21 -6.137 -1.143 9.674 1.00 0.14 N ATOM 641 C2 DC B 21 -5.244 -0.183 10.140 1.00 0.17 C ATOM 642 O2 DC B 21 -5.562 1.005 10.149 1.00 0.21 O ATOM 643 N3 DC B 21 -4.023 -0.593 10.579 1.00 0.21 N ATOM 644 C4 DC B 21 -3.684 -1.887 10.564 1.00 0.22 C ATOM 645 N4 DC B 21 -2.479 -2.251 11.005 1.00 0.27 N ATOM 646 C5 DC B 21 -4.594 -2.881 10.087 1.00 0.23 C ATOM 647 C6 DC B 21 -5.801 -2.470 9.653 1.00 0.19 C ATOM 0 H5' DC B 21 -11.243 -1.500 10.697 1.00 0.16 H new ATOM 0 H5'' DC B 21 -11.552 -1.972 9.038 1.00 0.16 H new ATOM 0 H4' DC B 21 -10.232 0.102 9.435 1.00 0.13 H new ATOM 0 H3' DC B 21 -9.877 -1.914 7.380 1.00 0.13 H new ATOM 0 H2' DC B 21 -7.601 -2.334 7.836 1.00 0.14 H new ATOM 0 H2'' DC B 21 -7.370 -0.791 7.038 1.00 0.14 H new ATOM 0 H1' DC B 21 -7.302 0.414 9.091 1.00 0.12 H new ATOM 0 H41 DC B 21 -2.209 -3.235 10.998 1.00 0.27 H new ATOM 0 H42 DC B 21 -1.827 -1.546 11.349 1.00 0.27 H new ATOM 0 H5 DC B 21 -4.323 -3.926 10.075 1.00 0.23 H new ATOM 0 H6 DC B 21 -6.511 -3.195 9.284 1.00 0.19 H new ATOM 659 P DG B 22 -9.026 0.370 5.619 1.00 0.17 P ATOM 660 OP1 DG B 22 -9.956 1.219 4.842 1.00 0.24 O ATOM 661 OP2 DG B 22 -8.571 -0.922 5.056 1.00 0.21 O ATOM 662 O5' DG B 22 -7.714 1.255 5.969 1.00 0.14 O ATOM 663 C5' DG B 22 -7.742 2.246 7.008 1.00 0.13 C ATOM 664 C4' DG B 22 -6.634 3.290 6.849 1.00 0.13 C ATOM 665 O4' DG B 22 -5.375 2.884 7.462 1.00 0.12 O ATOM 666 C3' DG B 22 -6.344 3.524 5.376 1.00 0.13 C ATOM 667 O3' DG B 22 -6.091 4.918 5.139 1.00 0.15 O ATOM 668 C2' DG B 22 -5.119 2.683 5.153 1.00 0.13 C ATOM 669 C1' DG B 22 -4.350 2.837 6.437 1.00 0.12 C ATOM 670 N9 DG B 22 -3.459 1.700 6.684 1.00 0.12 N ATOM 671 C8 DG B 22 -3.795 0.414 6.762 1.00 0.12 C ATOM 672 N7 DG B 22 -2.876 -0.446 7.029 1.00 0.12 N ATOM 673 C5 DG B 22 -1.757 0.376 7.149 1.00 0.13 C ATOM 674 C6 DG B 22 -0.414 0.034 7.438 1.00 0.15 C ATOM 675 O6 DG B 22 0.060 -1.082 7.642 1.00 0.16 O ATOM 676 N1 DG B 22 0.399 1.156 7.468 1.00 0.17 N ATOM 677 C2 DG B 22 -0.018 2.446 7.246 1.00 0.17 C ATOM 678 N2 DG B 22 0.935 3.375 7.321 1.00 0.20 N ATOM 679 N3 DG B 22 -1.285 2.786 6.972 1.00 0.15 N ATOM 680 C4 DG B 22 -2.101 1.705 6.938 1.00 0.13 C ATOM 0 H5' DG B 22 -7.640 1.756 7.976 1.00 0.13 H new ATOM 0 H5'' DG B 22 -8.711 2.745 7.004 1.00 0.13 H new ATOM 0 H4' DG B 22 -7.002 4.188 7.345 1.00 0.13 H new ATOM 0 H3' DG B 22 -7.162 3.262 4.705 1.00 0.13 H new ATOM 0 H2' DG B 22 -5.376 1.641 4.962 1.00 0.13 H new ATOM 0 H2'' DG B 22 -4.543 3.032 4.296 1.00 0.13 H new ATOM 0 H1' DG B 22 -3.713 3.721 6.414 1.00 0.12 H new ATOM 0 H8 DG B 22 -4.816 0.100 6.605 1.00 0.12 H new ATOM 0 H1 DG B 22 1.388 1.012 7.672 1.00 0.17 H new ATOM 0 H21 DG B 22 0.704 4.357 7.168 1.00 0.20 H new ATOM 0 H22 DG B 22 1.896 3.104 7.531 1.00 0.20 H new ATOM 692 P DA B 23 -5.979 5.519 3.650 1.00 0.15 P ATOM 693 OP1 DA B 23 -6.773 6.767 3.595 1.00 0.20 O ATOM 694 OP2 DA B 23 -6.249 4.430 2.684 1.00 0.20 O ATOM 695 O5' DA B 23 -4.420 5.907 3.549 1.00 0.19 O ATOM 696 C5' DA B 23 -3.854 6.956 4.350 1.00 0.15 C ATOM 697 C4' DA B 23 -2.335 6.981 4.206 1.00 0.13 C ATOM 698 O4' DA B 23 -1.784 5.735 4.663 1.00 0.13 O ATOM 699 C3' DA B 23 -1.961 7.132 2.735 1.00 0.13 C ATOM 700 O3' DA B 23 -0.991 8.190 2.607 1.00 0.14 O ATOM 701 C2' DA B 23 -1.394 5.767 2.365 1.00 0.14 C ATOM 702 C1' DA B 23 -0.844 5.267 3.689 1.00 0.13 C ATOM 703 N9 DA B 23 -0.813 3.801 3.759 1.00 0.14 N ATOM 704 C8 DA B 23 -1.835 2.937 3.600 1.00 0.15 C ATOM 705 N7 DA B 23 -1.585 1.679 3.734 1.00 0.17 N ATOM 706 C5 DA B 23 -0.218 1.698 4.023 1.00 0.17 C ATOM 707 C6 DA B 23 0.704 0.682 4.281 1.00 0.19 C ATOM 708 N6 DA B 23 0.379 -0.610 4.290 1.00 0.21 N ATOM 709 N1 DA B 23 1.973 1.047 4.527 1.00 0.21 N ATOM 710 C2 DA B 23 2.319 2.337 4.525 1.00 0.21 C ATOM 711 N3 DA B 23 1.527 3.381 4.291 1.00 0.19 N ATOM 712 C4 DA B 23 0.262 2.988 4.043 1.00 0.16 C ATOM 0 H5' DA B 23 -4.123 6.808 5.396 1.00 0.15 H new ATOM 0 H5'' DA B 23 -4.269 7.917 4.047 1.00 0.15 H new ATOM 0 H4' DA B 23 -1.946 7.814 4.792 1.00 0.13 H new ATOM 0 H3' DA B 23 -2.789 7.402 2.080 1.00 0.13 H new ATOM 0 H2' DA B 23 -2.162 5.103 1.968 1.00 0.14 H new ATOM 0 H2'' DA B 23 -0.616 5.844 1.606 1.00 0.14 H new ATOM 0 H1' DA B 23 0.177 5.618 3.837 1.00 0.13 H new ATOM 0 H8 DA B 23 -2.830 3.287 3.368 1.00 0.15 H new ATOM 0 H61 DA B 23 1.091 -1.314 4.484 1.00 0.21 H new ATOM 0 H62 DA B 23 -0.582 -0.895 4.103 1.00 0.21 H new ATOM 0 H2 DA B 23 3.355 2.557 4.736 1.00 0.21 H new ATOM 724 P DG B 24 -1.085 9.255 1.406 1.00 0.16 P ATOM 725 OP1 DG B 24 -0.381 10.487 1.830 1.00 0.20 O ATOM 726 OP2 DG B 24 -2.496 9.333 0.966 1.00 0.21 O ATOM 727 O5' DG B 24 -0.237 8.574 0.233 1.00 0.14 O ATOM 728 C5' DG B 24 1.169 8.806 0.043 1.00 0.13 C ATOM 729 C4' DG B 24 1.751 7.687 -0.767 1.00 0.13 C ATOM 730 O4' DG B 24 1.776 6.462 0.014 1.00 0.11 O ATOM 731 C3' DG B 24 0.774 7.502 -1.889 1.00 0.14 C ATOM 732 O3' DG B 24 1.388 7.729 -3.162 1.00 0.17 O ATOM 733 C2' DG B 24 0.335 6.089 -1.732 1.00 0.13 C ATOM 734 C1' DG B 24 1.404 5.437 -0.910 1.00 0.11 C ATOM 735 N9 DG B 24 0.819 4.243 -0.352 1.00 0.11 N ATOM 736 C8 DG B 24 -0.446 3.889 -0.490 1.00 0.12 C ATOM 737 N7 DG B 24 -0.826 2.766 0.012 1.00 0.14 N ATOM 738 C5 DG B 24 0.376 2.301 0.565 1.00 0.13 C ATOM 739 C6 DG B 24 0.649 1.107 1.272 1.00 0.16 C ATOM 740 O6 DG B 24 -0.127 0.200 1.566 1.00 0.20 O ATOM 741 N1 DG B 24 1.982 1.033 1.648 1.00 0.16 N ATOM 742 C2 DG B 24 2.943 1.986 1.380 1.00 0.14 C ATOM 743 N2 DG B 24 4.172 1.722 1.824 1.00 0.16 N ATOM 744 N3 DG B 24 2.696 3.119 0.713 1.00 0.11 N ATOM 745 C4 DG B 24 1.400 3.211 0.339 1.00 0.11 C ATOM 0 H5' DG B 24 1.672 8.872 1.008 1.00 0.13 H new ATOM 0 H5'' DG B 24 1.327 9.758 -0.464 1.00 0.13 H new ATOM 0 H4' DG B 24 2.767 7.906 -1.094 1.00 0.13 H new ATOM 0 H3' DG B 24 -0.056 8.207 -1.852 1.00 0.14 H new ATOM 0 H2' DG B 24 -0.634 6.030 -1.237 1.00 0.13 H new ATOM 0 H2'' DG B 24 0.228 5.599 -2.700 1.00 0.13 H new ATOM 0 HO3' DG B 24 0.726 7.599 -3.872 1.00 0.17 H new ATOM 0 H1' DG B 24 2.306 5.096 -1.419 1.00 0.11 H new ATOM 0 H8 DG B 24 -1.145 4.526 -1.011 1.00 0.12 H new ATOM 0 H1 DG B 24 2.276 0.205 2.166 1.00 0.16 H new ATOM 0 H21 DG B 24 4.928 2.387 1.658 1.00 0.16 H new ATOM 0 H22 DG B 24 4.356 0.855 2.329 1.00 0.16 H new TER 758 DG B 24 HETATM 759 N3A GIQ A 25 -0.991 4.207 10.460 1.00 0.09 N HETATM 760 C3A GIQ A 25 -2.160 4.894 10.517 1.00 0.09 C HETATM 761 C1A GIQ A 25 -3.110 4.038 11.091 1.00 0.09 C HETATM 762 N1A GIQ A 25 -2.500 2.805 11.397 1.00 0.10 N HETATM 763 C GIQ A 25 0.228 4.748 9.918 1.00 0.10 C HETATM 764 C4A GIQ A 25 -2.430 6.202 10.106 1.00 0.09 C HETATM 765 C5A GIQ A 25 -3.684 6.668 10.283 1.00 0.09 C HETATM 766 C6A GIQ A 25 -4.709 5.877 10.861 1.00 0.09 C HETATM 767 C10 GIQ A 25 -4.465 4.508 11.288 1.00 0.09 C HETATM 768 N6A GIQ A 25 -5.902 6.492 10.984 1.00 0.11 N HETATM 769 C7A GIQ A 25 -6.874 5.836 11.521 1.00 0.11 C HETATM 770 C8A GIQ A 25 -6.796 4.510 11.965 1.00 0.11 C HETATM 771 C9A GIQ A 25 -5.581 3.790 11.855 1.00 0.10 C HETATM 772 N10 GIQ A 25 0.033 2.309 10.938 1.00 0.11 N HETATM 773 C2A GIQ A 25 -1.230 2.963 11.002 1.00 0.10 C HETATM 0 H9A GIQ A 25 -5.494 2.753 12.180 1.00 0.10 H new HETATM 0 H8A GIQ A 25 -7.674 4.030 12.397 1.00 0.11 H new HETATM 0 H7A GIQ A 25 -7.827 6.352 11.638 1.00 0.11 H new HETATM 0 H5A GIQ A 25 -3.917 7.686 9.971 1.00 0.09 H new HETATM 0 H4A GIQ A 25 -1.655 6.824 9.658 1.00 0.09 H new HETATM 0 H3 GIQ A 25 0.074 5.017 8.873 1.00 0.10 H new HETATM 0 H2 GIQ A 25 0.515 5.635 10.483 1.00 0.10 H new HETATM 0 H1 GIQ A 25 1.020 4.002 9.987 1.00 0.10 H new