USER MOD reduce.3.24.130724 H: found=0, std=0, add=272, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 274 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 4 A O2' : rot -151:sc= 1.12 USER MOD Single : A 5 A O2' : rot 180:sc= -0.21 USER MOD Single : A 6 A O2' : rot -143:sc= -1.6! USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 8 DT C7 :methyl -30:sc= -0.119 (180deg=-1.29!) USER MOD Single : A 9 DT C7 :methyl -30:sc= 0 (180deg=-0.0449) USER MOD Single : A 12 DG O3' : rot 180:sc= 0 USER MOD Single : B 16 A O2' : rot -150:sc= 0.874 USER MOD Single : B 17 A O2' : rot -28:sc= -0.0526 USER MOD Single : B 18 A O2' : rot -140:sc= -1.01! USER MOD Single : B 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 20 DT C7 :methyl -30:sc= -0.561 (180deg=-1.55!) USER MOD Single : B 21 DT C7 :methyl -30:sc= -0.0128 (180deg=-0.066) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 DC A 1 5.695 12.531 6.853 1.00 0.13 O ATOM 2 P DC A 1 4.299 11.873 7.295 1.00 0.08 P ATOM 3 OP1 DC A 1 3.304 12.954 7.481 1.00 0.09 O ATOM 4 OP2 DC A 1 4.012 10.739 6.390 1.00 0.17 O ATOM 5 O5' DC A 1 4.693 11.273 8.736 1.00 0.06 O ATOM 6 C5' DC A 1 5.599 11.949 9.624 1.00 0.07 C ATOM 7 C4' DC A 1 6.713 11.016 10.096 1.00 0.08 C ATOM 8 O4' DC A 1 6.206 9.903 10.857 1.00 0.07 O ATOM 9 C3' DC A 1 7.503 10.464 8.903 1.00 0.08 C ATOM 10 O3' DC A 1 8.912 10.522 9.157 1.00 0.07 O ATOM 11 C2' DC A 1 7.018 8.959 8.887 1.00 0.07 C ATOM 12 C1' DC A 1 6.758 8.672 10.359 1.00 0.06 C ATOM 13 N1 DC A 1 5.755 7.600 10.548 1.00 0.05 N ATOM 14 C2 DC A 1 6.119 6.371 11.084 1.00 0.06 C ATOM 15 O2 DC A 1 7.273 6.106 11.408 1.00 0.07 O ATOM 16 N3 DC A 1 5.149 5.436 11.245 1.00 0.06 N ATOM 17 C4 DC A 1 3.882 5.684 10.900 1.00 0.06 C ATOM 18 N4 DC A 1 2.978 4.732 11.086 1.00 0.07 N ATOM 19 C5 DC A 1 3.502 6.941 10.348 1.00 0.06 C ATOM 20 C6 DC A 1 4.471 7.852 10.195 1.00 0.06 C ATOM 0 H5' DC A 1 5.051 12.329 10.486 1.00 0.07 H new ATOM 0 H5'' DC A 1 6.034 12.810 9.117 1.00 0.07 H new ATOM 0 H4' DC A 1 7.362 11.614 10.736 1.00 0.08 H new ATOM 0 H3' DC A 1 7.344 11.007 7.972 1.00 0.08 H new ATOM 0 H2' DC A 1 6.118 8.830 8.285 1.00 0.07 H new ATOM 0 H2'' DC A 1 7.776 8.294 8.473 1.00 0.07 H new ATOM 0 H1' DC A 1 7.668 8.345 10.863 1.00 0.06 H new ATOM 0 H41 DC A 1 2.004 4.897 10.831 1.00 0.07 H new ATOM 0 H42 DC A 1 3.256 3.835 11.484 1.00 0.07 H new ATOM 0 H5 DC A 1 2.480 7.149 10.066 1.00 0.06 H new ATOM 0 H6 DC A 1 4.222 8.817 9.778 1.00 0.06 H new ATOM 33 P DG A 2 9.966 10.133 7.997 1.00 0.06 P ATOM 34 OP1 DG A 2 11.330 10.451 8.479 1.00 0.07 O ATOM 35 OP2 DG A 2 9.480 10.712 6.724 1.00 0.09 O ATOM 36 O5' DG A 2 9.790 8.528 7.933 1.00 0.04 O ATOM 37 C5' DG A 2 10.453 7.654 8.861 1.00 0.04 C ATOM 38 C4' DG A 2 10.086 6.178 8.672 1.00 0.05 C ATOM 39 O4' DG A 2 8.749 5.802 9.088 1.00 0.05 O ATOM 40 C3' DG A 2 10.229 5.717 7.211 1.00 0.04 C ATOM 41 O3' DG A 2 11.198 4.661 7.124 1.00 0.07 O ATOM 42 C2' DG A 2 8.818 5.282 6.915 1.00 0.04 C ATOM 43 C1' DG A 2 8.335 4.728 8.224 1.00 0.04 C ATOM 44 N9 DG A 2 6.889 4.464 8.275 1.00 0.04 N ATOM 45 C8 DG A 2 5.861 5.285 7.960 1.00 0.04 C ATOM 46 N7 DG A 2 4.644 4.722 8.140 1.00 0.04 N ATOM 47 C5 DG A 2 4.939 3.473 8.591 1.00 0.04 C ATOM 48 C6 DG A 2 4.076 2.398 8.956 1.00 0.04 C ATOM 49 O6 DG A 2 2.850 2.326 8.960 1.00 0.06 O ATOM 50 N1 DG A 2 4.786 1.291 9.358 1.00 0.04 N ATOM 51 C2 DG A 2 6.153 1.205 9.412 1.00 0.04 C ATOM 52 N2 DG A 2 6.658 0.050 9.809 1.00 0.04 N ATOM 53 N3 DG A 2 6.976 2.196 9.081 1.00 0.04 N ATOM 54 C4 DG A 2 6.301 3.296 8.680 1.00 0.03 C ATOM 0 H5' DG A 2 10.201 7.956 9.877 1.00 0.04 H new ATOM 0 H5'' DG A 2 11.531 7.770 8.752 1.00 0.04 H new ATOM 0 H4' DG A 2 10.804 5.686 9.328 1.00 0.05 H new ATOM 0 H3' DG A 2 10.593 6.460 6.501 1.00 0.04 H new ATOM 0 H2' DG A 2 8.203 6.118 6.582 1.00 0.04 H new ATOM 0 H2'' DG A 2 8.788 4.530 6.126 1.00 0.04 H new ATOM 0 H1' DG A 2 8.729 3.743 8.474 1.00 0.04 H new ATOM 0 H8 DG A 2 5.999 6.294 7.599 1.00 0.04 H new ATOM 0 H1 DG A 2 4.253 0.468 9.638 1.00 0.04 H new ATOM 0 H21 DG A 2 7.669 -0.071 9.868 1.00 0.04 H new ATOM 0 H22 DG A 2 6.037 -0.720 10.056 1.00 0.04 H new ATOM 66 P DC A 3 11.599 3.872 5.770 1.00 0.07 P ATOM 67 OP1 DC A 3 13.067 3.966 5.594 1.00 0.11 O ATOM 68 OP2 DC A 3 10.693 4.303 4.681 1.00 0.07 O ATOM 69 O5' DC A 3 11.216 2.352 6.159 1.00 0.10 O ATOM 70 C5' DC A 3 11.908 1.619 7.188 1.00 0.13 C ATOM 71 C4' DC A 3 11.550 0.127 7.213 1.00 0.13 C ATOM 72 O4' DC A 3 10.152 -0.112 7.480 1.00 0.11 O ATOM 73 C3' DC A 3 11.891 -0.538 5.886 1.00 0.13 C ATOM 74 O3' DC A 3 12.255 -1.917 6.052 1.00 0.14 O ATOM 75 C2' DC A 3 10.534 -0.379 5.166 1.00 0.10 C ATOM 76 C1' DC A 3 9.497 -0.645 6.311 1.00 0.09 C ATOM 77 N1 DC A 3 8.151 0.010 6.258 1.00 0.07 N ATOM 78 C2 DC A 3 7.023 -0.790 6.462 1.00 0.06 C ATOM 79 O2 DC A 3 7.088 -1.999 6.673 1.00 0.07 O ATOM 80 N3 DC A 3 5.797 -0.210 6.428 1.00 0.05 N ATOM 81 C4 DC A 3 5.655 1.097 6.206 1.00 0.06 C ATOM 82 N4 DC A 3 4.425 1.598 6.194 1.00 0.06 N ATOM 83 C5 DC A 3 6.790 1.941 5.996 1.00 0.06 C ATOM 84 C6 DC A 3 8.008 1.358 6.031 1.00 0.07 C ATOM 0 H5' DC A 3 11.674 2.058 8.158 1.00 0.13 H new ATOM 0 H5'' DC A 3 12.983 1.726 7.041 1.00 0.13 H new ATOM 0 H4' DC A 3 12.140 -0.300 8.024 1.00 0.13 H new ATOM 0 H3' DC A 3 12.747 -0.114 5.361 1.00 0.13 H new ATOM 0 H2' DC A 3 10.418 0.617 4.739 1.00 0.10 H new ATOM 0 H2'' DC A 3 10.425 -1.091 4.348 1.00 0.10 H new ATOM 0 H1' DC A 3 9.261 -1.708 6.262 1.00 0.09 H new ATOM 0 H41 DC A 3 4.282 2.594 6.027 1.00 0.06 H new ATOM 0 H42 DC A 3 3.624 0.987 6.352 1.00 0.06 H new ATOM 0 H5 DC A 3 6.678 3.000 5.817 1.00 0.06 H new ATOM 0 H6 DC A 3 8.889 1.964 5.877 1.00 0.07 H new ATOM 96 P A A 4 12.819 -2.794 4.816 1.00 0.16 P ATOM 97 OP1 A A 4 13.546 -3.955 5.379 1.00 0.19 O ATOM 98 OP2 A A 4 13.514 -1.886 3.874 1.00 0.20 O ATOM 99 O5' A A 4 11.468 -3.319 4.100 1.00 0.12 O ATOM 100 C5' A A 4 10.812 -4.523 4.528 1.00 0.08 C ATOM 101 C4' A A 4 9.357 -4.620 4.076 1.00 0.06 C ATOM 102 O4' A A 4 8.525 -3.565 4.586 1.00 0.07 O ATOM 103 C3' A A 4 9.149 -4.510 2.570 1.00 0.08 C ATOM 104 O3' A A 4 9.645 -5.646 1.831 1.00 0.08 O ATOM 105 C2' A A 4 7.636 -4.347 2.539 1.00 0.08 C ATOM 106 O2' A A 4 6.929 -5.574 2.629 1.00 0.10 O ATOM 107 C1' A A 4 7.293 -3.722 3.865 1.00 0.06 C ATOM 108 N9 A A 4 6.432 -2.534 3.744 1.00 0.06 N ATOM 109 C8 A A 4 6.760 -1.237 3.518 1.00 0.06 C ATOM 110 N7 A A 4 5.693 -0.409 3.485 1.00 0.06 N ATOM 111 C5 A A 4 4.643 -1.245 3.702 1.00 0.06 C ATOM 112 C6 A A 4 3.260 -1.030 3.790 1.00 0.06 C ATOM 113 N6 A A 4 2.688 0.165 3.671 1.00 0.07 N ATOM 114 N1 A A 4 2.484 -2.097 4.018 1.00 0.07 N ATOM 115 C2 A A 4 3.032 -3.301 4.151 1.00 0.08 C ATOM 116 N3 A A 4 4.310 -3.630 4.091 1.00 0.08 N ATOM 117 C4 A A 4 5.070 -2.538 3.861 1.00 0.06 C ATOM 0 H5' A A 4 10.850 -4.581 5.616 1.00 0.08 H new ATOM 0 H5'' A A 4 11.361 -5.382 4.144 1.00 0.08 H new ATOM 0 H4' A A 4 9.088 -5.605 4.458 1.00 0.06 H new ATOM 0 H3' A A 4 9.699 -3.705 2.082 1.00 0.08 H new ATOM 0 H2' A A 4 7.381 -3.817 1.621 1.00 0.08 H new ATOM 0 HO2' A A 4 6.071 -5.492 2.162 1.00 0.10 H new ATOM 0 H1' A A 4 6.647 -4.368 4.459 1.00 0.06 H new ATOM 0 H8 A A 4 7.776 -0.899 3.378 1.00 0.06 H new ATOM 0 H61 A A 4 1.675 0.255 3.745 1.00 0.07 H new ATOM 0 H62 A A 4 3.263 0.991 3.506 1.00 0.07 H new ATOM 0 H2 A A 4 2.344 -4.114 4.331 1.00 0.08 H new ATOM 129 P A A 5 9.441 -5.825 0.230 1.00 0.07 P ATOM 130 OP1 A A 5 10.567 -6.640 -0.284 1.00 0.08 O ATOM 131 OP2 A A 5 9.184 -4.489 -0.354 1.00 0.09 O ATOM 132 O5' A A 5 8.076 -6.690 0.089 1.00 0.07 O ATOM 133 C5' A A 5 8.027 -8.104 0.358 1.00 0.07 C ATOM 134 C4' A A 5 6.604 -8.647 0.552 1.00 0.07 C ATOM 135 O4' A A 5 5.945 -7.975 1.651 1.00 0.07 O ATOM 136 C3' A A 5 5.681 -8.482 -0.665 1.00 0.07 C ATOM 137 O3' A A 5 5.805 -9.517 -1.658 1.00 0.08 O ATOM 138 C2' A A 5 4.347 -8.572 0.075 1.00 0.07 C ATOM 139 O2' A A 5 4.119 -9.897 0.578 1.00 0.09 O ATOM 140 C1' A A 5 4.601 -7.637 1.257 1.00 0.08 C ATOM 141 N9 A A 5 4.512 -6.188 0.902 1.00 0.07 N ATOM 142 C8 A A 5 5.450 -5.340 0.335 1.00 0.08 C ATOM 143 N7 A A 5 5.002 -4.075 0.197 1.00 0.07 N ATOM 144 C5 A A 5 3.740 -4.122 0.691 1.00 0.07 C ATOM 145 C6 A A 5 2.752 -3.139 0.829 1.00 0.08 C ATOM 146 N6 A A 5 2.931 -1.874 0.466 1.00 0.08 N ATOM 147 N1 A A 5 1.579 -3.502 1.363 1.00 0.09 N ATOM 148 C2 A A 5 1.387 -4.761 1.743 1.00 0.09 C ATOM 149 N3 A A 5 2.239 -5.774 1.666 1.00 0.08 N ATOM 150 C4 A A 5 3.416 -5.382 1.123 1.00 0.07 C ATOM 0 H5' A A 5 8.612 -8.315 1.253 1.00 0.07 H new ATOM 0 H5'' A A 5 8.501 -8.638 -0.466 1.00 0.07 H new ATOM 0 H4' A A 5 6.753 -9.711 0.735 1.00 0.07 H new ATOM 0 H3' A A 5 5.869 -7.587 -1.258 1.00 0.07 H new ATOM 0 H2' A A 5 3.488 -8.326 -0.549 1.00 0.07 H new ATOM 0 HO2' A A 5 3.259 -9.925 1.048 1.00 0.09 H new ATOM 0 H1' A A 5 3.852 -7.767 2.038 1.00 0.08 H new ATOM 0 H8 A A 5 6.437 -5.659 0.035 1.00 0.08 H new ATOM 0 H61 A A 5 2.178 -1.197 0.588 1.00 0.08 H new ATOM 0 H62 A A 5 3.822 -1.580 0.065 1.00 0.08 H new ATOM 0 H2 A A 5 0.419 -4.986 2.166 1.00 0.09 H new ATOM 162 P A A 6 5.282 -9.323 -3.182 1.00 0.07 P ATOM 163 OP1 A A 6 5.487 -10.601 -3.903 1.00 0.09 O ATOM 164 OP2 A A 6 5.889 -8.081 -3.712 1.00 0.09 O ATOM 165 O5' A A 6 3.691 -9.079 -3.046 1.00 0.08 O ATOM 166 C5' A A 6 2.789 -10.032 -2.455 1.00 0.07 C ATOM 167 C4' A A 6 1.489 -9.355 -2.020 1.00 0.08 C ATOM 168 O4' A A 6 1.846 -8.243 -1.174 1.00 0.08 O ATOM 169 C3' A A 6 0.722 -8.770 -3.206 1.00 0.08 C ATOM 170 O3' A A 6 -0.189 -9.728 -3.786 1.00 0.09 O ATOM 171 C2' A A 6 -0.007 -7.643 -2.487 1.00 0.09 C ATOM 172 O2' A A 6 -1.239 -8.021 -1.898 1.00 0.09 O ATOM 173 C1' A A 6 0.975 -7.143 -1.455 1.00 0.08 C ATOM 174 N9 A A 6 1.663 -5.913 -1.911 1.00 0.08 N ATOM 175 C8 A A 6 2.924 -5.725 -2.413 1.00 0.08 C ATOM 176 N7 A A 6 3.202 -4.431 -2.675 1.00 0.10 N ATOM 177 C5 A A 6 2.064 -3.784 -2.326 1.00 0.08 C ATOM 178 C6 A A 6 1.708 -2.433 -2.357 1.00 0.08 C ATOM 179 N6 A A 6 2.549 -1.490 -2.764 1.00 0.09 N ATOM 180 N1 A A 6 0.478 -2.099 -1.940 1.00 0.08 N ATOM 181 C2 A A 6 -0.347 -3.054 -1.516 1.00 0.08 C ATOM 182 N3 A A 6 -0.125 -4.353 -1.436 1.00 0.08 N ATOM 183 C4 A A 6 1.118 -4.656 -1.864 1.00 0.08 C ATOM 0 H5' A A 6 3.264 -10.503 -1.595 1.00 0.07 H new ATOM 0 H5'' A A 6 2.570 -10.824 -3.171 1.00 0.07 H new ATOM 0 H4' A A 6 0.865 -10.099 -1.524 1.00 0.08 H new ATOM 0 H3' A A 6 1.332 -8.463 -4.055 1.00 0.08 H new ATOM 0 H2' A A 6 -0.303 -6.874 -3.201 1.00 0.09 H new ATOM 0 HO2' A A 6 -1.881 -7.286 -1.983 1.00 0.09 H new ATOM 0 H1' A A 6 0.485 -6.830 -0.533 1.00 0.08 H new ATOM 0 H8 A A 6 3.624 -6.530 -2.582 1.00 0.08 H new ATOM 0 H61 A A 6 2.255 -0.513 -2.773 1.00 0.09 H new ATOM 0 H62 A A 6 3.490 -1.742 -3.067 1.00 0.09 H new ATOM 0 H2 A A 6 -1.324 -2.723 -1.196 1.00 0.08 H new ATOM 195 P DT A 7 -1.001 -9.503 -5.172 1.00 0.08 P ATOM 196 OP1 DT A 7 -1.724 -10.758 -5.486 1.00 0.10 O ATOM 197 OP2 DT A 7 -0.054 -8.940 -6.162 1.00 0.10 O ATOM 198 O5' DT A 7 -2.097 -8.363 -4.843 1.00 0.09 O ATOM 199 C5' DT A 7 -3.146 -8.533 -3.873 1.00 0.10 C ATOM 200 C4' DT A 7 -3.806 -7.194 -3.532 1.00 0.08 C ATOM 201 O4' DT A 7 -2.763 -6.251 -3.196 1.00 0.09 O ATOM 202 C3' DT A 7 -4.590 -6.640 -4.727 1.00 0.07 C ATOM 203 O3' DT A 7 -5.985 -6.482 -4.424 1.00 0.07 O ATOM 204 C2' DT A 7 -3.957 -5.241 -4.938 1.00 0.08 C ATOM 205 C1' DT A 7 -3.071 -4.960 -3.746 1.00 0.09 C ATOM 206 N1 DT A 7 -1.850 -4.305 -4.283 1.00 0.09 N ATOM 207 C2 DT A 7 -1.730 -2.934 -4.193 1.00 0.08 C ATOM 208 O2 DT A 7 -2.600 -2.215 -3.719 1.00 0.08 O ATOM 209 N3 DT A 7 -0.563 -2.397 -4.679 1.00 0.08 N ATOM 210 C4 DT A 7 0.484 -3.094 -5.234 1.00 0.09 C ATOM 211 C5 DT A 7 0.282 -4.526 -5.295 1.00 0.09 C ATOM 212 C6 DT A 7 -0.862 -5.064 -4.830 1.00 0.08 C ATOM 213 O4 DT A 7 1.478 -2.479 -5.608 1.00 0.10 O ATOM 226 C7 DT A 7 1.386 -5.435 -5.862 1.00 0.08 C ATOM 0 H5' DT A 7 -2.738 -8.982 -2.967 1.00 0.10 H new ATOM 0 H5'' DT A 7 -3.896 -9.223 -4.261 1.00 0.10 H new ATOM 0 H4' DT A 7 -4.497 -7.344 -2.702 1.00 0.08 H new ATOM 0 H3' DT A 7 -4.538 -7.300 -5.593 1.00 0.07 H new ATOM 0 H2' DT A 7 -3.377 -5.217 -5.861 1.00 0.08 H new ATOM 0 H2'' DT A 7 -4.731 -4.479 -5.028 1.00 0.08 H new ATOM 0 H1' DT A 7 -3.518 -4.321 -2.984 1.00 0.09 H new ATOM 0 H3 DT A 7 -0.464 -1.383 -4.623 1.00 0.08 H new ATOM 0 H71 DT A 7 1.337 -6.411 -5.380 1.00 0.08 H new ATOM 0 H72 DT A 7 1.244 -5.553 -6.936 1.00 0.08 H new ATOM 0 H73 DT A 7 2.361 -4.986 -5.672 1.00 0.08 H new ATOM 0 H6 DT A 7 -1.000 -6.133 -4.893 1.00 0.08 H new ATOM 227 P DT A 8 -7.068 -6.026 -5.546 1.00 0.06 P ATOM 228 OP1 DT A 8 -8.419 -6.283 -5.001 1.00 0.08 O ATOM 229 OP2 DT A 8 -6.675 -6.633 -6.840 1.00 0.08 O ATOM 230 O5' DT A 8 -6.863 -4.427 -5.657 1.00 0.08 O ATOM 231 C5' DT A 8 -7.161 -3.548 -4.558 1.00 0.08 C ATOM 232 C4' DT A 8 -6.952 -2.074 -4.916 1.00 0.08 C ATOM 233 O4' DT A 8 -5.581 -1.839 -5.258 1.00 0.08 O ATOM 234 C3' DT A 8 -7.831 -1.585 -6.078 1.00 0.10 C ATOM 235 O3' DT A 8 -8.584 -0.432 -5.656 1.00 0.08 O ATOM 236 C2' DT A 8 -6.770 -1.256 -7.135 1.00 0.10 C ATOM 237 C1' DT A 8 -5.546 -0.906 -6.338 1.00 0.12 C ATOM 238 N1 DT A 8 -4.237 -1.092 -6.999 1.00 0.08 N ATOM 239 C2 DT A 8 -3.414 0.000 -7.181 1.00 0.07 C ATOM 240 O2 DT A 8 -3.724 1.147 -6.873 1.00 0.09 O ATOM 241 N3 DT A 8 -2.187 -0.261 -7.740 1.00 0.10 N ATOM 242 C4 DT A 8 -1.710 -1.490 -8.124 1.00 0.10 C ATOM 243 C5 DT A 8 -2.633 -2.583 -7.909 1.00 0.09 C ATOM 244 C6 DT A 8 -3.841 -2.341 -7.367 1.00 0.08 C ATOM 245 O4 DT A 8 -0.577 -1.571 -8.585 1.00 0.10 O ATOM 258 C7 DT A 8 -2.241 -4.023 -8.286 1.00 0.09 C ATOM 0 H5' DT A 8 -6.529 -3.806 -3.708 1.00 0.08 H new ATOM 0 H5'' DT A 8 -8.194 -3.700 -4.244 1.00 0.08 H new ATOM 0 H4' DT A 8 -7.242 -1.513 -4.028 1.00 0.08 H new ATOM 0 H3' DT A 8 -8.580 -2.289 -6.441 1.00 0.10 H new ATOM 0 H2' DT A 8 -6.587 -2.106 -7.792 1.00 0.10 H new ATOM 0 H2'' DT A 8 -7.083 -0.426 -7.768 1.00 0.10 H new ATOM 0 H1' DT A 8 -5.594 0.158 -6.105 1.00 0.12 H new ATOM 0 H3 DT A 8 -1.569 0.537 -7.884 1.00 0.10 H new ATOM 0 H71 DT A 8 -1.549 -4.003 -9.128 1.00 0.09 H new ATOM 0 H72 DT A 8 -1.762 -4.505 -7.434 1.00 0.09 H new ATOM 0 H73 DT A 8 -3.134 -4.582 -8.564 1.00 0.09 H new ATOM 0 H6 DT A 8 -4.520 -3.167 -7.219 1.00 0.08 H new ATOM 259 P DT A 9 -9.825 0.192 -6.489 1.00 0.07 P ATOM 260 OP1 DT A 9 -10.624 1.032 -5.567 1.00 0.09 O ATOM 261 OP2 DT A 9 -10.489 -0.906 -7.229 1.00 0.09 O ATOM 262 O5' DT A 9 -9.120 1.162 -7.573 1.00 0.09 O ATOM 263 C5' DT A 9 -8.483 2.402 -7.206 1.00 0.08 C ATOM 264 C4' DT A 9 -7.500 2.885 -8.279 1.00 0.08 C ATOM 265 O4' DT A 9 -6.500 1.892 -8.510 1.00 0.09 O ATOM 266 C3' DT A 9 -8.151 3.164 -9.637 1.00 0.09 C ATOM 267 O3' DT A 9 -8.335 4.582 -9.800 1.00 0.09 O ATOM 268 C2' DT A 9 -7.134 2.534 -10.608 1.00 0.11 C ATOM 269 C1' DT A 9 -5.921 2.256 -9.762 1.00 0.09 C ATOM 270 N1 DT A 9 -5.076 1.113 -10.175 1.00 0.06 N ATOM 271 C2 DT A 9 -3.733 1.327 -10.408 1.00 0.07 C ATOM 272 O2 DT A 9 -3.194 2.426 -10.335 1.00 0.07 O ATOM 273 N3 DT A 9 -2.994 0.221 -10.740 1.00 0.07 N ATOM 274 C4 DT A 9 -3.454 -1.064 -10.862 1.00 0.07 C ATOM 275 C5 DT A 9 -4.873 -1.209 -10.607 1.00 0.07 C ATOM 276 C6 DT A 9 -5.618 -0.135 -10.282 1.00 0.07 C ATOM 277 O4 DT A 9 -2.655 -1.950 -11.154 1.00 0.08 O ATOM 290 C7 DT A 9 -5.545 -2.586 -10.682 1.00 0.09 C ATOM 0 H5' DT A 9 -7.954 2.272 -6.262 1.00 0.08 H new ATOM 0 H5'' DT A 9 -9.244 3.165 -7.042 1.00 0.08 H new ATOM 0 H4' DT A 9 -7.089 3.815 -7.887 1.00 0.08 H new ATOM 0 H3' DT A 9 -9.149 2.753 -9.786 1.00 0.09 H new ATOM 0 H2' DT A 9 -7.525 1.619 -11.052 1.00 0.11 H new ATOM 0 H2'' DT A 9 -6.898 3.211 -11.429 1.00 0.11 H new ATOM 0 H1' DT A 9 -5.261 3.123 -9.799 1.00 0.09 H new ATOM 0 H3 DT A 9 -2.000 0.370 -10.914 1.00 0.07 H new ATOM 0 H71 DT A 9 -5.020 -3.208 -11.407 1.00 0.09 H new ATOM 0 H72 DT A 9 -5.510 -3.062 -9.702 1.00 0.09 H new ATOM 0 H73 DT A 9 -6.584 -2.468 -10.991 1.00 0.09 H new ATOM 0 H6 DT A 9 -6.675 -0.265 -10.101 1.00 0.07 H new ATOM 291 P DG A 10 -8.659 5.316 -11.203 1.00 0.09 P ATOM 292 OP1 DG A 10 -9.118 6.695 -10.916 1.00 0.12 O ATOM 293 OP2 DG A 10 -9.502 4.413 -12.021 1.00 0.14 O ATOM 294 O5' DG A 10 -7.192 5.385 -11.874 1.00 0.10 O ATOM 295 C5' DG A 10 -6.153 6.226 -11.343 1.00 0.10 C ATOM 296 C4' DG A 10 -4.858 6.137 -12.156 1.00 0.11 C ATOM 297 O4' DG A 10 -4.223 4.838 -12.120 1.00 0.12 O ATOM 298 C3' DG A 10 -5.093 6.478 -13.634 1.00 0.13 C ATOM 299 O3' DG A 10 -4.294 7.608 -14.025 1.00 0.14 O ATOM 300 C2' DG A 10 -4.659 5.178 -14.290 1.00 0.12 C ATOM 301 C1' DG A 10 -3.573 4.660 -13.388 1.00 0.12 C ATOM 302 N9 DG A 10 -3.263 3.243 -13.651 1.00 0.10 N ATOM 303 C8 DG A 10 -4.100 2.181 -13.562 1.00 0.10 C ATOM 304 N7 DG A 10 -3.509 0.997 -13.836 1.00 0.10 N ATOM 305 C5 DG A 10 -2.225 1.349 -14.116 1.00 0.09 C ATOM 306 C6 DG A 10 -1.117 0.535 -14.481 1.00 0.10 C ATOM 307 O6 DG A 10 -1.041 -0.683 -14.617 1.00 0.10 O ATOM 308 N1 DG A 10 0.019 1.280 -14.686 1.00 0.11 N ATOM 309 C2 DG A 10 0.106 2.641 -14.561 1.00 0.10 C ATOM 310 N2 DG A 10 1.289 3.180 -14.804 1.00 0.10 N ATOM 311 N3 DG A 10 -0.917 3.421 -14.219 1.00 0.10 N ATOM 312 C4 DG A 10 -2.051 2.710 -14.012 1.00 0.09 C ATOM 0 H5' DG A 10 -5.951 5.941 -10.310 1.00 0.10 H new ATOM 0 H5'' DG A 10 -6.499 7.260 -11.327 1.00 0.10 H new ATOM 0 H4' DG A 10 -4.201 6.863 -11.678 1.00 0.11 H new ATOM 0 H3' DG A 10 -6.108 6.776 -13.899 1.00 0.13 H new ATOM 0 H2' DG A 10 -5.487 4.473 -14.364 1.00 0.12 H new ATOM 0 H2'' DG A 10 -4.291 5.345 -15.302 1.00 0.12 H new ATOM 0 H1' DG A 10 -2.607 5.154 -13.493 1.00 0.12 H new ATOM 0 H8 DG A 10 -5.143 2.272 -13.297 1.00 0.10 H new ATOM 0 H1 DG A 10 0.866 0.779 -14.953 1.00 0.11 H new ATOM 0 H21 DG A 10 1.415 4.189 -14.727 1.00 0.10 H new ATOM 0 H22 DG A 10 2.075 2.586 -15.068 1.00 0.10 H new ATOM 324 P DC A 11 -4.347 8.265 -15.501 1.00 0.15 P ATOM 325 OP1 DC A 11 -3.809 9.642 -15.414 1.00 0.18 O ATOM 326 OP2 DC A 11 -5.701 8.045 -16.059 1.00 0.16 O ATOM 327 O5' DC A 11 -3.304 7.359 -16.335 1.00 0.12 O ATOM 328 C5' DC A 11 -1.877 7.475 -16.177 1.00 0.10 C ATOM 329 C4' DC A 11 -1.117 6.502 -17.085 1.00 0.09 C ATOM 330 O4' DC A 11 -1.415 5.134 -16.769 1.00 0.10 O ATOM 331 C3' DC A 11 -1.454 6.713 -18.567 1.00 0.08 C ATOM 332 O3' DC A 11 -0.284 7.118 -19.298 1.00 0.08 O ATOM 333 C2' DC A 11 -1.921 5.302 -18.973 1.00 0.10 C ATOM 334 C1' DC A 11 -1.238 4.392 -17.976 1.00 0.07 C ATOM 335 N1 DC A 11 -1.831 3.044 -17.750 1.00 0.06 N ATOM 336 C2 DC A 11 -1.012 1.927 -17.837 1.00 0.08 C ATOM 337 O2 DC A 11 0.172 2.002 -18.145 1.00 0.09 O ATOM 338 N3 DC A 11 -1.546 0.708 -17.581 1.00 0.09 N ATOM 339 C4 DC A 11 -2.831 0.570 -17.252 1.00 0.08 C ATOM 340 N4 DC A 11 -3.287 -0.653 -17.003 1.00 0.09 N ATOM 341 C5 DC A 11 -3.696 1.707 -17.161 1.00 0.07 C ATOM 342 C6 DC A 11 -3.151 2.913 -17.420 1.00 0.07 C ATOM 0 H5' DC A 11 -1.611 7.284 -15.137 1.00 0.10 H new ATOM 0 H5'' DC A 11 -1.569 8.496 -16.402 1.00 0.10 H new ATOM 0 H4' DC A 11 -0.061 6.709 -16.910 1.00 0.09 H new ATOM 0 H3' DC A 11 -2.191 7.492 -18.763 1.00 0.08 H new ATOM 0 H2' DC A 11 -3.006 5.210 -18.920 1.00 0.10 H new ATOM 0 H2'' DC A 11 -1.630 5.064 -19.996 1.00 0.10 H new ATOM 0 H1' DC A 11 -0.230 4.168 -18.326 1.00 0.07 H new ATOM 0 H41 DC A 11 -4.265 -0.791 -16.749 1.00 0.09 H new ATOM 0 H42 DC A 11 -2.659 -1.454 -17.066 1.00 0.09 H new ATOM 0 H5 DC A 11 -4.738 1.604 -16.897 1.00 0.07 H new ATOM 0 H6 DC A 11 -3.771 3.795 -17.365 1.00 0.07 H new ATOM 354 P DG A 12 -0.325 7.490 -20.872 1.00 0.09 P ATOM 355 OP1 DG A 12 0.798 8.412 -21.161 1.00 0.11 O ATOM 356 OP2 DG A 12 -1.706 7.886 -21.231 1.00 0.10 O ATOM 357 O5' DG A 12 -0.017 6.062 -21.571 1.00 0.09 O ATOM 358 C5' DG A 12 1.329 5.587 -21.747 1.00 0.09 C ATOM 359 C4' DG A 12 1.415 4.205 -22.402 1.00 0.09 C ATOM 360 O4' DG A 12 0.873 3.152 -21.566 1.00 0.11 O ATOM 361 C3' DG A 12 0.679 4.125 -23.755 1.00 0.09 C ATOM 362 O3' DG A 12 1.436 3.333 -24.681 1.00 0.11 O ATOM 363 C2' DG A 12 -0.557 3.362 -23.326 1.00 0.08 C ATOM 364 C1' DG A 12 0.029 2.333 -22.386 1.00 0.09 C ATOM 365 N9 DG A 12 -0.908 1.478 -21.635 1.00 0.08 N ATOM 366 C8 DG A 12 -2.115 1.761 -21.077 1.00 0.08 C ATOM 367 N7 DG A 12 -2.685 0.707 -20.454 1.00 0.07 N ATOM 368 C5 DG A 12 -1.781 -0.289 -20.638 1.00 0.07 C ATOM 369 C6 DG A 12 -1.818 -1.644 -20.213 1.00 0.06 C ATOM 370 O6 DG A 12 -2.671 -2.247 -19.568 1.00 0.07 O ATOM 371 N1 DG A 12 -0.697 -2.332 -20.609 1.00 0.07 N ATOM 372 C2 DG A 12 0.345 -1.805 -21.324 1.00 0.08 C ATOM 373 N2 DG A 12 1.337 -2.628 -21.615 1.00 0.10 N ATOM 374 N3 DG A 12 0.402 -0.540 -21.730 1.00 0.08 N ATOM 375 C4 DG A 12 -0.695 0.157 -21.353 1.00 0.07 C ATOM 0 H5' DG A 12 1.821 5.550 -20.775 1.00 0.09 H new ATOM 0 H5'' DG A 12 1.880 6.303 -22.357 1.00 0.09 H new ATOM 0 H4' DG A 12 2.485 4.059 -22.552 1.00 0.09 H new ATOM 0 H3' DG A 12 0.499 5.082 -24.246 1.00 0.09 H new ATOM 0 H2' DG A 12 -1.283 4.005 -22.828 1.00 0.08 H new ATOM 0 H2'' DG A 12 -1.067 2.901 -24.171 1.00 0.08 H new ATOM 0 HO3' DG A 12 0.960 3.286 -25.537 1.00 0.11 H new ATOM 0 H1' DG A 12 0.542 1.539 -22.929 1.00 0.09 H new ATOM 0 H8 DG A 12 -2.575 2.737 -21.127 1.00 0.08 H new ATOM 0 H1 DG A 12 -0.636 -3.316 -20.349 1.00 0.07 H new ATOM 0 H21 DG A 12 2.140 -2.291 -22.146 1.00 0.10 H new ATOM 0 H22 DG A 12 1.299 -3.600 -21.309 1.00 0.10 H new TER 388 DG A 12 ATOM 389 OP3 DC B 13 -1.429 -10.871 -19.967 1.00 0.21 O ATOM 390 P DC B 13 -0.702 -11.714 -18.813 1.00 0.22 P ATOM 391 OP1 DC B 13 -0.878 -10.983 -17.539 1.00 0.21 O ATOM 392 OP2 DC B 13 -1.110 -13.132 -18.928 1.00 0.27 O ATOM 393 O5' DC B 13 0.829 -11.574 -19.274 1.00 0.20 O ATOM 394 C5' DC B 13 1.194 -11.629 -20.660 1.00 0.21 C ATOM 395 C4' DC B 13 1.585 -10.251 -21.178 1.00 0.17 C ATOM 396 O4' DC B 13 0.552 -9.264 -20.953 1.00 0.14 O ATOM 397 C3' DC B 13 2.851 -9.781 -20.470 1.00 0.16 C ATOM 398 O3' DC B 13 3.797 -9.364 -21.462 1.00 0.17 O ATOM 399 C2' DC B 13 2.309 -8.496 -19.678 1.00 0.11 C ATOM 400 C1' DC B 13 1.187 -8.022 -20.596 1.00 0.10 C ATOM 401 N1 DC B 13 0.196 -7.109 -19.968 1.00 0.08 N ATOM 402 C2 DC B 13 0.076 -5.792 -20.404 1.00 0.07 C ATOM 403 O2 DC B 13 0.802 -5.316 -21.272 1.00 0.08 O ATOM 404 N3 DC B 13 -0.872 -5.006 -19.827 1.00 0.06 N ATOM 405 C4 DC B 13 -1.671 -5.474 -18.864 1.00 0.08 C ATOM 406 N4 DC B 13 -2.587 -4.662 -18.343 1.00 0.06 N ATOM 407 C5 DC B 13 -1.547 -6.823 -18.409 1.00 0.08 C ATOM 408 C6 DC B 13 -0.609 -7.583 -18.990 1.00 0.08 C ATOM 0 H5' DC B 13 0.360 -12.017 -21.244 1.00 0.21 H new ATOM 0 H5'' DC B 13 2.026 -12.321 -20.793 1.00 0.21 H new ATOM 0 H4' DC B 13 1.742 -10.347 -22.252 1.00 0.17 H new ATOM 0 H3' DC B 13 3.334 -10.527 -19.839 1.00 0.16 H new ATOM 0 H2' DC B 13 1.944 -8.751 -18.683 1.00 0.11 H new ATOM 0 H2'' DC B 13 3.081 -7.738 -19.549 1.00 0.11 H new ATOM 0 H1' DC B 13 1.582 -7.428 -21.420 1.00 0.10 H new ATOM 0 H41 DC B 13 -3.207 -4.999 -17.607 1.00 0.06 H new ATOM 0 H42 DC B 13 -2.669 -3.703 -18.680 1.00 0.06 H new ATOM 0 H5 DC B 13 -2.183 -7.214 -17.629 1.00 0.08 H new ATOM 0 H6 DC B 13 -0.492 -8.607 -18.667 1.00 0.08 H new ATOM 421 P DG B 14 5.379 -9.365 -21.145 1.00 0.18 P ATOM 422 OP1 DG B 14 6.099 -9.201 -22.430 1.00 0.24 O ATOM 423 OP2 DG B 14 5.683 -10.528 -20.280 1.00 0.22 O ATOM 424 O5' DG B 14 5.536 -8.020 -20.267 1.00 0.10 O ATOM 425 C5' DG B 14 5.954 -6.775 -20.846 1.00 0.13 C ATOM 426 C4' DG B 14 5.700 -5.574 -19.935 1.00 0.12 C ATOM 427 O4' DG B 14 4.303 -5.244 -19.756 1.00 0.12 O ATOM 428 C3' DG B 14 6.297 -5.728 -18.522 1.00 0.11 C ATOM 429 O3' DG B 14 7.375 -4.790 -18.362 1.00 0.18 O ATOM 430 C2' DG B 14 5.076 -5.498 -17.656 1.00 0.10 C ATOM 431 C1' DG B 14 4.202 -4.592 -18.480 1.00 0.10 C ATOM 432 N9 DG B 14 2.807 -4.457 -18.026 1.00 0.09 N ATOM 433 C8 DG B 14 1.944 -5.391 -17.546 1.00 0.08 C ATOM 434 N7 DG B 14 0.726 -4.889 -17.243 1.00 0.09 N ATOM 435 C5 DG B 14 0.841 -3.570 -17.550 1.00 0.08 C ATOM 436 C6 DG B 14 -0.110 -2.514 -17.446 1.00 0.08 C ATOM 437 O6 DG B 14 -1.275 -2.529 -17.060 1.00 0.09 O ATOM 438 N1 DG B 14 0.414 -1.313 -17.861 1.00 0.09 N ATOM 439 C2 DG B 14 1.689 -1.125 -18.323 1.00 0.12 C ATOM 440 N2 DG B 14 2.026 0.106 -18.661 1.00 0.15 N ATOM 441 N3 DG B 14 2.590 -2.095 -18.431 1.00 0.12 N ATOM 442 C4 DG B 14 2.098 -3.288 -18.028 1.00 0.09 C ATOM 0 H5' DG B 14 5.429 -6.625 -21.789 1.00 0.13 H new ATOM 0 H5'' DG B 14 7.018 -6.828 -21.079 1.00 0.13 H new ATOM 0 H4' DG B 14 6.203 -4.773 -20.477 1.00 0.12 H new ATOM 0 H3' DG B 14 6.765 -6.681 -18.276 1.00 0.11 H new ATOM 0 H2' DG B 14 4.570 -6.435 -17.424 1.00 0.10 H new ATOM 0 H2'' DG B 14 5.344 -5.036 -16.706 1.00 0.10 H new ATOM 0 H1' DG B 14 4.521 -3.550 -18.445 1.00 0.10 H new ATOM 0 H8 DG B 14 2.206 -6.431 -17.419 1.00 0.08 H new ATOM 0 H1 DG B 14 -0.196 -0.496 -17.822 1.00 0.09 H new ATOM 0 H21 DG B 14 2.964 0.300 -19.011 1.00 0.15 H new ATOM 0 H22 DG B 14 1.348 0.863 -18.572 1.00 0.15 H new ATOM 454 P DC B 15 8.031 -4.272 -16.977 1.00 0.19 P ATOM 455 OP1 DC B 15 9.503 -4.262 -17.134 1.00 0.27 O ATOM 456 OP2 DC B 15 7.413 -5.002 -15.845 1.00 0.19 O ATOM 457 O5' DC B 15 7.503 -2.745 -16.927 1.00 0.18 O ATOM 458 C5' DC B 15 7.824 -1.797 -17.964 1.00 0.19 C ATOM 459 C4' DC B 15 7.411 -0.358 -17.626 1.00 0.16 C ATOM 460 O4' DC B 15 5.988 -0.219 -17.418 1.00 0.13 O ATOM 461 C3' DC B 15 8.123 0.134 -16.373 1.00 0.14 C ATOM 462 O3' DC B 15 8.366 1.549 -16.410 1.00 0.11 O ATOM 463 C2' DC B 15 7.064 -0.257 -15.317 1.00 0.11 C ATOM 464 C1' DC B 15 5.713 0.083 -16.035 1.00 0.10 C ATOM 465 N1 DC B 15 4.466 -0.669 -15.677 1.00 0.09 N ATOM 466 C2 DC B 15 3.301 0.072 -15.449 1.00 0.09 C ATOM 467 O2 DC B 15 3.258 1.297 -15.525 1.00 0.10 O ATOM 468 N3 DC B 15 2.159 -0.586 -15.131 1.00 0.09 N ATOM 469 C4 DC B 15 2.130 -1.914 -15.034 1.00 0.08 C ATOM 470 N4 DC B 15 0.975 -2.491 -14.719 1.00 0.10 N ATOM 471 C5 DC B 15 3.301 -2.701 -15.262 1.00 0.11 C ATOM 472 C6 DC B 15 4.437 -2.043 -15.580 1.00 0.12 C ATOM 0 H5' DC B 15 7.332 -2.100 -18.888 1.00 0.19 H new ATOM 0 H5'' DC B 15 8.898 -1.824 -18.151 1.00 0.19 H new ATOM 0 H4' DC B 15 7.698 0.242 -18.490 1.00 0.16 H new ATOM 0 H3' DC B 15 9.117 -0.280 -16.206 1.00 0.14 H new ATOM 0 H2' DC B 15 7.127 -1.313 -15.053 1.00 0.11 H new ATOM 0 H2'' DC B 15 7.185 0.310 -14.394 1.00 0.11 H new ATOM 0 H1' DC B 15 5.469 1.105 -15.746 1.00 0.10 H new ATOM 0 H41 DC B 15 0.918 -3.506 -14.637 1.00 0.10 H new ATOM 0 H42 DC B 15 0.146 -1.919 -14.560 1.00 0.10 H new ATOM 0 H5 DC B 15 3.279 -3.778 -15.183 1.00 0.11 H new ATOM 0 H6 DC B 15 5.341 -2.605 -15.762 1.00 0.12 H new ATOM 484 P A B 16 9.201 2.310 -15.251 1.00 0.10 P ATOM 485 OP1 A B 16 9.741 3.563 -15.827 1.00 0.11 O ATOM 486 OP2 A B 16 10.125 1.341 -14.618 1.00 0.14 O ATOM 487 O5' A B 16 8.052 2.686 -14.179 1.00 0.08 O ATOM 488 C5' A B 16 7.159 3.788 -14.405 1.00 0.06 C ATOM 489 C4' A B 16 5.890 3.729 -13.559 1.00 0.06 C ATOM 490 O4' A B 16 5.109 2.551 -13.802 1.00 0.06 O ATOM 491 C3' A B 16 6.134 3.671 -12.053 1.00 0.05 C ATOM 492 O3' A B 16 6.621 4.923 -11.525 1.00 0.06 O ATOM 493 C2' A B 16 4.739 3.271 -11.580 1.00 0.04 C ATOM 494 O2' A B 16 3.841 4.362 -11.447 1.00 0.06 O ATOM 495 C1' A B 16 4.121 2.577 -12.761 1.00 0.05 C ATOM 496 N9 A B 16 3.449 1.304 -12.453 1.00 0.04 N ATOM 497 C8 A B 16 3.926 0.035 -12.485 1.00 0.05 C ATOM 498 N7 A B 16 3.001 -0.897 -12.161 1.00 0.06 N ATOM 499 C5 A B 16 1.889 -0.158 -11.914 1.00 0.05 C ATOM 500 C6 A B 16 0.583 -0.504 -11.532 1.00 0.05 C ATOM 501 N6 A B 16 0.175 -1.755 -11.336 1.00 0.07 N ATOM 502 N1 A B 16 -0.295 0.493 -11.367 1.00 0.06 N ATOM 503 C2 A B 16 0.085 1.750 -11.565 1.00 0.06 C ATOM 504 N3 A B 16 1.274 2.203 -11.924 1.00 0.06 N ATOM 505 C4 A B 16 2.139 1.179 -12.084 1.00 0.05 C ATOM 0 H5' A B 16 6.882 3.810 -15.459 1.00 0.06 H new ATOM 0 H5'' A B 16 7.684 4.720 -14.193 1.00 0.06 H new ATOM 0 H4' A B 16 5.388 4.651 -13.854 1.00 0.06 H new ATOM 0 H3' A B 16 6.916 2.988 -11.723 1.00 0.05 H new ATOM 0 H2' A B 16 4.861 2.736 -10.638 1.00 0.04 H new ATOM 0 HO2' A B 16 3.192 4.167 -10.739 1.00 0.06 H new ATOM 0 H1' A B 16 3.261 3.140 -13.122 1.00 0.05 H new ATOM 0 H8 A B 16 4.946 -0.208 -12.744 1.00 0.05 H new ATOM 0 H61 A B 16 -0.789 -1.939 -11.059 1.00 0.07 H new ATOM 0 H62 A B 16 0.826 -2.530 -11.463 1.00 0.07 H new ATOM 0 H2 A B 16 -0.677 2.500 -11.413 1.00 0.06 H new ATOM 517 P A B 17 6.885 5.198 -9.948 1.00 0.10 P ATOM 518 OP1 A B 17 7.991 6.176 -9.837 1.00 0.14 O ATOM 519 OP2 A B 17 6.998 3.889 -9.264 1.00 0.11 O ATOM 520 O5' A B 17 5.522 5.906 -9.425 1.00 0.12 O ATOM 521 C5' A B 17 5.180 7.267 -9.752 1.00 0.16 C ATOM 522 C4' A B 17 3.703 7.605 -9.506 1.00 0.15 C ATOM 523 O4' A B 17 2.852 6.737 -10.287 1.00 0.14 O ATOM 524 C3' A B 17 3.249 7.469 -8.042 1.00 0.14 C ATOM 525 O3' A B 17 3.458 8.664 -7.264 1.00 0.18 O ATOM 526 C2' A B 17 1.763 7.249 -8.299 1.00 0.13 C ATOM 527 O2' A B 17 1.133 8.451 -8.767 1.00 0.17 O ATOM 528 C1' A B 17 1.791 6.248 -9.446 1.00 0.11 C ATOM 529 N9 A B 17 2.058 4.833 -9.046 1.00 0.07 N ATOM 530 C8 A B 17 3.250 4.169 -8.809 1.00 0.06 C ATOM 531 N7 A B 17 3.076 2.864 -8.511 1.00 0.04 N ATOM 532 C5 A B 17 1.731 2.697 -8.558 1.00 0.05 C ATOM 533 C6 A B 17 0.913 1.576 -8.347 1.00 0.06 C ATOM 534 N6 A B 17 1.376 0.366 -8.049 1.00 0.07 N ATOM 535 N1 A B 17 -0.408 1.740 -8.467 1.00 0.08 N ATOM 536 C2 A B 17 -0.898 2.933 -8.780 1.00 0.09 C ATOM 537 N3 A B 17 -0.240 4.058 -9.006 1.00 0.09 N ATOM 538 C4 A B 17 1.093 3.869 -8.876 1.00 0.07 C ATOM 0 H5' A B 17 5.416 7.451 -10.800 1.00 0.16 H new ATOM 0 H5'' A B 17 5.801 7.941 -9.162 1.00 0.16 H new ATOM 0 H4' A B 17 3.613 8.652 -9.795 1.00 0.15 H new ATOM 0 H3' A B 17 3.777 6.706 -7.470 1.00 0.14 H new ATOM 0 H2' A B 17 1.221 6.932 -7.408 1.00 0.13 H new ATOM 0 HO2' A B 17 1.612 9.230 -8.414 1.00 0.17 H new ATOM 0 H1' A B 17 0.812 6.193 -9.922 1.00 0.11 H new ATOM 0 H8 A B 17 4.218 4.646 -8.858 1.00 0.06 H new ATOM 0 H61 A B 17 0.727 -0.408 -7.908 1.00 0.07 H new ATOM 0 H62 A B 17 2.380 0.212 -7.962 1.00 0.07 H new ATOM 0 H2 A B 17 -1.973 2.993 -8.861 1.00 0.09 H new ATOM 550 P A B 18 3.512 8.689 -5.642 1.00 0.17 P ATOM 551 OP1 A B 18 3.584 10.104 -5.210 1.00 0.21 O ATOM 552 OP2 A B 18 4.572 7.746 -5.216 1.00 0.20 O ATOM 553 O5' A B 18 2.089 8.090 -5.154 1.00 0.16 O ATOM 554 C5' A B 18 0.822 8.713 -5.438 1.00 0.16 C ATOM 555 C4' A B 18 -0.331 7.704 -5.385 1.00 0.12 C ATOM 556 O4' A B 18 0.007 6.597 -6.243 1.00 0.10 O ATOM 557 C3' A B 18 -0.549 7.088 -4.003 1.00 0.11 C ATOM 558 O3' A B 18 -1.382 7.916 -3.161 1.00 0.11 O ATOM 559 C2' A B 18 -1.265 5.811 -4.428 1.00 0.11 C ATOM 560 O2' A B 18 -2.669 5.947 -4.596 1.00 0.13 O ATOM 561 C1' A B 18 -0.590 5.406 -5.717 1.00 0.09 C ATOM 562 N9 A B 18 0.370 4.300 -5.493 1.00 0.08 N ATOM 563 C8 A B 18 1.737 4.307 -5.420 1.00 0.08 C ATOM 564 N7 A B 18 2.264 3.078 -5.243 1.00 0.08 N ATOM 565 C5 A B 18 1.177 2.269 -5.201 1.00 0.07 C ATOM 566 C6 A B 18 1.044 0.889 -5.040 1.00 0.07 C ATOM 567 N6 A B 18 2.092 0.086 -4.909 1.00 0.09 N ATOM 568 N1 A B 18 -0.194 0.375 -5.036 1.00 0.07 N ATOM 569 C2 A B 18 -1.237 1.187 -5.187 1.00 0.08 C ATOM 570 N3 A B 18 -1.238 2.498 -5.350 1.00 0.08 N ATOM 571 C4 A B 18 0.021 2.984 -5.347 1.00 0.07 C ATOM 0 H5' A B 18 0.857 9.174 -6.425 1.00 0.16 H new ATOM 0 H5'' A B 18 0.640 9.512 -4.719 1.00 0.16 H new ATOM 0 H4' A B 18 -1.229 8.250 -5.676 1.00 0.12 H new ATOM 0 H3' A B 18 0.352 6.950 -3.405 1.00 0.11 H new ATOM 0 H2' A B 18 -1.184 5.058 -3.644 1.00 0.11 H new ATOM 0 HO2' A B 18 -3.119 5.148 -4.250 1.00 0.13 H new ATOM 0 H1' A B 18 -1.295 5.003 -6.444 1.00 0.09 H new ATOM 0 H8 A B 18 2.333 5.205 -5.496 1.00 0.08 H new ATOM 0 H61 A B 18 1.954 -0.918 -4.793 1.00 0.09 H new ATOM 0 H62 A B 18 3.036 0.473 -4.924 1.00 0.09 H new ATOM 0 H2 A B 18 -2.208 0.714 -5.175 1.00 0.08 H new ATOM 583 P DT B 19 -1.669 7.635 -1.591 1.00 0.10 P ATOM 584 OP1 DT B 19 -2.440 8.781 -1.055 1.00 0.12 O ATOM 585 OP2 DT B 19 -0.381 7.264 -0.960 1.00 0.13 O ATOM 586 O5' DT B 19 -2.621 6.329 -1.552 1.00 0.12 O ATOM 587 C5' DT B 19 -3.952 6.290 -2.100 1.00 0.10 C ATOM 588 C4' DT B 19 -4.476 4.852 -2.182 1.00 0.11 C ATOM 589 O4' DT B 19 -3.463 4.057 -2.840 1.00 0.13 O ATOM 590 C3' DT B 19 -4.719 4.263 -0.787 1.00 0.09 C ATOM 591 O3' DT B 19 -6.092 3.901 -0.563 1.00 0.08 O ATOM 592 C2' DT B 19 -3.871 2.967 -0.811 1.00 0.12 C ATOM 593 C1' DT B 19 -3.393 2.757 -2.230 1.00 0.10 C ATOM 594 N1 DT B 19 -1.987 2.293 -2.113 1.00 0.09 N ATOM 595 C2 DT B 19 -1.709 0.945 -2.212 1.00 0.09 C ATOM 596 O2 DT B 19 -2.574 0.093 -2.363 1.00 0.11 O ATOM 597 N3 DT B 19 -0.384 0.595 -2.123 1.00 0.10 N ATOM 598 C4 DT B 19 0.675 1.455 -1.953 1.00 0.09 C ATOM 599 C5 DT B 19 0.301 2.852 -1.855 1.00 0.11 C ATOM 600 C6 DT B 19 -0.997 3.206 -1.933 1.00 0.11 C ATOM 601 O4 DT B 19 1.813 0.998 -1.912 1.00 0.10 O ATOM 614 C7 DT B 19 1.380 3.938 -1.696 1.00 0.10 C ATOM 0 H5' DT B 19 -3.952 6.737 -3.094 1.00 0.10 H new ATOM 0 H5'' DT B 19 -4.620 6.889 -1.481 1.00 0.10 H new ATOM 0 H4' DT B 19 -5.421 4.847 -2.725 1.00 0.11 H new ATOM 0 H3' DT B 19 -4.466 4.979 -0.005 1.00 0.09 H new ATOM 0 H2' DT B 19 -3.024 3.052 -0.131 1.00 0.12 H new ATOM 0 H2'' DT B 19 -4.464 2.116 -0.477 1.00 0.12 H new ATOM 0 H1' DT B 19 -3.966 2.037 -2.814 1.00 0.10 H new ATOM 0 H3 DT B 19 -0.164 -0.399 -2.189 1.00 0.10 H new ATOM 0 H71 DT B 19 1.034 4.865 -2.154 1.00 0.10 H new ATOM 0 H72 DT B 19 1.573 4.106 -0.637 1.00 0.10 H new ATOM 0 H73 DT B 19 2.298 3.613 -2.185 1.00 0.10 H new ATOM 0 H6 DT B 19 -1.259 4.250 -1.850 1.00 0.11 H new ATOM 615 P DT B 20 -6.619 3.319 0.862 1.00 0.07 P ATOM 616 OP1 DT B 20 -8.100 3.364 0.847 1.00 0.10 O ATOM 617 OP2 DT B 20 -5.882 4.011 1.945 1.00 0.09 O ATOM 618 O5' DT B 20 -6.165 1.767 0.858 1.00 0.10 O ATOM 619 C5' DT B 20 -6.721 0.813 -0.065 1.00 0.09 C ATOM 620 C4' DT B 20 -6.221 -0.615 0.181 1.00 0.09 C ATOM 621 O4' DT B 20 -4.799 -0.683 0.013 1.00 0.10 O ATOM 622 C3' DT B 20 -6.569 -1.175 1.568 1.00 0.10 C ATOM 623 O3' DT B 20 -7.239 -2.441 1.418 1.00 0.10 O ATOM 624 C2' DT B 20 -5.177 -1.317 2.188 1.00 0.10 C ATOM 625 C1' DT B 20 -4.272 -1.555 1.014 1.00 0.12 C ATOM 626 N1 DT B 20 -2.851 -1.189 1.188 1.00 0.09 N ATOM 627 C2 DT B 20 -1.883 -2.168 1.115 1.00 0.10 C ATOM 628 O2 DT B 20 -2.126 -3.361 0.962 1.00 0.14 O ATOM 629 N3 DT B 20 -0.584 -1.732 1.222 1.00 0.11 N ATOM 630 C4 DT B 20 -0.174 -0.432 1.392 1.00 0.10 C ATOM 631 C5 DT B 20 -1.247 0.532 1.465 1.00 0.09 C ATOM 632 C6 DT B 20 -2.521 0.119 1.364 1.00 0.08 C ATOM 633 O4 DT B 20 1.025 -0.187 1.445 1.00 0.11 O ATOM 646 C7 DT B 20 -0.941 2.030 1.653 1.00 0.11 C ATOM 0 H5' DT B 20 -6.469 1.111 -1.083 1.00 0.09 H new ATOM 0 H5'' DT B 20 -7.808 0.831 0.013 1.00 0.09 H new ATOM 0 H4' DT B 20 -6.739 -1.228 -0.557 1.00 0.09 H new ATOM 0 H3' DT B 20 -7.242 -0.566 2.172 1.00 0.10 H new ATOM 0 H2' DT B 20 -4.891 -0.418 2.735 1.00 0.10 H new ATOM 0 H2'' DT B 20 -5.139 -2.146 2.895 1.00 0.10 H new ATOM 0 H1' DT B 20 -4.261 -2.625 0.805 1.00 0.12 H new ATOM 0 H3 DT B 20 0.146 -2.442 1.170 1.00 0.11 H new ATOM 0 H71 DT B 20 -0.017 2.144 2.219 1.00 0.11 H new ATOM 0 H72 DT B 20 -0.830 2.504 0.678 1.00 0.11 H new ATOM 0 H73 DT B 20 -1.759 2.503 2.196 1.00 0.11 H new ATOM 0 H6 DT B 20 -3.312 0.852 1.425 1.00 0.08 H new ATOM 647 P DT B 21 -8.075 -3.165 2.601 1.00 0.08 P ATOM 648 OP1 DT B 21 -8.962 -4.179 1.982 1.00 0.11 O ATOM 649 OP2 DT B 21 -8.666 -2.113 3.460 1.00 0.11 O ATOM 650 O5' DT B 21 -6.948 -3.940 3.466 1.00 0.08 O ATOM 651 C5' DT B 21 -6.298 -5.139 3.002 1.00 0.08 C ATOM 652 C4' DT B 21 -4.961 -5.394 3.713 1.00 0.09 C ATOM 653 O4' DT B 21 -4.080 -4.284 3.511 1.00 0.08 O ATOM 654 C3' DT B 21 -5.092 -5.570 5.232 1.00 0.08 C ATOM 655 O3' DT B 21 -4.992 -6.957 5.604 1.00 0.08 O ATOM 656 C2' DT B 21 -3.925 -4.712 5.750 1.00 0.09 C ATOM 657 C1' DT B 21 -3.090 -4.427 4.528 1.00 0.09 C ATOM 658 N1 DT B 21 -2.300 -3.179 4.548 1.00 0.08 N ATOM 659 C2 DT B 21 -0.942 -3.261 4.308 1.00 0.09 C ATOM 660 O2 DT B 21 -0.341 -4.312 4.110 1.00 0.10 O ATOM 661 N3 DT B 21 -0.262 -2.072 4.301 1.00 0.09 N ATOM 662 C4 DT B 21 -0.789 -0.824 4.506 1.00 0.10 C ATOM 663 C5 DT B 21 -2.216 -0.818 4.754 1.00 0.09 C ATOM 664 C6 DT B 21 -2.907 -1.975 4.768 1.00 0.08 C ATOM 665 O4 DT B 21 -0.038 0.146 4.454 1.00 0.10 O ATOM 678 C7 DT B 21 -2.965 0.499 4.984 1.00 0.10 C ATOM 0 H5' DT B 21 -6.127 -5.064 1.928 1.00 0.08 H new ATOM 0 H5'' DT B 21 -6.959 -5.991 3.160 1.00 0.08 H new ATOM 0 H4' DT B 21 -4.580 -6.319 3.281 1.00 0.09 H new ATOM 0 H3' DT B 21 -6.052 -5.264 5.647 1.00 0.08 H new ATOM 0 H2' DT B 21 -4.284 -3.791 6.209 1.00 0.09 H new ATOM 0 H2'' DT B 21 -3.349 -5.242 6.508 1.00 0.09 H new ATOM 0 H1' DT B 21 -2.346 -5.215 4.412 1.00 0.09 H new ATOM 0 H3 DT B 21 0.741 -2.121 4.125 1.00 0.09 H new ATOM 0 H71 DT B 21 -2.294 1.223 5.445 1.00 0.10 H new ATOM 0 H72 DT B 21 -3.318 0.888 4.029 1.00 0.10 H new ATOM 0 H73 DT B 21 -3.817 0.323 5.641 1.00 0.10 H new ATOM 0 H6 DT B 21 -3.970 -1.950 4.958 1.00 0.08 H new ATOM 679 P DG B 22 -4.970 -7.469 7.138 1.00 0.10 P ATOM 680 OP1 DG B 22 -5.269 -8.920 7.148 1.00 0.13 O ATOM 681 OP2 DG B 22 -5.791 -6.544 7.953 1.00 0.13 O ATOM 682 O5' DG B 22 -3.420 -7.256 7.538 1.00 0.12 O ATOM 683 C5' DG B 22 -2.384 -8.117 7.034 1.00 0.11 C ATOM 684 C4' DG B 22 -0.983 -7.670 7.458 1.00 0.10 C ATOM 685 O4' DG B 22 -0.589 -6.395 6.905 1.00 0.10 O ATOM 686 C3' DG B 22 -0.839 -7.559 8.985 1.00 0.09 C ATOM 687 O3' DG B 22 0.148 -8.480 9.480 1.00 0.09 O ATOM 688 C2' DG B 22 -0.406 -6.107 9.119 1.00 0.09 C ATOM 689 C1' DG B 22 0.336 -5.822 7.839 1.00 0.08 C ATOM 690 N9 DG B 22 0.536 -4.379 7.614 1.00 0.06 N ATOM 691 C8 DG B 22 -0.399 -3.400 7.550 1.00 0.07 C ATOM 692 N7 DG B 22 0.117 -2.172 7.318 1.00 0.08 N ATOM 693 C5 DG B 22 1.454 -2.404 7.235 1.00 0.07 C ATOM 694 C6 DG B 22 2.529 -1.498 7.003 1.00 0.07 C ATOM 695 O6 DG B 22 2.517 -0.285 6.813 1.00 0.08 O ATOM 696 N1 DG B 22 3.744 -2.141 6.993 1.00 0.07 N ATOM 697 C2 DG B 22 3.930 -3.487 7.181 1.00 0.08 C ATOM 698 N2 DG B 22 5.175 -3.929 7.138 1.00 0.08 N ATOM 699 N3 DG B 22 2.940 -4.348 7.398 1.00 0.07 N ATOM 700 C4 DG B 22 1.732 -3.740 7.412 1.00 0.07 C ATOM 0 H5' DG B 22 -2.438 -8.144 5.946 1.00 0.11 H new ATOM 0 H5'' DG B 22 -2.559 -9.133 7.387 1.00 0.11 H new ATOM 0 H4' DG B 22 -0.335 -8.453 7.065 1.00 0.10 H new ATOM 0 H3' DG B 22 -1.734 -7.806 9.557 1.00 0.09 H new ATOM 0 H2' DG B 22 -1.264 -5.445 9.238 1.00 0.09 H new ATOM 0 H2'' DG B 22 0.232 -5.961 9.990 1.00 0.09 H new ATOM 0 H1' DG B 22 1.351 -6.217 7.793 1.00 0.08 H new ATOM 0 H8 DG B 22 -1.456 -3.583 7.673 1.00 0.07 H new ATOM 0 H1 DG B 22 4.575 -1.571 6.833 1.00 0.07 H new ATOM 0 H21 DG B 22 5.369 -4.921 7.272 1.00 0.08 H new ATOM 0 H22 DG B 22 5.942 -3.278 6.971 1.00 0.08 H new ATOM 712 P DC B 23 0.480 -8.674 11.053 1.00 0.08 P ATOM 713 OP1 DC B 23 1.074 -10.019 11.232 1.00 0.11 O ATOM 714 OP2 DC B 23 -0.719 -8.296 11.835 1.00 0.09 O ATOM 715 O5' DC B 23 1.627 -7.572 11.331 1.00 0.07 O ATOM 716 C5' DC B 23 2.966 -7.719 10.828 1.00 0.07 C ATOM 717 C4' DC B 23 3.831 -6.484 11.098 1.00 0.06 C ATOM 718 O4' DC B 23 3.285 -5.313 10.460 1.00 0.08 O ATOM 719 C3' DC B 23 4.009 -6.165 12.594 1.00 0.06 C ATOM 720 O3' DC B 23 5.414 -6.070 12.900 1.00 0.07 O ATOM 721 C2' DC B 23 3.341 -4.784 12.658 1.00 0.06 C ATOM 722 C1' DC B 23 3.644 -4.212 11.292 1.00 0.06 C ATOM 723 N1 DC B 23 2.902 -2.990 10.885 1.00 0.05 N ATOM 724 C2 DC B 23 3.623 -1.902 10.413 1.00 0.05 C ATOM 725 O2 DC B 23 4.850 -1.900 10.350 1.00 0.06 O ATOM 726 N3 DC B 23 2.947 -0.798 10.011 1.00 0.04 N ATOM 727 C4 DC B 23 1.615 -0.747 10.064 1.00 0.05 C ATOM 728 N4 DC B 23 1.013 0.361 9.646 1.00 0.05 N ATOM 729 C5 DC B 23 0.851 -1.855 10.549 1.00 0.06 C ATOM 730 C6 DC B 23 1.537 -2.946 10.948 1.00 0.06 C ATOM 0 H5' DC B 23 2.929 -7.906 9.755 1.00 0.07 H new ATOM 0 H5'' DC B 23 3.430 -8.592 11.288 1.00 0.07 H new ATOM 0 H4' DC B 23 4.807 -6.736 10.683 1.00 0.06 H new ATOM 0 H3' DC B 23 3.599 -6.898 13.288 1.00 0.06 H new ATOM 0 H2' DC B 23 2.269 -4.860 12.838 1.00 0.06 H new ATOM 0 H2'' DC B 23 3.756 -4.169 13.457 1.00 0.06 H new ATOM 0 H1' DC B 23 4.673 -3.857 11.242 1.00 0.06 H new ATOM 0 H41 DC B 23 -0.004 0.430 9.674 1.00 0.05 H new ATOM 0 H42 DC B 23 1.568 1.142 9.297 1.00 0.05 H new ATOM 0 H5 DC B 23 -0.227 -1.820 10.594 1.00 0.06 H new ATOM 0 H6 DC B 23 0.997 -3.802 11.325 1.00 0.06 H new ATOM 742 P DG B 24 6.031 -5.893 14.390 1.00 0.07 P ATOM 743 OP1 DG B 24 6.750 -7.137 14.751 1.00 0.09 O ATOM 744 OP2 DG B 24 4.977 -5.367 15.286 1.00 0.07 O ATOM 745 O5' DG B 24 7.128 -4.719 14.173 1.00 0.07 O ATOM 746 C5' DG B 24 8.315 -4.914 13.383 1.00 0.06 C ATOM 747 C4' DG B 24 9.201 -3.659 13.246 1.00 0.05 C ATOM 748 O4' DG B 24 8.489 -2.578 12.596 1.00 0.05 O ATOM 749 C3' DG B 24 9.716 -3.092 14.582 1.00 0.06 C ATOM 750 O3' DG B 24 10.957 -2.400 14.391 1.00 0.08 O ATOM 751 C2' DG B 24 8.639 -2.072 14.847 1.00 0.06 C ATOM 752 C1' DG B 24 8.458 -1.437 13.475 1.00 0.05 C ATOM 753 N9 DG B 24 7.207 -0.671 13.301 1.00 0.04 N ATOM 754 C8 DG B 24 5.928 -1.066 13.544 1.00 0.06 C ATOM 755 N7 DG B 24 5.006 -0.126 13.262 1.00 0.06 N ATOM 756 C5 DG B 24 5.748 0.918 12.817 1.00 0.05 C ATOM 757 C6 DG B 24 5.327 2.195 12.373 1.00 0.05 C ATOM 758 O6 DG B 24 4.190 2.644 12.279 1.00 0.06 O ATOM 759 N1 DG B 24 6.384 2.987 12.002 1.00 0.05 N ATOM 760 C2 DG B 24 7.704 2.616 12.044 1.00 0.05 C ATOM 761 N2 DG B 24 8.584 3.520 11.645 1.00 0.06 N ATOM 762 N3 DG B 24 8.123 1.419 12.457 1.00 0.04 N ATOM 763 C4 DG B 24 7.092 0.618 12.831 1.00 0.04 C ATOM 0 H5' DG B 24 8.024 -5.249 12.387 1.00 0.06 H new ATOM 0 H5'' DG B 24 8.906 -5.714 13.828 1.00 0.06 H new ATOM 0 H4' DG B 24 10.049 -4.008 12.657 1.00 0.05 H new ATOM 0 H3' DG B 24 9.889 -3.837 15.359 1.00 0.06 H new ATOM 0 H2' DG B 24 7.720 -2.534 15.207 1.00 0.06 H new ATOM 0 H2'' DG B 24 8.944 -1.342 15.597 1.00 0.06 H new ATOM 0 HO3' DG B 24 11.269 -2.045 15.249 1.00 0.08 H new ATOM 0 H1' DG B 24 9.226 -0.687 13.287 1.00 0.05 H new ATOM 0 H8 DG B 24 5.675 -2.043 13.928 1.00 0.06 H new ATOM 0 H1 DG B 24 6.171 3.927 11.668 1.00 0.05 H new ATOM 0 H21 DG B 24 9.580 3.301 11.654 1.00 0.06 H new ATOM 0 H22 DG B 24 8.266 4.436 11.328 1.00 0.06 H new TER 776 DG B 24