USER MOD reduce.3.24.130724 H: found=0, std=0, add=232, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 256 hydrogens (24 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 Set 1.1: A 6 A O2' : rot 10:sc= 0.245 USER MOD Set 1.2: A 7 G O2' : rot 180:sc=-0.00797 USER MOD Single : A 1 C O2' : rot -29:sc= 0.0236 USER MOD Single : A 1 C O5' : rot 180:sc= 0 USER MOD Single : A 2 C O2' : rot -17:sc= 0.0294 USER MOD Single : A 3 G O2' : rot -21:sc= 0.00175 USER MOD Single : A 4 G O2' : rot -27:sc= 0.0191 USER MOD Single : A 5 C O2' : rot -17:sc= 0.105 USER MOD Single : A 8 U O2' : rot -22:sc= 0.00838 USER MOD Single : A 9 G O2' : rot -29:sc= 0.02 USER MOD Single : A 10 U O2' : rot -20:sc= 0.0223 USER MOD Single : A 11 G O2' : rot 180:sc= 0 USER MOD Single : A 11 G O3' : rot 138:sc= 0.129 USER MOD Single : B 12 C O2' : rot -22:sc= 0.0124 USER MOD Single : B 12 C O5' : rot 180:sc= 0 USER MOD Single : B 13 A O2' : rot -17:sc= 0.00726 USER MOD Single : B 14 C O2' : rot -29:sc= 0.0112 USER MOD Single : B 15 A O2' : rot -22:sc= 0.0349 USER MOD Single : B 16 C O2' : rot -16:sc= 0.173 USER MOD Single : B 17 G O2' : rot -23:sc= 0.0968 USER MOD Single : B 18 U O2' : rot -66:sc= 0.0432 USER MOD Single : B 19 C O2' : rot -18:sc= 0.0195 USER MOD Single : B 20 G O2' : rot -18:sc= 0.0304 USER MOD Single : B 21 G O2' : rot 180:sc= 0 USER MOD Single : B 21 G O3' : rot 129:sc= 0.0154 USER MOD ----------------------------------------------------------------- ATOM 1 O5' C A 1 -3.691 -11.023 14.729 1.00 0.00 O ATOM 2 C5' C A 1 -2.550 -10.439 14.111 1.00 0.00 C ATOM 3 C4' C A 1 -1.464 -11.498 13.887 1.00 0.00 C ATOM 4 O4' C A 1 -1.854 -12.475 12.922 1.00 0.00 O ATOM 5 C3' C A 1 -0.156 -10.904 13.367 1.00 0.00 C ATOM 6 O3' C A 1 0.609 -10.263 14.372 1.00 0.00 O ATOM 7 C2' C A 1 0.509 -12.176 12.826 1.00 0.00 C ATOM 8 O2' C A 1 1.046 -13.006 13.853 1.00 0.00 O ATOM 9 C1' C A 1 -0.691 -12.917 12.217 1.00 0.00 C ATOM 10 N1 C A 1 -0.822 -12.675 10.752 1.00 0.00 N ATOM 11 C2 C A 1 -0.034 -13.436 9.877 1.00 0.00 C ATOM 12 O2 C A 1 0.809 -14.240 10.276 1.00 0.00 O ATOM 13 N3 C A 1 -0.165 -13.297 8.535 1.00 0.00 N ATOM 14 C4 C A 1 -1.039 -12.425 8.066 1.00 0.00 C ATOM 15 N4 C A 1 -1.151 -12.358 6.765 1.00 0.00 N ATOM 16 C5 C A 1 -1.838 -11.595 8.897 1.00 0.00 C ATOM 17 C6 C A 1 -1.709 -11.753 10.241 1.00 0.00 C ATOM 0 H5' C A 1 -2.160 -9.636 14.737 1.00 0.00 H new ATOM 0 H5'' C A 1 -2.833 -9.992 13.158 1.00 0.00 H new ATOM 0 H4' C A 1 -1.322 -11.945 14.871 1.00 0.00 H new ATOM 0 H3' C A 1 -0.279 -10.103 12.638 1.00 0.00 H new ATOM 0 H2' C A 1 1.337 -11.943 12.157 1.00 0.00 H new ATOM 0 HO2' C A 1 1.307 -12.452 14.618 1.00 0.00 H new ATOM 0 HO5' C A 1 -4.376 -10.336 14.868 1.00 0.00 H new ATOM 0 H1' C A 1 -0.556 -13.993 12.322 1.00 0.00 H new ATOM 0 H41 C A 1 -1.810 -11.703 6.343 1.00 0.00 H new ATOM 0 H42 C A 1 -0.580 -12.960 6.172 1.00 0.00 H new ATOM 0 H5 C A 1 -2.519 -10.869 8.479 1.00 0.00 H new ATOM 0 H6 C A 1 -2.305 -11.152 10.912 1.00 0.00 H new ATOM 30 P C A 2 1.636 -9.093 14.018 1.00 0.00 P ATOM 31 OP1 C A 2 2.254 -8.631 15.285 1.00 0.00 O ATOM 32 OP2 C A 2 0.930 -8.105 13.166 1.00 0.00 O1- ATOM 33 O5' C A 2 2.764 -9.797 13.112 1.00 0.00 O ATOM 34 C5' C A 2 3.771 -10.624 13.687 1.00 0.00 C ATOM 35 C4' C A 2 4.670 -11.261 12.615 1.00 0.00 C ATOM 36 O4' C A 2 3.921 -12.081 11.719 1.00 0.00 O ATOM 37 C3' C A 2 5.412 -10.230 11.768 1.00 0.00 C ATOM 38 O3' C A 2 6.503 -9.662 12.473 1.00 0.00 O ATOM 39 C2' C A 2 5.782 -11.113 10.568 1.00 0.00 C ATOM 40 O2' C A 2 6.945 -11.902 10.805 1.00 0.00 O ATOM 41 C1' C A 2 4.573 -12.060 10.445 1.00 0.00 C ATOM 42 N1 C A 2 3.660 -11.603 9.351 1.00 0.00 N ATOM 43 C2 C A 2 3.916 -12.043 8.041 1.00 0.00 C ATOM 44 O2 C A 2 4.846 -12.799 7.768 1.00 0.00 O ATOM 45 N3 C A 2 3.145 -11.617 7.010 1.00 0.00 N ATOM 46 C4 C A 2 2.146 -10.795 7.264 1.00 0.00 C ATOM 47 N4 C A 2 1.464 -10.408 6.239 1.00 0.00 N ATOM 48 C5 C A 2 1.830 -10.325 8.573 1.00 0.00 C ATOM 49 C6 C A 2 2.612 -10.735 9.599 1.00 0.00 C ATOM 0 H5' C A 2 3.301 -11.409 14.280 1.00 0.00 H new ATOM 0 H5'' C A 2 4.382 -10.032 14.368 1.00 0.00 H new ATOM 0 H4' C A 2 5.391 -11.856 13.176 1.00 0.00 H new ATOM 0 H3' C A 2 4.859 -9.335 11.483 1.00 0.00 H new ATOM 0 H2' C A 2 5.995 -10.510 9.685 1.00 0.00 H new ATOM 0 HO2' C A 2 7.440 -11.534 11.567 1.00 0.00 H new ATOM 0 H1' C A 2 4.886 -13.069 10.179 1.00 0.00 H new ATOM 0 H41 C A 2 0.676 -9.771 6.361 1.00 0.00 H new ATOM 0 H42 C A 2 1.713 -10.739 5.307 1.00 0.00 H new ATOM 0 H5 C A 2 0.993 -9.663 8.740 1.00 0.00 H new ATOM 0 H6 C A 2 2.419 -10.387 10.603 1.00 0.00 H new ATOM 61 P G A 3 7.293 -8.394 11.901 1.00 0.00 P ATOM 62 OP1 G A 3 8.367 -8.047 12.856 1.00 0.00 O ATOM 63 OP2 G A 3 6.315 -7.352 11.521 1.00 0.00 O1- ATOM 64 O5' G A 3 8.006 -8.979 10.582 1.00 0.00 O ATOM 65 C5' G A 3 8.087 -8.246 9.384 1.00 0.00 C ATOM 66 C4' G A 3 8.687 -9.103 8.272 1.00 0.00 C ATOM 67 O4' G A 3 7.787 -10.097 7.803 1.00 0.00 O ATOM 68 C3' G A 3 9.064 -8.257 7.059 1.00 0.00 C ATOM 69 O3' G A 3 10.274 -7.523 7.219 1.00 0.00 O ATOM 70 C2' G A 3 9.117 -9.338 5.972 1.00 0.00 C ATOM 71 O2' G A 3 10.288 -10.158 6.032 1.00 0.00 O ATOM 72 C1' G A 3 7.894 -10.178 6.377 1.00 0.00 C ATOM 73 N9 G A 3 6.655 -9.634 5.760 1.00 0.00 N ATOM 74 C8 G A 3 5.573 -9.063 6.384 1.00 0.00 C ATOM 75 N7 G A 3 4.639 -8.659 5.571 1.00 0.00 N ATOM 76 C5 G A 3 5.120 -9.040 4.308 1.00 0.00 C ATOM 77 C6 G A 3 4.543 -8.930 2.994 1.00 0.00 C ATOM 78 O6 G A 3 3.468 -8.444 2.651 1.00 0.00 O ATOM 79 N1 G A 3 5.329 -9.469 1.996 1.00 0.00 N ATOM 80 C2 G A 3 6.557 -9.989 2.204 1.00 0.00 C ATOM 81 N2 G A 3 7.217 -10.411 1.163 1.00 0.00 N ATOM 82 N3 G A 3 7.117 -10.126 3.395 1.00 0.00 N ATOM 83 C4 G A 3 6.345 -9.647 4.421 1.00 0.00 C ATOM 0 H5' G A 3 8.698 -7.357 9.536 1.00 0.00 H new ATOM 0 H5'' G A 3 7.094 -7.904 9.092 1.00 0.00 H new ATOM 0 H4' G A 3 9.564 -9.571 8.718 1.00 0.00 H new ATOM 0 H3' G A 3 8.369 -7.446 6.842 1.00 0.00 H new ATOM 0 H2' G A 3 9.128 -8.926 4.963 1.00 0.00 H new ATOM 0 HO2' G A 3 10.993 -9.686 6.522 1.00 0.00 H new ATOM 0 H1' G A 3 8.014 -11.208 6.040 1.00 0.00 H new ATOM 0 H8 G A 3 5.503 -8.958 7.457 1.00 0.00 H new ATOM 0 H1 G A 3 4.960 -9.475 1.045 1.00 0.00 H new ATOM 0 H21 G A 3 8.148 -10.811 1.277 1.00 0.00 H new ATOM 0 H22 G A 3 6.802 -10.342 0.234 1.00 0.00 H new ATOM 95 P G A 4 10.546 -6.179 6.407 1.00 0.00 P ATOM 96 OP1 G A 4 11.887 -5.693 6.824 1.00 0.00 O ATOM 97 OP2 G A 4 9.364 -5.305 6.597 1.00 0.00 O1- ATOM 98 O5' G A 4 10.620 -6.592 4.852 1.00 0.00 O ATOM 99 C5' G A 4 11.694 -7.383 4.359 1.00 0.00 C ATOM 100 C4' G A 4 11.557 -7.664 2.856 1.00 0.00 C ATOM 101 O4' G A 4 10.348 -8.346 2.524 1.00 0.00 O ATOM 102 C3' G A 4 11.576 -6.392 2.012 1.00 0.00 C ATOM 103 O3' G A 4 12.889 -5.864 1.854 1.00 0.00 O ATOM 104 C2' G A 4 10.990 -6.951 0.707 1.00 0.00 C ATOM 105 O2' G A 4 11.932 -7.691 -0.084 1.00 0.00 O ATOM 106 C1' G A 4 9.942 -7.925 1.230 1.00 0.00 C ATOM 107 N9 G A 4 8.607 -7.278 1.294 1.00 0.00 N ATOM 108 C8 G A 4 7.912 -6.802 2.385 1.00 0.00 C ATOM 109 N7 G A 4 6.710 -6.369 2.097 1.00 0.00 N ATOM 110 C5 G A 4 6.615 -6.533 0.707 1.00 0.00 C ATOM 111 C6 G A 4 5.550 -6.250 -0.232 1.00 0.00 C ATOM 112 O6 G A 4 4.406 -5.853 -0.037 1.00 0.00 O ATOM 113 N1 G A 4 5.909 -6.476 -1.542 1.00 0.00 N ATOM 114 C2 G A 4 7.089 -7.013 -1.925 1.00 0.00 C ATOM 115 N2 G A 4 7.263 -7.208 -3.203 1.00 0.00 N ATOM 116 N3 G A 4 8.071 -7.338 -1.092 1.00 0.00 N ATOM 117 C4 G A 4 7.788 -7.057 0.212 1.00 0.00 C ATOM 0 H5' G A 4 11.729 -8.327 4.903 1.00 0.00 H new ATOM 0 H5'' G A 4 12.638 -6.871 4.548 1.00 0.00 H new ATOM 0 H4' G A 4 12.422 -8.289 2.631 1.00 0.00 H new ATOM 0 H3' G A 4 11.034 -5.544 2.431 1.00 0.00 H new ATOM 0 H2' G A 4 10.636 -6.151 0.057 1.00 0.00 H new ATOM 0 HO2' G A 4 12.838 -7.363 0.094 1.00 0.00 H new ATOM 0 H1' G A 4 9.860 -8.780 0.559 1.00 0.00 H new ATOM 0 H8 G A 4 8.321 -6.787 3.385 1.00 0.00 H new ATOM 0 H1 G A 4 5.242 -6.222 -2.270 1.00 0.00 H new ATOM 0 H21 G A 4 8.136 -7.611 -3.543 1.00 0.00 H new ATOM 0 H22 G A 4 6.526 -6.958 -3.862 1.00 0.00 H new ATOM 129 P C A 5 13.126 -4.399 1.249 1.00 0.00 P ATOM 130 OP1 C A 5 14.583 -4.152 1.187 1.00 0.00 O ATOM 131 OP2 C A 5 12.275 -3.451 2.002 1.00 0.00 O1- ATOM 132 O5' C A 5 12.577 -4.521 -0.267 1.00 0.00 O ATOM 133 C5' C A 5 12.215 -3.368 -1.001 1.00 0.00 C ATOM 134 C4' C A 5 11.455 -3.737 -2.293 1.00 0.00 C ATOM 135 O4' C A 5 10.299 -4.537 -2.026 1.00 0.00 O ATOM 136 C3' C A 5 10.958 -2.489 -3.039 1.00 0.00 C ATOM 137 O3' C A 5 11.853 -1.945 -3.999 1.00 0.00 O ATOM 138 C2' C A 5 9.702 -3.021 -3.741 1.00 0.00 C ATOM 139 O2' C A 5 10.009 -3.700 -4.958 1.00 0.00 O ATOM 140 C1' C A 5 9.163 -4.040 -2.733 1.00 0.00 C ATOM 141 N1 C A 5 8.135 -3.476 -1.801 1.00 0.00 N ATOM 142 C2 C A 5 6.813 -3.321 -2.253 1.00 0.00 C ATOM 143 O2 C A 5 6.483 -3.534 -3.421 1.00 0.00 O ATOM 144 N3 C A 5 5.835 -2.938 -1.405 1.00 0.00 N ATOM 145 C4 C A 5 6.131 -2.691 -0.151 1.00 0.00 C ATOM 146 N4 C A 5 5.124 -2.360 0.605 1.00 0.00 N ATOM 147 C5 C A 5 7.445 -2.816 0.373 1.00 0.00 C ATOM 148 C6 C A 5 8.416 -3.214 -0.481 1.00 0.00 C ATOM 0 H5' C A 5 13.110 -2.800 -1.254 1.00 0.00 H new ATOM 0 H5'' C A 5 11.592 -2.722 -0.383 1.00 0.00 H new ATOM 0 H4' C A 5 12.173 -4.290 -2.898 1.00 0.00 H new ATOM 0 H3' C A 5 10.814 -1.660 -2.347 1.00 0.00 H new ATOM 0 H2' C A 5 9.013 -2.219 -4.007 1.00 0.00 H new ATOM 0 HO2' C A 5 10.914 -3.460 -5.247 1.00 0.00 H new ATOM 0 H1' C A 5 8.634 -4.835 -3.259 1.00 0.00 H new ATOM 0 H41 C A 5 5.274 -2.153 1.592 1.00 0.00 H new ATOM 0 H42 C A 5 4.185 -2.308 0.210 1.00 0.00 H new ATOM 0 H5 C A 5 7.660 -2.602 1.410 1.00 0.00 H new ATOM 0 H6 C A 5 9.428 -3.328 -0.120 1.00 0.00 H new ATOM 160 P A A 6 13.131 -1.074 -3.576 1.00 0.00 P ATOM 161 OP1 A A 6 14.331 -1.923 -3.778 1.00 0.00 O ATOM 162 OP2 A A 6 12.890 -0.437 -2.255 1.00 0.00 O1- ATOM 163 O5' A A 6 13.137 0.068 -4.697 1.00 0.00 O ATOM 164 C5' A A 6 12.081 1.004 -4.759 1.00 0.00 C ATOM 165 C4' A A 6 12.338 2.069 -5.833 1.00 0.00 C ATOM 166 O4' A A 6 12.309 1.487 -7.135 1.00 0.00 O ATOM 167 C3' A A 6 11.258 3.175 -5.790 1.00 0.00 C ATOM 168 O3' A A 6 11.789 4.471 -5.493 1.00 0.00 O ATOM 169 C2' A A 6 10.681 3.140 -7.220 1.00 0.00 C ATOM 170 O2' A A 6 10.377 4.426 -7.749 1.00 0.00 O ATOM 171 C1' A A 6 11.793 2.471 -8.013 1.00 0.00 C ATOM 172 N9 A A 6 11.325 1.861 -9.273 1.00 0.00 N ATOM 173 C8 A A 6 10.337 0.915 -9.446 1.00 0.00 C ATOM 174 N7 A A 6 10.101 0.620 -10.707 1.00 0.00 N ATOM 175 C5 A A 6 11.002 1.442 -11.410 1.00 0.00 C ATOM 176 C6 A A 6 11.297 1.665 -12.780 1.00 0.00 C ATOM 177 N6 A A 6 10.715 1.068 -13.801 1.00 0.00 N ATOM 178 N1 A A 6 12.267 2.509 -13.145 1.00 0.00 N ATOM 179 C2 A A 6 12.919 3.149 -12.185 1.00 0.00 C ATOM 180 N3 A A 6 12.746 3.065 -10.867 1.00 0.00 N ATOM 181 C4 A A 6 11.762 2.178 -10.539 1.00 0.00 C ATOM 0 H5' A A 6 11.962 1.485 -3.788 1.00 0.00 H new ATOM 0 H5'' A A 6 11.146 0.486 -4.974 1.00 0.00 H new ATOM 0 H4' A A 6 13.319 2.497 -5.628 1.00 0.00 H new ATOM 0 H3' A A 6 10.525 2.999 -5.002 1.00 0.00 H new ATOM 0 H2' A A 6 9.725 2.618 -7.257 1.00 0.00 H new ATOM 0 HO2' A A 6 10.741 5.117 -7.157 1.00 0.00 H new ATOM 0 H1' A A 6 12.540 3.200 -8.327 1.00 0.00 H new ATOM 0 H8 A A 6 9.806 0.459 -8.624 1.00 0.00 H new ATOM 0 H61 A A 6 10.997 1.297 -14.754 1.00 0.00 H new ATOM 0 H62 A A 6 9.982 0.377 -13.638 1.00 0.00 H new ATOM 0 H2 A A 6 13.692 3.828 -12.515 1.00 0.00 H new ATOM 193 P G A 7 12.182 4.878 -3.988 1.00 0.00 P ATOM 194 OP1 G A 7 12.513 6.319 -3.992 1.00 0.00 O ATOM 195 OP2 G A 7 13.207 3.919 -3.513 1.00 0.00 O1- ATOM 196 O5' G A 7 10.843 4.657 -3.104 1.00 0.00 O ATOM 197 C5' G A 7 9.702 5.508 -3.203 1.00 0.00 C ATOM 198 C4' G A 7 8.752 5.104 -4.344 1.00 0.00 C ATOM 199 O4' G A 7 8.016 3.923 -4.038 1.00 0.00 O ATOM 200 C3' G A 7 7.714 6.190 -4.637 1.00 0.00 C ATOM 201 O3' G A 7 8.231 7.280 -5.397 1.00 0.00 O ATOM 202 C2' G A 7 6.651 5.351 -5.360 1.00 0.00 C ATOM 203 O2' G A 7 7.023 5.003 -6.699 1.00 0.00 O ATOM 204 C1' G A 7 6.684 4.055 -4.535 1.00 0.00 C ATOM 205 N9 G A 7 5.702 4.119 -3.423 1.00 0.00 N ATOM 206 C8 G A 7 5.925 4.223 -2.071 1.00 0.00 C ATOM 207 N7 G A 7 4.827 4.306 -1.347 1.00 0.00 N ATOM 208 C5 G A 7 3.799 4.282 -2.302 1.00 0.00 C ATOM 209 C6 G A 7 2.367 4.381 -2.154 1.00 0.00 C ATOM 210 O6 G A 7 1.678 4.529 -1.138 1.00 0.00 O ATOM 211 N1 G A 7 1.690 4.287 -3.356 1.00 0.00 N ATOM 212 C2 G A 7 2.312 4.141 -4.552 1.00 0.00 C ATOM 213 N2 G A 7 1.554 4.070 -5.618 1.00 0.00 N ATOM 214 N3 G A 7 3.629 4.067 -4.743 1.00 0.00 N ATOM 215 C4 G A 7 4.323 4.144 -3.568 1.00 0.00 C ATOM 0 H5' G A 7 10.033 6.535 -3.359 1.00 0.00 H new ATOM 0 H5'' G A 7 9.157 5.488 -2.259 1.00 0.00 H new ATOM 0 H4' G A 7 9.401 4.943 -5.204 1.00 0.00 H new ATOM 0 H3' G A 7 7.339 6.720 -3.761 1.00 0.00 H new ATOM 0 H2' G A 7 5.700 5.878 -5.432 1.00 0.00 H new ATOM 0 HO2' G A 7 6.310 4.469 -7.108 1.00 0.00 H new ATOM 0 H1' G A 7 6.412 3.192 -5.143 1.00 0.00 H new ATOM 0 H8 G A 7 6.915 4.236 -1.639 1.00 0.00 H new ATOM 0 H1 G A 7 0.671 4.330 -3.342 1.00 0.00 H new ATOM 0 H21 G A 7 1.978 3.960 -6.539 1.00 0.00 H new ATOM 0 H22 G A 7 0.540 4.125 -5.527 1.00 0.00 H new ATOM 227 P U A 8 7.495 8.694 -5.411 1.00 0.00 P ATOM 228 OP1 U A 8 8.307 9.641 -6.218 1.00 0.00 O ATOM 229 OP2 U A 8 7.163 9.058 -4.009 1.00 0.00 O1- ATOM 230 O5' U A 8 6.101 8.440 -6.186 1.00 0.00 O ATOM 231 C5' U A 8 6.082 8.117 -7.568 1.00 0.00 C ATOM 232 C4' U A 8 4.671 7.712 -8.047 1.00 0.00 C ATOM 233 O4' U A 8 4.061 6.681 -7.240 1.00 0.00 O ATOM 234 C3' U A 8 3.701 8.889 -8.065 1.00 0.00 C ATOM 235 O3' U A 8 3.880 9.733 -9.192 1.00 0.00 O ATOM 236 C2' U A 8 2.366 8.116 -8.076 1.00 0.00 C ATOM 237 O2' U A 8 2.056 7.532 -9.352 1.00 0.00 O ATOM 238 C1' U A 8 2.667 6.963 -7.097 1.00 0.00 C ATOM 239 N1 U A 8 2.280 7.308 -5.690 1.00 0.00 N ATOM 240 C2 U A 8 0.916 7.374 -5.381 1.00 0.00 C ATOM 241 O2 U A 8 0.005 7.198 -6.200 1.00 0.00 O ATOM 242 N3 U A 8 0.575 7.618 -4.065 1.00 0.00 N ATOM 243 C4 U A 8 1.447 7.849 -3.038 1.00 0.00 C ATOM 244 O4 U A 8 1.015 8.091 -1.905 1.00 0.00 O ATOM 245 C5 U A 8 2.837 7.763 -3.412 1.00 0.00 C ATOM 246 C6 U A 8 3.219 7.508 -4.690 1.00 0.00 C ATOM 0 H5' U A 8 6.778 7.300 -7.759 1.00 0.00 H new ATOM 0 H5'' U A 8 6.429 8.974 -8.146 1.00 0.00 H new ATOM 0 H4' U A 8 4.841 7.335 -9.056 1.00 0.00 H new ATOM 0 H3' U A 8 3.809 9.596 -7.242 1.00 0.00 H new ATOM 0 H2' U A 8 1.526 8.766 -7.831 1.00 0.00 H new ATOM 0 HO2' U A 8 2.549 8.003 -10.056 1.00 0.00 H new ATOM 0 H1' U A 8 2.075 6.078 -7.328 1.00 0.00 H new ATOM 0 H3 U A 8 -0.420 7.627 -3.839 1.00 0.00 H new ATOM 0 H5 U A 8 3.595 7.905 -2.655 1.00 0.00 H new ATOM 0 H6 U A 8 4.271 7.460 -4.931 1.00 0.00 H new ATOM 257 P G A 9 3.389 11.260 -9.177 1.00 0.00 P ATOM 258 OP1 G A 9 3.805 11.882 -10.465 1.00 0.00 O ATOM 259 OP2 G A 9 3.840 11.888 -7.911 1.00 0.00 O1- ATOM 260 O5' G A 9 1.785 11.193 -9.141 1.00 0.00 O ATOM 261 C5' G A 9 1.044 10.818 -10.292 1.00 0.00 C ATOM 262 C4' G A 9 -0.461 10.755 -10.010 1.00 0.00 C ATOM 263 O4' G A 9 -0.798 9.866 -8.946 1.00 0.00 O ATOM 264 C3' G A 9 -1.051 12.112 -9.634 1.00 0.00 C ATOM 265 O3' G A 9 -1.236 12.968 -10.750 1.00 0.00 O ATOM 266 C2' G A 9 -2.350 11.668 -8.965 1.00 0.00 C ATOM 267 O2' G A 9 -3.351 11.285 -9.904 1.00 0.00 O ATOM 268 C1' G A 9 -1.894 10.405 -8.217 1.00 0.00 C ATOM 269 N9 G A 9 -1.506 10.717 -6.811 1.00 0.00 N ATOM 270 C8 G A 9 -0.256 10.971 -6.285 1.00 0.00 C ATOM 271 N7 G A 9 -0.257 11.188 -4.990 1.00 0.00 N ATOM 272 C5 G A 9 -1.609 11.108 -4.643 1.00 0.00 C ATOM 273 C6 G A 9 -2.275 11.263 -3.380 1.00 0.00 C ATOM 274 O6 G A 9 -1.799 11.489 -2.262 1.00 0.00 O ATOM 275 N1 G A 9 -3.645 11.162 -3.474 1.00 0.00 N ATOM 276 C2 G A 9 -4.311 10.937 -4.629 1.00 0.00 C ATOM 277 N2 G A 9 -5.614 10.908 -4.582 1.00 0.00 N ATOM 278 N3 G A 9 -3.741 10.745 -5.814 1.00 0.00 N ATOM 279 C4 G A 9 -2.379 10.843 -5.753 1.00 0.00 C ATOM 0 H5' G A 9 1.388 9.845 -10.644 1.00 0.00 H new ATOM 0 H5'' G A 9 1.233 11.532 -11.094 1.00 0.00 H new ATOM 0 H4' G A 9 -0.880 10.398 -10.951 1.00 0.00 H new ATOM 0 H3' G A 9 -0.415 12.728 -8.998 1.00 0.00 H new ATOM 0 H2' G A 9 -2.791 12.460 -8.360 1.00 0.00 H new ATOM 0 HO2' G A 9 -3.227 11.787 -10.737 1.00 0.00 H new ATOM 0 H1' G A 9 -2.708 9.682 -8.154 1.00 0.00 H new ATOM 0 H8 G A 9 0.642 10.990 -6.884 1.00 0.00 H new ATOM 0 H1 G A 9 -4.192 11.263 -2.619 1.00 0.00 H new ATOM 0 H21 G A 9 -6.151 10.741 -5.433 1.00 0.00 H new ATOM 0 H22 G A 9 -6.096 11.052 -3.695 1.00 0.00 H new ATOM 291 P U A 10 -1.680 14.502 -10.585 1.00 0.00 P ATOM 292 OP1 U A 10 -1.657 15.153 -11.924 1.00 0.00 O ATOM 293 OP2 U A 10 -0.891 15.097 -9.479 1.00 0.00 O1- ATOM 294 O5' U A 10 -3.212 14.376 -10.128 1.00 0.00 O ATOM 295 C5' U A 10 -3.865 15.412 -9.414 1.00 0.00 C ATOM 296 C4' U A 10 -5.173 14.887 -8.810 1.00 0.00 C ATOM 297 O4' U A 10 -4.954 13.777 -7.945 1.00 0.00 O ATOM 298 C3' U A 10 -5.857 15.964 -7.961 1.00 0.00 C ATOM 299 O3' U A 10 -6.726 16.784 -8.723 1.00 0.00 O ATOM 300 C2' U A 10 -6.574 15.113 -6.912 1.00 0.00 C ATOM 301 O2' U A 10 -7.768 14.511 -7.414 1.00 0.00 O ATOM 302 C1' U A 10 -5.545 14.003 -6.675 1.00 0.00 C ATOM 303 N1 U A 10 -4.511 14.335 -5.633 1.00 0.00 N ATOM 304 C2 U A 10 -4.930 14.372 -4.293 1.00 0.00 C ATOM 305 O2 U A 10 -6.111 14.266 -3.948 1.00 0.00 O ATOM 306 N3 U A 10 -3.959 14.568 -3.333 1.00 0.00 N ATOM 307 C4 U A 10 -2.614 14.730 -3.575 1.00 0.00 C ATOM 308 O4 U A 10 -1.835 14.906 -2.652 1.00 0.00 O ATOM 309 C5 U A 10 -2.254 14.662 -4.965 1.00 0.00 C ATOM 310 C6 U A 10 -3.173 14.467 -5.943 1.00 0.00 C ATOM 0 H5' U A 10 -4.073 16.249 -10.080 1.00 0.00 H new ATOM 0 H5'' U A 10 -3.214 15.787 -8.624 1.00 0.00 H new ATOM 0 H4' U A 10 -5.792 14.593 -9.658 1.00 0.00 H new ATOM 0 H3' U A 10 -5.175 16.694 -7.526 1.00 0.00 H new ATOM 0 H2' U A 10 -6.875 15.695 -6.041 1.00 0.00 H new ATOM 0 HO2' U A 10 -8.072 14.999 -8.208 1.00 0.00 H new ATOM 0 H1' U A 10 -6.033 13.116 -6.271 1.00 0.00 H new ATOM 0 H3 U A 10 -4.264 14.595 -2.360 1.00 0.00 H new ATOM 0 H5 U A 10 -1.215 14.770 -5.240 1.00 0.00 H new ATOM 0 H6 U A 10 -2.855 14.415 -6.974 1.00 0.00 H new ATOM 321 P G A 11 -6.927 18.331 -8.362 1.00 0.00 P ATOM 322 OP1 G A 11 -7.847 18.909 -9.365 1.00 0.00 O ATOM 323 OP2 G A 11 -5.589 18.936 -8.191 1.00 0.00 O1- ATOM 324 O5' G A 11 -7.667 18.356 -6.928 1.00 0.00 O ATOM 325 C5' G A 11 -9.003 17.878 -6.775 1.00 0.00 C ATOM 326 C4' G A 11 -9.492 18.057 -5.324 1.00 0.00 C ATOM 327 O4' G A 11 -8.605 17.401 -4.411 1.00 0.00 O ATOM 328 C3' G A 11 -9.588 19.542 -4.937 1.00 0.00 C ATOM 329 O3' G A 11 -10.694 19.759 -4.051 1.00 0.00 O ATOM 330 C2' G A 11 -8.270 19.772 -4.192 1.00 0.00 C ATOM 331 O2' G A 11 -8.321 20.834 -3.235 1.00 0.00 O ATOM 332 C1' G A 11 -8.073 18.395 -3.549 1.00 0.00 C ATOM 333 N9 G A 11 -6.631 18.155 -3.242 1.00 0.00 N ATOM 334 C8 G A 11 -5.593 17.895 -4.110 1.00 0.00 C ATOM 335 N7 G A 11 -4.414 17.850 -3.531 1.00 0.00 N ATOM 336 C5 G A 11 -4.691 18.083 -2.178 1.00 0.00 C ATOM 337 C6 G A 11 -3.844 18.149 -1.012 1.00 0.00 C ATOM 338 O6 G A 11 -2.617 18.048 -0.935 1.00 0.00 O ATOM 339 N1 G A 11 -4.529 18.393 0.159 1.00 0.00 N ATOM 340 C2 G A 11 -5.864 18.589 0.225 1.00 0.00 C ATOM 341 N2 G A 11 -6.387 18.863 1.393 1.00 0.00 N ATOM 342 N3 G A 11 -6.696 18.516 -0.814 1.00 0.00 N ATOM 343 C4 G A 11 -6.053 18.260 -1.995 1.00 0.00 C ATOM 0 H5' G A 11 -9.050 16.824 -7.051 1.00 0.00 H new ATOM 0 H5'' G A 11 -9.665 18.415 -7.454 1.00 0.00 H new ATOM 0 H4' G A 11 -10.485 17.612 -5.265 1.00 0.00 H new ATOM 0 H3' G A 11 -9.739 20.205 -5.789 1.00 0.00 H new ATOM 0 H2' G A 11 -7.452 20.099 -4.834 1.00 0.00 H new ATOM 0 HO2' G A 11 -7.448 20.923 -2.798 1.00 0.00 H new ATOM 0 HO3' G A 11 -10.423 20.367 -3.332 1.00 0.00 H new ATOM 0 H1' G A 11 -8.607 18.352 -2.600 1.00 0.00 H new ATOM 0 H8 G A 11 -5.735 17.742 -5.170 1.00 0.00 H new ATOM 0 H1 G A 11 -3.996 18.428 1.028 1.00 0.00 H new ATOM 0 H21 G A 11 -7.392 19.017 1.479 1.00 0.00 H new ATOM 0 H22 G A 11 -5.790 18.923 2.218 1.00 0.00 H new TER 356 G A 11 ATOM 357 O5' C B 12 -1.109 18.982 9.788 1.00 0.00 O ATOM 358 C5' C B 12 -1.733 17.910 9.098 1.00 0.00 C ATOM 359 C4' C B 12 -2.995 18.402 8.373 1.00 0.00 C ATOM 360 O4' C B 12 -2.677 19.249 7.268 1.00 0.00 O ATOM 361 C3' C B 12 -3.799 17.234 7.779 1.00 0.00 C ATOM 362 O3' C B 12 -4.586 16.531 8.730 1.00 0.00 O ATOM 363 C2' C B 12 -4.630 17.982 6.722 1.00 0.00 C ATOM 364 O2' C B 12 -5.714 18.707 7.291 1.00 0.00 O ATOM 365 C1' C B 12 -3.589 18.987 6.198 1.00 0.00 C ATOM 366 N1 C B 12 -2.879 18.469 4.981 1.00 0.00 N ATOM 367 C2 C B 12 -3.509 18.633 3.737 1.00 0.00 C ATOM 368 O2 C B 12 -4.631 19.124 3.620 1.00 0.00 O ATOM 369 N3 C B 12 -2.885 18.254 2.598 1.00 0.00 N ATOM 370 C4 C B 12 -1.696 17.703 2.677 1.00 0.00 C ATOM 371 N4 C B 12 -1.130 17.354 1.549 1.00 0.00 N ATOM 372 C5 C B 12 -1.001 17.516 3.899 1.00 0.00 C ATOM 373 C6 C B 12 -1.621 17.904 5.040 1.00 0.00 C ATOM 0 H5' C B 12 -1.995 17.120 9.802 1.00 0.00 H new ATOM 0 H5'' C B 12 -1.037 17.478 8.378 1.00 0.00 H new ATOM 0 H4' C B 12 -3.568 18.937 9.130 1.00 0.00 H new ATOM 0 H3' C B 12 -3.184 16.426 7.382 1.00 0.00 H new ATOM 0 H2' C B 12 -5.078 17.315 5.986 1.00 0.00 H new ATOM 0 HO2' C B 12 -5.939 18.326 8.165 1.00 0.00 H new ATOM 0 HO5' C B 12 -0.307 18.654 10.246 1.00 0.00 H new ATOM 0 H1' C B 12 -4.080 19.908 5.884 1.00 0.00 H new ATOM 0 H41 C B 12 -0.206 16.922 1.554 1.00 0.00 H new ATOM 0 H42 C B 12 -1.613 17.514 0.665 1.00 0.00 H new ATOM 0 H5 C B 12 -0.013 17.080 3.920 1.00 0.00 H new ATOM 0 H6 C B 12 -1.132 17.771 5.994 1.00 0.00 H new ATOM 386 P A B 13 -4.901 14.967 8.553 1.00 0.00 P ATOM 387 OP1 A B 13 -5.665 14.515 9.739 1.00 0.00 O ATOM 388 OP2 A B 13 -3.628 14.290 8.225 1.00 0.00 O1- ATOM 389 O5' A B 13 -5.845 14.920 7.268 1.00 0.00 O ATOM 390 C5' A B 13 -7.198 15.341 7.347 1.00 0.00 C ATOM 391 C4' A B 13 -7.874 15.383 5.974 1.00 0.00 C ATOM 392 O4' A B 13 -7.228 16.301 5.095 1.00 0.00 O ATOM 393 C3' A B 13 -7.941 14.024 5.248 1.00 0.00 C ATOM 394 O3' A B 13 -8.937 13.156 5.773 1.00 0.00 O ATOM 395 C2' A B 13 -8.200 14.514 3.809 1.00 0.00 C ATOM 396 O2' A B 13 -9.553 14.915 3.600 1.00 0.00 O ATOM 397 C1' A B 13 -7.311 15.775 3.765 1.00 0.00 C ATOM 398 N9 A B 13 -5.958 15.442 3.238 1.00 0.00 N ATOM 399 C8 A B 13 -4.760 15.266 3.898 1.00 0.00 C ATOM 400 N7 A B 13 -3.743 15.016 3.108 1.00 0.00 N ATOM 401 C5 A B 13 -4.323 15.042 1.819 1.00 0.00 C ATOM 402 C6 A B 13 -3.860 14.885 0.488 1.00 0.00 C ATOM 403 N6 A B 13 -2.604 14.680 0.148 1.00 0.00 N ATOM 404 N1 A B 13 -4.689 14.947 -0.550 1.00 0.00 N ATOM 405 C2 A B 13 -5.970 15.163 -0.314 1.00 0.00 C ATOM 406 N3 A B 13 -6.556 15.353 0.858 1.00 0.00 N ATOM 407 C4 A B 13 -5.673 15.276 1.902 1.00 0.00 C ATOM 0 H5' A B 13 -7.242 16.331 7.802 1.00 0.00 H new ATOM 0 H5'' A B 13 -7.749 14.665 8.000 1.00 0.00 H new ATOM 0 H4' A B 13 -8.892 15.700 6.202 1.00 0.00 H new ATOM 0 H3' A B 13 -7.057 13.394 5.348 1.00 0.00 H new ATOM 0 H2' A B 13 -7.999 13.746 3.063 1.00 0.00 H new ATOM 0 HO2' A B 13 -10.116 14.553 4.316 1.00 0.00 H new ATOM 0 H1' A B 13 -7.743 16.520 3.097 1.00 0.00 H new ATOM 0 H8 A B 13 -4.667 15.329 4.972 1.00 0.00 H new ATOM 0 H61 A B 13 -2.352 14.577 -0.835 1.00 0.00 H new ATOM 0 H62 A B 13 -1.883 14.624 0.868 1.00 0.00 H new ATOM 0 H2 A B 13 -6.616 15.188 -1.179 1.00 0.00 H new ATOM 419 P C B 14 -8.835 11.570 5.555 1.00 0.00 P ATOM 420 OP1 C B 14 -10.013 10.946 6.195 1.00 0.00 O ATOM 421 OP2 C B 14 -7.484 11.137 5.991 1.00 0.00 O1- ATOM 422 O5' C B 14 -8.942 11.342 3.964 1.00 0.00 O ATOM 423 C5' C B 14 -10.173 11.530 3.278 1.00 0.00 C ATOM 424 C4' C B 14 -10.017 11.399 1.757 1.00 0.00 C ATOM 425 O4' C B 14 -9.109 12.365 1.233 1.00 0.00 O ATOM 426 C3' C B 14 -9.527 10.032 1.263 1.00 0.00 C ATOM 427 O3' C B 14 -10.495 9.007 1.284 1.00 0.00 O ATOM 428 C2' C B 14 -9.105 10.431 -0.154 1.00 0.00 C ATOM 429 O2' C B 14 -10.210 10.622 -1.042 1.00 0.00 O ATOM 430 C1' C B 14 -8.471 11.809 0.084 1.00 0.00 C ATOM 431 N1 C B 14 -6.988 11.678 0.256 1.00 0.00 N ATOM 432 C2 C B 14 -6.202 11.569 -0.896 1.00 0.00 C ATOM 433 O2 C B 14 -6.684 11.561 -2.030 1.00 0.00 O ATOM 434 N3 C B 14 -4.847 11.467 -0.814 1.00 0.00 N ATOM 435 C4 C B 14 -4.280 11.439 0.377 1.00 0.00 C ATOM 436 N4 C B 14 -2.981 11.329 0.393 1.00 0.00 N ATOM 437 C5 C B 14 -5.029 11.527 1.587 1.00 0.00 C ATOM 438 C6 C B 14 -6.377 11.645 1.486 1.00 0.00 C ATOM 0 H5' C B 14 -10.573 12.516 3.517 1.00 0.00 H new ATOM 0 H5'' C B 14 -10.899 10.798 3.631 1.00 0.00 H new ATOM 0 H4' C B 14 -11.035 11.552 1.398 1.00 0.00 H new ATOM 0 H3' C B 14 -8.754 9.582 1.886 1.00 0.00 H new ATOM 0 H2' C B 14 -8.475 9.667 -0.610 1.00 0.00 H new ATOM 0 HO2' C B 14 -10.958 10.055 -0.761 1.00 0.00 H new ATOM 0 H1' C B 14 -8.615 12.473 -0.769 1.00 0.00 H new ATOM 0 H41 C B 14 -2.482 11.302 1.282 1.00 0.00 H new ATOM 0 H42 C B 14 -2.463 11.270 -0.484 1.00 0.00 H new ATOM 0 H5 C B 14 -4.541 11.501 2.550 1.00 0.00 H new ATOM 0 H6 C B 14 -6.976 11.714 2.382 1.00 0.00 H new ATOM 450 P A B 15 -10.065 7.465 1.271 1.00 0.00 P ATOM 451 OP1 A B 15 -11.308 6.666 1.421 1.00 0.00 O ATOM 452 OP2 A B 15 -8.977 7.279 2.265 1.00 0.00 O1- ATOM 453 O5' A B 15 -9.438 7.204 -0.194 1.00 0.00 O ATOM 454 C5' A B 15 -10.262 7.107 -1.343 1.00 0.00 C ATOM 455 C4' A B 15 -9.431 7.002 -2.629 1.00 0.00 C ATOM 456 O4' A B 15 -8.554 8.108 -2.824 1.00 0.00 O ATOM 457 C3' A B 15 -8.554 5.745 -2.723 1.00 0.00 C ATOM 458 O3' A B 15 -9.303 4.598 -3.098 1.00 0.00 O ATOM 459 C2' A B 15 -7.599 6.177 -3.840 1.00 0.00 C ATOM 460 O2' A B 15 -8.221 6.177 -5.132 1.00 0.00 O ATOM 461 C1' A B 15 -7.360 7.647 -3.461 1.00 0.00 C ATOM 462 N9 A B 15 -6.190 7.766 -2.558 1.00 0.00 N ATOM 463 C8 A B 15 -6.160 7.906 -1.194 1.00 0.00 C ATOM 464 N7 A B 15 -4.957 8.013 -0.683 1.00 0.00 N ATOM 465 C5 A B 15 -4.131 7.929 -1.820 1.00 0.00 C ATOM 466 C6 A B 15 -2.731 7.977 -2.063 1.00 0.00 C ATOM 467 N6 A B 15 -1.814 8.178 -1.136 1.00 0.00 N ATOM 468 N1 A B 15 -2.230 7.843 -3.286 1.00 0.00 N ATOM 469 C2 A B 15 -3.082 7.656 -4.286 1.00 0.00 C ATOM 470 N3 A B 15 -4.414 7.609 -4.232 1.00 0.00 N ATOM 471 C4 A B 15 -4.872 7.749 -2.955 1.00 0.00 C ATOM 0 H5' A B 15 -10.912 7.980 -1.400 1.00 0.00 H new ATOM 0 H5'' A B 15 -10.908 6.234 -1.255 1.00 0.00 H new ATOM 0 H4' A B 15 -10.205 6.971 -3.396 1.00 0.00 H new ATOM 0 H3' A B 15 -8.077 5.451 -1.788 1.00 0.00 H new ATOM 0 H2' A B 15 -6.728 5.526 -3.912 1.00 0.00 H new ATOM 0 HO2' A B 15 -9.005 5.590 -5.117 1.00 0.00 H new ATOM 0 H1' A B 15 -7.140 8.251 -4.342 1.00 0.00 H new ATOM 0 H8 A B 15 -7.055 7.926 -0.590 1.00 0.00 H new ATOM 0 H61 A B 15 -0.827 8.199 -1.391 1.00 0.00 H new ATOM 0 H62 A B 15 -2.092 8.313 -0.164 1.00 0.00 H new ATOM 0 H2 A B 15 -2.643 7.526 -5.264 1.00 0.00 H new ATOM 483 P C B 16 -8.815 3.117 -2.735 1.00 0.00 P ATOM 484 OP1 C B 16 -9.845 2.185 -3.246 1.00 0.00 O ATOM 485 OP2 C B 16 -8.465 3.063 -1.301 1.00 0.00 O1- ATOM 486 O5' C B 16 -7.466 2.922 -3.582 1.00 0.00 O ATOM 487 C5' C B 16 -7.484 2.701 -4.989 1.00 0.00 C ATOM 488 C4' C B 16 -6.072 2.552 -5.582 1.00 0.00 C ATOM 489 O4' C B 16 -5.288 3.722 -5.347 1.00 0.00 O ATOM 490 C3' C B 16 -5.260 1.358 -5.065 1.00 0.00 C ATOM 491 O3' C B 16 -5.521 0.146 -5.764 1.00 0.00 O ATOM 492 C2' C B 16 -3.826 1.834 -5.373 1.00 0.00 C ATOM 493 O2' C B 16 -3.416 1.524 -6.705 1.00 0.00 O ATOM 494 C1' C B 16 -3.918 3.366 -5.273 1.00 0.00 C ATOM 495 N1 C B 16 -3.273 3.873 -4.026 1.00 0.00 N ATOM 496 C2 C B 16 -1.897 4.131 -4.055 1.00 0.00 C ATOM 497 O2 C B 16 -1.242 4.046 -5.094 1.00 0.00 O ATOM 498 N3 C B 16 -1.225 4.482 -2.920 1.00 0.00 N ATOM 499 C4 C B 16 -1.921 4.621 -1.804 1.00 0.00 C ATOM 500 N4 C B 16 -1.217 4.877 -0.735 1.00 0.00 N ATOM 501 C5 C B 16 -3.322 4.403 -1.720 1.00 0.00 C ATOM 502 C6 C B 16 -3.971 4.019 -2.847 1.00 0.00 C ATOM 0 H5' C B 16 -7.993 3.532 -5.477 1.00 0.00 H new ATOM 0 H5'' C B 16 -8.061 1.802 -5.205 1.00 0.00 H new ATOM 0 H4' C B 16 -6.264 2.387 -6.642 1.00 0.00 H new ATOM 0 H3' C B 16 -5.480 1.119 -4.024 1.00 0.00 H new ATOM 0 H2' C B 16 -3.115 1.358 -4.697 1.00 0.00 H new ATOM 0 HO2' C B 16 -4.017 0.849 -7.084 1.00 0.00 H new ATOM 0 H1' C B 16 -3.374 3.830 -6.096 1.00 0.00 H new ATOM 0 H41 C B 16 -1.682 4.998 0.165 1.00 0.00 H new ATOM 0 H42 C B 16 -0.202 4.956 -0.800 1.00 0.00 H new ATOM 0 H5 C B 16 -3.853 4.539 -0.789 1.00 0.00 H new ATOM 0 H6 C B 16 -5.034 3.828 -2.821 1.00 0.00 H new ATOM 514 P G B 17 -6.312 -1.083 -5.091 1.00 0.00 P ATOM 515 OP1 G B 17 -6.703 -2.014 -6.182 1.00 0.00 O ATOM 516 OP2 G B 17 -7.372 -0.560 -4.195 1.00 0.00 O1- ATOM 517 O5' G B 17 -5.213 -1.814 -4.162 1.00 0.00 O ATOM 518 C5' G B 17 -4.358 -2.850 -4.642 1.00 0.00 C ATOM 519 C4' G B 17 -3.327 -2.354 -5.671 1.00 0.00 C ATOM 520 O4' G B 17 -2.492 -1.326 -5.143 1.00 0.00 O ATOM 521 C3' G B 17 -2.419 -3.517 -6.096 1.00 0.00 C ATOM 522 O3' G B 17 -2.892 -4.169 -7.265 1.00 0.00 O ATOM 523 C2' G B 17 -1.090 -2.803 -6.352 1.00 0.00 C ATOM 524 O2' G B 17 -1.011 -2.192 -7.632 1.00 0.00 O ATOM 525 C1' G B 17 -1.120 -1.698 -5.297 1.00 0.00 C ATOM 526 N9 G B 17 -0.552 -2.120 -3.984 1.00 0.00 N ATOM 527 C8 G B 17 -1.189 -2.161 -2.768 1.00 0.00 C ATOM 528 N7 G B 17 -0.403 -2.372 -1.741 1.00 0.00 N ATOM 529 C5 G B 17 0.869 -2.478 -2.327 1.00 0.00 C ATOM 530 C6 G B 17 2.172 -2.651 -1.743 1.00 0.00 C ATOM 531 O6 G B 17 2.490 -2.723 -0.556 1.00 0.00 O ATOM 532 N1 G B 17 3.184 -2.733 -2.679 1.00 0.00 N ATOM 533 C2 G B 17 2.980 -2.654 -4.014 1.00 0.00 C ATOM 534 N2 G B 17 4.032 -2.808 -4.777 1.00 0.00 N ATOM 535 N3 G B 17 1.802 -2.458 -4.600 1.00 0.00 N ATOM 536 C4 G B 17 0.777 -2.372 -3.702 1.00 0.00 C ATOM 0 H5' G B 17 -4.966 -3.634 -5.094 1.00 0.00 H new ATOM 0 H5'' G B 17 -3.834 -3.300 -3.799 1.00 0.00 H new ATOM 0 H4' G B 17 -3.889 -1.956 -6.516 1.00 0.00 H new ATOM 0 H3' G B 17 -2.361 -4.313 -5.353 1.00 0.00 H new ATOM 0 H2' G B 17 -0.250 -3.496 -6.308 1.00 0.00 H new ATOM 0 HO2' G B 17 -1.645 -2.625 -8.241 1.00 0.00 H new ATOM 0 H1' G B 17 -0.497 -0.867 -5.628 1.00 0.00 H new ATOM 0 H8 G B 17 -2.256 -2.029 -2.666 1.00 0.00 H new ATOM 0 H1 G B 17 4.139 -2.860 -2.345 1.00 0.00 H new ATOM 0 H21 G B 17 3.938 -2.758 -5.791 1.00 0.00 H new ATOM 0 H22 G B 17 4.946 -2.978 -4.357 1.00 0.00 H new ATOM 548 P U B 18 -2.714 -5.748 -7.441 1.00 0.00 P ATOM 549 OP1 U B 18 -3.121 -6.112 -8.818 1.00 0.00 O ATOM 550 OP2 U B 18 -3.396 -6.396 -6.291 1.00 0.00 O1- ATOM 551 O5' U B 18 -1.143 -6.019 -7.275 1.00 0.00 O ATOM 552 C5' U B 18 -0.217 -5.667 -8.297 1.00 0.00 C ATOM 553 C4' U B 18 1.225 -5.929 -7.837 1.00 0.00 C ATOM 554 O4' U B 18 1.579 -5.167 -6.692 1.00 0.00 O ATOM 555 C3' U B 18 1.474 -7.400 -7.484 1.00 0.00 C ATOM 556 O3' U B 18 1.708 -8.147 -8.677 1.00 0.00 O ATOM 557 C2' U B 18 2.688 -7.280 -6.550 1.00 0.00 C ATOM 558 O2' U B 18 3.947 -7.201 -7.217 1.00 0.00 O ATOM 559 C1' U B 18 2.444 -5.930 -5.858 1.00 0.00 C ATOM 560 N1 U B 18 1.902 -6.081 -4.472 1.00 0.00 N ATOM 561 C2 U B 18 2.803 -6.091 -3.405 1.00 0.00 C ATOM 562 O2 U B 18 4.022 -6.086 -3.561 1.00 0.00 O ATOM 563 N3 U B 18 2.278 -6.116 -2.125 1.00 0.00 N ATOM 564 C4 U B 18 0.941 -6.137 -1.804 1.00 0.00 C ATOM 565 O4 U B 18 0.579 -6.176 -0.631 1.00 0.00 O ATOM 566 C5 U B 18 0.060 -6.146 -2.956 1.00 0.00 C ATOM 567 C6 U B 18 0.549 -6.118 -4.230 1.00 0.00 C ATOM 0 H5' U B 18 -0.336 -4.615 -8.556 1.00 0.00 H new ATOM 0 H5'' U B 18 -0.427 -6.243 -9.199 1.00 0.00 H new ATOM 0 H4' U B 18 1.836 -5.637 -8.691 1.00 0.00 H new ATOM 0 H3' U B 18 0.652 -7.934 -7.008 1.00 0.00 H new ATOM 0 H2' U B 18 2.756 -8.159 -5.908 1.00 0.00 H new ATOM 0 HO2' U B 18 4.130 -8.049 -7.673 1.00 0.00 H new ATOM 0 H1' U B 18 3.394 -5.411 -5.730 1.00 0.00 H new ATOM 0 H3 U B 18 2.942 -6.119 -1.351 1.00 0.00 H new ATOM 0 H5 U B 18 -1.009 -6.176 -2.802 1.00 0.00 H new ATOM 0 H6 U B 18 -0.139 -6.125 -5.063 1.00 0.00 H new ATOM 578 P C B 19 1.751 -9.753 -8.654 1.00 0.00 P ATOM 579 OP1 C B 19 1.947 -10.214 -10.048 1.00 0.00 O ATOM 580 OP2 C B 19 0.577 -10.234 -7.882 1.00 0.00 O1- ATOM 581 O5' C B 19 3.091 -10.084 -7.822 1.00 0.00 O ATOM 582 C5' C B 19 3.134 -11.126 -6.869 1.00 0.00 C ATOM 583 C4' C B 19 4.482 -11.122 -6.139 1.00 0.00 C ATOM 584 O4' C B 19 4.675 -9.959 -5.339 1.00 0.00 O ATOM 585 C3' C B 19 4.573 -12.316 -5.195 1.00 0.00 C ATOM 586 O3' C B 19 4.945 -13.515 -5.868 1.00 0.00 O ATOM 587 C2' C B 19 5.609 -11.820 -4.179 1.00 0.00 C ATOM 588 O2' C B 19 6.953 -11.941 -4.648 1.00 0.00 O ATOM 589 C1' C B 19 5.254 -10.327 -4.078 1.00 0.00 C ATOM 590 N1 C B 19 4.325 -10.029 -2.941 1.00 0.00 N ATOM 591 C2 C B 19 4.872 -9.836 -1.669 1.00 0.00 C ATOM 592 O2 C B 19 6.069 -10.025 -1.439 1.00 0.00 O ATOM 593 N3 C B 19 4.099 -9.450 -0.626 1.00 0.00 N ATOM 594 C4 C B 19 2.806 -9.288 -0.822 1.00 0.00 C ATOM 595 N4 C B 19 2.123 -8.883 0.199 1.00 0.00 N ATOM 596 C5 C B 19 2.180 -9.501 -2.082 1.00 0.00 C ATOM 597 C6 C B 19 2.966 -9.889 -3.118 1.00 0.00 C ATOM 0 H5' C B 19 2.982 -12.086 -7.362 1.00 0.00 H new ATOM 0 H5'' C B 19 2.323 -11.005 -6.151 1.00 0.00 H new ATOM 0 H4' C B 19 5.241 -11.156 -6.921 1.00 0.00 H new ATOM 0 H3' C B 19 3.628 -12.601 -4.733 1.00 0.00 H new ATOM 0 H2' C B 19 5.574 -12.386 -3.248 1.00 0.00 H new ATOM 0 HO2' C B 19 6.983 -12.574 -5.395 1.00 0.00 H new ATOM 0 H1' C B 19 6.151 -9.744 -3.869 1.00 0.00 H new ATOM 0 H41 C B 19 1.117 -8.738 0.114 1.00 0.00 H new ATOM 0 H42 C B 19 2.590 -8.709 1.089 1.00 0.00 H new ATOM 0 H5 C B 19 1.117 -9.359 -2.209 1.00 0.00 H new ATOM 0 H6 C B 19 2.525 -10.088 -4.084 1.00 0.00 H new ATOM 609 P G B 20 4.722 -14.942 -5.197 1.00 0.00 P ATOM 610 OP1 G B 20 5.154 -15.979 -6.161 1.00 0.00 O ATOM 611 OP2 G B 20 3.338 -14.980 -4.661 1.00 0.00 O1- ATOM 612 O5' G B 20 5.769 -14.923 -3.978 1.00 0.00 O ATOM 613 C5' G B 20 5.470 -15.516 -2.738 1.00 0.00 C ATOM 614 C4' G B 20 6.580 -15.213 -1.730 1.00 0.00 C ATOM 615 O4' G B 20 6.559 -13.847 -1.314 1.00 0.00 O ATOM 616 C3' G B 20 6.413 -16.061 -0.466 1.00 0.00 C ATOM 617 O3' G B 20 7.005 -17.351 -0.590 1.00 0.00 O ATOM 618 C2' G B 20 7.124 -15.181 0.560 1.00 0.00 C ATOM 619 O2' G B 20 8.539 -15.255 0.471 1.00 0.00 O ATOM 620 C1' G B 20 6.679 -13.783 0.103 1.00 0.00 C ATOM 621 N9 G B 20 5.386 -13.364 0.698 1.00 0.00 N ATOM 622 C8 G B 20 4.232 -12.970 0.061 1.00 0.00 C ATOM 623 N7 G B 20 3.311 -12.490 0.856 1.00 0.00 N ATOM 624 C5 G B 20 3.879 -12.589 2.128 1.00 0.00 C ATOM 625 C6 G B 20 3.413 -12.173 3.424 1.00 0.00 C ATOM 626 O6 G B 20 2.367 -11.613 3.733 1.00 0.00 O ATOM 627 N1 G B 20 4.301 -12.432 4.447 1.00 0.00 N ATOM 628 C2 G B 20 5.496 -13.041 4.257 1.00 0.00 C ATOM 629 N2 G B 20 6.185 -13.333 5.329 1.00 0.00 N ATOM 630 N3 G B 20 5.998 -13.388 3.074 1.00 0.00 N ATOM 631 C4 G B 20 5.138 -13.144 2.038 1.00 0.00 C ATOM 0 H5' G B 20 5.361 -16.594 -2.858 1.00 0.00 H new ATOM 0 H5'' G B 20 4.517 -15.139 -2.366 1.00 0.00 H new ATOM 0 H4' G B 20 7.519 -15.439 -2.236 1.00 0.00 H new ATOM 0 H3' G B 20 5.379 -16.296 -0.215 1.00 0.00 H new ATOM 0 H2' G B 20 6.884 -15.461 1.586 1.00 0.00 H new ATOM 0 HO2' G B 20 8.794 -16.063 -0.021 1.00 0.00 H new ATOM 0 H1' G B 20 7.411 -13.044 0.429 1.00 0.00 H new ATOM 0 H8 G B 20 4.098 -13.050 -1.008 1.00 0.00 H new ATOM 0 H1 G B 20 4.045 -12.151 5.394 1.00 0.00 H new ATOM 0 H21 G B 20 7.092 -13.792 5.243 1.00 0.00 H new ATOM 0 H22 G B 20 5.816 -13.102 6.251 1.00 0.00 H new ATOM 643 P G B 21 6.373 -18.629 0.140 1.00 0.00 P ATOM 644 OP1 G B 21 7.207 -19.810 -0.194 1.00 0.00 O ATOM 645 OP2 G B 21 4.925 -18.656 -0.196 1.00 0.00 O1- ATOM 646 O5' G B 21 6.512 -18.339 1.710 1.00 0.00 O ATOM 647 C5' G B 21 7.781 -18.292 2.345 1.00 0.00 C ATOM 648 C4' G B 21 7.651 -18.208 3.881 1.00 0.00 C ATOM 649 O4' G B 21 6.917 -17.044 4.246 1.00 0.00 O ATOM 650 C3' G B 21 6.925 -19.431 4.456 1.00 0.00 C ATOM 651 O3' G B 21 7.523 -19.812 5.696 1.00 0.00 O ATOM 652 C2' G B 21 5.491 -18.883 4.600 1.00 0.00 C ATOM 653 O2' G B 21 4.688 -19.572 5.556 1.00 0.00 O ATOM 654 C1' G B 21 5.764 -17.434 4.977 1.00 0.00 C ATOM 655 N9 G B 21 4.595 -16.572 4.686 1.00 0.00 N ATOM 656 C8 G B 21 4.035 -16.272 3.471 1.00 0.00 C ATOM 657 N7 G B 21 2.946 -15.543 3.545 1.00 0.00 N ATOM 658 C5 G B 21 2.762 -15.369 4.926 1.00 0.00 C ATOM 659 C6 G B 21 1.734 -14.702 5.703 1.00 0.00 C ATOM 660 O6 G B 21 0.749 -14.072 5.330 1.00 0.00 O ATOM 661 N1 G B 21 1.897 -14.826 7.073 1.00 0.00 N ATOM 662 C2 G B 21 2.929 -15.486 7.646 1.00 0.00 C ATOM 663 N2 G B 21 2.958 -15.541 8.952 1.00 0.00 N ATOM 664 N3 G B 21 3.896 -16.097 6.979 1.00 0.00 N ATOM 665 C4 G B 21 3.764 -16.009 5.626 1.00 0.00 C ATOM 0 H5' G B 21 8.338 -17.429 1.980 1.00 0.00 H new ATOM 0 H5'' G B 21 8.355 -19.179 2.077 1.00 0.00 H new ATOM 0 H4' G B 21 8.662 -18.170 4.287 1.00 0.00 H new ATOM 0 H3' G B 21 6.964 -20.339 3.855 1.00 0.00 H new ATOM 0 H2' G B 21 4.893 -19.007 3.697 1.00 0.00 H new ATOM 0 HO2' G B 21 3.797 -19.165 5.589 1.00 0.00 H new ATOM 0 HO3' G B 21 6.828 -19.898 6.382 1.00 0.00 H new ATOM 0 H1' G B 21 5.939 -17.327 6.048 1.00 0.00 H new ATOM 0 H8 G B 21 4.454 -16.607 2.534 1.00 0.00 H new ATOM 0 H1 G B 21 1.201 -14.396 7.683 1.00 0.00 H new ATOM 0 H21 G B 21 3.719 -16.029 9.425 1.00 0.00 H new ATOM 0 H22 G B 21 2.220 -15.096 9.498 1.00 0.00 H new TER 678 G B 21 HETATM 679 N1 QSV A 101 7.045 0.899 0.625 1.00 0.00 N HETATM 680 C4 QSV A 101 7.164 0.564 -3.100 1.00 0.00 C HETATM 681 C5 QSV A 101 6.390 0.567 -4.264 1.00 0.00 C HETATM 682 C6 QSV A 101 7.450 0.689 -0.589 1.00 0.00 C HETATM 683 C7 QSV A 101 8.936 0.486 -0.777 1.00 0.00 C HETATM 684 C8 QSV A 101 5.349 1.533 2.219 1.00 0.00 C HETATM 685 C1 QSV A 101 4.385 0.687 -2.915 1.00 0.00 C HETATM 686 C2 QSV A 101 5.166 0.668 -1.749 1.00 0.00 C HETATM 687 C3 QSV A 101 6.571 0.647 -1.822 1.00 0.00 C HETATM 688 C9 QSV A 101 3.426 2.970 1.385 1.00 0.00 C HETATM 689 C4' QSV A 101 0.186 1.018 -3.528 1.00 0.00 C HETATM 690 C3' QSV A 101 0.624 0.973 -2.188 1.00 0.00 C HETATM 691 C2' QSV A 101 2.002 0.842 -1.931 1.00 0.00 C HETATM 692 C1' QSV A 101 2.909 0.762 -3.003 1.00 0.00 C HETATM 693 C5' QSV A 101 1.089 0.944 -4.593 1.00 0.00 C HETATM 694 C0' QSV A 101 2.440 0.816 -4.311 1.00 0.00 C HETATM 695 C0 QSV A 101 5.008 0.651 -4.157 1.00 0.00 C HETATM 696 S0 QSV A 101 3.796 0.734 -5.460 1.00 0.00 S HETATM 697 N2 QSV A 101 5.893 1.556 0.995 1.00 0.00 N1+ HETATM 698 N3 QSV A 101 5.868 0.905 3.187 1.00 0.00 N HETATM 699 N4 QSV A 101 4.106 2.006 2.270 1.00 0.00 N HETATM 700 C6' QSV A 101 -0.331 1.046 -1.036 1.00 0.00 C HETATM 701 C7' QSV A 101 -1.825 1.194 -1.289 1.00 0.00 C HETATM 702 N1' QSV A 101 0.134 1.008 0.175 1.00 0.00 N HETATM 703 N2' QSV A 101 -0.645 1.003 1.304 1.00 0.00 N1+ HETATM 704 C8' QSV A 101 -0.200 0.941 2.562 1.00 0.00 C HETATM 705 N3' QSV A 101 1.006 0.724 2.893 1.00 0.00 N HETATM 706 N4' QSV A 101 -1.172 1.021 3.475 1.00 0.00 N HETATM 707 C9' QSV A 101 -2.433 1.769 3.399 1.00 0.00 C