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 Single : A 1 C O2' : rot -22:sc= 0.0229 USER MOD Single : A 1 C O5' : rot 180:sc= 0 USER MOD Single : A 2 C O2' : rot -29:sc= 0.0224 USER MOD Single : A 3 G O2' : rot -21:sc= 0.0465 USER MOD Single : A 4 G O2' : rot -21:sc= 0.0166 USER MOD Single : A 5 C O2' : rot -20:sc= 0.0976 USER MOD Single : A 6 A O2' : rot -15:sc= 0.788 USER MOD Single : A 7 G O2' : rot -22:sc= 0.00772 USER MOD Single : A 8 U O2' : rot -70:sc= 0.0618 USER MOD Single : A 9 G O2' : rot -24:sc= 0.0683 USER MOD Single : A 10 U O2' : rot -73:sc= 0.0854 USER MOD Single : A 11 G O2' : rot 180:sc= 0 USER MOD Single : A 11 G O3' : rot 135:sc= 0.0251 USER MOD Single : B 12 C O2' : rot -70:sc= 0.0941 USER MOD Single : B 12 C O5' : rot 180:sc= 0 USER MOD Single : B 13 A O2' : rot -19:sc= 0.0394 USER MOD Single : B 14 C O2' : rot -24:sc= 0.0108 USER MOD Single : B 15 A O2' : rot -21:sc= 0.00837 USER MOD Single : B 16 C O2' : rot 180:sc= 0 USER MOD Single : B 17 G O2' : rot -18:sc= 0.0341 USER MOD Single : B 18 U O2' : rot -15:sc= 0.0336 USER MOD Single : B 19 C O2' : rot -19:sc= 0.0176 USER MOD Single : B 20 G O2' : rot -20:sc=-0.00108 USER MOD Single : B 21 G O2' : rot 180:sc= 0 USER MOD Single : B 21 G O3' : rot 132:sc= 0.0579 USER MOD ----------------------------------------------------------------- ATOM 1 O5' C A 1 -2.632 -0.398 11.831 1.00 0.00 O ATOM 2 C5' C A 1 -1.392 -0.884 11.322 1.00 0.00 C ATOM 3 C4' C A 1 -1.138 -2.361 11.648 1.00 0.00 C ATOM 4 O4' C A 1 -2.051 -3.224 10.979 1.00 0.00 O ATOM 5 C3' C A 1 0.251 -2.798 11.185 1.00 0.00 C ATOM 6 O3' C A 1 1.310 -2.397 12.053 1.00 0.00 O ATOM 7 C2' C A 1 0.048 -4.324 11.173 1.00 0.00 C ATOM 8 O2' C A 1 0.059 -4.902 12.477 1.00 0.00 O ATOM 9 C1' C A 1 -1.377 -4.441 10.622 1.00 0.00 C ATOM 10 N1 C A 1 -1.368 -4.675 9.138 1.00 0.00 N ATOM 11 C2 C A 1 -1.197 -5.984 8.674 1.00 0.00 C ATOM 12 O2 C A 1 -0.964 -6.928 9.431 1.00 0.00 O ATOM 13 N3 C A 1 -1.252 -6.268 7.347 1.00 0.00 N ATOM 14 C4 C A 1 -1.508 -5.283 6.499 1.00 0.00 C ATOM 15 N4 C A 1 -1.615 -5.613 5.247 1.00 0.00 N ATOM 16 C5 C A 1 -1.674 -3.929 6.910 1.00 0.00 C ATOM 17 C6 C A 1 -1.596 -3.667 8.233 1.00 0.00 C ATOM 0 H5' C A 1 -0.579 -0.284 11.731 1.00 0.00 H new ATOM 0 H5'' C A 1 -1.374 -0.750 10.240 1.00 0.00 H new ATOM 0 H4' C A 1 -1.250 -2.439 12.729 1.00 0.00 H new ATOM 0 H3' C A 1 0.563 -2.354 10.240 1.00 0.00 H new ATOM 0 H2' C A 1 0.834 -4.831 10.614 1.00 0.00 H new ATOM 0 HO2' C A 1 0.536 -4.308 13.094 1.00 0.00 H new ATOM 0 HO5' C A 1 -2.736 0.547 11.593 1.00 0.00 H new ATOM 0 H1' C A 1 -1.898 -5.299 11.046 1.00 0.00 H new ATOM 0 H41 C A 1 -1.811 -4.898 4.546 1.00 0.00 H new ATOM 0 H42 C A 1 -1.503 -6.587 4.965 1.00 0.00 H new ATOM 0 H5 C A 1 -1.855 -3.143 6.192 1.00 0.00 H new ATOM 0 H6 C A 1 -1.714 -2.652 8.584 1.00 0.00 H new ATOM 30 P C A 2 2.816 -2.252 11.497 1.00 0.00 P ATOM 31 OP1 C A 2 3.675 -1.787 12.611 1.00 0.00 O ATOM 32 OP2 C A 2 2.776 -1.445 10.252 1.00 0.00 O1- ATOM 33 O5' C A 2 3.251 -3.744 11.095 1.00 0.00 O ATOM 34 C5' C A 2 3.592 -4.710 12.082 1.00 0.00 C ATOM 35 C4' C A 2 3.870 -6.092 11.485 1.00 0.00 C ATOM 36 O4' C A 2 2.757 -6.649 10.794 1.00 0.00 O ATOM 37 C3' C A 2 5.047 -6.135 10.501 1.00 0.00 C ATOM 38 O3' C A 2 6.321 -6.040 11.122 1.00 0.00 O ATOM 39 C2' C A 2 4.788 -7.497 9.846 1.00 0.00 C ATOM 40 O2' C A 2 5.180 -8.593 10.671 1.00 0.00 O ATOM 41 C1' C A 2 3.251 -7.506 9.759 1.00 0.00 C ATOM 42 N1 C A 2 2.792 -7.056 8.412 1.00 0.00 N ATOM 43 C2 C A 2 2.736 -8.012 7.383 1.00 0.00 C ATOM 44 O2 C A 2 3.070 -9.175 7.547 1.00 0.00 O ATOM 45 N3 C A 2 2.318 -7.677 6.149 1.00 0.00 N ATOM 46 C4 C A 2 1.991 -6.425 5.905 1.00 0.00 C ATOM 47 N4 C A 2 1.589 -6.166 4.691 1.00 0.00 N ATOM 48 C5 C A 2 2.056 -5.401 6.882 1.00 0.00 C ATOM 49 C6 C A 2 2.464 -5.750 8.132 1.00 0.00 C ATOM 0 H5' C A 2 2.780 -4.788 12.804 1.00 0.00 H new ATOM 0 H5'' C A 2 4.472 -4.371 12.628 1.00 0.00 H new ATOM 0 H4' C A 2 4.107 -6.676 12.374 1.00 0.00 H new ATOM 0 H3' C A 2 5.088 -5.293 9.810 1.00 0.00 H new ATOM 0 H2' C A 2 5.335 -7.610 8.910 1.00 0.00 H new ATOM 0 HO2' C A 2 5.919 -8.317 11.252 1.00 0.00 H new ATOM 0 H1' C A 2 2.865 -8.516 9.896 1.00 0.00 H new ATOM 0 H41 C A 2 1.320 -5.216 4.434 1.00 0.00 H new ATOM 0 H42 C A 2 1.543 -6.914 3.999 1.00 0.00 H new ATOM 0 H5 C A 2 1.792 -4.381 6.643 1.00 0.00 H new ATOM 0 H6 C A 2 2.530 -5.000 8.906 1.00 0.00 H new ATOM 61 P G A 3 7.576 -5.467 10.293 1.00 0.00 P ATOM 62 OP1 G A 3 8.732 -5.408 11.219 1.00 0.00 O ATOM 63 OP2 G A 3 7.140 -4.227 9.611 1.00 0.00 O1- ATOM 64 O5' G A 3 7.869 -6.572 9.162 1.00 0.00 O ATOM 65 C5' G A 3 8.491 -7.805 9.490 1.00 0.00 C ATOM 66 C4' G A 3 8.720 -8.668 8.245 1.00 0.00 C ATOM 67 O4' G A 3 7.496 -9.046 7.634 1.00 0.00 O ATOM 68 C3' G A 3 9.555 -7.961 7.171 1.00 0.00 C ATOM 69 O3' G A 3 10.932 -7.975 7.486 1.00 0.00 O ATOM 70 C2' G A 3 9.198 -8.848 5.962 1.00 0.00 C ATOM 71 O2' G A 3 9.934 -10.072 5.936 1.00 0.00 O ATOM 72 C1' G A 3 7.721 -9.173 6.228 1.00 0.00 C ATOM 73 N9 G A 3 6.812 -8.255 5.483 1.00 0.00 N ATOM 74 C8 G A 3 6.227 -7.086 5.891 1.00 0.00 C ATOM 75 N7 G A 3 5.419 -6.550 5.015 1.00 0.00 N ATOM 76 C5 G A 3 5.487 -7.427 3.922 1.00 0.00 C ATOM 77 C6 G A 3 4.809 -7.443 2.649 1.00 0.00 C ATOM 78 O6 G A 3 3.966 -6.668 2.196 1.00 0.00 O ATOM 79 N1 G A 3 5.176 -8.504 1.850 1.00 0.00 N ATOM 80 C2 G A 3 6.067 -9.452 2.220 1.00 0.00 C ATOM 81 N2 G A 3 6.376 -10.381 1.352 1.00 0.00 N ATOM 82 N3 G A 3 6.697 -9.503 3.389 1.00 0.00 N ATOM 83 C4 G A 3 6.368 -8.461 4.202 1.00 0.00 C ATOM 0 H5' G A 3 7.870 -8.349 10.202 1.00 0.00 H new ATOM 0 H5'' G A 3 9.445 -7.613 9.981 1.00 0.00 H new ATOM 0 H4' G A 3 9.259 -9.542 8.612 1.00 0.00 H new ATOM 0 H3' G A 3 9.354 -6.899 7.030 1.00 0.00 H new ATOM 0 H2' G A 3 9.415 -8.352 5.016 1.00 0.00 H new ATOM 0 HO2' G A 3 10.747 -9.977 6.475 1.00 0.00 H new ATOM 0 H1' G A 3 7.506 -10.185 5.885 1.00 0.00 H new ATOM 0 H8 G A 3 6.418 -6.643 6.857 1.00 0.00 H new ATOM 0 H1 G A 3 4.751 -8.579 0.926 1.00 0.00 H new ATOM 0 H21 G A 3 7.045 -11.110 1.601 1.00 0.00 H new ATOM 0 H22 G A 3 5.948 -10.376 0.426 1.00 0.00 H new ATOM 95 P G A 4 11.946 -6.952 6.780 1.00 0.00 P ATOM 96 OP1 G A 4 13.304 -7.299 7.264 1.00 0.00 O ATOM 97 OP2 G A 4 11.432 -5.571 6.948 1.00 0.00 O1- ATOM 98 O5' G A 4 11.860 -7.364 5.230 1.00 0.00 O ATOM 99 C5' G A 4 11.530 -6.422 4.220 1.00 0.00 C ATOM 100 C4' G A 4 11.567 -7.084 2.841 1.00 0.00 C ATOM 101 O4' G A 4 10.343 -7.744 2.520 1.00 0.00 O ATOM 102 C3' G A 4 11.779 -6.065 1.726 1.00 0.00 C ATOM 103 O3' G A 4 13.129 -5.628 1.629 1.00 0.00 O ATOM 104 C2' G A 4 11.323 -6.903 0.518 1.00 0.00 C ATOM 105 O2' G A 4 12.305 -7.849 0.069 1.00 0.00 O ATOM 106 C1' G A 4 10.125 -7.668 1.111 1.00 0.00 C ATOM 107 N9 G A 4 8.845 -6.984 0.809 1.00 0.00 N ATOM 108 C8 G A 4 8.097 -6.133 1.583 1.00 0.00 C ATOM 109 N7 G A 4 6.996 -5.719 1.021 1.00 0.00 N ATOM 110 C5 G A 4 7.015 -6.323 -0.249 1.00 0.00 C ATOM 111 C6 G A 4 6.085 -6.282 -1.356 1.00 0.00 C ATOM 112 O6 G A 4 4.997 -5.704 -1.464 1.00 0.00 O ATOM 113 N1 G A 4 6.530 -6.963 -2.470 1.00 0.00 N ATOM 114 C2 G A 4 7.695 -7.660 -2.508 1.00 0.00 C ATOM 115 N2 G A 4 7.981 -8.274 -3.625 1.00 0.00 N ATOM 116 N3 G A 4 8.557 -7.768 -1.500 1.00 0.00 N ATOM 117 C4 G A 4 8.167 -7.069 -0.391 1.00 0.00 C ATOM 0 H5' G A 4 12.231 -5.588 4.249 1.00 0.00 H new ATOM 0 H5'' G A 4 10.538 -6.011 4.407 1.00 0.00 H new ATOM 0 H4' G A 4 12.392 -7.793 2.902 1.00 0.00 H new ATOM 0 H3' G A 4 11.244 -5.124 1.853 1.00 0.00 H new ATOM 0 H2' G A 4 11.117 -6.281 -0.353 1.00 0.00 H new ATOM 0 HO2' G A 4 13.191 -7.576 0.386 1.00 0.00 H new ATOM 0 H1' G A 4 10.051 -8.663 0.673 1.00 0.00 H new ATOM 0 H8 G A 4 8.396 -5.831 2.576 1.00 0.00 H new ATOM 0 H1 G A 4 5.953 -6.942 -3.311 1.00 0.00 H new ATOM 0 H21 G A 4 8.844 -8.811 -3.705 1.00 0.00 H new ATOM 0 H22 G A 4 7.341 -8.216 -4.417 1.00 0.00 H new ATOM 129 P C A 5 13.463 -4.121 1.222 1.00 0.00 P ATOM 130 OP1 C A 5 14.934 -3.951 1.332 1.00 0.00 O ATOM 131 OP2 C A 5 12.587 -3.216 2.004 1.00 0.00 O1- ATOM 132 O5' C A 5 13.023 -4.014 -0.310 1.00 0.00 O ATOM 133 C5' C A 5 13.759 -4.649 -1.346 1.00 0.00 C ATOM 134 C4' C A 5 13.079 -4.487 -2.717 1.00 0.00 C ATOM 135 O4' C A 5 11.833 -5.183 -2.763 1.00 0.00 O ATOM 136 C3' C A 5 12.769 -3.041 -3.145 1.00 0.00 C ATOM 137 O3' C A 5 13.851 -2.340 -3.733 1.00 0.00 O ATOM 138 C2' C A 5 11.667 -3.284 -4.185 1.00 0.00 C ATOM 139 O2' C A 5 12.177 -3.630 -5.467 1.00 0.00 O ATOM 140 C1' C A 5 10.916 -4.486 -3.603 1.00 0.00 C ATOM 141 N1 C A 5 9.705 -4.038 -2.854 1.00 0.00 N ATOM 142 C2 C A 5 8.506 -3.907 -3.564 1.00 0.00 C ATOM 143 O2 C A 5 8.420 -4.131 -4.774 1.00 0.00 O ATOM 144 N3 C A 5 7.373 -3.482 -2.957 1.00 0.00 N ATOM 145 C4 C A 5 7.427 -3.177 -1.682 1.00 0.00 C ATOM 146 N4 C A 5 6.300 -2.815 -1.136 1.00 0.00 N ATOM 147 C5 C A 5 8.622 -3.243 -0.914 1.00 0.00 C ATOM 148 C6 C A 5 9.749 -3.680 -1.527 1.00 0.00 C ATOM 0 H5' C A 5 13.866 -5.709 -1.117 1.00 0.00 H new ATOM 0 H5'' C A 5 14.764 -4.229 -1.387 1.00 0.00 H new ATOM 0 H4' C A 5 13.823 -4.895 -3.401 1.00 0.00 H new ATOM 0 H3' C A 5 12.511 -2.411 -2.294 1.00 0.00 H new ATOM 0 H2' C A 5 11.064 -2.390 -4.346 1.00 0.00 H new ATOM 0 HO2' C A 5 13.113 -3.348 -5.534 1.00 0.00 H new ATOM 0 H1' C A 5 10.558 -5.147 -4.392 1.00 0.00 H new ATOM 0 H41 C A 5 6.269 -2.564 -0.148 1.00 0.00 H new ATOM 0 H42 C A 5 5.449 -2.783 -1.697 1.00 0.00 H new ATOM 0 H5 C A 5 8.631 -2.954 0.126 1.00 0.00 H new ATOM 0 H6 C A 5 10.676 -3.747 -0.977 1.00 0.00 H new ATOM 160 P A A 6 14.936 -1.540 -2.878 1.00 0.00 P ATOM 161 OP1 A A 6 16.168 -2.364 -2.789 1.00 0.00 O ATOM 162 OP2 A A 6 14.302 -1.030 -1.639 1.00 0.00 O1- ATOM 163 O5' A A 6 15.235 -0.273 -3.823 1.00 0.00 O ATOM 164 C5' A A 6 14.174 0.623 -4.171 1.00 0.00 C ATOM 165 C4' A A 6 14.695 1.800 -5.000 1.00 0.00 C ATOM 166 O4' A A 6 15.251 1.332 -6.224 1.00 0.00 O ATOM 167 C3' A A 6 13.520 2.744 -5.351 1.00 0.00 C ATOM 168 O3' A A 6 13.983 4.088 -5.362 1.00 0.00 O ATOM 169 C2' A A 6 13.127 2.244 -6.755 1.00 0.00 C ATOM 170 O2' A A 6 12.471 3.192 -7.591 1.00 0.00 O ATOM 171 C1' A A 6 14.506 1.875 -7.313 1.00 0.00 C ATOM 172 N9 A A 6 14.429 0.940 -8.459 1.00 0.00 N ATOM 173 C8 A A 6 13.819 -0.293 -8.541 1.00 0.00 C ATOM 174 N7 A A 6 13.904 -0.862 -9.724 1.00 0.00 N ATOM 175 C5 A A 6 14.629 0.084 -10.484 1.00 0.00 C ATOM 176 C6 A A 6 15.109 0.151 -11.821 1.00 0.00 C ATOM 177 N6 A A 6 14.945 -0.774 -12.750 1.00 0.00 N ATOM 178 N1 A A 6 15.787 1.218 -12.253 1.00 0.00 N ATOM 179 C2 A A 6 16.004 2.201 -11.394 1.00 0.00 C ATOM 180 N3 A A 6 15.624 2.286 -10.123 1.00 0.00 N ATOM 181 C4 A A 6 14.938 1.185 -9.720 1.00 0.00 C ATOM 0 H5' A A 6 13.697 0.996 -3.265 1.00 0.00 H new ATOM 0 H5'' A A 6 13.411 0.086 -4.735 1.00 0.00 H new ATOM 0 H4' A A 6 15.454 2.322 -4.417 1.00 0.00 H new ATOM 0 H3' A A 6 12.683 2.733 -4.653 1.00 0.00 H new ATOM 0 H2' A A 6 12.387 1.445 -6.712 1.00 0.00 H new ATOM 0 HO2' A A 6 12.163 3.948 -7.049 1.00 0.00 H new ATOM 0 H1' A A 6 14.998 2.759 -7.718 1.00 0.00 H new ATOM 0 H8 A A 6 13.314 -0.753 -7.705 1.00 0.00 H new ATOM 0 H61 A A 6 15.329 -0.632 -13.684 1.00 0.00 H new ATOM 0 H62 A A 6 14.434 -1.630 -12.533 1.00 0.00 H new ATOM 0 H2 A A 6 16.562 3.043 -11.775 1.00 0.00 H new ATOM 193 P G A 7 13.069 5.257 -4.753 1.00 0.00 P ATOM 194 OP1 G A 7 13.738 6.547 -5.070 1.00 0.00 O ATOM 195 OP2 G A 7 12.769 4.930 -3.341 1.00 0.00 O1- ATOM 196 O5' G A 7 11.730 5.136 -5.623 1.00 0.00 O ATOM 197 C5' G A 7 10.587 5.938 -5.379 1.00 0.00 C ATOM 198 C4' G A 7 9.516 5.606 -6.424 1.00 0.00 C ATOM 199 O4' G A 7 8.848 4.380 -6.154 1.00 0.00 O ATOM 200 C3' G A 7 8.401 6.659 -6.482 1.00 0.00 C ATOM 201 O3' G A 7 8.764 7.854 -7.152 1.00 0.00 O ATOM 202 C2' G A 7 7.338 5.870 -7.254 1.00 0.00 C ATOM 203 O2' G A 7 7.625 5.705 -8.641 1.00 0.00 O ATOM 204 C1' G A 7 7.482 4.498 -6.568 1.00 0.00 C ATOM 205 N9 G A 7 6.564 4.399 -5.407 1.00 0.00 N ATOM 206 C8 G A 7 6.855 4.300 -4.061 1.00 0.00 C ATOM 207 N7 G A 7 5.801 4.205 -3.290 1.00 0.00 N ATOM 208 C5 G A 7 4.728 4.237 -4.179 1.00 0.00 C ATOM 209 C6 G A 7 3.305 4.185 -3.963 1.00 0.00 C ATOM 210 O6 G A 7 2.675 4.115 -2.901 1.00 0.00 O ATOM 211 N1 G A 7 2.568 4.247 -5.129 1.00 0.00 N ATOM 212 C2 G A 7 3.124 4.358 -6.358 1.00 0.00 C ATOM 213 N2 G A 7 2.313 4.446 -7.377 1.00 0.00 N ATOM 214 N3 G A 7 4.430 4.421 -6.608 1.00 0.00 N ATOM 215 C4 G A 7 5.194 4.355 -5.472 1.00 0.00 C ATOM 0 H5' G A 7 10.850 6.995 -5.431 1.00 0.00 H new ATOM 0 H5'' G A 7 10.204 5.754 -4.375 1.00 0.00 H new ATOM 0 H4' G A 7 10.074 5.560 -7.359 1.00 0.00 H new ATOM 0 H3' G A 7 8.100 7.032 -5.503 1.00 0.00 H new ATOM 0 H2' G A 7 6.362 6.355 -7.231 1.00 0.00 H new ATOM 0 HO2' G A 7 8.257 6.397 -8.929 1.00 0.00 H new ATOM 0 H1' G A 7 7.219 3.690 -7.251 1.00 0.00 H new ATOM 0 H8 G A 7 7.865 4.301 -3.677 1.00 0.00 H new ATOM 0 H1 G A 7 1.551 4.207 -5.061 1.00 0.00 H new ATOM 0 H21 G A 7 2.688 4.531 -8.322 1.00 0.00 H new ATOM 0 H22 G A 7 1.304 4.430 -7.229 1.00 0.00 H new ATOM 227 P U A 8 8.034 9.241 -6.800 1.00 0.00 P ATOM 228 OP1 U A 8 8.657 10.288 -7.648 1.00 0.00 O ATOM 229 OP2 U A 8 8.061 9.406 -5.326 1.00 0.00 O1- ATOM 230 O5' U A 8 6.503 9.037 -7.261 1.00 0.00 O ATOM 231 C5' U A 8 6.144 9.013 -8.631 1.00 0.00 C ATOM 232 C4' U A 8 4.640 8.823 -8.840 1.00 0.00 C ATOM 233 O4' U A 8 4.146 7.641 -8.221 1.00 0.00 O ATOM 234 C3' U A 8 3.795 9.979 -8.291 1.00 0.00 C ATOM 235 O3' U A 8 3.896 11.145 -9.103 1.00 0.00 O ATOM 236 C2' U A 8 2.425 9.285 -8.303 1.00 0.00 C ATOM 237 O2' U A 8 1.854 9.232 -9.609 1.00 0.00 O ATOM 238 C1' U A 8 2.779 7.858 -7.851 1.00 0.00 C ATOM 239 N1 U A 8 2.535 7.697 -6.389 1.00 0.00 N ATOM 240 C2 U A 8 1.204 7.530 -5.957 1.00 0.00 C ATOM 241 O2 U A 8 0.229 7.496 -6.712 1.00 0.00 O ATOM 242 N3 U A 8 0.990 7.420 -4.607 1.00 0.00 N ATOM 243 C4 U A 8 1.950 7.470 -3.625 1.00 0.00 C ATOM 244 O4 U A 8 1.623 7.398 -2.440 1.00 0.00 O ATOM 245 C5 U A 8 3.300 7.617 -4.134 1.00 0.00 C ATOM 246 C6 U A 8 3.564 7.728 -5.464 1.00 0.00 C ATOM 0 H5' U A 8 6.681 8.207 -9.130 1.00 0.00 H new ATOM 0 H5'' U A 8 6.458 9.945 -9.102 1.00 0.00 H new ATOM 0 H4' U A 8 4.541 8.768 -9.924 1.00 0.00 H new ATOM 0 H3' U A 8 4.076 10.382 -7.318 1.00 0.00 H new ATOM 0 H2' U A 8 1.695 9.804 -7.682 1.00 0.00 H new ATOM 0 HO2' U A 8 1.591 10.134 -9.888 1.00 0.00 H new ATOM 0 H1' U A 8 2.150 7.108 -8.332 1.00 0.00 H new ATOM 0 H3 U A 8 0.025 7.288 -4.302 1.00 0.00 H new ATOM 0 H5 U A 8 4.123 7.639 -3.434 1.00 0.00 H new ATOM 0 H6 U A 8 4.584 7.841 -5.800 1.00 0.00 H new ATOM 257 P G A 9 3.191 12.525 -8.690 1.00 0.00 P ATOM 258 OP1 G A 9 3.693 13.565 -9.620 1.00 0.00 O ATOM 259 OP2 G A 9 3.325 12.715 -7.230 1.00 0.00 O1- ATOM 260 O5' G A 9 1.650 12.234 -9.038 1.00 0.00 O ATOM 261 C5' G A 9 0.604 12.947 -8.403 1.00 0.00 C ATOM 262 C4' G A 9 -0.736 12.236 -8.657 1.00 0.00 C ATOM 263 O4' G A 9 -0.745 10.930 -8.089 1.00 0.00 O ATOM 264 C3' G A 9 -1.921 13.009 -8.048 1.00 0.00 C ATOM 265 O3' G A 9 -2.485 13.938 -8.968 1.00 0.00 O ATOM 266 C2' G A 9 -2.884 11.866 -7.716 1.00 0.00 C ATOM 267 O2' G A 9 -3.607 11.400 -8.850 1.00 0.00 O ATOM 268 C1' G A 9 -1.917 10.762 -7.294 1.00 0.00 C ATOM 269 N9 G A 9 -1.552 10.813 -5.846 1.00 0.00 N ATOM 270 C8 G A 9 -0.315 11.024 -5.274 1.00 0.00 C ATOM 271 N7 G A 9 -0.301 10.887 -3.979 1.00 0.00 N ATOM 272 C5 G A 9 -1.622 10.578 -3.653 1.00 0.00 C ATOM 273 C6 G A 9 -2.263 10.314 -2.383 1.00 0.00 C ATOM 274 O6 G A 9 -1.772 10.260 -1.252 1.00 0.00 O ATOM 275 N1 G A 9 -3.622 10.089 -2.491 1.00 0.00 N ATOM 276 C2 G A 9 -4.299 10.079 -3.664 1.00 0.00 C ATOM 277 N2 G A 9 -5.590 9.888 -3.632 1.00 0.00 N ATOM 278 N3 G A 9 -3.736 10.290 -4.853 1.00 0.00 N ATOM 279 C4 G A 9 -2.397 10.545 -4.785 1.00 0.00 C ATOM 0 H5' G A 9 0.563 13.968 -8.784 1.00 0.00 H new ATOM 0 H5'' G A 9 0.794 13.014 -7.332 1.00 0.00 H new ATOM 0 H4' G A 9 -0.844 12.183 -9.740 1.00 0.00 H new ATOM 0 H3' G A 9 -1.655 13.628 -7.191 1.00 0.00 H new ATOM 0 H2' G A 9 -3.633 12.168 -6.984 1.00 0.00 H new ATOM 0 HO2' G A 9 -3.656 12.112 -9.522 1.00 0.00 H new ATOM 0 H1' G A 9 -2.396 9.794 -7.444 1.00 0.00 H new ATOM 0 H8 G A 9 0.563 11.280 -5.848 1.00 0.00 H new ATOM 0 H1 G A 9 -4.148 9.920 -1.634 1.00 0.00 H new ATOM 0 H21 G A 9 -6.125 9.876 -4.500 1.00 0.00 H new ATOM 0 H22 G A 9 -6.063 9.751 -2.739 1.00 0.00 H new ATOM 291 P U A 10 -3.051 15.338 -8.455 1.00 0.00 P ATOM 292 OP1 U A 10 -3.566 16.088 -9.628 1.00 0.00 O ATOM 293 OP2 U A 10 -2.016 15.985 -7.601 1.00 0.00 O1- ATOM 294 O5' U A 10 -4.279 14.964 -7.507 1.00 0.00 O ATOM 295 C5' U A 10 -5.508 14.467 -8.018 1.00 0.00 C ATOM 296 C4' U A 10 -6.522 14.166 -6.908 1.00 0.00 C ATOM 297 O4' U A 10 -6.136 13.062 -6.090 1.00 0.00 O ATOM 298 C3' U A 10 -6.776 15.353 -5.974 1.00 0.00 C ATOM 299 O3' U A 10 -7.627 16.336 -6.558 1.00 0.00 O ATOM 300 C2' U A 10 -7.391 14.601 -4.784 1.00 0.00 C ATOM 301 O2' U A 10 -8.762 14.260 -4.984 1.00 0.00 O ATOM 302 C1' U A 10 -6.560 13.316 -4.746 1.00 0.00 C ATOM 303 N1 U A 10 -5.410 13.415 -3.791 1.00 0.00 N ATOM 304 C2 U A 10 -5.661 13.156 -2.440 1.00 0.00 C ATOM 305 O2 U A 10 -6.779 12.889 -1.989 1.00 0.00 O ATOM 306 N3 U A 10 -4.581 13.194 -1.583 1.00 0.00 N ATOM 307 C4 U A 10 -3.296 13.519 -1.932 1.00 0.00 C ATOM 308 O4 U A 10 -2.415 13.534 -1.073 1.00 0.00 O ATOM 309 C5 U A 10 -3.098 13.788 -3.335 1.00 0.00 C ATOM 310 C6 U A 10 -4.130 13.736 -4.213 1.00 0.00 C ATOM 0 H5' U A 10 -5.320 13.559 -8.591 1.00 0.00 H new ATOM 0 H5'' U A 10 -5.933 15.196 -8.707 1.00 0.00 H new ATOM 0 H4' U A 10 -7.435 13.930 -7.455 1.00 0.00 H new ATOM 0 H3' U A 10 -5.905 15.955 -5.717 1.00 0.00 H new ATOM 0 H2' U A 10 -7.373 15.202 -3.875 1.00 0.00 H new ATOM 0 HO2' U A 10 -9.314 15.066 -4.908 1.00 0.00 H new ATOM 0 H1' U A 10 -7.156 12.483 -4.373 1.00 0.00 H new ATOM 0 H3 U A 10 -4.753 12.960 -0.605 1.00 0.00 H new ATOM 0 H5 U A 10 -2.110 14.035 -3.693 1.00 0.00 H new ATOM 0 H6 U A 10 -3.952 13.948 -5.257 1.00 0.00 H new ATOM 321 P G A 11 -7.944 17.713 -5.808 1.00 0.00 P ATOM 322 OP1 G A 11 -8.730 18.577 -6.729 1.00 0.00 O ATOM 323 OP2 G A 11 -6.680 18.237 -5.224 1.00 0.00 O1- ATOM 324 O5' G A 11 -8.918 17.252 -4.612 1.00 0.00 O ATOM 325 C5' G A 11 -9.111 18.074 -3.465 1.00 0.00 C ATOM 326 C4' G A 11 -9.902 17.309 -2.382 1.00 0.00 C ATOM 327 O4' G A 11 -9.088 16.261 -1.854 1.00 0.00 O ATOM 328 C3' G A 11 -10.270 18.218 -1.188 1.00 0.00 C ATOM 329 O3' G A 11 -11.453 17.735 -0.556 1.00 0.00 O ATOM 330 C2' G A 11 -9.017 18.086 -0.324 1.00 0.00 C ATOM 331 O2' G A 11 -9.226 18.447 1.034 1.00 0.00 O ATOM 332 C1' G A 11 -8.671 16.609 -0.530 1.00 0.00 C ATOM 333 N9 G A 11 -7.220 16.367 -0.360 1.00 0.00 N ATOM 334 C8 G A 11 -6.204 16.471 -1.285 1.00 0.00 C ATOM 335 N7 G A 11 -5.001 16.302 -0.788 1.00 0.00 N ATOM 336 C5 G A 11 -5.241 16.037 0.569 1.00 0.00 C ATOM 337 C6 G A 11 -4.348 15.788 1.677 1.00 0.00 C ATOM 338 O6 G A 11 -3.121 15.749 1.708 1.00 0.00 O ATOM 339 N1 G A 11 -4.995 15.579 2.883 1.00 0.00 N ATOM 340 C2 G A 11 -6.342 15.578 3.023 1.00 0.00 C ATOM 341 N2 G A 11 -6.830 15.367 4.218 1.00 0.00 N ATOM 342 N3 G A 11 -7.202 15.797 2.033 1.00 0.00 N ATOM 343 C4 G A 11 -6.597 16.050 0.829 1.00 0.00 C ATOM 0 H5' G A 11 -9.648 18.980 -3.745 1.00 0.00 H new ATOM 0 H5'' G A 11 -8.146 18.386 -3.067 1.00 0.00 H new ATOM 0 H4' G A 11 -10.809 16.933 -2.856 1.00 0.00 H new ATOM 0 H3' G A 11 -10.504 19.255 -1.430 1.00 0.00 H new ATOM 0 H2' G A 11 -8.211 18.765 -0.602 1.00 0.00 H new ATOM 0 HO2' G A 11 -8.390 18.340 1.533 1.00 0.00 H new ATOM 0 HO3' G A 11 -11.331 17.744 0.416 1.00 0.00 H new ATOM 0 H1' G A 11 -9.180 15.995 0.213 1.00 0.00 H new ATOM 0 H8 G A 11 -6.382 16.674 -2.331 1.00 0.00 H new ATOM 0 H1 G A 11 -4.425 15.417 3.713 1.00 0.00 H new ATOM 0 H21 G A 11 -7.840 15.359 4.362 1.00 0.00 H new ATOM 0 H22 G A 11 -6.201 15.210 5.005 1.00 0.00 H new TER 356 G A 11 ATOM 357 O5' C B 12 -1.360 14.737 12.313 1.00 0.00 O ATOM 358 C5' C B 12 -1.800 13.522 11.703 1.00 0.00 C ATOM 359 C4' C B 12 -3.064 13.683 10.857 1.00 0.00 C ATOM 360 O4' C B 12 -2.829 14.544 9.760 1.00 0.00 O ATOM 361 C3' C B 12 -3.524 12.351 10.250 1.00 0.00 C ATOM 362 O3' C B 12 -4.171 11.486 11.189 1.00 0.00 O ATOM 363 C2' C B 12 -4.430 12.881 9.121 1.00 0.00 C ATOM 364 O2' C B 12 -5.747 13.171 9.600 1.00 0.00 O ATOM 365 C1' C B 12 -3.771 14.212 8.738 1.00 0.00 C ATOM 366 N1 C B 12 -3.116 14.170 7.403 1.00 0.00 N ATOM 367 C2 C B 12 -3.827 14.645 6.289 1.00 0.00 C ATOM 368 O2 C B 12 -5.008 15.009 6.361 1.00 0.00 O ATOM 369 N3 C B 12 -3.252 14.694 5.064 1.00 0.00 N ATOM 370 C4 C B 12 -2.009 14.272 4.940 1.00 0.00 C ATOM 371 N4 C B 12 -1.477 14.395 3.759 1.00 0.00 N ATOM 372 C5 C B 12 -1.240 13.774 6.017 1.00 0.00 C ATOM 373 C6 C B 12 -1.823 13.728 7.240 1.00 0.00 C ATOM 0 H5' C B 12 -1.986 12.781 12.481 1.00 0.00 H new ATOM 0 H5'' C B 12 -1.000 13.130 11.075 1.00 0.00 H new ATOM 0 H4' C B 12 -3.821 14.081 11.533 1.00 0.00 H new ATOM 0 H3' C B 12 -2.725 11.695 9.905 1.00 0.00 H new ATOM 0 H2' C B 12 -4.526 12.160 8.310 1.00 0.00 H new ATOM 0 HO2' C B 12 -6.207 12.334 9.818 1.00 0.00 H new ATOM 0 HO5' C B 12 -0.551 14.565 12.839 1.00 0.00 H new ATOM 0 H1' C B 12 -4.543 14.977 8.660 1.00 0.00 H new ATOM 0 H41 C B 12 -0.518 14.087 3.597 1.00 0.00 H new ATOM 0 H42 C B 12 -2.019 14.799 2.995 1.00 0.00 H new ATOM 0 H5 C B 12 -0.223 13.442 5.870 1.00 0.00 H new ATOM 0 H6 C B 12 -1.273 13.344 8.086 1.00 0.00 H new ATOM 386 P A B 13 -4.564 9.974 10.820 1.00 0.00 P ATOM 387 OP1 A B 13 -5.085 9.324 12.039 1.00 0.00 O ATOM 388 OP2 A B 13 -3.406 9.371 10.113 1.00 0.00 O1- ATOM 389 O5' A B 13 -5.791 10.137 9.784 1.00 0.00 O ATOM 390 C5' A B 13 -5.905 9.338 8.620 1.00 0.00 C ATOM 391 C4' A B 13 -7.005 9.906 7.730 1.00 0.00 C ATOM 392 O4' A B 13 -6.630 11.164 7.180 1.00 0.00 O ATOM 393 C3' A B 13 -7.309 8.994 6.530 1.00 0.00 C ATOM 394 O3' A B 13 -8.229 7.959 6.853 1.00 0.00 O ATOM 395 C2' A B 13 -7.869 10.011 5.528 1.00 0.00 C ATOM 396 O2' A B 13 -9.220 10.357 5.819 1.00 0.00 O ATOM 397 C1' A B 13 -6.990 11.234 5.799 1.00 0.00 C ATOM 398 N9 A B 13 -5.756 11.232 4.977 1.00 0.00 N ATOM 399 C8 A B 13 -4.461 10.998 5.381 1.00 0.00 C ATOM 400 N7 A B 13 -3.563 11.258 4.461 1.00 0.00 N ATOM 401 C5 A B 13 -4.332 11.710 3.378 1.00 0.00 C ATOM 402 C6 A B 13 -4.038 12.197 2.075 1.00 0.00 C ATOM 403 N6 A B 13 -2.837 12.337 1.565 1.00 0.00 N ATOM 404 N1 A B 13 -5.023 12.541 1.238 1.00 0.00 N ATOM 405 C2 A B 13 -6.275 12.444 1.671 1.00 0.00 C ATOM 406 N3 A B 13 -6.699 12.031 2.859 1.00 0.00 N ATOM 407 C4 A B 13 -5.670 11.673 3.676 1.00 0.00 C ATOM 0 H5' A B 13 -6.136 8.308 8.892 1.00 0.00 H new ATOM 0 H5'' A B 13 -4.957 9.321 8.082 1.00 0.00 H new ATOM 0 H4' A B 13 -7.878 9.997 8.377 1.00 0.00 H new ATOM 0 H3' A B 13 -6.450 8.437 6.156 1.00 0.00 H new ATOM 0 H2' A B 13 -7.860 9.636 4.505 1.00 0.00 H new ATOM 0 HO2' A B 13 -9.615 9.673 6.398 1.00 0.00 H new ATOM 0 H1' A B 13 -7.536 12.143 5.547 1.00 0.00 H new ATOM 0 H8 A B 13 -4.208 10.634 6.366 1.00 0.00 H new ATOM 0 H61 A B 13 -2.724 12.696 0.617 1.00 0.00 H new ATOM 0 H62 A B 13 -2.016 12.087 2.117 1.00 0.00 H new ATOM 0 H2 A B 13 -7.042 12.737 0.970 1.00 0.00 H new ATOM 419 P C B 14 -8.145 6.522 6.121 1.00 0.00 P ATOM 420 OP1 C B 14 -9.275 5.694 6.616 1.00 0.00 O ATOM 421 OP2 C B 14 -6.760 6.024 6.291 1.00 0.00 O1- ATOM 422 O5' C B 14 -8.366 6.854 4.571 1.00 0.00 O ATOM 423 C5' C B 14 -9.667 7.120 4.046 1.00 0.00 C ATOM 424 C4' C B 14 -9.612 7.543 2.570 1.00 0.00 C ATOM 425 O4' C B 14 -8.858 8.731 2.384 1.00 0.00 O ATOM 426 C3' C B 14 -8.993 6.502 1.633 1.00 0.00 C ATOM 427 O3' C B 14 -9.853 5.401 1.348 1.00 0.00 O ATOM 428 C2' C B 14 -8.736 7.409 0.416 1.00 0.00 C ATOM 429 O2' C B 14 -9.921 7.727 -0.308 1.00 0.00 O ATOM 430 C1' C B 14 -8.240 8.683 1.096 1.00 0.00 C ATOM 431 N1 C B 14 -6.749 8.716 1.179 1.00 0.00 N ATOM 432 C2 C B 14 -6.033 9.237 0.090 1.00 0.00 C ATOM 433 O2 C B 14 -6.584 9.614 -0.946 1.00 0.00 O ATOM 434 N3 C B 14 -4.680 9.299 0.126 1.00 0.00 N ATOM 435 C4 C B 14 -4.045 8.847 1.188 1.00 0.00 C ATOM 436 N4 C B 14 -2.750 8.961 1.164 1.00 0.00 N ATOM 437 C5 C B 14 -4.708 8.298 2.315 1.00 0.00 C ATOM 438 C6 C B 14 -6.065 8.245 2.272 1.00 0.00 C ATOM 0 H5' C B 14 -10.141 7.907 4.632 1.00 0.00 H new ATOM 0 H5'' C B 14 -10.288 6.230 4.146 1.00 0.00 H new ATOM 0 H4' C B 14 -10.663 7.681 2.316 1.00 0.00 H new ATOM 0 H3' C B 14 -8.118 5.985 2.027 1.00 0.00 H new ATOM 0 H2' C B 14 -8.066 6.944 -0.307 1.00 0.00 H new ATOM 0 HO2' C B 14 -10.596 7.034 -0.152 1.00 0.00 H new ATOM 0 H1' C B 14 -8.513 9.565 0.517 1.00 0.00 H new ATOM 0 H41 C B 14 -2.194 8.632 1.953 1.00 0.00 H new ATOM 0 H42 C B 14 -2.290 9.380 0.356 1.00 0.00 H new ATOM 0 H5 C B 14 -4.158 7.937 3.171 1.00 0.00 H new ATOM 0 H6 C B 14 -6.611 7.828 3.106 1.00 0.00 H new ATOM 450 P A B 15 -9.243 4.001 0.850 1.00 0.00 P ATOM 451 OP1 A B 15 -10.370 3.050 0.693 1.00 0.00 O ATOM 452 OP2 A B 15 -8.129 3.636 1.756 1.00 0.00 O1- ATOM 453 O5' A B 15 -8.610 4.343 -0.589 1.00 0.00 O ATOM 454 C5' A B 15 -9.454 4.509 -1.722 1.00 0.00 C ATOM 455 C4' A B 15 -8.680 4.946 -2.973 1.00 0.00 C ATOM 456 O4' A B 15 -7.960 6.171 -2.784 1.00 0.00 O ATOM 457 C3' A B 15 -7.661 3.916 -3.467 1.00 0.00 C ATOM 458 O3' A B 15 -8.247 2.805 -4.117 1.00 0.00 O ATOM 459 C2' A B 15 -6.828 4.816 -4.401 1.00 0.00 C ATOM 460 O2' A B 15 -7.491 5.116 -5.628 1.00 0.00 O ATOM 461 C1' A B 15 -6.772 6.104 -3.575 1.00 0.00 C ATOM 462 N9 A B 15 -5.544 6.153 -2.742 1.00 0.00 N ATOM 463 C8 A B 15 -5.398 5.897 -1.398 1.00 0.00 C ATOM 464 N7 A B 15 -4.184 6.103 -0.951 1.00 0.00 N ATOM 465 C5 A B 15 -3.470 6.501 -2.097 1.00 0.00 C ATOM 466 C6 A B 15 -2.131 6.876 -2.385 1.00 0.00 C ATOM 467 N6 A B 15 -1.149 6.954 -1.495 1.00 0.00 N ATOM 468 N1 A B 15 -1.763 7.184 -3.625 1.00 0.00 N ATOM 469 C2 A B 15 -2.675 7.131 -4.586 1.00 0.00 C ATOM 470 N3 A B 15 -3.957 6.822 -4.479 1.00 0.00 N ATOM 471 C4 A B 15 -4.293 6.510 -3.196 1.00 0.00 C ATOM 0 H5' A B 15 -10.220 5.251 -1.495 1.00 0.00 H new ATOM 0 H5'' A B 15 -9.970 3.571 -1.927 1.00 0.00 H new ATOM 0 H4' A B 15 -9.469 5.068 -3.715 1.00 0.00 H new ATOM 0 H3' A B 15 -7.091 3.418 -2.682 1.00 0.00 H new ATOM 0 H2' A B 15 -5.879 4.358 -4.680 1.00 0.00 H new ATOM 0 HO2' A B 15 -8.183 4.444 -5.799 1.00 0.00 H new ATOM 0 H1' A B 15 -6.725 6.973 -4.231 1.00 0.00 H new ATOM 0 H8 A B 15 -6.209 5.558 -0.770 1.00 0.00 H new ATOM 0 H61 A B 15 -0.214 7.233 -1.791 1.00 0.00 H new ATOM 0 H62 A B 15 -1.330 6.735 -0.515 1.00 0.00 H new ATOM 0 H2 A B 15 -2.328 7.370 -5.580 1.00 0.00 H new ATOM 483 P C B 16 -7.457 1.405 -4.199 1.00 0.00 P ATOM 484 OP1 C B 16 -8.339 0.426 -4.880 1.00 0.00 O ATOM 485 OP2 C B 16 -6.968 1.081 -2.839 1.00 0.00 O1- ATOM 486 O5' C B 16 -6.183 1.684 -5.135 1.00 0.00 O ATOM 487 C5' C B 16 -6.324 1.845 -6.536 1.00 0.00 C ATOM 488 C4' C B 16 -4.975 2.071 -7.239 1.00 0.00 C ATOM 489 O4' C B 16 -4.361 3.300 -6.865 1.00 0.00 O ATOM 490 C3' C B 16 -3.950 0.958 -6.958 1.00 0.00 C ATOM 491 O3' C B 16 -4.229 -0.232 -7.686 1.00 0.00 O ATOM 492 C2' C B 16 -2.683 1.688 -7.399 1.00 0.00 C ATOM 493 O2' C B 16 -2.549 1.710 -8.816 1.00 0.00 O ATOM 494 C1' C B 16 -2.944 3.132 -6.933 1.00 0.00 C ATOM 495 N1 C B 16 -2.304 3.459 -5.621 1.00 0.00 N ATOM 496 C2 C B 16 -0.987 3.916 -5.641 1.00 0.00 C ATOM 497 O2 C B 16 -0.391 4.134 -6.693 1.00 0.00 O ATOM 498 N3 C B 16 -0.289 4.087 -4.491 1.00 0.00 N ATOM 499 C4 C B 16 -0.891 3.842 -3.346 1.00 0.00 C ATOM 500 N4 C B 16 -0.153 3.937 -2.277 1.00 0.00 N ATOM 501 C5 C B 16 -2.248 3.423 -3.260 1.00 0.00 C ATOM 502 C6 C B 16 -2.921 3.238 -4.422 1.00 0.00 C ATOM 0 H5' C B 16 -6.982 2.691 -6.737 1.00 0.00 H new ATOM 0 H5'' C B 16 -6.805 0.961 -6.954 1.00 0.00 H new ATOM 0 H4' C B 16 -5.233 2.079 -8.298 1.00 0.00 H new ATOM 0 H3' C B 16 -3.916 0.579 -5.937 1.00 0.00 H new ATOM 0 H2' C B 16 -1.786 1.217 -6.998 1.00 0.00 H new ATOM 0 HO2' C B 16 -1.728 2.187 -9.060 1.00 0.00 H new ATOM 0 H1' C B 16 -2.492 3.822 -7.646 1.00 0.00 H new ATOM 0 H41 C B 16 -0.560 3.759 -1.359 1.00 0.00 H new ATOM 0 H42 C B 16 0.832 4.189 -2.358 1.00 0.00 H new ATOM 0 H5 C B 16 -2.724 3.259 -2.305 1.00 0.00 H new ATOM 0 H6 C B 16 -3.951 2.914 -4.400 1.00 0.00 H new ATOM 514 P G B 17 -3.685 -1.658 -7.180 1.00 0.00 P ATOM 515 OP1 G B 17 -4.471 -2.696 -7.892 1.00 0.00 O ATOM 516 OP2 G B 17 -3.651 -1.691 -5.702 1.00 0.00 O1- ATOM 517 O5' G B 17 -2.175 -1.734 -7.715 1.00 0.00 O ATOM 518 C5' G B 17 -1.893 -1.745 -9.107 1.00 0.00 C ATOM 519 C4' G B 17 -0.413 -2.002 -9.381 1.00 0.00 C ATOM 520 O4' G B 17 0.453 -1.243 -8.534 1.00 0.00 O ATOM 521 C3' G B 17 -0.008 -3.469 -9.200 1.00 0.00 C ATOM 522 O3' G B 17 -0.399 -4.293 -10.299 1.00 0.00 O ATOM 523 C2' G B 17 1.511 -3.307 -9.126 1.00 0.00 C ATOM 524 O2' G B 17 2.111 -3.058 -10.394 1.00 0.00 O ATOM 525 C1' G B 17 1.630 -2.018 -8.302 1.00 0.00 C ATOM 526 N9 G B 17 1.803 -2.323 -6.865 1.00 0.00 N ATOM 527 C8 G B 17 0.866 -2.493 -5.882 1.00 0.00 C ATOM 528 N7 G B 17 1.368 -2.663 -4.685 1.00 0.00 N ATOM 529 C5 G B 17 2.747 -2.664 -4.901 1.00 0.00 C ATOM 530 C6 G B 17 3.864 -2.797 -4.002 1.00 0.00 C ATOM 531 O6 G B 17 3.880 -2.877 -2.764 1.00 0.00 O ATOM 532 N1 G B 17 5.078 -2.847 -4.647 1.00 0.00 N ATOM 533 C2 G B 17 5.219 -2.737 -5.990 1.00 0.00 C ATOM 534 N2 G B 17 6.425 -2.900 -6.471 1.00 0.00 N ATOM 535 N3 G B 17 4.237 -2.536 -6.852 1.00 0.00 N ATOM 536 C4 G B 17 3.016 -2.506 -6.244 1.00 0.00 C ATOM 0 H5' G B 17 -2.184 -0.790 -9.545 1.00 0.00 H new ATOM 0 H5'' G B 17 -2.492 -2.514 -9.594 1.00 0.00 H new ATOM 0 H4' G B 17 -0.297 -1.700 -10.422 1.00 0.00 H new ATOM 0 H3' G B 17 -0.471 -3.964 -8.346 1.00 0.00 H new ATOM 0 H2' G B 17 1.997 -4.200 -8.732 1.00 0.00 H new ATOM 0 HO2' G B 17 1.491 -3.320 -11.106 1.00 0.00 H new ATOM 0 H1' G B 17 2.511 -1.453 -8.607 1.00 0.00 H new ATOM 0 H8 G B 17 -0.196 -2.487 -6.077 1.00 0.00 H new ATOM 0 H1 G B 17 5.918 -2.974 -4.083 1.00 0.00 H new ATOM 0 H21 G B 17 6.588 -2.828 -7.475 1.00 0.00 H new ATOM 0 H22 G B 17 7.202 -3.099 -5.842 1.00 0.00 H new ATOM 548 P U B 18 -0.717 -5.843 -10.093 1.00 0.00 P ATOM 549 OP1 U B 18 -0.918 -6.452 -11.433 1.00 0.00 O ATOM 550 OP2 U B 18 -1.802 -5.966 -9.085 1.00 0.00 O1- ATOM 551 O5' U B 18 0.629 -6.434 -9.452 1.00 0.00 O ATOM 552 C5' U B 18 1.777 -6.729 -10.244 1.00 0.00 C ATOM 553 C4' U B 18 2.937 -7.241 -9.376 1.00 0.00 C ATOM 554 O4' U B 18 3.297 -6.305 -8.371 1.00 0.00 O ATOM 555 C3' U B 18 2.605 -8.565 -8.662 1.00 0.00 C ATOM 556 O3' U B 18 2.749 -9.692 -9.517 1.00 0.00 O ATOM 557 C2' U B 18 3.600 -8.513 -7.484 1.00 0.00 C ATOM 558 O2' U B 18 4.882 -9.039 -7.807 1.00 0.00 O ATOM 559 C1' U B 18 3.745 -6.998 -7.221 1.00 0.00 C ATOM 560 N1 U B 18 3.017 -6.561 -5.997 1.00 0.00 N ATOM 561 C2 U B 18 3.752 -6.337 -4.833 1.00 0.00 C ATOM 562 O2 U B 18 4.976 -6.489 -4.766 1.00 0.00 O ATOM 563 N3 U B 18 3.060 -5.928 -3.713 1.00 0.00 N ATOM 564 C4 U B 18 1.698 -5.777 -3.626 1.00 0.00 C ATOM 565 O4 U B 18 1.173 -5.449 -2.560 1.00 0.00 O ATOM 566 C5 U B 18 0.998 -6.045 -4.859 1.00 0.00 C ATOM 567 C6 U B 18 1.653 -6.424 -5.994 1.00 0.00 C ATOM 0 H5' U B 18 2.090 -5.834 -10.782 1.00 0.00 H new ATOM 0 H5'' U B 18 1.522 -7.479 -10.993 1.00 0.00 H new ATOM 0 H4' U B 18 3.761 -7.394 -10.073 1.00 0.00 H new ATOM 0 H3' U B 18 1.570 -8.673 -8.338 1.00 0.00 H new ATOM 0 H2' U B 18 3.241 -9.106 -6.642 1.00 0.00 H new ATOM 0 HO2' U B 18 4.824 -9.553 -8.639 1.00 0.00 H new ATOM 0 H1' U B 18 4.794 -6.767 -7.033 1.00 0.00 H new ATOM 0 H3 U B 18 3.607 -5.720 -2.877 1.00 0.00 H new ATOM 0 H5 U B 18 -0.077 -5.942 -4.884 1.00 0.00 H new ATOM 0 H6 U B 18 1.093 -6.618 -6.897 1.00 0.00 H new ATOM 578 P C B 19 2.103 -11.105 -9.151 1.00 0.00 P ATOM 579 OP1 C B 19 2.451 -12.056 -10.242 1.00 0.00 O ATOM 580 OP2 C B 19 0.676 -10.901 -8.804 1.00 0.00 O1- ATOM 581 O5' C B 19 2.909 -11.584 -7.836 1.00 0.00 O ATOM 582 C5' C B 19 2.244 -11.793 -6.601 1.00 0.00 C ATOM 583 C4' C B 19 3.246 -12.143 -5.488 1.00 0.00 C ATOM 584 O4' C B 19 3.934 -10.980 -5.019 1.00 0.00 O ATOM 585 C3' C B 19 2.577 -12.722 -4.244 1.00 0.00 C ATOM 586 O3' C B 19 2.151 -14.079 -4.332 1.00 0.00 O ATOM 587 C2' C B 19 3.709 -12.530 -3.232 1.00 0.00 C ATOM 588 O2' C B 19 4.749 -13.497 -3.374 1.00 0.00 O ATOM 589 C1' C B 19 4.277 -11.172 -3.644 1.00 0.00 C ATOM 590 N1 C B 19 3.711 -10.095 -2.777 1.00 0.00 N ATOM 591 C2 C B 19 4.430 -9.720 -1.641 1.00 0.00 C ATOM 592 O2 C B 19 5.535 -10.195 -1.368 1.00 0.00 O ATOM 593 N3 C B 19 3.932 -8.809 -0.769 1.00 0.00 N ATOM 594 C4 C B 19 2.748 -8.289 -1.014 1.00 0.00 C ATOM 595 N4 C B 19 2.330 -7.384 -0.174 1.00 0.00 N ATOM 596 C5 C B 19 1.953 -8.655 -2.134 1.00 0.00 C ATOM 597 C6 C B 19 2.476 -9.543 -3.022 1.00 0.00 C ATOM 0 H5' C B 19 1.517 -12.598 -6.707 1.00 0.00 H new ATOM 0 H5'' C B 19 1.689 -10.896 -6.327 1.00 0.00 H new ATOM 0 H4' C B 19 3.915 -12.870 -5.949 1.00 0.00 H new ATOM 0 H3' C B 19 1.628 -12.239 -4.011 1.00 0.00 H new ATOM 0 H2' C B 19 3.350 -12.615 -2.206 1.00 0.00 H new ATOM 0 HO2' C B 19 4.412 -14.269 -3.874 1.00 0.00 H new ATOM 0 H1' C B 19 5.360 -11.136 -3.522 1.00 0.00 H new ATOM 0 H41 C B 19 1.420 -6.944 -0.310 1.00 0.00 H new ATOM 0 H42 C B 19 2.913 -7.116 0.619 1.00 0.00 H new ATOM 0 H5 C B 19 0.965 -8.241 -2.275 1.00 0.00 H new ATOM 0 H6 C B 19 1.926 -9.812 -3.912 1.00 0.00 H new ATOM 609 P G B 20 0.995 -14.645 -3.390 1.00 0.00 P ATOM 610 OP1 G B 20 0.687 -16.024 -3.839 1.00 0.00 O ATOM 611 OP2 G B 20 -0.102 -13.655 -3.363 1.00 0.00 O1- ATOM 612 O5' G B 20 1.633 -14.706 -1.906 1.00 0.00 O ATOM 613 C5' G B 20 2.538 -15.745 -1.556 1.00 0.00 C ATOM 614 C4' G B 20 3.116 -15.571 -0.155 1.00 0.00 C ATOM 615 O4' G B 20 3.839 -14.355 -0.035 1.00 0.00 O ATOM 616 C3' G B 20 2.111 -15.583 0.998 1.00 0.00 C ATOM 617 O3' G B 20 1.606 -16.875 1.313 1.00 0.00 O ATOM 618 C2' G B 20 2.996 -14.996 2.107 1.00 0.00 C ATOM 619 O2' G B 20 3.960 -15.920 2.605 1.00 0.00 O ATOM 620 C1' G B 20 3.752 -13.911 1.320 1.00 0.00 C ATOM 621 N9 G B 20 3.023 -12.612 1.393 1.00 0.00 N ATOM 622 C8 G B 20 2.147 -12.059 0.496 1.00 0.00 C ATOM 623 N7 G B 20 1.672 -10.892 0.841 1.00 0.00 N ATOM 624 C5 G B 20 2.239 -10.668 2.098 1.00 0.00 C ATOM 625 C6 G B 20 2.095 -9.584 3.043 1.00 0.00 C ATOM 626 O6 G B 20 1.462 -8.527 2.941 1.00 0.00 O ATOM 627 N1 G B 20 2.765 -9.804 4.225 1.00 0.00 N ATOM 628 C2 G B 20 3.507 -10.907 4.473 1.00 0.00 C ATOM 629 N2 G B 20 4.063 -11.001 5.651 1.00 0.00 N ATOM 630 N3 G B 20 3.705 -11.911 3.622 1.00 0.00 N ATOM 631 C4 G B 20 3.046 -11.722 2.443 1.00 0.00 C ATOM 0 H5' G B 20 3.352 -15.772 -2.280 1.00 0.00 H new ATOM 0 H5'' G B 20 2.025 -16.705 -1.617 1.00 0.00 H new ATOM 0 H4' G B 20 3.749 -16.453 -0.059 1.00 0.00 H new ATOM 0 H3' G B 20 1.188 -15.039 0.798 1.00 0.00 H new ATOM 0 H2' G B 20 2.417 -14.677 2.973 1.00 0.00 H new ATOM 0 HO2' G B 20 3.684 -16.833 2.381 1.00 0.00 H new ATOM 0 H1' G B 20 4.746 -13.754 1.740 1.00 0.00 H new ATOM 0 H8 G B 20 1.871 -12.550 -0.425 1.00 0.00 H new ATOM 0 H1 G B 20 2.698 -9.095 4.955 1.00 0.00 H new ATOM 0 H21 G B 20 4.632 -11.815 5.883 1.00 0.00 H new ATOM 0 H22 G B 20 3.929 -10.260 6.339 1.00 0.00 H new ATOM 643 P G B 21 0.173 -17.063 2.039 1.00 0.00 P ATOM 644 OP1 G B 21 -0.052 -18.518 2.216 1.00 0.00 O ATOM 645 OP2 G B 21 -0.839 -16.279 1.294 1.00 0.00 O1- ATOM 646 O5' G B 21 0.318 -16.394 3.494 1.00 0.00 O ATOM 647 C5' G B 21 1.165 -16.950 4.480 1.00 0.00 C ATOM 648 C4' G B 21 1.066 -16.193 5.813 1.00 0.00 C ATOM 649 O4' G B 21 1.372 -14.814 5.632 1.00 0.00 O ATOM 650 C3' G B 21 -0.333 -16.307 6.453 1.00 0.00 C ATOM 651 O3' G B 21 -0.214 -16.459 7.872 1.00 0.00 O ATOM 652 C2' G B 21 -0.938 -14.957 6.067 1.00 0.00 C ATOM 653 O2' G B 21 -2.008 -14.576 6.915 1.00 0.00 O ATOM 654 C1' G B 21 0.292 -14.048 6.162 1.00 0.00 C ATOM 655 N9 G B 21 0.079 -12.790 5.431 1.00 0.00 N ATOM 656 C8 G B 21 -0.223 -12.605 4.100 1.00 0.00 C ATOM 657 N7 G B 21 -0.578 -11.382 3.794 1.00 0.00 N ATOM 658 C5 G B 21 -0.519 -10.702 5.021 1.00 0.00 C ATOM 659 C6 G B 21 -0.843 -9.345 5.376 1.00 0.00 C ATOM 660 O6 G B 21 -1.291 -8.434 4.664 1.00 0.00 O ATOM 661 N1 G B 21 -0.651 -9.072 6.716 1.00 0.00 N ATOM 662 C2 G B 21 -0.249 -9.983 7.622 1.00 0.00 C ATOM 663 N2 G B 21 -0.189 -9.589 8.872 1.00 0.00 N ATOM 664 N3 G B 21 0.041 -11.256 7.350 1.00 0.00 N ATOM 665 C4 G B 21 -0.099 -11.554 6.021 1.00 0.00 C ATOM 0 H5' G B 21 2.196 -16.930 4.127 1.00 0.00 H new ATOM 0 H5'' G B 21 0.902 -17.996 4.636 1.00 0.00 H new ATOM 0 H4' G B 21 1.790 -16.657 6.483 1.00 0.00 H new ATOM 0 H3' G B 21 -0.929 -17.160 6.129 1.00 0.00 H new ATOM 0 H2' G B 21 -1.414 -14.934 5.087 1.00 0.00 H new ATOM 0 HO2' G B 21 -2.359 -13.707 6.629 1.00 0.00 H new ATOM 0 HO3' G B 21 -0.822 -15.834 8.320 1.00 0.00 H new ATOM 0 H1' G B 21 0.502 -13.745 7.188 1.00 0.00 H new ATOM 0 H8 G B 21 -0.171 -13.400 3.371 1.00 0.00 H new ATOM 0 H1 G B 21 -0.825 -8.120 7.040 1.00 0.00 H new ATOM 0 H21 G B 21 0.109 -10.240 9.598 1.00 0.00 H new ATOM 0 H22 G B 21 -0.441 -8.632 9.118 1.00 0.00 H new TER 678 G B 21 HETATM 679 N1 QSV A 101 7.856 0.143 -1.148 1.00 0.00 N HETATM 680 C4 QSV A 101 8.896 0.551 -4.673 1.00 0.00 C HETATM 681 C5 QSV A 101 8.360 0.745 -5.947 1.00 0.00 C HETATM 682 C6 QSV A 101 8.647 0.229 -2.173 1.00 0.00 C HETATM 683 C7 QSV A 101 10.160 0.080 -2.024 1.00 0.00 C HETATM 684 C8 QSV A 101 7.476 -0.353 1.181 1.00 0.00 C HETATM 685 C1 QSV A 101 6.135 0.741 -4.991 1.00 0.00 C HETATM 686 C2 QSV A 101 6.666 0.536 -3.710 1.00 0.00 C HETATM 687 C3 QSV A 101 8.064 0.445 -3.540 1.00 0.00 C HETATM 688 C9 QSV A 101 9.541 -0.923 2.537 1.00 0.00 C HETATM 689 C4' QSV A 101 2.125 0.999 -6.480 1.00 0.00 C HETATM 690 C3' QSV A 101 2.282 0.766 -5.095 1.00 0.00 C HETATM 691 C2' QSV A 101 3.578 0.755 -4.550 1.00 0.00 C HETATM 692 C1' QSV A 101 4.702 0.852 -5.389 1.00 0.00 C HETATM 693 C5' QSV A 101 3.241 1.113 -7.309 1.00 0.00 C HETATM 694 C0' QSV A 101 4.511 1.012 -6.759 1.00 0.00 C HETATM 695 C0 QSV A 101 6.988 0.834 -6.086 1.00 0.00 C HETATM 696 S0 QSV A 101 6.077 1.063 -7.600 1.00 0.00 S HETATM 697 N2 QSV A 101 8.269 -0.031 0.154 1.00 0.00 N1+ HETATM 698 N3 QSV A 101 6.211 -0.385 1.095 1.00 0.00 N HETATM 699 N4 QSV A 101 8.123 -0.664 2.306 1.00 0.00 N HETATM 700 C6' QSV A 101 1.106 0.540 -4.194 1.00 0.00 C HETATM 701 C7' QSV A 101 -0.287 0.386 -4.780 1.00 0.00 C HETATM 702 N1' QSV A 101 1.303 0.472 -2.916 1.00 0.00 N HETATM 703 N2' QSV A 101 0.300 0.395 -1.975 1.00 0.00 N1+ HETATM 704 C8' QSV A 101 0.475 0.472 -0.648 1.00 0.00 C HETATM 705 N3' QSV A 101 1.620 0.576 -0.107 1.00 0.00 N HETATM 706 N4' QSV A 101 -0.649 0.598 0.049 1.00 0.00 N HETATM 707 C9' QSV A 101 -1.997 0.121 -0.282 1.00 0.00 C