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 180:sc= 0.298 USER MOD Set 1.2: A 7 G O2' : rot 66:sc= 0.316 USER MOD Single : A 1 C O2' : rot -23:sc= 0.0299 USER MOD Single : A 1 C O5' : rot 180:sc= 0 USER MOD Single : A 2 C O2' : rot -19:sc= 0.0156 USER MOD Single : A 3 G O2' : rot -23:sc= 0.00797 USER MOD Single : A 4 G O2' : rot -24:sc= 0.11 USER MOD Single : A 5 C O2' : rot -29:sc= 0.0539 USER MOD Single : A 8 U O2' : rot -72:sc= 0.032 USER MOD Single : A 9 G O2' : rot -17:sc= 0.0275 USER MOD Single : A 10 U O2' : rot -27:sc= 0.0148 USER MOD Single : A 11 G O2' : rot 180:sc= 0 USER MOD Single : A 11 G O3' : rot 131:sc= 0.11 USER MOD Single : B 12 C O2' : rot -22:sc= 0.00514 USER MOD Single : B 12 C O5' : rot 180:sc= 0 USER MOD Single : B 13 A O2' : rot -26:sc= 0.0349 USER MOD Single : B 14 C O2' : rot -18:sc= 0.0268 USER MOD Single : B 15 A O2' : rot -19:sc= 0.0182 USER MOD Single : B 16 C O2' : rot 13:sc= 0.154 USER MOD Single : B 17 G O2' : rot -19:sc= 0.128 USER MOD Single : B 18 U O2' : rot -24:sc= 0.0329 USER MOD Single : B 19 C O2' : rot -31:sc= 0.0689 USER MOD Single : B 20 G O2' : rot -27:sc= 0.0896 USER MOD Single : B 21 G O2' : rot 180:sc= 0 USER MOD Single : B 21 G O3' : rot 139:sc= 0.068 USER MOD ----------------------------------------------------------------- ATOM 1 O5' C A 1 -2.989 -6.361 15.637 1.00 0.00 O ATOM 2 C5' C A 1 -1.830 -6.338 14.817 1.00 0.00 C ATOM 3 C4' C A 1 -1.158 -7.715 14.776 1.00 0.00 C ATOM 4 O4' C A 1 -1.910 -8.655 14.003 1.00 0.00 O ATOM 5 C3' C A 1 0.238 -7.682 14.152 1.00 0.00 C ATOM 6 O3' C A 1 1.239 -7.218 15.041 1.00 0.00 O ATOM 7 C2' C A 1 0.405 -9.166 13.782 1.00 0.00 C ATOM 8 O2' C A 1 0.708 -9.979 14.910 1.00 0.00 O ATOM 9 C1' C A 1 -1.010 -9.520 13.302 1.00 0.00 C ATOM 10 N1 C A 1 -1.154 -9.370 11.819 1.00 0.00 N ATOM 11 C2 C A 1 -0.680 -10.402 11.000 1.00 0.00 C ATOM 12 O2 C A 1 -0.083 -11.381 11.439 1.00 0.00 O ATOM 13 N3 C A 1 -0.868 -10.361 9.656 1.00 0.00 N ATOM 14 C4 C A 1 -1.481 -9.327 9.135 1.00 0.00 C ATOM 15 N4 C A 1 -1.641 -9.327 7.842 1.00 0.00 N ATOM 16 C5 C A 1 -1.948 -8.232 9.913 1.00 0.00 C ATOM 17 C6 C A 1 -1.771 -8.277 11.253 1.00 0.00 C ATOM 0 H5' C A 1 -1.126 -5.597 15.197 1.00 0.00 H new ATOM 0 H5'' C A 1 -2.101 -6.032 13.807 1.00 0.00 H new ATOM 0 H4' C A 1 -1.100 -8.014 15.823 1.00 0.00 H new ATOM 0 H3' C A 1 0.341 -6.990 13.316 1.00 0.00 H new ATOM 0 H2' C A 1 1.214 -9.327 13.069 1.00 0.00 H new ATOM 0 HO2' C A 1 1.101 -9.425 15.616 1.00 0.00 H new ATOM 0 HO5' C A 1 -3.399 -5.471 15.649 1.00 0.00 H new ATOM 0 H1' C A 1 -1.230 -10.567 13.513 1.00 0.00 H new ATOM 0 H41 C A 1 -2.112 -8.545 7.386 1.00 0.00 H new ATOM 0 H42 C A 1 -1.295 -10.109 7.285 1.00 0.00 H new ATOM 0 H5 C A 1 -2.431 -7.387 9.446 1.00 0.00 H new ATOM 0 H6 C A 1 -2.111 -7.462 11.874 1.00 0.00 H new ATOM 30 P C A 2 2.558 -6.506 14.475 1.00 0.00 P ATOM 31 OP1 C A 2 3.388 -6.115 15.645 1.00 0.00 O ATOM 32 OP2 C A 2 2.137 -5.461 13.511 1.00 0.00 O1- ATOM 33 O5' C A 2 3.308 -7.670 13.650 1.00 0.00 O ATOM 34 C5' C A 2 4.026 -8.716 14.303 1.00 0.00 C ATOM 35 C4' C A 2 4.645 -9.688 13.285 1.00 0.00 C ATOM 36 O4' C A 2 3.683 -10.342 12.463 1.00 0.00 O ATOM 37 C3' C A 2 5.628 -9.004 12.335 1.00 0.00 C ATOM 38 O3' C A 2 6.875 -8.717 12.945 1.00 0.00 O ATOM 39 C2' C A 2 5.714 -10.074 11.228 1.00 0.00 C ATOM 40 O2' C A 2 6.567 -11.174 11.571 1.00 0.00 O ATOM 41 C1' C A 2 4.263 -10.589 11.180 1.00 0.00 C ATOM 42 N1 C A 2 3.483 -9.920 10.084 1.00 0.00 N ATOM 43 C2 C A 2 3.605 -10.439 8.793 1.00 0.00 C ATOM 44 O2 C A 2 4.357 -11.376 8.518 1.00 0.00 O ATOM 45 N3 C A 2 2.895 -9.904 7.770 1.00 0.00 N ATOM 46 C4 C A 2 2.108 -8.885 8.012 1.00 0.00 C ATOM 47 N4 C A 2 1.444 -8.424 6.985 1.00 0.00 N ATOM 48 C5 C A 2 1.974 -8.291 9.301 1.00 0.00 C ATOM 49 C6 C A 2 2.671 -8.840 10.322 1.00 0.00 C ATOM 0 H5' C A 2 3.355 -9.260 14.968 1.00 0.00 H new ATOM 0 H5'' C A 2 4.812 -8.287 14.925 1.00 0.00 H new ATOM 0 H4' C A 2 5.156 -10.416 13.915 1.00 0.00 H new ATOM 0 H3' C A 2 5.321 -8.019 11.985 1.00 0.00 H new ATOM 0 H2' C A 2 6.117 -9.666 10.301 1.00 0.00 H new ATOM 0 HO2' C A 2 7.171 -10.906 12.294 1.00 0.00 H new ATOM 0 H1' C A 2 4.244 -11.656 10.957 1.00 0.00 H new ATOM 0 H41 C A 2 0.812 -7.632 7.100 1.00 0.00 H new ATOM 0 H42 C A 2 1.558 -8.857 6.068 1.00 0.00 H new ATOM 0 H5 C A 2 1.338 -7.432 9.457 1.00 0.00 H new ATOM 0 H6 C A 2 2.589 -8.431 11.318 1.00 0.00 H new ATOM 61 P G A 3 7.930 -7.748 12.239 1.00 0.00 P ATOM 62 OP1 G A 3 9.149 -7.731 13.084 1.00 0.00 O ATOM 63 OP2 G A 3 7.237 -6.470 11.939 1.00 0.00 O1- ATOM 64 O5' G A 3 8.285 -8.517 10.878 1.00 0.00 O ATOM 65 C5' G A 3 8.425 -7.808 9.659 1.00 0.00 C ATOM 66 C4' G A 3 8.685 -8.772 8.498 1.00 0.00 C ATOM 67 O4' G A 3 7.490 -9.422 8.072 1.00 0.00 O ATOM 68 C3' G A 3 9.230 -8.038 7.271 1.00 0.00 C ATOM 69 O3' G A 3 10.613 -7.741 7.388 1.00 0.00 O ATOM 70 C2' G A 3 8.890 -9.055 6.177 1.00 0.00 C ATOM 71 O2' G A 3 9.789 -10.171 6.116 1.00 0.00 O ATOM 72 C1' G A 3 7.522 -9.573 6.652 1.00 0.00 C ATOM 73 N9 G A 3 6.408 -8.799 6.016 1.00 0.00 N ATOM 74 C8 G A 3 5.508 -7.950 6.606 1.00 0.00 C ATOM 75 N7 G A 3 4.616 -7.470 5.785 1.00 0.00 N ATOM 76 C5 G A 3 4.940 -8.039 4.549 1.00 0.00 C ATOM 77 C6 G A 3 4.321 -7.948 3.248 1.00 0.00 C ATOM 78 O6 G A 3 3.316 -7.318 2.898 1.00 0.00 O ATOM 79 N1 G A 3 4.975 -8.684 2.283 1.00 0.00 N ATOM 80 C2 G A 3 6.081 -9.430 2.525 1.00 0.00 C ATOM 81 N2 G A 3 6.635 -10.041 1.509 1.00 0.00 N ATOM 82 N3 G A 3 6.667 -9.563 3.707 1.00 0.00 N ATOM 83 C4 G A 3 6.051 -8.847 4.684 1.00 0.00 C ATOM 0 H5' G A 3 9.247 -7.097 9.739 1.00 0.00 H new ATOM 0 H5'' G A 3 7.522 -7.230 9.463 1.00 0.00 H new ATOM 0 H4' G A 3 9.407 -9.495 8.877 1.00 0.00 H new ATOM 0 H3' G A 3 8.810 -7.048 7.091 1.00 0.00 H new ATOM 0 H2' G A 3 8.931 -8.600 5.187 1.00 0.00 H new ATOM 0 HO2' G A 3 10.645 -9.924 6.523 1.00 0.00 H new ATOM 0 H1' G A 3 7.388 -10.617 6.368 1.00 0.00 H new ATOM 0 H8 G A 3 5.535 -7.701 7.657 1.00 0.00 H new ATOM 0 H1 G A 3 4.606 -8.666 1.332 1.00 0.00 H new ATOM 0 H21 G A 3 7.468 -10.612 1.650 1.00 0.00 H new ATOM 0 H22 G A 3 6.233 -9.946 0.576 1.00 0.00 H new ATOM 95 P G A 4 11.311 -6.656 6.431 1.00 0.00 P ATOM 96 OP1 G A 4 12.747 -6.595 6.793 1.00 0.00 O ATOM 97 OP2 G A 4 10.504 -5.408 6.478 1.00 0.00 O1- ATOM 98 O5' G A 4 11.195 -7.302 4.961 1.00 0.00 O ATOM 99 C5' G A 4 11.434 -6.532 3.803 1.00 0.00 C ATOM 100 C4' G A 4 11.110 -7.344 2.542 1.00 0.00 C ATOM 101 O4' G A 4 9.717 -7.607 2.459 1.00 0.00 O ATOM 102 C3' G A 4 11.485 -6.575 1.275 1.00 0.00 C ATOM 103 O3' G A 4 12.854 -6.762 0.944 1.00 0.00 O ATOM 104 C2' G A 4 10.522 -7.182 0.241 1.00 0.00 C ATOM 105 O2' G A 4 11.069 -8.318 -0.430 1.00 0.00 O ATOM 106 C1' G A 4 9.325 -7.649 1.088 1.00 0.00 C ATOM 107 N9 G A 4 8.109 -6.835 0.876 1.00 0.00 N ATOM 108 C8 G A 4 7.338 -6.194 1.822 1.00 0.00 C ATOM 109 N7 G A 4 6.202 -5.734 1.376 1.00 0.00 N ATOM 110 C5 G A 4 6.219 -6.060 0.014 1.00 0.00 C ATOM 111 C6 G A 4 5.239 -5.855 -1.023 1.00 0.00 C ATOM 112 O6 G A 4 4.113 -5.365 -0.976 1.00 0.00 O ATOM 113 N1 G A 4 5.665 -6.307 -2.252 1.00 0.00 N ATOM 114 C2 G A 4 6.834 -6.962 -2.464 1.00 0.00 C ATOM 115 N2 G A 4 7.063 -7.376 -3.682 1.00 0.00 N ATOM 116 N3 G A 4 7.750 -7.204 -1.529 1.00 0.00 N ATOM 117 C4 G A 4 7.393 -6.719 -0.300 1.00 0.00 C ATOM 0 H5' G A 4 12.476 -6.213 3.780 1.00 0.00 H new ATOM 0 H5'' G A 4 10.825 -5.629 3.828 1.00 0.00 H new ATOM 0 H4' G A 4 11.683 -8.269 2.613 1.00 0.00 H new ATOM 0 H3' G A 4 11.388 -5.492 1.356 1.00 0.00 H new ATOM 0 H2' G A 4 10.283 -6.456 -0.536 1.00 0.00 H new ATOM 0 HO2' G A 4 12.048 -8.274 -0.403 1.00 0.00 H new ATOM 0 H1' G A 4 9.061 -8.661 0.782 1.00 0.00 H new ATOM 0 H8 G A 4 7.650 -6.082 2.850 1.00 0.00 H new ATOM 0 H1 G A 4 5.061 -6.138 -3.057 1.00 0.00 H new ATOM 0 H21 G A 4 7.927 -7.874 -3.897 1.00 0.00 H new ATOM 0 H22 G A 4 6.378 -7.201 -4.417 1.00 0.00 H new ATOM 129 P C A 5 13.693 -5.634 0.180 1.00 0.00 P ATOM 130 OP1 C A 5 15.021 -6.205 -0.161 1.00 0.00 O ATOM 131 OP2 C A 5 13.642 -4.401 0.997 1.00 0.00 O1- ATOM 132 O5' C A 5 12.884 -5.419 -1.198 1.00 0.00 O ATOM 133 C5' C A 5 12.290 -4.169 -1.512 1.00 0.00 C ATOM 134 C4' C A 5 11.562 -4.240 -2.867 1.00 0.00 C ATOM 135 O4' C A 5 10.295 -4.889 -2.719 1.00 0.00 O ATOM 136 C3' C A 5 11.250 -2.866 -3.468 1.00 0.00 C ATOM 137 O3' C A 5 12.294 -2.269 -4.220 1.00 0.00 O ATOM 138 C2' C A 5 10.054 -3.200 -4.377 1.00 0.00 C ATOM 139 O2' C A 5 10.449 -3.813 -5.608 1.00 0.00 O ATOM 140 C1' C A 5 9.317 -4.247 -3.537 1.00 0.00 C ATOM 141 N1 C A 5 8.223 -3.618 -2.743 1.00 0.00 N ATOM 142 C2 C A 5 7.003 -3.327 -3.373 1.00 0.00 C ATOM 143 O2 C A 5 6.818 -3.569 -4.570 1.00 0.00 O ATOM 144 N3 C A 5 5.970 -2.799 -2.672 1.00 0.00 N ATOM 145 C4 C A 5 6.137 -2.557 -1.389 1.00 0.00 C ATOM 146 N4 C A 5 5.078 -2.160 -0.734 1.00 0.00 N ATOM 147 C5 C A 5 7.354 -2.792 -0.699 1.00 0.00 C ATOM 148 C6 C A 5 8.373 -3.337 -1.403 1.00 0.00 C ATOM 0 H5' C A 5 13.056 -3.394 -1.545 1.00 0.00 H new ATOM 0 H5'' C A 5 11.586 -3.888 -0.729 1.00 0.00 H new ATOM 0 H4' C A 5 12.244 -4.782 -3.522 1.00 0.00 H new ATOM 0 H3' C A 5 11.076 -2.124 -2.688 1.00 0.00 H new ATOM 0 H2' C A 5 9.486 -2.312 -4.654 1.00 0.00 H new ATOM 0 HO2' C A 5 11.348 -3.508 -5.852 1.00 0.00 H new ATOM 0 H1' C A 5 8.827 -4.989 -4.167 1.00 0.00 H new ATOM 0 H41 C A 5 5.142 -1.956 0.263 1.00 0.00 H new ATOM 0 H42 C A 5 4.188 -2.054 -1.220 1.00 0.00 H new ATOM 0 H5 C A 5 7.463 -2.546 0.347 1.00 0.00 H new ATOM 0 H6 C A 5 9.310 -3.553 -0.911 1.00 0.00 H new ATOM 160 P A A 6 13.453 -1.419 -3.520 1.00 0.00 P ATOM 161 OP1 A A 6 14.699 -2.219 -3.597 1.00 0.00 O ATOM 162 OP2 A A 6 12.994 -0.922 -2.200 1.00 0.00 O1- ATOM 163 O5' A A 6 13.598 -0.140 -4.485 1.00 0.00 O ATOM 164 C5' A A 6 12.511 0.757 -4.652 1.00 0.00 C ATOM 165 C4' A A 6 12.931 1.963 -5.512 1.00 0.00 C ATOM 166 O4' A A 6 13.323 1.541 -6.817 1.00 0.00 O ATOM 167 C3' A A 6 11.744 2.936 -5.671 1.00 0.00 C ATOM 168 O3' A A 6 12.187 4.285 -5.857 1.00 0.00 O ATOM 169 C2' A A 6 11.077 2.344 -6.924 1.00 0.00 C ATOM 170 O2' A A 6 10.284 3.268 -7.671 1.00 0.00 O ATOM 171 C1' A A 6 12.286 1.861 -7.733 1.00 0.00 C ATOM 172 N9 A A 6 11.956 0.677 -8.564 1.00 0.00 N ATOM 173 C8 A A 6 11.735 -0.626 -8.175 1.00 0.00 C ATOM 174 N7 A A 6 11.411 -1.434 -9.149 1.00 0.00 N ATOM 175 C5 A A 6 11.422 -0.596 -10.271 1.00 0.00 C ATOM 176 C6 A A 6 11.181 -0.780 -11.655 1.00 0.00 C ATOM 177 N6 A A 6 10.837 -1.927 -12.222 1.00 0.00 N ATOM 178 N1 A A 6 11.262 0.245 -12.512 1.00 0.00 N ATOM 179 C2 A A 6 11.602 1.432 -12.037 1.00 0.00 C ATOM 180 N3 A A 6 11.848 1.766 -10.772 1.00 0.00 N ATOM 181 C4 A A 6 11.753 0.698 -9.928 1.00 0.00 C ATOM 0 H5' A A 6 12.164 1.101 -3.678 1.00 0.00 H new ATOM 0 H5'' A A 6 11.675 0.240 -5.124 1.00 0.00 H new ATOM 0 H4' A A 6 13.767 2.452 -5.012 1.00 0.00 H new ATOM 0 H3' A A 6 11.083 3.011 -4.808 1.00 0.00 H new ATOM 0 H2' A A 6 10.355 1.568 -6.669 1.00 0.00 H new ATOM 0 HO2' A A 6 9.898 2.814 -8.449 1.00 0.00 H new ATOM 0 H1' A A 6 12.599 2.651 -8.416 1.00 0.00 H new ATOM 0 H8 A A 6 11.822 -0.953 -7.149 1.00 0.00 H new ATOM 0 H61 A A 6 10.682 -1.972 -13.229 1.00 0.00 H new ATOM 0 H62 A A 6 10.727 -2.765 -11.651 1.00 0.00 H new ATOM 0 H2 A A 6 11.691 2.226 -12.763 1.00 0.00 H new ATOM 193 P G A 7 12.525 5.245 -4.609 1.00 0.00 P ATOM 194 OP1 G A 7 12.792 6.600 -5.137 1.00 0.00 O ATOM 195 OP2 G A 7 13.579 4.594 -3.791 1.00 0.00 O1- ATOM 196 O5' G A 7 11.175 5.288 -3.716 1.00 0.00 O ATOM 197 C5' G A 7 10.020 6.043 -4.090 1.00 0.00 C ATOM 198 C4' G A 7 9.261 5.452 -5.291 1.00 0.00 C ATOM 199 O4' G A 7 8.619 4.213 -4.966 1.00 0.00 O ATOM 200 C3' G A 7 8.160 6.388 -5.783 1.00 0.00 C ATOM 201 O3' G A 7 8.668 7.419 -6.605 1.00 0.00 O ATOM 202 C2' G A 7 7.244 5.383 -6.501 1.00 0.00 C ATOM 203 O2' G A 7 7.715 4.940 -7.766 1.00 0.00 O ATOM 204 C1' G A 7 7.303 4.197 -5.534 1.00 0.00 C ATOM 205 N9 G A 7 6.282 4.319 -4.459 1.00 0.00 N ATOM 206 C8 G A 7 6.475 4.476 -3.108 1.00 0.00 C ATOM 207 N7 G A 7 5.377 4.573 -2.402 1.00 0.00 N ATOM 208 C5 G A 7 4.367 4.497 -3.372 1.00 0.00 C ATOM 209 C6 G A 7 2.933 4.563 -3.266 1.00 0.00 C ATOM 210 O6 G A 7 2.235 4.712 -2.252 1.00 0.00 O ATOM 211 N1 G A 7 2.284 4.445 -4.475 1.00 0.00 N ATOM 212 C2 G A 7 2.921 4.253 -5.647 1.00 0.00 C ATOM 213 N2 G A 7 2.185 4.196 -6.723 1.00 0.00 N ATOM 214 N3 G A 7 4.240 4.197 -5.809 1.00 0.00 N ATOM 215 C4 G A 7 4.916 4.321 -4.627 1.00 0.00 C ATOM 0 H5' G A 7 10.324 7.062 -4.329 1.00 0.00 H new ATOM 0 H5'' G A 7 9.344 6.103 -3.237 1.00 0.00 H new ATOM 0 H4' G A 7 10.019 5.303 -6.060 1.00 0.00 H new ATOM 0 H3' G A 7 7.644 6.959 -5.011 1.00 0.00 H new ATOM 0 H2' G A 7 6.268 5.820 -6.711 1.00 0.00 H new ATOM 0 HO2' G A 7 8.535 4.418 -7.645 1.00 0.00 H new ATOM 0 H1' G A 7 7.095 3.264 -6.058 1.00 0.00 H new ATOM 0 H8 G A 7 7.458 4.516 -2.662 1.00 0.00 H new ATOM 0 H1 G A 7 1.266 4.506 -4.484 1.00 0.00 H new ATOM 0 H21 G A 7 2.622 4.052 -7.633 1.00 0.00 H new ATOM 0 H22 G A 7 1.172 4.295 -6.654 1.00 0.00 H new ATOM 227 P U A 8 7.959 8.849 -6.661 1.00 0.00 P ATOM 228 OP1 U A 8 8.693 9.677 -7.657 1.00 0.00 O ATOM 229 OP2 U A 8 7.840 9.342 -5.263 1.00 0.00 O1- ATOM 230 O5' U A 8 6.482 8.547 -7.207 1.00 0.00 O ATOM 231 C5' U A 8 6.254 8.104 -8.543 1.00 0.00 C ATOM 232 C4' U A 8 4.760 7.983 -8.859 1.00 0.00 C ATOM 233 O4' U A 8 4.097 7.023 -8.039 1.00 0.00 O ATOM 234 C3' U A 8 3.999 9.295 -8.688 1.00 0.00 C ATOM 235 O3' U A 8 4.248 10.203 -9.751 1.00 0.00 O ATOM 236 C2' U A 8 2.561 8.749 -8.622 1.00 0.00 C ATOM 237 O2' U A 8 2.028 8.419 -9.909 1.00 0.00 O ATOM 238 C1' U A 8 2.758 7.459 -7.805 1.00 0.00 C ATOM 239 N1 U A 8 2.474 7.664 -6.346 1.00 0.00 N ATOM 240 C2 U A 8 1.126 7.758 -5.957 1.00 0.00 C ATOM 241 O2 U A 8 0.175 7.681 -6.741 1.00 0.00 O ATOM 242 N3 U A 8 0.888 7.949 -4.613 1.00 0.00 N ATOM 243 C4 U A 8 1.837 8.044 -3.619 1.00 0.00 C ATOM 244 O4 U A 8 1.471 8.192 -2.455 1.00 0.00 O ATOM 245 C5 U A 8 3.204 7.937 -4.095 1.00 0.00 C ATOM 246 C6 U A 8 3.487 7.769 -5.414 1.00 0.00 C ATOM 0 H5' U A 8 6.736 7.138 -8.692 1.00 0.00 H new ATOM 0 H5'' U A 8 6.717 8.802 -9.241 1.00 0.00 H new ATOM 0 H4' U A 8 4.746 7.673 -9.904 1.00 0.00 H new ATOM 0 H3' U A 8 4.273 9.902 -7.825 1.00 0.00 H new ATOM 0 H2' U A 8 1.861 9.473 -8.205 1.00 0.00 H new ATOM 0 HO2' U A 8 1.829 9.242 -10.402 1.00 0.00 H new ATOM 0 H1' U A 8 2.049 6.695 -8.122 1.00 0.00 H new ATOM 0 H3 U A 8 -0.088 8.028 -4.326 1.00 0.00 H new ATOM 0 H5 U A 8 4.016 7.992 -3.385 1.00 0.00 H new ATOM 0 H6 U A 8 4.516 7.717 -5.737 1.00 0.00 H new ATOM 257 P G A 9 3.692 11.703 -9.701 1.00 0.00 P ATOM 258 OP1 G A 9 4.200 12.434 -10.882 1.00 0.00 O ATOM 259 OP2 G A 9 3.935 12.251 -8.338 1.00 0.00 O1- ATOM 260 O5' G A 9 2.107 11.475 -9.904 1.00 0.00 O ATOM 261 C5' G A 9 1.172 12.379 -9.347 1.00 0.00 C ATOM 262 C4' G A 9 -0.257 11.829 -9.504 1.00 0.00 C ATOM 263 O4' G A 9 -0.452 10.689 -8.664 1.00 0.00 O ATOM 264 C3' G A 9 -1.287 12.876 -9.093 1.00 0.00 C ATOM 265 O3' G A 9 -1.634 13.744 -10.170 1.00 0.00 O ATOM 266 C2' G A 9 -2.446 12.008 -8.580 1.00 0.00 C ATOM 267 O2' G A 9 -3.275 11.500 -9.633 1.00 0.00 O ATOM 268 C1' G A 9 -1.685 10.839 -7.951 1.00 0.00 C ATOM 269 N9 G A 9 -1.416 11.050 -6.505 1.00 0.00 N ATOM 270 C8 G A 9 -0.207 11.255 -5.884 1.00 0.00 C ATOM 271 N7 G A 9 -0.274 11.362 -4.582 1.00 0.00 N ATOM 272 C5 G A 9 -1.645 11.220 -4.317 1.00 0.00 C ATOM 273 C6 G A 9 -2.396 11.225 -3.082 1.00 0.00 C ATOM 274 O6 G A 9 -1.985 11.400 -1.939 1.00 0.00 O ATOM 275 N1 G A 9 -3.745 11.028 -3.253 1.00 0.00 N ATOM 276 C2 G A 9 -4.347 10.843 -4.448 1.00 0.00 C ATOM 277 N2 G A 9 -5.643 10.695 -4.426 1.00 0.00 N ATOM 278 N3 G A 9 -3.707 10.831 -5.621 1.00 0.00 N ATOM 279 C4 G A 9 -2.356 11.020 -5.491 1.00 0.00 C ATOM 0 H5' G A 9 1.253 13.348 -9.840 1.00 0.00 H new ATOM 0 H5'' G A 9 1.394 12.539 -8.292 1.00 0.00 H new ATOM 0 H4' G A 9 -0.384 11.560 -10.553 1.00 0.00 H new ATOM 0 H3' G A 9 -0.935 13.579 -8.338 1.00 0.00 H new ATOM 0 H2' G A 9 -3.118 12.560 -7.924 1.00 0.00 H new ATOM 0 HO2' G A 9 -3.111 12.010 -10.454 1.00 0.00 H new ATOM 0 H1' G A 9 -2.296 9.940 -8.023 1.00 0.00 H new ATOM 0 H8 G A 9 0.724 11.322 -6.428 1.00 0.00 H new ATOM 0 H1 G A 9 -4.333 11.021 -2.419 1.00 0.00 H new ATOM 0 H21 G A 9 -6.155 10.552 -5.297 1.00 0.00 H new ATOM 0 H22 G A 9 -6.144 10.723 -3.538 1.00 0.00 H new ATOM 291 P U A 10 -2.226 15.194 -9.897 1.00 0.00 P ATOM 292 OP1 U A 10 -2.480 15.839 -11.209 1.00 0.00 O ATOM 293 OP2 U A 10 -1.322 15.871 -8.932 1.00 0.00 O1- ATOM 294 O5' U A 10 -3.645 14.904 -9.196 1.00 0.00 O ATOM 295 C5' U A 10 -4.226 15.846 -8.299 1.00 0.00 C ATOM 296 C4' U A 10 -5.470 15.261 -7.612 1.00 0.00 C ATOM 297 O4' U A 10 -5.172 14.055 -6.891 1.00 0.00 O ATOM 298 C3' U A 10 -6.051 16.248 -6.597 1.00 0.00 C ATOM 299 O3' U A 10 -6.905 17.215 -7.192 1.00 0.00 O ATOM 300 C2' U A 10 -6.763 15.287 -5.638 1.00 0.00 C ATOM 301 O2' U A 10 -8.015 14.812 -6.145 1.00 0.00 O ATOM 302 C1' U A 10 -5.759 14.122 -5.586 1.00 0.00 C ATOM 303 N1 U A 10 -4.716 14.296 -4.530 1.00 0.00 N ATOM 304 C2 U A 10 -5.122 14.146 -3.184 1.00 0.00 C ATOM 305 O2 U A 10 -6.279 13.924 -2.843 1.00 0.00 O ATOM 306 N3 U A 10 -4.156 14.312 -2.224 1.00 0.00 N ATOM 307 C4 U A 10 -2.820 14.567 -2.443 1.00 0.00 C ATOM 308 O4 U A 10 -2.045 14.693 -1.496 1.00 0.00 O ATOM 309 C5 U A 10 -2.459 14.628 -3.847 1.00 0.00 C ATOM 310 C6 U A 10 -3.380 14.486 -4.832 1.00 0.00 C ATOM 0 H5' U A 10 -4.499 16.750 -8.843 1.00 0.00 H new ATOM 0 H5'' U A 10 -3.493 16.136 -7.546 1.00 0.00 H new ATOM 0 H4' U A 10 -6.180 15.054 -8.412 1.00 0.00 H new ATOM 0 H3' U A 10 -5.314 16.883 -6.106 1.00 0.00 H new ATOM 0 H2' U A 10 -7.008 15.753 -4.684 1.00 0.00 H new ATOM 0 HO2' U A 10 -8.390 15.473 -6.763 1.00 0.00 H new ATOM 0 H1' U A 10 -6.269 13.196 -5.319 1.00 0.00 H new ATOM 0 H3 U A 10 -4.457 14.239 -1.252 1.00 0.00 H new ATOM 0 H5 U A 10 -1.426 14.791 -4.116 1.00 0.00 H new ATOM 0 H6 U A 10 -3.066 14.522 -5.865 1.00 0.00 H new ATOM 321 P G A 11 -7.429 18.469 -6.361 1.00 0.00 P ATOM 322 OP1 G A 11 -8.118 19.380 -7.316 1.00 0.00 O ATOM 323 OP2 G A 11 -6.302 18.992 -5.554 1.00 0.00 O1- ATOM 324 O5' G A 11 -8.517 17.862 -5.359 1.00 0.00 O ATOM 325 C5' G A 11 -9.103 18.681 -4.365 1.00 0.00 C ATOM 326 C4' G A 11 -10.067 17.852 -3.476 1.00 0.00 C ATOM 327 O4' G A 11 -9.383 16.862 -2.708 1.00 0.00 O ATOM 328 C3' G A 11 -10.770 18.757 -2.447 1.00 0.00 C ATOM 329 O3' G A 11 -12.015 18.181 -2.054 1.00 0.00 O ATOM 330 C2' G A 11 -9.745 18.753 -1.300 1.00 0.00 C ATOM 331 O2' G A 11 -10.346 19.005 -0.032 1.00 0.00 O ATOM 332 C1' G A 11 -9.099 17.367 -1.409 1.00 0.00 C ATOM 333 N9 G A 11 -7.623 17.408 -1.188 1.00 0.00 N ATOM 334 C8 G A 11 -6.614 17.423 -2.120 1.00 0.00 C ATOM 335 N7 G A 11 -5.411 17.440 -1.601 1.00 0.00 N ATOM 336 C5 G A 11 -5.642 17.436 -0.215 1.00 0.00 C ATOM 337 C6 G A 11 -4.735 17.439 0.905 1.00 0.00 C ATOM 338 O6 G A 11 -3.503 17.448 0.895 1.00 0.00 O ATOM 339 N1 G A 11 -5.372 17.419 2.132 1.00 0.00 N ATOM 340 C2 G A 11 -6.714 17.414 2.284 1.00 0.00 C ATOM 341 N2 G A 11 -7.194 17.458 3.505 1.00 0.00 N ATOM 342 N3 G A 11 -7.590 17.398 1.280 1.00 0.00 N ATOM 343 C4 G A 11 -6.997 17.411 0.043 1.00 0.00 C ATOM 0 H5' G A 11 -9.647 19.501 -4.835 1.00 0.00 H new ATOM 0 H5'' G A 11 -8.324 19.128 -3.748 1.00 0.00 H new ATOM 0 H4' G A 11 -10.769 17.385 -4.166 1.00 0.00 H new ATOM 0 H3' G A 11 -11.022 19.756 -2.802 1.00 0.00 H new ATOM 0 H2' G A 11 -9.009 19.553 -1.380 1.00 0.00 H new ATOM 0 HO2' G A 11 -9.657 18.991 0.665 1.00 0.00 H new ATOM 0 HO3' G A 11 -12.076 18.170 -1.076 1.00 0.00 H new ATOM 0 H1' G A 11 -9.510 16.722 -0.632 1.00 0.00 H new ATOM 0 H8 G A 11 -6.796 17.421 -3.185 1.00 0.00 H new ATOM 0 H1 G A 11 -4.794 17.407 2.972 1.00 0.00 H new ATOM 0 H21 G A 11 -8.203 17.456 3.657 1.00 0.00 H new ATOM 0 H22 G A 11 -6.558 17.494 4.302 1.00 0.00 H new TER 356 G A 11 ATOM 357 O5' C B 12 -1.381 16.095 11.543 1.00 0.00 O ATOM 358 C5' C B 12 -1.966 15.240 10.578 1.00 0.00 C ATOM 359 C4' C B 12 -3.296 15.785 10.041 1.00 0.00 C ATOM 360 O4' C B 12 -3.118 16.917 9.185 1.00 0.00 O ATOM 361 C3' C B 12 -4.008 14.741 9.179 1.00 0.00 C ATOM 362 O3' C B 12 -4.669 13.736 9.939 1.00 0.00 O ATOM 363 C2' C B 12 -4.972 15.646 8.395 1.00 0.00 C ATOM 364 O2' C B 12 -6.083 16.100 9.171 1.00 0.00 O ATOM 365 C1' C B 12 -4.064 16.858 8.113 1.00 0.00 C ATOM 366 N1 C B 12 -3.407 16.709 6.772 1.00 0.00 N ATOM 367 C2 C B 12 -4.127 17.107 5.633 1.00 0.00 C ATOM 368 O2 C B 12 -5.289 17.522 5.685 1.00 0.00 O ATOM 369 N3 C B 12 -3.552 17.051 4.404 1.00 0.00 N ATOM 370 C4 C B 12 -2.306 16.610 4.299 1.00 0.00 C ATOM 371 N4 C B 12 -1.797 16.599 3.096 1.00 0.00 N ATOM 372 C5 C B 12 -1.527 16.197 5.418 1.00 0.00 C ATOM 373 C6 C B 12 -2.108 16.271 6.641 1.00 0.00 C ATOM 0 H5' C B 12 -2.131 14.258 11.020 1.00 0.00 H new ATOM 0 H5'' C B 12 -1.271 15.104 9.749 1.00 0.00 H new ATOM 0 H4' C B 12 -3.870 16.054 10.928 1.00 0.00 H new ATOM 0 H3' C B 12 -3.344 14.142 8.556 1.00 0.00 H new ATOM 0 H2' C B 12 -5.406 15.136 7.535 1.00 0.00 H new ATOM 0 HO2' C B 12 -6.226 15.491 9.925 1.00 0.00 H new ATOM 0 HO5' C B 12 -0.538 15.706 11.857 1.00 0.00 H new ATOM 0 H1' C B 12 -4.626 17.791 8.070 1.00 0.00 H new ATOM 0 H41 C B 12 -0.842 16.271 2.949 1.00 0.00 H new ATOM 0 H42 C B 12 -2.354 16.919 2.304 1.00 0.00 H new ATOM 0 H5 C B 12 -0.515 15.840 5.297 1.00 0.00 H new ATOM 0 H6 C B 12 -1.548 15.984 7.519 1.00 0.00 H new ATOM 386 P A B 13 -4.923 12.274 9.304 1.00 0.00 P ATOM 387 OP1 A B 13 -5.619 11.464 10.338 1.00 0.00 O ATOM 388 OP2 A B 13 -3.643 11.785 8.740 1.00 0.00 O1- ATOM 389 O5' A B 13 -5.934 12.504 8.083 1.00 0.00 O ATOM 390 C5' A B 13 -7.307 12.784 8.325 1.00 0.00 C ATOM 391 C4' A B 13 -8.050 13.140 7.040 1.00 0.00 C ATOM 392 O4' A B 13 -7.447 14.246 6.355 1.00 0.00 O ATOM 393 C3' A B 13 -8.135 12.002 6.006 1.00 0.00 C ATOM 394 O3' A B 13 -9.157 11.064 6.303 1.00 0.00 O ATOM 395 C2' A B 13 -8.432 12.815 4.738 1.00 0.00 C ATOM 396 O2' A B 13 -9.782 13.279 4.684 1.00 0.00 O ATOM 397 C1' A B 13 -7.530 14.031 4.948 1.00 0.00 C ATOM 398 N9 A B 13 -6.180 13.787 4.375 1.00 0.00 N ATOM 399 C8 A B 13 -4.971 13.613 5.011 1.00 0.00 C ATOM 400 N7 A B 13 -3.939 13.621 4.203 1.00 0.00 N ATOM 401 C5 A B 13 -4.529 13.798 2.932 1.00 0.00 C ATOM 402 C6 A B 13 -4.047 13.937 1.606 1.00 0.00 C ATOM 403 N6 A B 13 -2.780 13.950 1.242 1.00 0.00 N ATOM 404 N1 A B 13 -4.884 14.079 0.583 1.00 0.00 N ATOM 405 C2 A B 13 -6.183 14.085 0.848 1.00 0.00 C ATOM 406 N3 A B 13 -6.788 14.013 2.025 1.00 0.00 N ATOM 407 C4 A B 13 -5.895 13.863 3.037 1.00 0.00 C ATOM 0 H5' A B 13 -7.390 13.609 9.033 1.00 0.00 H new ATOM 0 H5'' A B 13 -7.778 11.917 8.789 1.00 0.00 H new ATOM 0 H4' A B 13 -9.051 13.376 7.401 1.00 0.00 H new ATOM 0 H3' A B 13 -7.246 11.373 5.949 1.00 0.00 H new ATOM 0 H2' A B 13 -8.273 12.235 3.829 1.00 0.00 H new ATOM 0 HO2' A B 13 -10.355 12.681 5.209 1.00 0.00 H new ATOM 0 H1' A B 13 -7.938 14.908 4.445 1.00 0.00 H new ATOM 0 H8 A B 13 -4.881 13.482 6.079 1.00 0.00 H new ATOM 0 H61 A B 13 -2.533 14.056 0.258 1.00 0.00 H new ATOM 0 H62 A B 13 -2.047 13.854 1.944 1.00 0.00 H new ATOM 0 H2 A B 13 -6.835 14.158 -0.010 1.00 0.00 H new ATOM 419 P C B 14 -9.098 9.600 5.668 1.00 0.00 P ATOM 420 OP1 C B 14 -10.298 8.855 6.135 1.00 0.00 O ATOM 421 OP2 C B 14 -7.767 9.027 5.975 1.00 0.00 O1- ATOM 422 O5' C B 14 -9.184 9.778 4.070 1.00 0.00 O ATOM 423 C5' C B 14 -10.409 10.066 3.416 1.00 0.00 C ATOM 424 C4' C B 14 -10.260 10.113 1.886 1.00 0.00 C ATOM 425 O4' C B 14 -9.291 11.076 1.457 1.00 0.00 O ATOM 426 C3' C B 14 -9.816 8.765 1.319 1.00 0.00 C ATOM 427 O3' C B 14 -10.911 7.853 1.226 1.00 0.00 O ATOM 428 C2' C B 14 -9.229 9.216 -0.032 1.00 0.00 C ATOM 429 O2' C B 14 -10.221 9.391 -1.047 1.00 0.00 O ATOM 430 C1' C B 14 -8.651 10.596 0.273 1.00 0.00 C ATOM 431 N1 C B 14 -7.166 10.544 0.432 1.00 0.00 N ATOM 432 C2 C B 14 -6.365 10.699 -0.710 1.00 0.00 C ATOM 433 O2 C B 14 -6.833 10.772 -1.844 1.00 0.00 O ATOM 434 N3 C B 14 -5.013 10.750 -0.602 1.00 0.00 N ATOM 435 C4 C B 14 -4.458 10.601 0.587 1.00 0.00 C ATOM 436 N4 C B 14 -3.156 10.678 0.623 1.00 0.00 N ATOM 437 C5 C B 14 -5.212 10.410 1.774 1.00 0.00 C ATOM 438 C6 C B 14 -6.563 10.404 1.662 1.00 0.00 C ATOM 0 H5' C B 14 -10.791 11.023 3.771 1.00 0.00 H new ATOM 0 H5'' C B 14 -11.147 9.310 3.683 1.00 0.00 H new ATOM 0 H4' C B 14 -11.249 10.386 1.518 1.00 0.00 H new ATOM 0 H3' C B 14 -9.104 8.200 1.921 1.00 0.00 H new ATOM 0 H2' C B 14 -8.524 8.473 -0.404 1.00 0.00 H new ATOM 0 HO2' C B 14 -11.041 8.922 -0.787 1.00 0.00 H new ATOM 0 H1' C B 14 -8.840 11.277 -0.557 1.00 0.00 H new ATOM 0 H41 C B 14 -2.663 10.572 1.510 1.00 0.00 H new ATOM 0 H42 C B 14 -2.631 10.844 -0.236 1.00 0.00 H new ATOM 0 H5 C B 14 -4.728 10.275 2.730 1.00 0.00 H new ATOM 0 H6 C B 14 -7.172 10.288 2.546 1.00 0.00 H new ATOM 450 P A B 15 -10.692 6.304 0.897 1.00 0.00 P ATOM 451 OP1 A B 15 -12.026 5.660 0.903 1.00 0.00 O ATOM 452 OP2 A B 15 -9.633 5.794 1.804 1.00 0.00 O1- ATOM 453 O5' A B 15 -10.161 6.321 -0.617 1.00 0.00 O ATOM 454 C5' A B 15 -9.090 5.477 -1.018 1.00 0.00 C ATOM 455 C4' A B 15 -8.711 5.743 -2.474 1.00 0.00 C ATOM 456 O4' A B 15 -8.112 7.032 -2.649 1.00 0.00 O ATOM 457 C3' A B 15 -7.690 4.713 -2.941 1.00 0.00 C ATOM 458 O3' A B 15 -8.314 3.508 -3.345 1.00 0.00 O ATOM 459 C2' A B 15 -6.996 5.493 -4.067 1.00 0.00 C ATOM 460 O2' A B 15 -7.735 5.498 -5.290 1.00 0.00 O ATOM 461 C1' A B 15 -6.970 6.909 -3.489 1.00 0.00 C ATOM 462 N9 A B 15 -5.742 7.149 -2.690 1.00 0.00 N ATOM 463 C8 A B 15 -5.597 7.226 -1.325 1.00 0.00 C ATOM 464 N7 A B 15 -4.375 7.456 -0.920 1.00 0.00 N ATOM 465 C5 A B 15 -3.659 7.547 -2.128 1.00 0.00 C ATOM 466 C6 A B 15 -2.311 7.808 -2.469 1.00 0.00 C ATOM 467 N6 A B 15 -1.357 8.074 -1.604 1.00 0.00 N ATOM 468 N1 A B 15 -1.916 7.847 -3.744 1.00 0.00 N ATOM 469 C2 A B 15 -2.822 7.612 -4.685 1.00 0.00 C ATOM 470 N3 A B 15 -4.121 7.369 -4.513 1.00 0.00 N ATOM 471 C4 A B 15 -4.482 7.360 -3.197 1.00 0.00 C ATOM 0 H5' A B 15 -9.378 4.433 -0.897 1.00 0.00 H new ATOM 0 H5'' A B 15 -8.226 5.646 -0.375 1.00 0.00 H new ATOM 0 H4' A B 15 -9.635 5.688 -3.050 1.00 0.00 H new ATOM 0 H3' A B 15 -6.990 4.359 -2.184 1.00 0.00 H new ATOM 0 H2' A B 15 -6.028 5.065 -4.327 1.00 0.00 H new ATOM 0 HO2' A B 15 -8.382 4.762 -5.285 1.00 0.00 H new ATOM 0 H1' A B 15 -6.978 7.639 -4.298 1.00 0.00 H new ATOM 0 H8 A B 15 -6.425 7.106 -0.642 1.00 0.00 H new ATOM 0 H61 A B 15 -0.407 8.252 -1.931 1.00 0.00 H new ATOM 0 H62 A B 15 -1.567 8.103 -0.606 1.00 0.00 H new ATOM 0 H2 A B 15 -2.467 7.618 -5.705 1.00 0.00 H new ATOM 483 P C B 16 -7.461 2.167 -3.587 1.00 0.00 P ATOM 484 OP1 C B 16 -8.419 1.057 -3.788 1.00 0.00 O ATOM 485 OP2 C B 16 -6.468 2.069 -2.491 1.00 0.00 O1- ATOM 486 O5' C B 16 -6.672 2.446 -4.955 1.00 0.00 O ATOM 487 C5' C B 16 -5.682 1.528 -5.403 1.00 0.00 C ATOM 488 C4' C B 16 -5.068 2.008 -6.738 1.00 0.00 C ATOM 489 O4' C B 16 -4.472 3.298 -6.606 1.00 0.00 O ATOM 490 C3' C B 16 -3.951 1.039 -7.163 1.00 0.00 C ATOM 491 O3' C B 16 -3.747 0.958 -8.576 1.00 0.00 O ATOM 492 C2' C B 16 -2.742 1.676 -6.474 1.00 0.00 C ATOM 493 O2' C B 16 -1.506 1.397 -7.124 1.00 0.00 O ATOM 494 C1' C B 16 -3.069 3.170 -6.477 1.00 0.00 C ATOM 495 N1 C B 16 -2.557 3.833 -5.240 1.00 0.00 N ATOM 496 C2 C B 16 -1.233 4.311 -5.246 1.00 0.00 C ATOM 497 O2 C B 16 -0.587 4.428 -6.286 1.00 0.00 O ATOM 498 N3 C B 16 -0.613 4.628 -4.083 1.00 0.00 N ATOM 499 C4 C B 16 -1.289 4.536 -2.957 1.00 0.00 C ATOM 500 N4 C B 16 -0.631 4.798 -1.864 1.00 0.00 N ATOM 501 C5 C B 16 -2.663 4.157 -2.892 1.00 0.00 C ATOM 502 C6 C B 16 -3.262 3.824 -4.061 1.00 0.00 C ATOM 0 H5' C B 16 -6.125 0.540 -5.533 1.00 0.00 H new ATOM 0 H5'' C B 16 -4.900 1.430 -4.650 1.00 0.00 H new ATOM 0 H4' C B 16 -5.873 2.047 -7.472 1.00 0.00 H new ATOM 0 H3' C B 16 -4.167 0.006 -6.890 1.00 0.00 H new ATOM 0 H2' C B 16 -2.592 1.274 -5.472 1.00 0.00 H new ATOM 0 HO2' C B 16 -1.681 1.015 -8.009 1.00 0.00 H new ATOM 0 H1' C B 16 -2.577 3.670 -7.312 1.00 0.00 H new ATOM 0 H41 C B 16 -1.101 4.744 -0.960 1.00 0.00 H new ATOM 0 H42 C B 16 0.354 5.058 -1.912 1.00 0.00 H new ATOM 0 H5 C B 16 -3.200 4.136 -1.955 1.00 0.00 H new ATOM 0 H6 C B 16 -4.306 3.548 -4.066 1.00 0.00 H new ATOM 514 P G B 17 -4.697 0.057 -9.494 1.00 0.00 P ATOM 515 OP1 G B 17 -4.054 -0.049 -10.828 1.00 0.00 O ATOM 516 OP2 G B 17 -6.088 0.566 -9.402 1.00 0.00 O1- ATOM 517 O5' G B 17 -4.658 -1.384 -8.789 1.00 0.00 O ATOM 518 C5' G B 17 -3.692 -2.374 -9.112 1.00 0.00 C ATOM 519 C4' G B 17 -2.240 -1.958 -8.849 1.00 0.00 C ATOM 520 O4' G B 17 -1.941 -1.744 -7.471 1.00 0.00 O ATOM 521 C3' G B 17 -1.284 -3.097 -9.190 1.00 0.00 C ATOM 522 O3' G B 17 -1.127 -3.262 -10.594 1.00 0.00 O ATOM 523 C2' G B 17 0.003 -2.656 -8.480 1.00 0.00 C ATOM 524 O2' G B 17 0.851 -1.876 -9.332 1.00 0.00 O ATOM 525 C1' G B 17 -0.520 -1.766 -7.344 1.00 0.00 C ATOM 526 N9 G B 17 -0.096 -2.184 -5.978 1.00 0.00 N ATOM 527 C8 G B 17 -0.880 -2.284 -4.853 1.00 0.00 C ATOM 528 N7 G B 17 -0.205 -2.394 -3.737 1.00 0.00 N ATOM 529 C5 G B 17 1.131 -2.415 -4.159 1.00 0.00 C ATOM 530 C6 G B 17 2.362 -2.491 -3.409 1.00 0.00 C ATOM 531 O6 G B 17 2.532 -2.493 -2.193 1.00 0.00 O ATOM 532 N1 G B 17 3.484 -2.589 -4.203 1.00 0.00 N ATOM 533 C2 G B 17 3.446 -2.571 -5.559 1.00 0.00 C ATOM 534 N2 G B 17 4.582 -2.780 -6.182 1.00 0.00 N ATOM 535 N3 G B 17 2.341 -2.442 -6.289 1.00 0.00 N ATOM 536 C4 G B 17 1.207 -2.361 -5.533 1.00 0.00 C ATOM 0 H5' G B 17 -3.796 -2.635 -10.165 1.00 0.00 H new ATOM 0 H5'' G B 17 -3.908 -3.275 -8.538 1.00 0.00 H new ATOM 0 H4' G B 17 -2.124 -1.053 -9.445 1.00 0.00 H new ATOM 0 H3' G B 17 -1.629 -4.079 -8.868 1.00 0.00 H new ATOM 0 H2' G B 17 0.601 -3.508 -8.157 1.00 0.00 H new ATOM 0 HO2' G B 17 0.604 -2.029 -10.268 1.00 0.00 H new ATOM 0 H1' G B 17 -0.084 -0.772 -7.447 1.00 0.00 H new ATOM 0 H8 G B 17 -1.959 -2.273 -4.887 1.00 0.00 H new ATOM 0 H1 G B 17 4.392 -2.680 -3.747 1.00 0.00 H new ATOM 0 H21 G B 17 4.612 -2.778 -7.202 1.00 0.00 H new ATOM 0 H22 G B 17 5.434 -2.945 -5.647 1.00 0.00 H new ATOM 548 P U B 18 -0.958 -4.711 -11.253 1.00 0.00 P ATOM 549 OP1 U B 18 -0.621 -4.507 -12.688 1.00 0.00 O ATOM 550 OP2 U B 18 -2.156 -5.513 -10.911 1.00 0.00 O1- ATOM 551 O5' U B 18 0.329 -5.316 -10.509 1.00 0.00 O ATOM 552 C5' U B 18 0.222 -6.337 -9.533 1.00 0.00 C ATOM 553 C4' U B 18 1.571 -6.551 -8.847 1.00 0.00 C ATOM 554 O4' U B 18 1.808 -5.561 -7.849 1.00 0.00 O ATOM 555 C3' U B 18 1.656 -7.892 -8.126 1.00 0.00 C ATOM 556 O3' U B 18 1.879 -8.974 -9.024 1.00 0.00 O ATOM 557 C2' U B 18 2.803 -7.611 -7.144 1.00 0.00 C ATOM 558 O2' U B 18 4.083 -7.736 -7.754 1.00 0.00 O ATOM 559 C1' U B 18 2.572 -6.137 -6.799 1.00 0.00 C ATOM 560 N1 U B 18 1.896 -5.987 -5.481 1.00 0.00 N ATOM 561 C2 U B 18 2.699 -5.864 -4.348 1.00 0.00 C ATOM 562 O2 U B 18 3.931 -5.876 -4.402 1.00 0.00 O ATOM 563 N3 U B 18 2.074 -5.711 -3.127 1.00 0.00 N ATOM 564 C4 U B 18 0.716 -5.686 -2.929 1.00 0.00 C ATOM 565 O4 U B 18 0.259 -5.565 -1.792 1.00 0.00 O ATOM 566 C5 U B 18 -0.062 -5.843 -4.136 1.00 0.00 C ATOM 567 C6 U B 18 0.522 -5.984 -5.354 1.00 0.00 C ATOM 0 H5' U B 18 -0.108 -7.265 -10.001 1.00 0.00 H new ATOM 0 H5'' U B 18 -0.532 -6.067 -8.794 1.00 0.00 H new ATOM 0 H4' U B 18 2.305 -6.501 -9.651 1.00 0.00 H new ATOM 0 H3' U B 18 0.744 -8.217 -7.626 1.00 0.00 H new ATOM 0 H2' U B 18 2.801 -8.303 -6.302 1.00 0.00 H new ATOM 0 HO2' U B 18 4.019 -8.332 -8.529 1.00 0.00 H new ATOM 0 H1' U B 18 3.527 -5.619 -6.709 1.00 0.00 H new ATOM 0 H3 U B 18 2.669 -5.608 -2.305 1.00 0.00 H new ATOM 0 H5 U B 18 -1.140 -5.848 -4.068 1.00 0.00 H new ATOM 0 H6 U B 18 -0.096 -6.095 -6.233 1.00 0.00 H new ATOM 578 P C B 19 1.677 -10.496 -8.573 1.00 0.00 P ATOM 579 OP1 C B 19 1.936 -11.356 -9.754 1.00 0.00 O ATOM 580 OP2 C B 19 0.375 -10.595 -7.887 1.00 0.00 O1- ATOM 581 O5' C B 19 2.858 -10.739 -7.510 1.00 0.00 O ATOM 582 C5' C B 19 2.639 -11.474 -6.314 1.00 0.00 C ATOM 583 C4' C B 19 3.874 -11.398 -5.419 1.00 0.00 C ATOM 584 O4' C B 19 4.064 -10.095 -4.884 1.00 0.00 O ATOM 585 C3' C B 19 3.715 -12.291 -4.181 1.00 0.00 C ATOM 586 O3' C B 19 3.976 -13.679 -4.351 1.00 0.00 O ATOM 587 C2' C B 19 4.774 -11.683 -3.267 1.00 0.00 C ATOM 588 O2' C B 19 6.096 -12.082 -3.637 1.00 0.00 O ATOM 589 C1' C B 19 4.614 -10.191 -3.579 1.00 0.00 C ATOM 590 N1 C B 19 3.749 -9.547 -2.544 1.00 0.00 N ATOM 591 C2 C B 19 4.315 -9.252 -1.299 1.00 0.00 C ATOM 592 O2 C B 19 5.483 -9.535 -1.024 1.00 0.00 O ATOM 593 N3 C B 19 3.590 -8.652 -0.326 1.00 0.00 N ATOM 594 C4 C B 19 2.323 -8.384 -0.556 1.00 0.00 C ATOM 595 N4 C B 19 1.700 -7.764 0.402 1.00 0.00 N ATOM 596 C5 C B 19 1.668 -8.705 -1.785 1.00 0.00 C ATOM 597 C6 C B 19 2.410 -9.297 -2.754 1.00 0.00 C ATOM 0 H5' C B 19 2.416 -12.514 -6.552 1.00 0.00 H new ATOM 0 H5'' C B 19 1.773 -11.075 -5.786 1.00 0.00 H new ATOM 0 H4' C B 19 4.705 -11.702 -6.056 1.00 0.00 H new ATOM 0 H3' C B 19 2.681 -12.296 -3.836 1.00 0.00 H new ATOM 0 H2' C B 19 4.650 -11.974 -2.224 1.00 0.00 H new ATOM 0 HO2' C B 19 6.069 -12.981 -4.027 1.00 0.00 H new ATOM 0 H1' C B 19 5.568 -9.665 -3.553 1.00 0.00 H new ATOM 0 H41 C B 19 0.715 -7.522 0.297 1.00 0.00 H new ATOM 0 H42 C B 19 2.197 -7.520 1.259 1.00 0.00 H new ATOM 0 H5 C B 19 0.622 -8.485 -1.937 1.00 0.00 H new ATOM 0 H6 C B 19 1.951 -9.573 -3.692 1.00 0.00 H new ATOM 609 P G B 20 2.923 -14.770 -3.845 1.00 0.00 P ATOM 610 OP1 G B 20 3.620 -16.071 -3.742 1.00 0.00 O ATOM 611 OP2 G B 20 1.727 -14.663 -4.711 1.00 0.00 O1- ATOM 612 O5' G B 20 2.514 -14.239 -2.372 1.00 0.00 O ATOM 613 C5' G B 20 2.756 -14.969 -1.174 1.00 0.00 C ATOM 614 C4' G B 20 4.229 -14.957 -0.708 1.00 0.00 C ATOM 615 O4' G B 20 4.735 -13.633 -0.547 1.00 0.00 O ATOM 616 C3' G B 20 4.327 -15.650 0.655 1.00 0.00 C ATOM 617 O3' G B 20 4.758 -17.005 0.590 1.00 0.00 O ATOM 618 C2' G B 20 5.337 -14.778 1.417 1.00 0.00 C ATOM 619 O2' G B 20 6.695 -15.135 1.136 1.00 0.00 O ATOM 620 C1' G B 20 5.086 -13.393 0.817 1.00 0.00 C ATOM 621 N9 G B 20 4.003 -12.622 1.483 1.00 0.00 N ATOM 622 C8 G B 20 2.933 -11.991 0.889 1.00 0.00 C ATOM 623 N7 G B 20 2.225 -11.251 1.693 1.00 0.00 N ATOM 624 C5 G B 20 2.882 -11.377 2.928 1.00 0.00 C ATOM 625 C6 G B 20 2.626 -10.773 4.210 1.00 0.00 C ATOM 626 O6 G B 20 1.745 -9.969 4.537 1.00 0.00 O ATOM 627 N1 G B 20 3.525 -11.157 5.189 1.00 0.00 N ATOM 628 C2 G B 20 4.541 -12.025 4.977 1.00 0.00 C ATOM 629 N2 G B 20 5.268 -12.377 6.004 1.00 0.00 N ATOM 630 N3 G B 20 4.833 -12.575 3.795 1.00 0.00 N ATOM 631 C4 G B 20 3.964 -12.226 2.802 1.00 0.00 C ATOM 0 H5' G B 20 2.443 -16.002 -1.323 1.00 0.00 H new ATOM 0 H5'' G B 20 2.133 -14.558 -0.380 1.00 0.00 H new ATOM 0 H4' G B 20 4.813 -15.468 -1.473 1.00 0.00 H new ATOM 0 H3' G B 20 3.351 -15.724 1.134 1.00 0.00 H new ATOM 0 H2' G B 20 5.211 -14.866 2.496 1.00 0.00 H new ATOM 0 HO2' G B 20 6.738 -16.080 0.879 1.00 0.00 H new ATOM 0 H1' G B 20 5.979 -12.781 0.943 1.00 0.00 H new ATOM 0 H8 G B 20 2.700 -12.101 -0.160 1.00 0.00 H new ATOM 0 H1 G B 20 3.416 -10.763 6.124 1.00 0.00 H new ATOM 0 H21 G B 20 6.042 -13.030 5.881 1.00 0.00 H new ATOM 0 H22 G B 20 5.061 -11.999 6.929 1.00 0.00 H new ATOM 643 P G B 21 4.035 -18.121 1.479 1.00 0.00 P ATOM 644 OP1 G B 21 4.750 -19.411 1.318 1.00 0.00 O ATOM 645 OP2 G B 21 2.585 -18.061 1.176 1.00 0.00 O1- ATOM 646 O5' G B 21 4.225 -17.601 2.993 1.00 0.00 O ATOM 647 C5' G B 21 5.494 -17.615 3.636 1.00 0.00 C ATOM 648 C4' G B 21 5.395 -17.244 5.131 1.00 0.00 C ATOM 649 O4' G B 21 4.894 -15.906 5.300 1.00 0.00 O ATOM 650 C3' G B 21 4.491 -18.216 5.906 1.00 0.00 C ATOM 651 O3' G B 21 5.071 -18.541 7.179 1.00 0.00 O ATOM 652 C2' G B 21 3.214 -17.378 6.046 1.00 0.00 C ATOM 653 O2' G B 21 2.397 -17.785 7.141 1.00 0.00 O ATOM 654 C1' G B 21 3.790 -15.965 6.207 1.00 0.00 C ATOM 655 N9 G B 21 2.774 -14.926 5.907 1.00 0.00 N ATOM 656 C8 G B 21 2.144 -14.666 4.716 1.00 0.00 C ATOM 657 N7 G B 21 1.201 -13.767 4.799 1.00 0.00 N ATOM 658 C5 G B 21 1.193 -13.400 6.151 1.00 0.00 C ATOM 659 C6 G B 21 0.391 -12.457 6.892 1.00 0.00 C ATOM 660 O6 G B 21 -0.515 -11.709 6.505 1.00 0.00 O ATOM 661 N1 G B 21 0.686 -12.427 8.232 1.00 0.00 N ATOM 662 C2 G B 21 1.646 -13.191 8.813 1.00 0.00 C ATOM 663 N2 G B 21 1.787 -13.101 10.111 1.00 0.00 N ATOM 664 N3 G B 21 2.421 -14.063 8.181 1.00 0.00 N ATOM 665 C4 G B 21 2.145 -14.127 6.839 1.00 0.00 C ATOM 0 H5' G B 21 6.162 -16.915 3.133 1.00 0.00 H new ATOM 0 H5'' G B 21 5.938 -18.606 3.538 1.00 0.00 H new ATOM 0 H4' G B 21 6.406 -17.310 5.533 1.00 0.00 H new ATOM 0 H3' G B 21 4.329 -19.181 5.426 1.00 0.00 H new ATOM 0 H2' G B 21 2.530 -17.474 5.203 1.00 0.00 H new ATOM 0 HO2' G B 21 1.600 -17.217 7.183 1.00 0.00 H new ATOM 0 HO3' G B 21 4.371 -18.548 7.865 1.00 0.00 H new ATOM 0 H1' G B 21 4.104 -15.770 7.232 1.00 0.00 H new ATOM 0 H8 G B 21 2.405 -15.161 3.792 1.00 0.00 H new ATOM 0 H1 G B 21 0.152 -11.793 8.827 1.00 0.00 H new ATOM 0 H21 G B 21 2.497 -13.658 10.587 1.00 0.00 H new ATOM 0 H22 G B 21 1.187 -12.474 10.647 1.00 0.00 H new TER 678 G B 21 HETATM 679 N1 QSV A 101 7.454 0.564 -0.094 1.00 0.00 N HETATM 680 C4 QSV A 101 8.328 0.545 -3.684 1.00 0.00 C HETATM 681 C5 QSV A 101 7.728 0.603 -4.941 1.00 0.00 C HETATM 682 C6 QSV A 101 8.210 0.534 -1.145 1.00 0.00 C HETATM 683 C7 QSV A 101 9.717 0.422 -1.065 1.00 0.00 C HETATM 684 C8 QSV A 101 7.118 0.432 2.311 1.00 0.00 C HETATM 685 C1 QSV A 101 5.557 0.772 -3.861 1.00 0.00 C HETATM 686 C2 QSV A 101 6.161 0.713 -2.601 1.00 0.00 C HETATM 687 C3 QSV A 101 7.566 0.603 -2.501 1.00 0.00 C HETATM 688 C9 QSV A 101 4.662 0.362 2.896 1.00 0.00 C HETATM 689 C4' QSV A 101 1.487 0.962 -5.088 1.00 0.00 C HETATM 690 C3' QSV A 101 1.724 0.988 -3.700 1.00 0.00 C HETATM 691 C2' QSV A 101 3.053 0.934 -3.238 1.00 0.00 C HETATM 692 C1' QSV A 101 4.110 0.872 -4.162 1.00 0.00 C HETATM 693 C5' QSV A 101 2.537 0.919 -6.003 1.00 0.00 C HETATM 694 C0' QSV A 101 3.836 0.874 -5.524 1.00 0.00 C HETATM 695 C0 QSV A 101 6.345 0.716 -5.008 1.00 0.00 C HETATM 696 S0 QSV A 101 5.336 0.760 -6.479 1.00 0.00 S HETATM 697 N2 QSV A 101 7.890 0.507 1.214 1.00 0.00 N1+ HETATM 698 N3 QSV A 101 7.581 0.373 3.493 1.00 0.00 N HETATM 699 N4 QSV A 101 5.828 0.288 2.018 1.00 0.00 N HETATM 700 C6' QSV A 101 0.582 1.056 -2.729 1.00 0.00 C HETATM 701 C7' QSV A 101 -0.826 1.130 -3.277 1.00 0.00 C HETATM 702 N1' QSV A 101 0.821 1.037 -1.455 1.00 0.00 N HETATM 703 N2' QSV A 101 -0.143 1.032 -0.472 1.00 0.00 N1+ HETATM 704 C8' QSV A 101 0.101 1.093 0.841 1.00 0.00 C HETATM 705 N3' QSV A 101 1.262 1.050 1.345 1.00 0.00 N HETATM 706 N4' QSV A 101 -0.979 1.232 1.612 1.00 0.00 N HETATM 707 C9' QSV A 101 -2.382 1.516 1.247 1.00 0.00 C