USER MOD reduce.3.24.130724 H: found=0, std=0, add=133, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 133 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 G O2' : rot -19:sc= 0.229 USER MOD Single : A 1 G O5' : rot -4:sc= -0.542! USER MOD Single : A 2 G O2' : rot -170:sc= -1.58! USER MOD Single : A 3 G O2' : rot -76:sc= 0.775 USER MOD Single : A 4 C O2' : rot -24:sc= 0.212 USER MOD Single : A 5 G O2' : rot -87:sc= 2.31 USER MOD Single : A 6 A O2' : rot -19:sc= 0.202 USER MOD Single : A 7 G O2' : rot -96:sc= 1.95 USER MOD Single : A 8 A O2' : rot -29:sc= 0.269 USER MOD Single : A 9 G O2' : rot -5:sc= -1.59! USER MOD Single : A 10 C O2' : rot -1:sc= -0.446 USER MOD Single : A 11 C O2' : rot -150:sc= 0.484 USER MOD Single : A 12 U O2' : rot -27:sc= 0.129 USER MOD Single : A 12 U O3' : rot 180:sc= 0.114 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -8.044 -0.437 -9.218 1.00 0.00 O ATOM 2 C5' G A 1 -9.345 0.047 -9.569 1.00 0.00 C ATOM 3 C4' G A 1 -10.379 -0.277 -8.492 1.00 0.00 C ATOM 4 O4' G A 1 -10.478 -1.692 -8.268 1.00 0.00 O ATOM 5 C3' G A 1 -9.982 0.320 -7.149 1.00 0.00 C ATOM 6 O3' G A 1 -10.565 1.623 -7.031 1.00 0.00 O ATOM 7 C2' G A 1 -10.670 -0.615 -6.177 1.00 0.00 C ATOM 8 O2' G A 1 -12.066 -0.315 -6.050 1.00 0.00 O ATOM 9 C1' G A 1 -10.445 -1.957 -6.855 1.00 0.00 C ATOM 10 N9 G A 1 -9.149 -2.536 -6.452 1.00 0.00 N ATOM 11 C8 G A 1 -7.991 -2.624 -7.146 1.00 0.00 C ATOM 12 N7 G A 1 -6.981 -3.172 -6.558 1.00 0.00 N ATOM 13 C5 G A 1 -7.521 -3.495 -5.309 1.00 0.00 C ATOM 14 C6 G A 1 -6.916 -4.125 -4.189 1.00 0.00 C ATOM 15 O6 G A 1 -5.762 -4.528 -4.070 1.00 0.00 O ATOM 16 N1 G A 1 -7.810 -4.258 -3.137 1.00 0.00 N ATOM 17 C2 G A 1 -9.123 -3.842 -3.154 1.00 0.00 C ATOM 18 N2 G A 1 -9.824 -4.056 -2.046 1.00 0.00 N ATOM 19 N3 G A 1 -9.701 -3.250 -4.199 1.00 0.00 N ATOM 20 C4 G A 1 -8.849 -3.108 -5.238 1.00 0.00 C ATOM 0 H5' G A 1 -9.655 -0.396 -10.516 1.00 0.00 H new ATOM 0 H5'' G A 1 -9.303 1.126 -9.720 1.00 0.00 H new ATOM 0 H4' G A 1 -11.321 0.136 -8.853 1.00 0.00 H new ATOM 0 H3' G A 1 -8.907 0.416 -6.998 1.00 0.00 H new ATOM 0 H2' G A 1 -10.291 -0.558 -5.157 1.00 0.00 H new ATOM 0 HO2' G A 1 -12.234 0.599 -6.361 1.00 0.00 H new ATOM 0 HO5' G A 1 -8.072 -0.831 -8.321 1.00 0.00 H new ATOM 0 H1' G A 1 -11.207 -2.683 -6.571 1.00 0.00 H new ATOM 0 H8 G A 1 -7.914 -2.249 -8.156 1.00 0.00 H new ATOM 0 H1 G A 1 -7.468 -4.699 -2.283 1.00 0.00 H new ATOM 0 H21 G A 1 -10.802 -3.770 -1.998 1.00 0.00 H new ATOM 0 H22 G A 1 -9.384 -4.506 -1.243 1.00 0.00 H new ATOM 33 P G A 2 -9.829 2.773 -6.174 1.00 0.00 P ATOM 34 OP1 G A 2 -10.657 3.999 -6.238 1.00 0.00 O ATOM 35 OP2 G A 2 -8.409 2.820 -6.585 1.00 0.00 O ATOM 36 O5' G A 2 -9.901 2.194 -4.672 1.00 0.00 O ATOM 37 C5' G A 2 -11.136 2.190 -3.945 1.00 0.00 C ATOM 38 C4' G A 2 -11.044 1.350 -2.673 1.00 0.00 C ATOM 39 O4' G A 2 -10.653 0.001 -2.964 1.00 0.00 O ATOM 40 C3' G A 2 -9.973 1.878 -1.732 1.00 0.00 C ATOM 41 O3' G A 2 -10.554 2.868 -0.872 1.00 0.00 O ATOM 42 C2' G A 2 -9.646 0.644 -0.917 1.00 0.00 C ATOM 43 O2' G A 2 -10.614 0.410 0.114 1.00 0.00 O ATOM 44 C1' G A 2 -9.693 -0.441 -1.987 1.00 0.00 C ATOM 45 N9 G A 2 -8.361 -0.636 -2.590 1.00 0.00 N ATOM 46 C8 G A 2 -7.850 -0.150 -3.748 1.00 0.00 C ATOM 47 N7 G A 2 -6.632 -0.463 -4.041 1.00 0.00 N ATOM 48 C5 G A 2 -6.272 -1.258 -2.947 1.00 0.00 C ATOM 49 C6 G A 2 -5.047 -1.918 -2.662 1.00 0.00 C ATOM 50 O6 G A 2 -4.013 -1.936 -3.325 1.00 0.00 O ATOM 51 N1 G A 2 -5.111 -2.610 -1.461 1.00 0.00 N ATOM 52 C2 G A 2 -6.210 -2.663 -0.633 1.00 0.00 C ATOM 53 N2 G A 2 -6.074 -3.374 0.481 1.00 0.00 N ATOM 54 N3 G A 2 -7.363 -2.050 -0.890 1.00 0.00 N ATOM 55 C4 G A 2 -7.327 -1.367 -2.056 1.00 0.00 C ATOM 0 H5' G A 2 -11.931 1.800 -4.581 1.00 0.00 H new ATOM 0 H5'' G A 2 -11.408 3.213 -3.686 1.00 0.00 H new ATOM 0 H4' G A 2 -12.035 1.397 -2.222 1.00 0.00 H new ATOM 0 H3' G A 2 -9.115 2.331 -2.230 1.00 0.00 H new ATOM 0 H2' G A 2 -8.698 0.706 -0.382 1.00 0.00 H new ATOM 0 HO2' G A 2 -10.289 -0.294 0.714 1.00 0.00 H new ATOM 0 H1' G A 2 -9.983 -1.404 -1.568 1.00 0.00 H new ATOM 0 H8 G A 2 -8.440 0.476 -4.401 1.00 0.00 H new ATOM 0 H1 G A 2 -4.278 -3.120 -1.168 1.00 0.00 H new ATOM 0 H21 G A 2 -6.853 -3.451 1.135 1.00 0.00 H new ATOM 0 H22 G A 2 -5.191 -3.843 0.682 1.00 0.00 H new ATOM 67 P G A 3 -9.620 3.845 0.007 1.00 0.00 P ATOM 68 OP1 G A 3 -10.493 4.803 0.722 1.00 0.00 O ATOM 69 OP2 G A 3 -8.531 4.349 -0.861 1.00 0.00 O ATOM 70 O5' G A 3 -8.974 2.843 1.091 1.00 0.00 O ATOM 71 C5' G A 3 -9.768 2.299 2.152 1.00 0.00 C ATOM 72 C4' G A 3 -8.988 1.276 2.977 1.00 0.00 C ATOM 73 O4' G A 3 -8.495 0.209 2.156 1.00 0.00 O ATOM 74 C3' G A 3 -7.753 1.901 3.609 1.00 0.00 C ATOM 75 O3' G A 3 -8.113 2.429 4.893 1.00 0.00 O ATOM 76 C2' G A 3 -6.854 0.694 3.805 1.00 0.00 C ATOM 77 O2' G A 3 -7.190 -0.026 4.998 1.00 0.00 O ATOM 78 C1' G A 3 -7.150 -0.122 2.551 1.00 0.00 C ATOM 79 N9 G A 3 -6.188 0.192 1.479 1.00 0.00 N ATOM 80 C8 G A 3 -6.271 1.104 0.478 1.00 0.00 C ATOM 81 N7 G A 3 -5.281 1.178 -0.347 1.00 0.00 N ATOM 82 C5 G A 3 -4.418 0.199 0.155 1.00 0.00 C ATOM 83 C6 G A 3 -3.142 -0.216 -0.308 1.00 0.00 C ATOM 84 O6 G A 3 -2.507 0.198 -1.273 1.00 0.00 O ATOM 85 N1 G A 3 -2.618 -1.224 0.484 1.00 0.00 N ATOM 86 C2 G A 3 -3.234 -1.773 1.585 1.00 0.00 C ATOM 87 N2 G A 3 -2.562 -2.727 2.218 1.00 0.00 N ATOM 88 N3 G A 3 -4.432 -1.393 2.029 1.00 0.00 N ATOM 89 C4 G A 3 -4.967 -0.408 1.274 1.00 0.00 C ATOM 0 H5' G A 3 -10.658 1.827 1.735 1.00 0.00 H new ATOM 0 H5'' G A 3 -10.109 3.105 2.801 1.00 0.00 H new ATOM 0 H4' G A 3 -9.686 0.913 3.731 1.00 0.00 H new ATOM 0 H3' G A 3 -7.302 2.704 3.025 1.00 0.00 H new ATOM 0 H2' G A 3 -5.800 0.944 3.928 1.00 0.00 H new ATOM 0 HO2' G A 3 -6.850 0.458 5.779 1.00 0.00 H new ATOM 0 H1' G A 3 -7.055 -1.190 2.747 1.00 0.00 H new ATOM 0 H8 G A 3 -7.134 1.745 0.375 1.00 0.00 H new ATOM 0 H1 G A 3 -1.700 -1.589 0.230 1.00 0.00 H new ATOM 0 H21 G A 3 -2.965 -3.174 3.042 1.00 0.00 H new ATOM 0 H22 G A 3 -1.643 -3.013 1.881 1.00 0.00 H new ATOM 101 P C A 4 -7.043 3.244 5.780 1.00 0.00 P ATOM 102 OP1 C A 4 -7.713 3.687 7.023 1.00 0.00 O ATOM 103 OP2 C A 4 -6.380 4.239 4.905 1.00 0.00 O ATOM 104 O5' C A 4 -5.966 2.108 6.163 1.00 0.00 O ATOM 105 C5' C A 4 -4.570 2.421 6.244 1.00 0.00 C ATOM 106 C4' C A 4 -3.703 1.167 6.137 1.00 0.00 C ATOM 107 O4' C A 4 -3.878 0.509 4.873 1.00 0.00 O ATOM 108 C3' C A 4 -2.224 1.516 6.205 1.00 0.00 C ATOM 109 O3' C A 4 -1.805 1.493 7.576 1.00 0.00 O ATOM 110 C2' C A 4 -1.599 0.343 5.479 1.00 0.00 C ATOM 111 O2' C A 4 -1.522 -0.817 6.318 1.00 0.00 O ATOM 112 C1' C A 4 -2.591 0.143 4.340 1.00 0.00 C ATOM 113 N1 C A 4 -2.243 0.975 3.164 1.00 0.00 N ATOM 114 C2 C A 4 -1.176 0.566 2.371 1.00 0.00 C ATOM 115 O2 C A 4 -0.537 -0.443 2.662 1.00 0.00 O ATOM 116 N3 C A 4 -0.864 1.309 1.276 1.00 0.00 N ATOM 117 C4 C A 4 -1.563 2.407 0.968 1.00 0.00 C ATOM 118 N4 C A 4 -1.237 3.103 -0.117 1.00 0.00 N ATOM 119 C5 C A 4 -2.658 2.836 1.781 1.00 0.00 C ATOM 120 C6 C A 4 -2.962 2.096 2.862 1.00 0.00 C ATOM 0 H5' C A 4 -4.364 2.926 7.188 1.00 0.00 H new ATOM 0 H5'' C A 4 -4.306 3.115 5.446 1.00 0.00 H new ATOM 0 H4' C A 4 -4.009 0.527 6.965 1.00 0.00 H new ATOM 0 H3' C A 4 -1.968 2.492 5.792 1.00 0.00 H new ATOM 0 H2' C A 4 -0.572 0.512 5.157 1.00 0.00 H new ATOM 0 HO2' C A 4 -1.525 -0.541 7.258 1.00 0.00 H new ATOM 0 H1' C A 4 -2.583 -0.888 3.987 1.00 0.00 H new ATOM 0 H41 C A 4 -1.763 3.942 -0.362 1.00 0.00 H new ATOM 0 H42 C A 4 -0.461 2.798 -0.704 1.00 0.00 H new ATOM 0 H5 C A 4 -3.222 3.724 1.535 1.00 0.00 H new ATOM 0 H6 C A 4 -3.783 2.391 3.498 1.00 0.00 H new ATOM 132 P G A 5 -0.790 2.610 8.143 1.00 0.00 P ATOM 133 OP1 G A 5 -0.661 2.420 9.605 1.00 0.00 O ATOM 134 OP2 G A 5 -1.201 3.925 7.603 1.00 0.00 O ATOM 135 O5' G A 5 0.605 2.197 7.452 1.00 0.00 O ATOM 136 C5' G A 5 1.332 1.048 7.904 1.00 0.00 C ATOM 137 C4' G A 5 2.398 0.620 6.897 1.00 0.00 C ATOM 138 O4' G A 5 1.818 0.319 5.620 1.00 0.00 O ATOM 139 C3' G A 5 3.396 1.741 6.639 1.00 0.00 C ATOM 140 O3' G A 5 4.493 1.605 7.553 1.00 0.00 O ATOM 141 C2' G A 5 3.888 1.407 5.246 1.00 0.00 C ATOM 142 O2' G A 5 4.893 0.383 5.273 1.00 0.00 O ATOM 143 C1' G A 5 2.607 0.918 4.579 1.00 0.00 C ATOM 144 N9 G A 5 1.878 2.028 3.934 1.00 0.00 N ATOM 145 C8 G A 5 0.783 2.706 4.357 1.00 0.00 C ATOM 146 N7 G A 5 0.324 3.640 3.593 1.00 0.00 N ATOM 147 C5 G A 5 1.217 3.593 2.519 1.00 0.00 C ATOM 148 C6 G A 5 1.262 4.377 1.335 1.00 0.00 C ATOM 149 O6 G A 5 0.507 5.281 0.987 1.00 0.00 O ATOM 150 N1 G A 5 2.321 4.008 0.520 1.00 0.00 N ATOM 151 C2 G A 5 3.228 3.012 0.801 1.00 0.00 C ATOM 152 N2 G A 5 4.173 2.811 -0.105 1.00 0.00 N ATOM 153 N3 G A 5 3.197 2.267 1.907 1.00 0.00 N ATOM 154 C4 G A 5 2.172 2.608 2.720 1.00 0.00 C ATOM 0 H5' G A 5 0.640 0.223 8.073 1.00 0.00 H new ATOM 0 H5'' G A 5 1.804 1.270 8.861 1.00 0.00 H new ATOM 0 H4' G A 5 2.883 -0.255 7.331 1.00 0.00 H new ATOM 0 H3' G A 5 2.982 2.743 6.747 1.00 0.00 H new ATOM 0 H2' G A 5 4.365 2.242 4.732 1.00 0.00 H new ATOM 0 HO2' G A 5 5.774 0.792 5.404 1.00 0.00 H new ATOM 0 H1' G A 5 2.828 0.202 3.787 1.00 0.00 H new ATOM 0 H8 G A 5 0.311 2.473 5.300 1.00 0.00 H new ATOM 0 H1 G A 5 2.437 4.515 -0.357 1.00 0.00 H new ATOM 0 H21 G A 5 4.876 2.087 0.043 1.00 0.00 H new ATOM 0 H22 G A 5 4.197 3.380 -0.951 1.00 0.00 H new ATOM 166 P A A 6 4.754 2.702 8.706 1.00 0.00 P ATOM 167 OP1 A A 6 5.996 2.332 9.422 1.00 0.00 O ATOM 168 OP2 A A 6 3.495 2.888 9.462 1.00 0.00 O ATOM 169 O5' A A 6 5.046 4.044 7.862 1.00 0.00 O ATOM 170 C5' A A 6 4.283 5.239 8.088 1.00 0.00 C ATOM 171 C4' A A 6 4.985 6.471 7.519 1.00 0.00 C ATOM 172 O4' A A 6 6.282 6.643 8.101 1.00 0.00 O ATOM 173 C3' A A 6 5.221 6.321 6.024 1.00 0.00 C ATOM 174 O3' A A 6 4.123 6.913 5.320 1.00 0.00 O ATOM 175 C2' A A 6 6.449 7.178 5.794 1.00 0.00 C ATOM 176 O2' A A 6 6.101 8.556 5.617 1.00 0.00 O ATOM 177 C1' A A 6 7.240 6.959 7.076 1.00 0.00 C ATOM 178 N9 A A 6 8.225 5.875 6.910 1.00 0.00 N ATOM 179 C8 A A 6 8.252 4.638 7.459 1.00 0.00 C ATOM 180 N7 A A 6 9.265 3.884 7.184 1.00 0.00 N ATOM 181 C5 A A 6 10.011 4.716 6.342 1.00 0.00 C ATOM 182 C6 A A 6 11.228 4.547 5.671 1.00 0.00 C ATOM 183 N6 A A 6 11.963 3.440 5.760 1.00 0.00 N ATOM 184 N1 A A 6 11.672 5.568 4.920 1.00 0.00 N ATOM 185 C2 A A 6 10.964 6.696 4.832 1.00 0.00 C ATOM 186 N3 A A 6 9.807 6.966 5.425 1.00 0.00 N ATOM 187 C4 A A 6 9.382 5.927 6.169 1.00 0.00 C ATOM 0 H5' A A 6 4.123 5.372 9.158 1.00 0.00 H new ATOM 0 H5'' A A 6 3.300 5.136 7.629 1.00 0.00 H new ATOM 0 H4' A A 6 4.336 7.318 7.739 1.00 0.00 H new ATOM 0 H3' A A 6 5.328 5.286 5.698 1.00 0.00 H new ATOM 0 H2' A A 6 7.002 6.916 4.892 1.00 0.00 H new ATOM 0 HO2' A A 6 5.154 8.626 5.376 1.00 0.00 H new ATOM 0 H1' A A 6 7.809 7.850 7.342 1.00 0.00 H new ATOM 0 H8 A A 6 7.456 4.294 8.103 1.00 0.00 H new ATOM 0 H61 A A 6 12.843 3.370 5.249 1.00 0.00 H new ATOM 0 H62 A A 6 11.646 2.662 6.339 1.00 0.00 H new ATOM 0 H2 A A 6 11.378 7.475 4.210 1.00 0.00 H new ATOM 199 P G A 7 3.599 6.275 3.937 1.00 0.00 P ATOM 200 OP1 G A 7 2.800 7.298 3.225 1.00 0.00 O ATOM 201 OP2 G A 7 3.008 4.954 4.237 1.00 0.00 O ATOM 202 O5' G A 7 4.967 6.038 3.114 1.00 0.00 O ATOM 203 C5' G A 7 5.668 7.134 2.510 1.00 0.00 C ATOM 204 C4' G A 7 6.926 6.666 1.775 1.00 0.00 C ATOM 205 O4' G A 7 7.888 6.119 2.687 1.00 0.00 O ATOM 206 C3' G A 7 6.583 5.583 0.753 1.00 0.00 C ATOM 207 O3' G A 7 6.834 6.127 -0.553 1.00 0.00 O ATOM 208 C2' G A 7 7.580 4.451 1.010 1.00 0.00 C ATOM 209 O2' G A 7 8.621 4.437 0.026 1.00 0.00 O ATOM 210 C1' G A 7 8.151 4.742 2.396 1.00 0.00 C ATOM 211 N9 G A 7 7.581 3.862 3.439 1.00 0.00 N ATOM 212 C8 G A 7 6.337 3.836 3.978 1.00 0.00 C ATOM 213 N7 G A 7 6.108 2.984 4.917 1.00 0.00 N ATOM 214 C5 G A 7 7.345 2.352 5.037 1.00 0.00 C ATOM 215 C6 G A 7 7.751 1.307 5.909 1.00 0.00 C ATOM 216 O6 G A 7 7.086 0.717 6.755 1.00 0.00 O ATOM 217 N1 G A 7 9.078 0.963 5.707 1.00 0.00 N ATOM 218 C2 G A 7 9.916 1.546 4.784 1.00 0.00 C ATOM 219 N2 G A 7 11.156 1.072 4.733 1.00 0.00 N ATOM 220 N3 G A 7 9.547 2.528 3.958 1.00 0.00 N ATOM 221 C4 G A 7 8.254 2.883 4.137 1.00 0.00 C ATOM 0 H5' G A 7 5.943 7.857 3.278 1.00 0.00 H new ATOM 0 H5'' G A 7 5.008 7.647 1.811 1.00 0.00 H new ATOM 0 H4' G A 7 7.345 7.540 1.276 1.00 0.00 H new ATOM 0 H3' G A 7 5.550 5.241 0.824 1.00 0.00 H new ATOM 0 H2' G A 7 7.103 3.473 0.954 1.00 0.00 H new ATOM 0 HO2' G A 7 8.399 3.790 -0.676 1.00 0.00 H new ATOM 0 H1' G A 7 9.222 4.542 2.395 1.00 0.00 H new ATOM 0 H8 G A 7 5.564 4.507 3.632 1.00 0.00 H new ATOM 0 H1 G A 7 9.464 0.219 6.288 1.00 0.00 H new ATOM 0 H21 G A 7 11.825 1.463 4.069 1.00 0.00 H new ATOM 0 H22 G A 7 11.439 0.317 5.357 1.00 0.00 H new ATOM 233 P A A 8 6.190 5.456 -1.872 1.00 0.00 P ATOM 234 OP1 A A 8 6.202 6.463 -2.957 1.00 0.00 O ATOM 235 OP2 A A 8 4.917 4.799 -1.492 1.00 0.00 O ATOM 236 O5' A A 8 7.259 4.305 -2.237 1.00 0.00 O ATOM 237 C5' A A 8 8.368 4.580 -3.103 1.00 0.00 C ATOM 238 C4' A A 8 9.367 3.423 -3.131 1.00 0.00 C ATOM 239 O4' A A 8 9.888 3.159 -1.818 1.00 0.00 O ATOM 240 C3' A A 8 8.704 2.127 -3.591 1.00 0.00 C ATOM 241 O3' A A 8 8.948 1.956 -4.991 1.00 0.00 O ATOM 242 C2' A A 8 9.484 1.074 -2.827 1.00 0.00 C ATOM 243 O2' A A 8 10.731 0.774 -3.465 1.00 0.00 O ATOM 244 C1' A A 8 9.691 1.777 -1.493 1.00 0.00 C ATOM 245 N9 A A 8 8.525 1.601 -0.600 1.00 0.00 N ATOM 246 C8 A A 8 7.233 1.966 -0.778 1.00 0.00 C ATOM 247 N7 A A 8 6.398 1.687 0.162 1.00 0.00 N ATOM 248 C5 A A 8 7.224 1.060 1.095 1.00 0.00 C ATOM 249 C6 A A 8 6.977 0.508 2.354 1.00 0.00 C ATOM 250 N6 A A 8 5.772 0.504 2.922 1.00 0.00 N ATOM 251 N1 A A 8 8.021 -0.028 3.007 1.00 0.00 N ATOM 252 C2 A A 8 9.236 -0.018 2.455 1.00 0.00 C ATOM 253 N3 A A 8 9.581 0.475 1.273 1.00 0.00 N ATOM 254 C4 A A 8 8.520 1.004 0.639 1.00 0.00 C ATOM 0 H5' A A 8 8.872 5.488 -2.771 1.00 0.00 H new ATOM 0 H5'' A A 8 8.003 4.769 -4.112 1.00 0.00 H new ATOM 0 H4' A A 8 10.158 3.724 -3.819 1.00 0.00 H new ATOM 0 H3' A A 8 7.627 2.093 -3.424 1.00 0.00 H new ATOM 0 H2' A A 8 8.982 0.109 -2.753 1.00 0.00 H new ATOM 0 HO2' A A 8 10.649 0.924 -4.430 1.00 0.00 H new ATOM 0 H1' A A 8 10.542 1.362 -0.953 1.00 0.00 H new ATOM 0 H8 A A 8 6.914 2.473 -1.677 1.00 0.00 H new ATOM 0 H61 A A 8 5.644 0.088 3.844 1.00 0.00 H new ATOM 0 H62 A A 8 4.977 0.917 2.434 1.00 0.00 H new ATOM 0 H2 A A 8 10.029 -0.462 3.038 1.00 0.00 H new ATOM 266 P G A 9 7.833 1.284 -5.943 1.00 0.00 P ATOM 267 OP1 G A 9 8.095 1.720 -7.333 1.00 0.00 O ATOM 268 OP2 G A 9 6.501 1.516 -5.339 1.00 0.00 O ATOM 269 O5' G A 9 8.178 -0.290 -5.839 1.00 0.00 O ATOM 270 C5' G A 9 7.182 -1.245 -5.446 1.00 0.00 C ATOM 271 C4' G A 9 7.161 -1.469 -3.934 1.00 0.00 C ATOM 272 O4' G A 9 6.830 -0.271 -3.220 1.00 0.00 O ATOM 273 C3' G A 9 6.086 -2.472 -3.549 1.00 0.00 C ATOM 274 O3' G A 9 6.648 -3.789 -3.597 1.00 0.00 O ATOM 275 C2' G A 9 5.820 -2.107 -2.102 1.00 0.00 C ATOM 276 O2' G A 9 6.805 -2.674 -1.230 1.00 0.00 O ATOM 277 C1' G A 9 5.925 -0.586 -2.143 1.00 0.00 C ATOM 278 N9 G A 9 4.608 0.045 -2.360 1.00 0.00 N ATOM 279 C8 G A 9 4.149 0.738 -3.431 1.00 0.00 C ATOM 280 N7 G A 9 2.956 1.227 -3.362 1.00 0.00 N ATOM 281 C5 G A 9 2.553 0.815 -2.087 1.00 0.00 C ATOM 282 C6 G A 9 1.328 1.036 -1.402 1.00 0.00 C ATOM 283 O6 G A 9 0.341 1.655 -1.787 1.00 0.00 O ATOM 284 N1 G A 9 1.334 0.454 -0.145 1.00 0.00 N ATOM 285 C2 G A 9 2.384 -0.256 0.395 1.00 0.00 C ATOM 286 N2 G A 9 2.197 -0.745 1.617 1.00 0.00 N ATOM 287 N3 G A 9 3.541 -0.470 -0.237 1.00 0.00 N ATOM 288 C4 G A 9 3.559 0.090 -1.468 1.00 0.00 C ATOM 0 H5' G A 9 7.372 -2.193 -5.949 1.00 0.00 H new ATOM 0 H5'' G A 9 6.201 -0.900 -5.774 1.00 0.00 H new ATOM 0 H4' G A 9 8.161 -1.818 -3.677 1.00 0.00 H new ATOM 0 H3' G A 9 5.203 -2.454 -4.187 1.00 0.00 H new ATOM 0 H2' G A 9 4.868 -2.476 -1.721 1.00 0.00 H new ATOM 0 HO2' G A 9 7.409 -3.246 -1.747 1.00 0.00 H new ATOM 0 H1' G A 9 6.291 -0.200 -1.191 1.00 0.00 H new ATOM 0 H8 G A 9 4.760 0.876 -4.311 1.00 0.00 H new ATOM 0 H1 G A 9 0.495 0.559 0.426 1.00 0.00 H new ATOM 0 H21 G A 9 2.937 -1.280 2.071 1.00 0.00 H new ATOM 0 H22 G A 9 1.313 -0.585 2.100 1.00 0.00 H new ATOM 300 P C A 10 5.700 -5.086 -3.746 1.00 0.00 P ATOM 301 OP1 C A 10 6.560 -6.290 -3.759 1.00 0.00 O ATOM 302 OP2 C A 10 4.754 -4.844 -4.859 1.00 0.00 O ATOM 303 O5' C A 10 4.866 -5.075 -2.366 1.00 0.00 O ATOM 304 C5' C A 10 5.507 -5.370 -1.118 1.00 0.00 C ATOM 305 C4' C A 10 4.559 -5.167 0.065 1.00 0.00 C ATOM 306 O4' C A 10 3.990 -3.854 0.071 1.00 0.00 O ATOM 307 C3' C A 10 3.366 -6.098 -0.014 1.00 0.00 C ATOM 308 O3' C A 10 3.722 -7.360 0.568 1.00 0.00 O ATOM 309 C2' C A 10 2.377 -5.400 0.901 1.00 0.00 C ATOM 310 O2' C A 10 2.633 -5.709 2.277 1.00 0.00 O ATOM 311 C1' C A 10 2.650 -3.923 0.602 1.00 0.00 C ATOM 312 N1 C A 10 1.658 -3.373 -0.354 1.00 0.00 N ATOM 313 C2 C A 10 0.423 -2.986 0.153 1.00 0.00 C ATOM 314 O2 C A 10 0.173 -3.117 1.348 1.00 0.00 O ATOM 315 N3 C A 10 -0.492 -2.466 -0.707 1.00 0.00 N ATOM 316 C4 C A 10 -0.217 -2.329 -2.007 1.00 0.00 C ATOM 317 N4 C A 10 -1.139 -1.813 -2.816 1.00 0.00 N ATOM 318 C5 C A 10 1.048 -2.726 -2.537 1.00 0.00 C ATOM 319 C6 C A 10 1.953 -3.240 -1.682 1.00 0.00 C ATOM 0 H5' C A 10 6.382 -4.731 -0.998 1.00 0.00 H new ATOM 0 H5'' C A 10 5.864 -6.400 -1.126 1.00 0.00 H new ATOM 0 H4' C A 10 5.168 -5.351 0.950 1.00 0.00 H new ATOM 0 H3' C A 10 3.001 -6.283 -1.024 1.00 0.00 H new ATOM 0 H2' C A 10 1.341 -5.697 0.735 1.00 0.00 H new ATOM 0 HO2' C A 10 3.390 -6.328 2.338 1.00 0.00 H new ATOM 0 H1' C A 10 2.560 -3.320 1.505 1.00 0.00 H new ATOM 0 H41 C A 10 -0.941 -1.703 -3.811 1.00 0.00 H new ATOM 0 H42 C A 10 -2.044 -1.527 -2.441 1.00 0.00 H new ATOM 0 H5 C A 10 1.272 -2.618 -3.588 1.00 0.00 H new ATOM 0 H6 C A 10 2.920 -3.550 -2.049 1.00 0.00 H new ATOM 331 P C A 11 2.988 -8.718 0.099 1.00 0.00 P ATOM 332 OP1 C A 11 3.594 -9.850 0.835 1.00 0.00 O ATOM 333 OP2 C A 11 2.947 -8.736 -1.380 1.00 0.00 O ATOM 334 O5' C A 11 1.483 -8.513 0.640 1.00 0.00 O ATOM 335 C5' C A 11 1.208 -8.473 2.046 1.00 0.00 C ATOM 336 C4' C A 11 -0.151 -7.841 2.339 1.00 0.00 C ATOM 337 O4' C A 11 -0.272 -6.559 1.728 1.00 0.00 O ATOM 338 C3' C A 11 -1.283 -8.653 1.742 1.00 0.00 C ATOM 339 O3' C A 11 -1.658 -9.677 2.676 1.00 0.00 O ATOM 340 C2' C A 11 -2.407 -7.627 1.660 1.00 0.00 C ATOM 341 O2' C A 11 -3.187 -7.598 2.861 1.00 0.00 O ATOM 342 C1' C A 11 -1.658 -6.305 1.451 1.00 0.00 C ATOM 343 N1 C A 11 -1.852 -5.799 0.072 1.00 0.00 N ATOM 344 C2 C A 11 -2.985 -5.037 -0.172 1.00 0.00 C ATOM 345 O2 C A 11 -3.781 -4.804 0.735 1.00 0.00 O ATOM 346 N3 C A 11 -3.191 -4.567 -1.429 1.00 0.00 N ATOM 347 C4 C A 11 -2.325 -4.832 -2.412 1.00 0.00 C ATOM 348 N4 C A 11 -2.564 -4.357 -3.632 1.00 0.00 N ATOM 349 C5 C A 11 -1.154 -5.616 -2.172 1.00 0.00 C ATOM 350 C6 C A 11 -0.955 -6.077 -0.923 1.00 0.00 C ATOM 0 H5' C A 11 1.989 -7.907 2.553 1.00 0.00 H new ATOM 0 H5'' C A 11 1.233 -9.485 2.451 1.00 0.00 H new ATOM 0 H4' C A 11 -0.213 -7.787 3.426 1.00 0.00 H new ATOM 0 H3' C A 11 -1.041 -9.129 0.792 1.00 0.00 H new ATOM 0 H2' C A 11 -3.122 -7.846 0.867 1.00 0.00 H new ATOM 0 HO2' C A 11 -4.109 -7.344 2.646 1.00 0.00 H new ATOM 0 H1' C A 11 -2.041 -5.532 2.118 1.00 0.00 H new ATOM 0 H41 C A 11 -1.912 -4.551 -4.392 1.00 0.00 H new ATOM 0 H42 C A 11 -3.399 -3.799 -3.807 1.00 0.00 H new ATOM 0 H5 C A 11 -0.453 -5.831 -2.965 1.00 0.00 H new ATOM 0 H6 C A 11 -0.080 -6.671 -0.705 1.00 0.00 H new ATOM 362 P U A 12 -2.525 -10.952 2.201 1.00 0.00 P ATOM 363 OP1 U A 12 -2.635 -11.889 3.342 1.00 0.00 O ATOM 364 OP2 U A 12 -1.981 -11.425 0.908 1.00 0.00 O ATOM 365 O5' U A 12 -3.980 -10.311 1.928 1.00 0.00 O ATOM 366 C5' U A 12 -4.845 -9.965 3.017 1.00 0.00 C ATOM 367 C4' U A 12 -5.986 -9.062 2.560 1.00 0.00 C ATOM 368 O4' U A 12 -5.494 -7.865 1.945 1.00 0.00 O ATOM 369 C3' U A 12 -6.835 -9.738 1.496 1.00 0.00 C ATOM 370 O3' U A 12 -7.810 -10.620 2.067 1.00 0.00 O ATOM 371 C2' U A 12 -7.481 -8.537 0.835 1.00 0.00 C ATOM 372 O2' U A 12 -8.595 -8.052 1.598 1.00 0.00 O ATOM 373 C1' U A 12 -6.332 -7.530 0.824 1.00 0.00 C ATOM 374 N1 U A 12 -5.574 -7.587 -0.447 1.00 0.00 N ATOM 375 C2 U A 12 -5.801 -6.580 -1.368 1.00 0.00 C ATOM 376 O2 U A 12 -6.605 -5.673 -1.166 1.00 0.00 O ATOM 377 N3 U A 12 -5.074 -6.653 -2.538 1.00 0.00 N ATOM 378 C4 U A 12 -4.154 -7.627 -2.869 1.00 0.00 C ATOM 379 O4 U A 12 -3.565 -7.587 -3.944 1.00 0.00 O ATOM 380 C5 U A 12 -3.978 -8.641 -1.855 1.00 0.00 C ATOM 381 C6 U A 12 -4.678 -8.593 -0.697 1.00 0.00 C ATOM 0 H5' U A 12 -4.270 -9.461 3.794 1.00 0.00 H new ATOM 0 H5'' U A 12 -5.254 -10.873 3.461 1.00 0.00 H new ATOM 0 H4' U A 12 -6.563 -8.844 3.459 1.00 0.00 H new ATOM 0 H3' U A 12 -6.272 -10.377 0.816 1.00 0.00 H new ATOM 0 H2' U A 12 -7.894 -8.747 -0.152 1.00 0.00 H new ATOM 0 HO2' U A 12 -8.984 -8.789 2.114 1.00 0.00 H new ATOM 0 HO3' U A 12 -8.336 -11.033 1.351 1.00 0.00 H new ATOM 0 H1' U A 12 -6.707 -6.510 0.903 1.00 0.00 H new ATOM 0 H3 U A 12 -5.232 -5.916 -3.225 1.00 0.00 H new ATOM 0 H5 U A 12 -3.279 -9.447 -2.023 1.00 0.00 H new ATOM 0 H6 U A 12 -4.527 -9.363 0.045 1.00 0.00 H new TER 393 U A 12