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 -17:sc= 0.0544 USER MOD Single : A 1 G O5' : rot -4:sc= -0.236! USER MOD Single : A 2 G O2' : rot -15:sc= 0.265 USER MOD Single : A 3 G O2' : rot -29:sc= 0.285 USER MOD Single : A 4 C O2' : rot -19:sc= 0.243 USER MOD Single : A 5 G O2' : rot -23:sc= 1.12 USER MOD Single : A 6 C O2' : rot -20:sc= 0.27 USER MOD Single : A 7 A O2' : rot -14:sc= 0.00639 USER MOD Single : A 8 A O2' : rot -17:sc= 0.191 USER MOD Single : A 9 G O2' : rot -5:sc= -0.538 USER MOD Single : A 10 C O2' : rot -11:sc= -0.903 USER MOD Single : A 11 C O2' : rot -10:sc= -0.632 USER MOD Single : A 12 U O2' : rot -21:sc= 0.11 USER MOD Single : A 12 U O3' : rot 180:sc= 0.157 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -10.412 -5.792 -3.233 1.00 0.00 O ATOM 2 C5' G A 1 -10.860 -6.361 -4.468 1.00 0.00 C ATOM 3 C4' G A 1 -10.925 -5.318 -5.581 1.00 0.00 C ATOM 4 O4' G A 1 -11.812 -4.239 -5.243 1.00 0.00 O ATOM 5 C3' G A 1 -9.567 -4.666 -5.807 1.00 0.00 C ATOM 6 O3' G A 1 -8.853 -5.405 -6.806 1.00 0.00 O ATOM 7 C2' G A 1 -9.963 -3.324 -6.384 1.00 0.00 C ATOM 8 O2' G A 1 -10.318 -3.424 -7.769 1.00 0.00 O ATOM 9 C1' G A 1 -11.165 -2.984 -5.519 1.00 0.00 C ATOM 10 N9 G A 1 -10.735 -2.320 -4.274 1.00 0.00 N ATOM 11 C8 G A 1 -10.679 -2.806 -3.013 1.00 0.00 C ATOM 12 N7 G A 1 -10.234 -2.024 -2.087 1.00 0.00 N ATOM 13 C5 G A 1 -9.950 -0.862 -2.813 1.00 0.00 C ATOM 14 C6 G A 1 -9.422 0.382 -2.374 1.00 0.00 C ATOM 15 O6 G A 1 -9.096 0.719 -1.238 1.00 0.00 O ATOM 16 N1 G A 1 -9.290 1.276 -3.425 1.00 0.00 N ATOM 17 C2 G A 1 -9.621 1.016 -4.737 1.00 0.00 C ATOM 18 N2 G A 1 -9.419 2.003 -5.601 1.00 0.00 N ATOM 19 N3 G A 1 -10.118 -0.147 -5.159 1.00 0.00 N ATOM 20 C4 G A 1 -10.255 -1.037 -4.153 1.00 0.00 C ATOM 0 H5' G A 1 -11.846 -6.805 -4.328 1.00 0.00 H new ATOM 0 H5'' G A 1 -10.187 -7.166 -4.763 1.00 0.00 H new ATOM 0 H4' G A 1 -11.268 -5.855 -6.465 1.00 0.00 H new ATOM 0 H3' G A 1 -8.940 -4.611 -4.917 1.00 0.00 H new ATOM 0 H2' G A 1 -9.170 -2.576 -6.368 1.00 0.00 H new ATOM 0 HO2' G A 1 -9.981 -4.269 -8.133 1.00 0.00 H new ATOM 0 HO5' G A 1 -10.172 -4.852 -3.374 1.00 0.00 H new ATOM 0 H1' G A 1 -11.843 -2.292 -6.019 1.00 0.00 H new ATOM 0 H8 G A 1 -10.996 -3.814 -2.788 1.00 0.00 H new ATOM 0 H1 G A 1 -8.918 2.201 -3.210 1.00 0.00 H new ATOM 0 H21 G A 1 -9.644 1.872 -6.587 1.00 0.00 H new ATOM 0 H22 G A 1 -9.038 2.893 -5.279 1.00 0.00 H new ATOM 33 P G A 2 -7.242 -5.473 -6.777 1.00 0.00 P ATOM 34 OP1 G A 2 -6.791 -6.254 -7.951 1.00 0.00 O ATOM 35 OP2 G A 2 -6.819 -5.876 -5.417 1.00 0.00 O ATOM 36 O5' G A 2 -6.818 -3.933 -7.001 1.00 0.00 O ATOM 37 C5' G A 2 -7.003 -3.302 -8.274 1.00 0.00 C ATOM 38 C4' G A 2 -6.765 -1.794 -8.200 1.00 0.00 C ATOM 39 O4' G A 2 -7.600 -1.176 -7.214 1.00 0.00 O ATOM 40 C3' G A 2 -5.346 -1.471 -7.765 1.00 0.00 C ATOM 41 O3' G A 2 -4.501 -1.425 -8.923 1.00 0.00 O ATOM 42 C2' G A 2 -5.498 -0.066 -7.221 1.00 0.00 C ATOM 43 O2' G A 2 -5.478 0.915 -8.266 1.00 0.00 O ATOM 44 C1' G A 2 -6.861 -0.135 -6.544 1.00 0.00 C ATOM 45 N9 G A 2 -6.705 -0.422 -5.107 1.00 0.00 N ATOM 46 C8 G A 2 -7.106 -1.498 -4.395 1.00 0.00 C ATOM 47 N7 G A 2 -6.848 -1.509 -3.129 1.00 0.00 N ATOM 48 C5 G A 2 -6.184 -0.288 -2.965 1.00 0.00 C ATOM 49 C6 G A 2 -5.633 0.303 -1.796 1.00 0.00 C ATOM 50 O6 G A 2 -5.626 -0.133 -0.648 1.00 0.00 O ATOM 51 N1 G A 2 -5.054 1.531 -2.073 1.00 0.00 N ATOM 52 C2 G A 2 -5.006 2.123 -3.315 1.00 0.00 C ATOM 53 N2 G A 2 -4.383 3.291 -3.385 1.00 0.00 N ATOM 54 N3 G A 2 -5.522 1.581 -4.417 1.00 0.00 N ATOM 55 C4 G A 2 -6.093 0.382 -4.174 1.00 0.00 C ATOM 0 H5' G A 2 -8.015 -3.493 -8.631 1.00 0.00 H new ATOM 0 H5'' G A 2 -6.320 -3.742 -9.001 1.00 0.00 H new ATOM 0 H4' G A 2 -6.977 -1.423 -9.203 1.00 0.00 H new ATOM 0 H3' G A 2 -4.920 -2.186 -7.062 1.00 0.00 H new ATOM 0 H2' G A 2 -4.690 0.233 -6.554 1.00 0.00 H new ATOM 0 HO2' G A 2 -5.130 0.510 -9.088 1.00 0.00 H new ATOM 0 H1' G A 2 -7.392 0.814 -6.616 1.00 0.00 H new ATOM 0 H8 G A 2 -7.624 -2.320 -4.867 1.00 0.00 H new ATOM 0 H1 G A 2 -4.630 2.036 -1.295 1.00 0.00 H new ATOM 0 H21 G A 2 -4.314 3.780 -4.278 1.00 0.00 H new ATOM 0 H22 G A 2 -3.973 3.701 -2.546 1.00 0.00 H new ATOM 67 P G A 3 -2.939 -1.808 -8.814 1.00 0.00 P ATOM 68 OP1 G A 3 -2.431 -2.076 -10.180 1.00 0.00 O ATOM 69 OP2 G A 3 -2.781 -2.830 -7.755 1.00 0.00 O ATOM 70 O5' G A 3 -2.279 -0.433 -8.290 1.00 0.00 O ATOM 71 C5' G A 3 -2.099 0.680 -9.176 1.00 0.00 C ATOM 72 C4' G A 3 -1.498 1.890 -8.460 1.00 0.00 C ATOM 73 O4' G A 3 -2.331 2.332 -7.383 1.00 0.00 O ATOM 74 C3' G A 3 -0.160 1.547 -7.823 1.00 0.00 C ATOM 75 O3' G A 3 0.876 1.798 -8.782 1.00 0.00 O ATOM 76 C2' G A 3 -0.062 2.575 -6.711 1.00 0.00 C ATOM 77 O2' G A 3 0.431 3.831 -7.194 1.00 0.00 O ATOM 78 C1' G A 3 -1.514 2.684 -6.250 1.00 0.00 C ATOM 79 N9 G A 3 -1.785 1.787 -5.110 1.00 0.00 N ATOM 80 C8 G A 3 -2.335 0.548 -5.099 1.00 0.00 C ATOM 81 N7 G A 3 -2.496 -0.024 -3.953 1.00 0.00 N ATOM 82 C5 G A 3 -1.995 0.945 -3.078 1.00 0.00 C ATOM 83 C6 G A 3 -1.890 0.924 -1.663 1.00 0.00 C ATOM 84 O6 G A 3 -2.227 0.036 -0.889 1.00 0.00 O ATOM 85 N1 G A 3 -1.328 2.094 -1.176 1.00 0.00 N ATOM 86 C2 G A 3 -0.915 3.158 -1.948 1.00 0.00 C ATOM 87 N2 G A 3 -0.397 4.193 -1.296 1.00 0.00 N ATOM 88 N3 G A 3 -1.011 3.189 -3.280 1.00 0.00 N ATOM 89 C4 G A 3 -1.556 2.056 -3.779 1.00 0.00 C ATOM 0 H5' G A 3 -3.059 0.956 -9.611 1.00 0.00 H new ATOM 0 H5'' G A 3 -1.449 0.386 -10.000 1.00 0.00 H new ATOM 0 H4' G A 3 -1.394 2.660 -9.224 1.00 0.00 H new ATOM 0 H3' G A 3 -0.071 0.515 -7.483 1.00 0.00 H new ATOM 0 H2' G A 3 0.631 2.296 -5.918 1.00 0.00 H new ATOM 0 HO2' G A 3 1.024 3.677 -7.959 1.00 0.00 H new ATOM 0 H1' G A 3 -1.733 3.694 -5.904 1.00 0.00 H new ATOM 0 H8 G A 3 -2.628 0.057 -6.016 1.00 0.00 H new ATOM 0 H1 G A 3 -1.211 2.174 -0.166 1.00 0.00 H new ATOM 0 H21 G A 3 -0.073 5.011 -1.812 1.00 0.00 H new ATOM 0 H22 G A 3 -0.323 4.170 -0.279 1.00 0.00 H new ATOM 101 P C A 4 2.329 1.121 -8.626 1.00 0.00 P ATOM 102 OP1 C A 4 3.075 1.329 -9.887 1.00 0.00 O ATOM 103 OP2 C A 4 2.147 -0.249 -8.092 1.00 0.00 O ATOM 104 O5' C A 4 3.009 2.028 -7.480 1.00 0.00 O ATOM 105 C5' C A 4 3.804 1.432 -6.449 1.00 0.00 C ATOM 106 C4' C A 4 3.931 2.352 -5.238 1.00 0.00 C ATOM 107 O4' C A 4 2.645 2.661 -4.677 1.00 0.00 O ATOM 108 C3' C A 4 4.716 1.681 -4.120 1.00 0.00 C ATOM 109 O3' C A 4 6.100 2.029 -4.260 1.00 0.00 O ATOM 110 C2' C A 4 4.160 2.365 -2.887 1.00 0.00 C ATOM 111 O2' C A 4 4.752 3.654 -2.686 1.00 0.00 O ATOM 112 C1' C A 4 2.684 2.475 -3.251 1.00 0.00 C ATOM 113 N1 C A 4 1.938 1.260 -2.851 1.00 0.00 N ATOM 114 C2 C A 4 1.661 1.089 -1.501 1.00 0.00 C ATOM 115 O2 C A 4 2.030 1.926 -0.682 1.00 0.00 O ATOM 116 N3 C A 4 0.971 -0.020 -1.117 1.00 0.00 N ATOM 117 C4 C A 4 0.569 -0.923 -2.020 1.00 0.00 C ATOM 118 N4 C A 4 -0.113 -1.988 -1.613 1.00 0.00 N ATOM 119 C5 C A 4 0.852 -0.754 -3.411 1.00 0.00 C ATOM 120 C6 C A 4 1.535 0.344 -3.780 1.00 0.00 C ATOM 0 H5' C A 4 4.796 1.204 -6.839 1.00 0.00 H new ATOM 0 H5'' C A 4 3.356 0.486 -6.143 1.00 0.00 H new ATOM 0 H4' C A 4 4.433 3.250 -5.598 1.00 0.00 H new ATOM 0 H3' C A 4 4.637 0.594 -4.102 1.00 0.00 H new ATOM 0 H2' C A 4 4.352 1.833 -1.955 1.00 0.00 H new ATOM 0 HO2' C A 4 5.591 3.710 -3.189 1.00 0.00 H new ATOM 0 H1' C A 4 2.209 3.304 -2.727 1.00 0.00 H new ATOM 0 H41 C A 4 -0.425 -2.683 -2.291 1.00 0.00 H new ATOM 0 H42 C A 4 -0.325 -2.110 -0.623 1.00 0.00 H new ATOM 0 H5 C A 4 0.529 -1.482 -4.140 1.00 0.00 H new ATOM 0 H6 C A 4 1.767 0.503 -4.823 1.00 0.00 H new ATOM 132 P G A 5 7.242 0.893 -4.215 1.00 0.00 P ATOM 133 OP1 G A 5 8.517 1.498 -4.662 1.00 0.00 O ATOM 134 OP2 G A 5 6.720 -0.316 -4.892 1.00 0.00 O ATOM 135 O5' G A 5 7.356 0.576 -2.639 1.00 0.00 O ATOM 136 C5' G A 5 8.145 1.407 -1.780 1.00 0.00 C ATOM 137 C4' G A 5 7.922 1.071 -0.307 1.00 0.00 C ATOM 138 O4' G A 5 6.553 1.275 0.075 1.00 0.00 O ATOM 139 C3' G A 5 8.212 -0.397 -0.026 1.00 0.00 C ATOM 140 O3' G A 5 9.583 -0.531 0.370 1.00 0.00 O ATOM 141 C2' G A 5 7.333 -0.665 1.175 1.00 0.00 C ATOM 142 O2' G A 5 7.937 -0.186 2.385 1.00 0.00 O ATOM 143 C1' G A 5 6.087 0.133 0.813 1.00 0.00 C ATOM 144 N9 G A 5 5.153 -0.676 0.007 1.00 0.00 N ATOM 145 C8 G A 5 4.978 -0.724 -1.337 1.00 0.00 C ATOM 146 N7 G A 5 4.095 -1.547 -1.796 1.00 0.00 N ATOM 147 C5 G A 5 3.611 -2.128 -0.619 1.00 0.00 C ATOM 148 C6 G A 5 2.615 -3.125 -0.436 1.00 0.00 C ATOM 149 O6 G A 5 1.954 -3.713 -1.287 1.00 0.00 O ATOM 150 N1 G A 5 2.436 -3.421 0.906 1.00 0.00 N ATOM 151 C2 G A 5 3.126 -2.837 1.945 1.00 0.00 C ATOM 152 N2 G A 5 2.805 -3.243 3.162 1.00 0.00 N ATOM 153 N3 G A 5 4.060 -1.904 1.786 1.00 0.00 N ATOM 154 C4 G A 5 4.253 -1.596 0.486 1.00 0.00 C ATOM 0 H5' G A 5 7.895 2.453 -1.956 1.00 0.00 H new ATOM 0 H5'' G A 5 9.200 1.286 -2.025 1.00 0.00 H new ATOM 0 H4' G A 5 8.592 1.725 0.251 1.00 0.00 H new ATOM 0 H3' G A 5 8.035 -1.060 -0.873 1.00 0.00 H new ATOM 0 H2' G A 5 7.145 -1.721 1.367 1.00 0.00 H new ATOM 0 HO2' G A 5 8.908 -0.127 2.265 1.00 0.00 H new ATOM 0 H1' G A 5 5.535 0.434 1.704 1.00 0.00 H new ATOM 0 H8 G A 5 5.556 -0.097 -1.999 1.00 0.00 H new ATOM 0 H1 G A 5 1.739 -4.127 1.143 1.00 0.00 H new ATOM 0 H21 G A 5 3.281 -2.848 3.973 1.00 0.00 H new ATOM 0 H22 G A 5 2.082 -3.951 3.289 1.00 0.00 H new ATOM 166 P C A 6 10.578 -1.521 -0.424 1.00 0.00 P ATOM 167 OP1 C A 6 11.898 -1.479 0.241 1.00 0.00 O ATOM 168 OP2 C A 6 10.470 -1.225 -1.871 1.00 0.00 O ATOM 169 O5' C A 6 9.923 -2.969 -0.150 1.00 0.00 O ATOM 170 C5' C A 6 9.861 -3.958 -1.188 1.00 0.00 C ATOM 171 C4' C A 6 9.603 -5.356 -0.626 1.00 0.00 C ATOM 172 O4' C A 6 10.624 -5.746 0.304 1.00 0.00 O ATOM 173 C3' C A 6 8.300 -5.406 0.158 1.00 0.00 C ATOM 174 O3' C A 6 7.235 -5.769 -0.732 1.00 0.00 O ATOM 175 C2' C A 6 8.552 -6.557 1.111 1.00 0.00 C ATOM 176 O2' C A 6 8.354 -7.824 0.469 1.00 0.00 O ATOM 177 C1' C A 6 10.017 -6.335 1.468 1.00 0.00 C ATOM 178 N1 C A 6 10.152 -5.451 2.649 1.00 0.00 N ATOM 179 C2 C A 6 10.174 -6.050 3.901 1.00 0.00 C ATOM 180 O2 C A 6 10.075 -7.269 4.006 1.00 0.00 O ATOM 181 N3 C A 6 10.306 -5.252 4.995 1.00 0.00 N ATOM 182 C4 C A 6 10.412 -3.925 4.869 1.00 0.00 C ATOM 183 N4 C A 6 10.542 -3.178 5.962 1.00 0.00 N ATOM 184 C5 C A 6 10.390 -3.302 3.583 1.00 0.00 C ATOM 185 C6 C A 6 10.259 -4.097 2.505 1.00 0.00 C ATOM 0 H5' C A 6 10.797 -3.958 -1.746 1.00 0.00 H new ATOM 0 H5'' C A 6 9.070 -3.697 -1.891 1.00 0.00 H new ATOM 0 H4' C A 6 9.577 -6.019 -1.491 1.00 0.00 H new ATOM 0 H3' C A 6 8.032 -4.468 0.643 1.00 0.00 H new ATOM 0 H2' C A 6 7.882 -6.579 1.970 1.00 0.00 H new ATOM 0 HO2' C A 6 7.800 -7.703 -0.330 1.00 0.00 H new ATOM 0 H1' C A 6 10.505 -7.272 1.736 1.00 0.00 H new ATOM 0 H41 C A 6 10.624 -2.165 5.880 1.00 0.00 H new ATOM 0 H42 C A 6 10.560 -3.619 6.882 1.00 0.00 H new ATOM 0 H5 C A 6 10.476 -2.230 3.480 1.00 0.00 H new ATOM 0 H6 C A 6 10.238 -3.660 1.517 1.00 0.00 H new ATOM 197 P A A 7 5.783 -5.087 -0.584 1.00 0.00 P ATOM 198 OP1 A A 7 4.867 -5.722 -1.559 1.00 0.00 O ATOM 199 OP2 A A 7 5.965 -3.620 -0.584 1.00 0.00 O ATOM 200 O5' A A 7 5.337 -5.541 0.900 1.00 0.00 O ATOM 201 C5' A A 7 4.936 -6.893 1.161 1.00 0.00 C ATOM 202 C4' A A 7 5.040 -7.242 2.647 1.00 0.00 C ATOM 203 O4' A A 7 6.361 -6.981 3.147 1.00 0.00 O ATOM 204 C3' A A 7 4.103 -6.388 3.497 1.00 0.00 C ATOM 205 O3' A A 7 2.858 -7.085 3.660 1.00 0.00 O ATOM 206 C2' A A 7 4.827 -6.371 4.829 1.00 0.00 C ATOM 207 O2' A A 7 4.617 -7.586 5.558 1.00 0.00 O ATOM 208 C1' A A 7 6.272 -6.237 4.373 1.00 0.00 C ATOM 209 N9 A A 7 6.637 -4.821 4.167 1.00 0.00 N ATOM 210 C8 A A 7 6.649 -4.084 3.028 1.00 0.00 C ATOM 211 N7 A A 7 7.025 -2.854 3.118 1.00 0.00 N ATOM 212 C5 A A 7 7.300 -2.743 4.484 1.00 0.00 C ATOM 213 C6 A A 7 7.751 -1.683 5.274 1.00 0.00 C ATOM 214 N6 A A 7 8.021 -0.475 4.785 1.00 0.00 N ATOM 215 N1 A A 7 7.915 -1.915 6.587 1.00 0.00 N ATOM 216 C2 A A 7 7.653 -3.120 7.097 1.00 0.00 C ATOM 217 N3 A A 7 7.224 -4.194 6.441 1.00 0.00 N ATOM 218 C4 A A 7 7.066 -3.935 5.128 1.00 0.00 C ATOM 0 H5' A A 7 5.560 -7.575 0.583 1.00 0.00 H new ATOM 0 H5'' A A 7 3.909 -7.039 0.825 1.00 0.00 H new ATOM 0 H4' A A 7 4.781 -8.298 2.719 1.00 0.00 H new ATOM 0 H3' A A 7 3.889 -5.403 3.082 1.00 0.00 H new ATOM 0 H2' A A 7 4.496 -5.587 5.510 1.00 0.00 H new ATOM 0 HO2' A A 7 3.880 -8.088 5.151 1.00 0.00 H new ATOM 0 H1' A A 7 6.965 -6.619 5.123 1.00 0.00 H new ATOM 0 H8 A A 7 6.355 -4.512 2.081 1.00 0.00 H new ATOM 0 H61 A A 7 8.348 0.265 5.406 1.00 0.00 H new ATOM 0 H62 A A 7 7.901 -0.289 3.789 1.00 0.00 H new ATOM 0 H2 A A 7 7.806 -3.236 8.160 1.00 0.00 H new ATOM 230 P A A 8 1.527 -6.304 4.133 1.00 0.00 P ATOM 231 OP1 A A 8 0.446 -7.301 4.307 1.00 0.00 O ATOM 232 OP2 A A 8 1.323 -5.147 3.232 1.00 0.00 O ATOM 233 O5' A A 8 1.940 -5.745 5.588 1.00 0.00 O ATOM 234 C5' A A 8 1.826 -6.576 6.750 1.00 0.00 C ATOM 235 C4' A A 8 2.263 -5.849 8.021 1.00 0.00 C ATOM 236 O4' A A 8 3.633 -5.420 7.943 1.00 0.00 O ATOM 237 C3' A A 8 1.460 -4.575 8.238 1.00 0.00 C ATOM 238 O3' A A 8 0.281 -4.883 8.994 1.00 0.00 O ATOM 239 C2' A A 8 2.405 -3.773 9.108 1.00 0.00 C ATOM 240 O2' A A 8 2.391 -4.228 10.467 1.00 0.00 O ATOM 241 C1' A A 8 3.734 -4.067 8.427 1.00 0.00 C ATOM 242 N9 A A 8 3.975 -3.124 7.320 1.00 0.00 N ATOM 243 C8 A A 8 3.613 -3.214 6.018 1.00 0.00 C ATOM 244 N7 A A 8 3.927 -2.231 5.242 1.00 0.00 N ATOM 245 C5 A A 8 4.582 -1.372 6.129 1.00 0.00 C ATOM 246 C6 A A 8 5.182 -0.119 5.964 1.00 0.00 C ATOM 247 N6 A A 8 5.222 0.521 4.798 1.00 0.00 N ATOM 248 N1 A A 8 5.736 0.450 7.048 1.00 0.00 N ATOM 249 C2 A A 8 5.704 -0.174 8.228 1.00 0.00 C ATOM 250 N3 A A 8 5.165 -1.359 8.496 1.00 0.00 N ATOM 251 C4 A A 8 4.617 -1.908 7.394 1.00 0.00 C ATOM 0 H5' A A 8 2.435 -7.470 6.617 1.00 0.00 H new ATOM 0 H5'' A A 8 0.793 -6.907 6.859 1.00 0.00 H new ATOM 0 H4' A A 8 2.112 -6.566 8.828 1.00 0.00 H new ATOM 0 H3' A A 8 1.145 -4.076 7.322 1.00 0.00 H new ATOM 0 H2' A A 8 2.161 -2.713 9.183 1.00 0.00 H new ATOM 0 HO2' A A 8 1.589 -4.769 10.623 1.00 0.00 H new ATOM 0 H1' A A 8 4.572 -3.953 9.114 1.00 0.00 H new ATOM 0 H8 A A 8 3.081 -4.076 5.643 1.00 0.00 H new ATOM 0 H61 A A 8 5.673 1.434 4.732 1.00 0.00 H new ATOM 0 H62 A A 8 4.802 0.099 3.970 1.00 0.00 H new ATOM 0 H2 A A 8 6.167 0.341 9.056 1.00 0.00 H new ATOM 263 P G A 9 -1.187 -4.636 8.370 1.00 0.00 P ATOM 264 OP1 G A 9 -2.191 -5.079 9.363 1.00 0.00 O ATOM 265 OP2 G A 9 -1.208 -5.199 7.000 1.00 0.00 O ATOM 266 O5' G A 9 -1.268 -3.027 8.251 1.00 0.00 O ATOM 267 C5' G A 9 -0.743 -2.186 9.289 1.00 0.00 C ATOM 268 C4' G A 9 0.173 -1.096 8.728 1.00 0.00 C ATOM 269 O4' G A 9 1.142 -1.638 7.819 1.00 0.00 O ATOM 270 C3' G A 9 -0.603 -0.076 7.909 1.00 0.00 C ATOM 271 O3' G A 9 -1.081 0.961 8.777 1.00 0.00 O ATOM 272 C2' G A 9 0.492 0.495 7.033 1.00 0.00 C ATOM 273 O2' G A 9 1.301 1.438 7.745 1.00 0.00 O ATOM 274 C1' G A 9 1.273 -0.760 6.684 1.00 0.00 C ATOM 275 N9 G A 9 0.739 -1.378 5.456 1.00 0.00 N ATOM 276 C8 G A 9 -0.025 -2.486 5.304 1.00 0.00 C ATOM 277 N7 G A 9 -0.386 -2.805 4.105 1.00 0.00 N ATOM 278 C5 G A 9 0.207 -1.785 3.351 1.00 0.00 C ATOM 279 C6 G A 9 0.187 -1.559 1.948 1.00 0.00 C ATOM 280 O6 G A 9 -0.366 -2.221 1.076 1.00 0.00 O ATOM 281 N1 G A 9 0.909 -0.425 1.605 1.00 0.00 N ATOM 282 C2 G A 9 1.569 0.395 2.496 1.00 0.00 C ATOM 283 N2 G A 9 2.202 1.441 1.979 1.00 0.00 N ATOM 284 N3 G A 9 1.593 0.190 3.813 1.00 0.00 N ATOM 285 C4 G A 9 0.897 -0.911 4.173 1.00 0.00 C ATOM 0 H5' G A 9 -0.189 -2.794 10.004 1.00 0.00 H new ATOM 0 H5'' G A 9 -1.566 -1.724 9.834 1.00 0.00 H new ATOM 0 H4' G A 9 0.643 -0.642 9.600 1.00 0.00 H new ATOM 0 H3' G A 9 -1.459 -0.484 7.372 1.00 0.00 H new ATOM 0 H2' G A 9 0.129 1.051 6.169 1.00 0.00 H new ATOM 0 HO2' G A 9 0.927 1.581 8.639 1.00 0.00 H new ATOM 0 H1' G A 9 2.322 -0.541 6.484 1.00 0.00 H new ATOM 0 H8 G A 9 -0.322 -3.082 6.155 1.00 0.00 H new ATOM 0 H1 G A 9 0.955 -0.178 0.616 1.00 0.00 H new ATOM 0 H21 G A 9 2.708 2.083 2.589 1.00 0.00 H new ATOM 0 H22 G A 9 2.182 1.602 0.972 1.00 0.00 H new ATOM 297 P C A 10 -2.150 2.048 8.248 1.00 0.00 P ATOM 298 OP1 C A 10 -2.486 2.952 9.371 1.00 0.00 O ATOM 299 OP2 C A 10 -3.228 1.328 7.532 1.00 0.00 O ATOM 300 O5' C A 10 -1.300 2.885 7.161 1.00 0.00 O ATOM 301 C5' C A 10 -0.441 3.957 7.567 1.00 0.00 C ATOM 302 C4' C A 10 -0.033 4.842 6.387 1.00 0.00 C ATOM 303 O4' C A 10 0.715 4.111 5.397 1.00 0.00 O ATOM 304 C3' C A 10 -1.248 5.376 5.644 1.00 0.00 C ATOM 305 O3' C A 10 -1.677 6.601 6.251 1.00 0.00 O ATOM 306 C2' C A 10 -0.644 5.683 4.294 1.00 0.00 C ATOM 307 O2' C A 10 0.151 6.874 4.336 1.00 0.00 O ATOM 308 C1' C A 10 0.214 4.448 4.087 1.00 0.00 C ATOM 309 N1 C A 10 -0.556 3.322 3.507 1.00 0.00 N ATOM 310 C2 C A 10 -0.619 3.225 2.122 1.00 0.00 C ATOM 311 O2 C A 10 -0.082 4.074 1.414 1.00 0.00 O ATOM 312 N3 C A 10 -1.290 2.174 1.578 1.00 0.00 N ATOM 313 C4 C A 10 -1.877 1.257 2.357 1.00 0.00 C ATOM 314 N4 C A 10 -2.523 0.243 1.790 1.00 0.00 N ATOM 315 C5 C A 10 -1.818 1.351 3.781 1.00 0.00 C ATOM 316 C6 C A 10 -1.153 2.393 4.312 1.00 0.00 C ATOM 0 H5' C A 10 0.452 3.547 8.039 1.00 0.00 H new ATOM 0 H5'' C A 10 -0.948 4.564 8.317 1.00 0.00 H new ATOM 0 H4' C A 10 0.562 5.642 6.828 1.00 0.00 H new ATOM 0 H3' C A 10 -2.105 4.702 5.627 1.00 0.00 H new ATOM 0 H2' C A 10 -1.369 5.870 3.502 1.00 0.00 H new ATOM 0 HO2' C A 10 -0.007 7.343 5.182 1.00 0.00 H new ATOM 0 H1' C A 10 1.017 4.644 3.376 1.00 0.00 H new ATOM 0 H41 C A 10 -2.975 -0.463 2.371 1.00 0.00 H new ATOM 0 H42 C A 10 -2.567 0.171 0.774 1.00 0.00 H new ATOM 0 H5 C A 10 -2.291 0.611 4.410 1.00 0.00 H new ATOM 0 H6 C A 10 -1.090 2.496 5.385 1.00 0.00 H new ATOM 328 P C A 11 -3.182 7.133 6.033 1.00 0.00 P ATOM 329 OP1 C A 11 -3.288 8.484 6.629 1.00 0.00 O ATOM 330 OP2 C A 11 -4.117 6.065 6.452 1.00 0.00 O ATOM 331 O5' C A 11 -3.272 7.279 4.430 1.00 0.00 O ATOM 332 C5' C A 11 -2.528 8.295 3.749 1.00 0.00 C ATOM 333 C4' C A 11 -2.469 8.054 2.241 1.00 0.00 C ATOM 334 O4' C A 11 -1.924 6.768 1.919 1.00 0.00 O ATOM 335 C3' C A 11 -3.851 8.040 1.617 1.00 0.00 C ATOM 336 O3' C A 11 -4.263 9.388 1.361 1.00 0.00 O ATOM 337 C2' C A 11 -3.557 7.357 0.298 1.00 0.00 C ATOM 338 O2' C A 11 -2.953 8.263 -0.634 1.00 0.00 O ATOM 339 C1' C A 11 -2.575 6.269 0.732 1.00 0.00 C ATOM 340 N1 C A 11 -3.262 4.980 0.989 1.00 0.00 N ATOM 341 C2 C A 11 -3.661 4.238 -0.114 1.00 0.00 C ATOM 342 O2 C A 11 -3.445 4.655 -1.247 1.00 0.00 O ATOM 343 N3 C A 11 -4.290 3.050 0.097 1.00 0.00 N ATOM 344 C4 C A 11 -4.517 2.605 1.338 1.00 0.00 C ATOM 345 N4 C A 11 -5.141 1.442 1.508 1.00 0.00 N ATOM 346 C5 C A 11 -4.108 3.363 2.480 1.00 0.00 C ATOM 347 C6 C A 11 -3.485 4.536 2.261 1.00 0.00 C ATOM 0 H5' C A 11 -1.515 8.331 4.149 1.00 0.00 H new ATOM 0 H5'' C A 11 -2.982 9.267 3.942 1.00 0.00 H new ATOM 0 H4' C A 11 -1.850 8.867 1.860 1.00 0.00 H new ATOM 0 H3' C A 11 -4.625 7.567 2.221 1.00 0.00 H new ATOM 0 H2' C A 11 -4.441 6.979 -0.215 1.00 0.00 H new ATOM 0 HO2' C A 11 -2.999 9.176 -0.280 1.00 0.00 H new ATOM 0 H1' C A 11 -1.851 6.060 -0.056 1.00 0.00 H new ATOM 0 H41 C A 11 -5.320 1.092 2.449 1.00 0.00 H new ATOM 0 H42 C A 11 -5.440 0.901 0.697 1.00 0.00 H new ATOM 0 H5 C A 11 -4.293 3.007 3.483 1.00 0.00 H new ATOM 0 H6 C A 11 -3.158 5.132 3.100 1.00 0.00 H new ATOM 359 P U A 12 -5.829 9.765 1.278 1.00 0.00 P ATOM 360 OP1 U A 12 -5.944 11.189 0.890 1.00 0.00 O ATOM 361 OP2 U A 12 -6.488 9.280 2.511 1.00 0.00 O ATOM 362 O5' U A 12 -6.340 8.862 0.045 1.00 0.00 O ATOM 363 C5' U A 12 -5.906 9.138 -1.292 1.00 0.00 C ATOM 364 C4' U A 12 -6.209 7.978 -2.237 1.00 0.00 C ATOM 365 O4' U A 12 -5.606 6.759 -1.799 1.00 0.00 O ATOM 366 C3' U A 12 -7.691 7.671 -2.284 1.00 0.00 C ATOM 367 O3' U A 12 -8.407 8.593 -3.115 1.00 0.00 O ATOM 368 C2' U A 12 -7.668 6.277 -2.879 1.00 0.00 C ATOM 369 O2' U A 12 -7.503 6.316 -4.303 1.00 0.00 O ATOM 370 C1' U A 12 -6.446 5.658 -2.191 1.00 0.00 C ATOM 371 N1 U A 12 -6.848 4.836 -1.028 1.00 0.00 N ATOM 372 C2 U A 12 -7.547 3.671 -1.285 1.00 0.00 C ATOM 373 O2 U A 12 -7.818 3.310 -2.427 1.00 0.00 O ATOM 374 N3 U A 12 -7.922 2.930 -0.185 1.00 0.00 N ATOM 375 C4 U A 12 -7.667 3.244 1.135 1.00 0.00 C ATOM 376 O4 U A 12 -8.051 2.504 2.036 1.00 0.00 O ATOM 377 C5 U A 12 -6.933 4.474 1.318 1.00 0.00 C ATOM 378 C6 U A 12 -6.550 5.220 0.253 1.00 0.00 C ATOM 0 H5' U A 12 -4.834 9.337 -1.293 1.00 0.00 H new ATOM 0 H5'' U A 12 -6.398 10.040 -1.655 1.00 0.00 H new ATOM 0 H4' U A 12 -5.822 8.298 -3.204 1.00 0.00 H new ATOM 0 H3' U A 12 -8.196 7.746 -1.321 1.00 0.00 H new ATOM 0 H2' U A 12 -8.591 5.718 -2.723 1.00 0.00 H new ATOM 0 HO2' U A 12 -7.772 7.196 -4.639 1.00 0.00 H new ATOM 0 HO3' U A 12 -9.359 8.359 -3.119 1.00 0.00 H new ATOM 0 H1' U A 12 -5.913 4.984 -2.861 1.00 0.00 H new ATOM 0 H3 U A 12 -8.437 2.068 -0.363 1.00 0.00 H new ATOM 0 H5 U A 12 -6.686 4.804 2.316 1.00 0.00 H new ATOM 0 H6 U A 12 -5.999 6.134 0.417 1.00 0.00 H new TER 390 U A 12