USER MOD reduce.3.24.130724 H: found=0, std=0, add=206, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 206 hydrogens (30 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 180:sc= -2.83! USER MOD Single : A 2 G O2' : rot -159:sc= -2.44! USER MOD Single : A 3 C O2' : rot -19:sc= 0.0656 USER MOD Single : A 4 C O2' : rot -170:sc= -2.81! USER MOD Single : A 5 G O2' : rot 180:sc= -0.913 USER MOD Single : A 6 PSU O2' : rot 126:sc= 1.08 USER MOD Single : A 7 A O2' : rot -24:sc= 0.0796 USER MOD Single : A 8 A O2' : rot -22:sc= -0.818 USER MOD Single : A 9 C O2' : rot 86:sc= -1.24! USER MOD Single : A 10 PSU O2' : rot -139:sc= -0.388 USER MOD Single : A 11 A O2' : rot 115:sc= -9.11! USER MOD Single : A 12 PSU O2' : rot -173:sc= -1.18! USER MOD Single : A 13 A O2' : rot -127:sc= 1.12 USER MOD Single : A 14 A O2' : rot -158:sc= -2.46! USER MOD Single : A 15 C O2' : rot 180:sc= -4.68! USER MOD Single : A 16 G O2' : rot -126:sc= 0.684 USER MOD Single : A 17 G O2' : rot 180:sc= -3.76! USER MOD Single : A 18 U O2' : rot 180:sc= -4.4! USER MOD Single : A 19 C O2' : rot -21:sc= 0.0926 USER MOD Single : A 19 C O3' : rot 180:sc= 0.136 USER MOD ----------------------------------------------------------------- ATOM 1 P G A 1 17.959 -8.779 -1.705 1.00 46.84 P ATOM 2 OP1 G A 1 18.024 -8.694 -3.195 1.00 50.38 O ATOM 3 OP2 G A 1 17.517 -7.587 -0.936 1.00 43.27 O ATOM 4 O5' G A 1 17.002 -9.975 -1.336 1.00 0.00 O ATOM 5 C5' G A 1 17.203 -11.274 -1.902 1.00 0.00 C ATOM 6 C4' G A 1 16.430 -12.314 -1.127 1.00 0.00 C ATOM 7 O4' G A 1 17.026 -12.438 0.198 1.00 0.00 O ATOM 8 C3' G A 1 14.963 -11.985 -0.884 1.00 0.00 C ATOM 9 O3' G A 1 14.122 -12.530 -1.890 1.00 0.00 O ATOM 10 C2' G A 1 14.698 -12.604 0.478 1.00 0.00 C ATOM 11 O2' G A 1 14.518 -14.010 0.388 1.00 0.00 O ATOM 12 C1' G A 1 16.019 -12.316 1.182 1.00 0.00 C ATOM 13 N9 G A 1 16.101 -10.981 1.762 1.00 0.00 N ATOM 14 C8 G A 1 16.820 -9.914 1.282 1.00 0.00 C ATOM 15 N7 G A 1 16.693 -8.839 2.012 1.00 0.00 N ATOM 16 C5 G A 1 15.838 -9.220 3.038 1.00 0.00 C ATOM 17 C6 G A 1 15.331 -8.477 4.136 1.00 0.00 C ATOM 18 O6 G A 1 15.545 -7.297 4.430 1.00 0.00 O ATOM 19 N1 G A 1 14.493 -9.253 4.934 1.00 0.00 N ATOM 20 C2 G A 1 14.187 -10.570 4.706 1.00 0.00 C ATOM 21 N2 G A 1 13.358 -11.148 5.589 1.00 0.00 N ATOM 22 N3 G A 1 14.653 -11.274 3.687 1.00 0.00 N ATOM 23 C4 G A 1 15.463 -10.538 2.899 1.00 0.00 C ATOM 0 H5' G A 1 18.265 -11.520 -1.894 1.00 0.00 H new ATOM 0 H5'' G A 1 16.883 -11.277 -2.944 1.00 0.00 H new ATOM 0 H4' G A 1 16.477 -13.216 -1.737 1.00 0.00 H new ATOM 0 H3' G A 1 14.754 -10.916 -0.914 1.00 0.00 H new ATOM 0 H2' G A 1 13.803 -12.219 0.966 1.00 0.00 H new ATOM 0 HO2' G A 1 14.351 -14.376 1.282 1.00 0.00 H new ATOM 0 H1' G A 1 16.126 -13.015 2.012 1.00 0.00 H new ATOM 0 H8 G A 1 17.429 -9.959 0.391 1.00 0.00 H new ATOM 0 H1 G A 1 14.075 -8.807 5.751 1.00 0.00 H new ATOM 0 H21 G A 1 13.092 -12.126 5.474 1.00 0.00 H new ATOM 0 H22 G A 1 12.994 -10.609 6.375 1.00 0.00 H new ATOM 35 P G A 2 12.653 -11.923 -2.119 1.00 0.00 P ATOM 36 OP1 G A 2 12.003 -12.672 -3.224 1.00 0.00 O ATOM 37 OP2 G A 2 12.795 -10.445 -2.215 1.00 0.00 O ATOM 38 O5' G A 2 11.879 -12.256 -0.767 1.00 0.00 O ATOM 39 C5' G A 2 11.678 -13.602 -0.352 1.00 0.00 C ATOM 40 C4' G A 2 10.873 -13.647 0.925 1.00 0.00 C ATOM 41 O4' G A 2 11.644 -13.070 2.015 1.00 0.00 O ATOM 42 C3' G A 2 9.594 -12.823 0.923 1.00 0.00 C ATOM 43 O3' G A 2 8.524 -13.484 0.263 1.00 0.00 O ATOM 44 C2' G A 2 9.343 -12.644 2.409 1.00 0.00 C ATOM 45 O2' G A 2 8.857 -13.836 2.998 1.00 0.00 O ATOM 46 C1' G A 2 10.767 -12.397 2.909 1.00 0.00 C ATOM 47 N9 G A 2 11.126 -10.986 2.939 1.00 0.00 N ATOM 48 C8 G A 2 11.885 -10.304 2.021 1.00 0.00 C ATOM 49 N7 G A 2 12.034 -9.041 2.307 1.00 0.00 N ATOM 50 C5 G A 2 11.321 -8.876 3.488 1.00 0.00 C ATOM 51 C6 G A 2 11.114 -7.717 4.283 1.00 0.00 C ATOM 52 O6 G A 2 11.529 -6.565 4.096 1.00 0.00 O ATOM 53 N1 G A 2 10.327 -7.995 5.396 1.00 0.00 N ATOM 54 C2 G A 2 9.812 -9.227 5.712 1.00 0.00 C ATOM 55 N2 G A 2 9.078 -9.293 6.832 1.00 0.00 N ATOM 56 N3 G A 2 9.998 -10.313 4.981 1.00 0.00 N ATOM 57 C4 G A 2 10.758 -10.068 3.894 1.00 0.00 C ATOM 0 H5' G A 2 12.641 -14.089 -0.199 1.00 0.00 H new ATOM 0 H5'' G A 2 11.161 -14.157 -1.135 1.00 0.00 H new ATOM 0 H4' G A 2 10.630 -14.704 1.031 1.00 0.00 H new ATOM 0 H3' G A 2 9.677 -11.883 0.378 1.00 0.00 H new ATOM 0 H2' G A 2 8.612 -11.869 2.638 1.00 0.00 H new ATOM 0 HO2' G A 2 8.398 -13.623 3.837 1.00 0.00 H new ATOM 0 H1' G A 2 10.841 -12.763 3.933 1.00 0.00 H new ATOM 0 H8 G A 2 12.317 -10.769 1.147 1.00 0.00 H new ATOM 0 H1 G A 2 10.116 -7.222 6.027 1.00 0.00 H new ATOM 0 H21 G A 2 8.667 -10.181 7.121 1.00 0.00 H new ATOM 0 H22 G A 2 8.930 -8.455 7.395 1.00 0.00 H new ATOM 69 P C A 3 7.229 -12.651 -0.188 1.00 0.00 P ATOM 70 OP1 C A 3 6.267 -13.586 -0.822 1.00 0.00 O ATOM 71 OP2 C A 3 7.707 -11.464 -0.946 1.00 0.00 O ATOM 72 O5' C A 3 6.598 -12.141 1.183 1.00 0.00 O ATOM 73 C5' C A 3 6.104 -13.065 2.147 1.00 0.00 C ATOM 74 C4' C A 3 5.517 -12.324 3.326 1.00 0.00 C ATOM 75 O4' C A 3 6.553 -11.505 3.943 1.00 0.00 O ATOM 76 C3' C A 3 4.409 -11.334 2.998 1.00 0.00 C ATOM 77 O3' C A 3 3.143 -11.975 2.903 1.00 0.00 O ATOM 78 C2' C A 3 4.488 -10.369 4.172 1.00 0.00 C ATOM 79 O2' C A 3 3.934 -10.939 5.341 1.00 0.00 O ATOM 80 C1' C A 3 6.004 -10.266 4.348 1.00 0.00 C ATOM 81 N1 C A 3 6.605 -9.198 3.537 1.00 0.00 N ATOM 82 C2 C A 3 6.616 -7.895 4.039 1.00 0.00 C ATOM 83 O2 C A 3 6.123 -7.677 5.157 1.00 0.00 O ATOM 84 N3 C A 3 7.160 -6.905 3.292 1.00 0.00 N ATOM 85 C4 C A 3 7.682 -7.182 2.097 1.00 0.00 C ATOM 86 N4 C A 3 8.208 -6.174 1.394 1.00 0.00 N ATOM 87 C5 C A 3 7.688 -8.502 1.563 1.00 0.00 C ATOM 88 C6 C A 3 7.148 -9.470 2.313 1.00 0.00 C ATOM 0 H5' C A 3 6.910 -13.717 2.483 1.00 0.00 H new ATOM 0 H5'' C A 3 5.345 -13.703 1.694 1.00 0.00 H new ATOM 0 H4' C A 3 5.110 -13.116 3.954 1.00 0.00 H new ATOM 0 H3' C A 3 4.525 -10.843 2.032 1.00 0.00 H new ATOM 0 H2' C A 3 3.959 -9.431 4.007 1.00 0.00 H new ATOM 0 HO2' C A 3 3.352 -11.689 5.095 1.00 0.00 H new ATOM 0 H1' C A 3 6.216 -10.029 5.391 1.00 0.00 H new ATOM 0 H41 C A 3 8.616 -6.351 0.476 1.00 0.00 H new ATOM 0 H42 C A 3 8.202 -5.228 1.776 1.00 0.00 H new ATOM 0 H5 C A 3 8.111 -8.713 0.592 1.00 0.00 H new ATOM 0 H6 C A 3 7.141 -10.485 1.944 1.00 0.00 H new ATOM 100 P C A 4 1.972 -11.295 2.035 1.00 0.00 P ATOM 101 OP1 C A 4 0.860 -12.278 1.949 1.00 0.00 O ATOM 102 OP2 C A 4 2.563 -10.751 0.788 1.00 0.00 O ATOM 103 O5' C A 4 1.479 -10.075 2.932 1.00 0.00 O ATOM 104 C5' C A 4 0.754 -10.296 4.137 1.00 0.00 C ATOM 105 C4' C A 4 0.666 -9.019 4.935 1.00 0.00 C ATOM 106 O4' C A 4 1.991 -8.417 4.999 1.00 0.00 O ATOM 107 C3' C A 4 -0.228 -7.940 4.338 1.00 0.00 C ATOM 108 O3' C A 4 -1.568 -8.048 4.796 1.00 0.00 O ATOM 109 C2' C A 4 0.418 -6.650 4.820 1.00 0.00 C ATOM 110 O2' C A 4 0.061 -6.350 6.158 1.00 0.00 O ATOM 111 C1' C A 4 1.897 -7.025 4.778 1.00 0.00 C ATOM 112 N1 C A 4 2.535 -6.708 3.489 1.00 0.00 N ATOM 113 C2 C A 4 3.011 -5.409 3.280 1.00 0.00 C ATOM 114 O2 C A 4 2.878 -4.570 4.184 1.00 0.00 O ATOM 115 N3 C A 4 3.594 -5.106 2.103 1.00 0.00 N ATOM 116 C4 C A 4 3.726 -6.040 1.160 1.00 0.00 C ATOM 117 N4 C A 4 4.324 -5.696 0.019 1.00 0.00 N ATOM 118 C5 C A 4 3.248 -7.368 1.344 1.00 0.00 C ATOM 119 C6 C A 4 2.667 -7.657 2.515 1.00 0.00 C ATOM 0 H5' C A 4 1.244 -11.069 4.728 1.00 0.00 H new ATOM 0 H5'' C A 4 -0.248 -10.658 3.906 1.00 0.00 H new ATOM 0 H4' C A 4 0.249 -9.320 5.896 1.00 0.00 H new ATOM 0 H3' C A 4 -0.300 -8.007 3.252 1.00 0.00 H new ATOM 0 H2' C A 4 0.130 -5.781 4.229 1.00 0.00 H new ATOM 0 HO2' C A 4 0.361 -5.444 6.381 1.00 0.00 H new ATOM 0 H1' C A 4 2.415 -6.445 5.542 1.00 0.00 H new ATOM 0 H41 C A 4 4.441 -6.386 -0.723 1.00 0.00 H new ATOM 0 H42 C A 4 4.664 -4.743 -0.111 1.00 0.00 H new ATOM 0 H5 C A 4 3.350 -8.113 0.569 1.00 0.00 H new ATOM 0 H6 C A 4 2.297 -8.656 2.693 1.00 0.00 H new ATOM 131 P G A 5 -2.719 -7.154 4.112 1.00 0.00 P ATOM 132 OP1 G A 5 -4.039 -7.707 4.505 1.00 0.00 O ATOM 133 OP2 G A 5 -2.378 -7.021 2.672 1.00 0.00 O ATOM 134 O5' G A 5 -2.548 -5.723 4.796 1.00 0.00 O ATOM 135 C5' G A 5 -2.623 -5.574 6.210 1.00 0.00 C ATOM 136 C4' G A 5 -2.429 -4.128 6.597 1.00 0.00 C ATOM 137 O4' G A 5 -1.083 -3.709 6.236 1.00 0.00 O ATOM 138 C3' G A 5 -3.342 -3.133 5.893 1.00 0.00 C ATOM 139 O3' G A 5 -4.584 -2.974 6.565 1.00 0.00 O ATOM 140 C2' G A 5 -2.503 -1.865 5.916 1.00 0.00 C ATOM 141 O2' G A 5 -2.475 -1.291 7.209 1.00 0.00 O ATOM 142 C1' G A 5 -1.131 -2.439 5.603 1.00 0.00 C ATOM 143 N9 G A 5 -0.872 -2.630 4.182 1.00 0.00 N ATOM 144 C8 G A 5 -1.092 -3.772 3.451 1.00 0.00 C ATOM 145 N7 G A 5 -0.769 -3.652 2.194 1.00 0.00 N ATOM 146 C5 G A 5 -0.302 -2.347 2.085 1.00 0.00 C ATOM 147 C6 G A 5 0.189 -1.643 0.958 1.00 0.00 C ATOM 148 O6 G A 5 0.315 -2.042 -0.206 1.00 0.00 O ATOM 149 N1 G A 5 0.554 -0.341 1.287 1.00 0.00 N ATOM 150 C2 G A 5 0.457 0.208 2.539 1.00 0.00 C ATOM 151 N2 G A 5 0.864 1.480 2.660 1.00 0.00 N ATOM 152 N3 G A 5 0.002 -0.435 3.600 1.00 0.00 N ATOM 153 C4 G A 5 -0.357 -1.704 3.301 1.00 0.00 C ATOM 0 H5' G A 5 -1.862 -6.190 6.688 1.00 0.00 H new ATOM 0 H5'' G A 5 -3.590 -5.927 6.569 1.00 0.00 H new ATOM 0 H4' G A 5 -2.647 -4.110 7.665 1.00 0.00 H new ATOM 0 H3' G A 5 -3.635 -3.442 4.889 1.00 0.00 H new ATOM 0 H2' G A 5 -2.862 -1.085 5.245 1.00 0.00 H new ATOM 0 HO2' G A 5 -1.928 -0.478 7.194 1.00 0.00 H new ATOM 0 H1' G A 5 -0.378 -1.734 5.955 1.00 0.00 H new ATOM 0 H8 G A 5 -1.493 -4.680 3.876 1.00 0.00 H new ATOM 0 H1 G A 5 0.921 0.249 0.540 1.00 0.00 H new ATOM 0 H21 G A 5 0.817 1.946 3.566 1.00 0.00 H new ATOM 0 H22 G A 5 1.220 1.981 1.846 1.00 0.00 H new HETATM 165 N1 PSU A 6 -3.664 -0.943 1.247 1.00 0.00 N HETATM 166 C2 PSU A 6 -3.289 -0.348 0.094 1.00 0.00 C HETATM 167 N3 PSU A 6 -2.846 0.948 0.218 1.00 0.00 N HETATM 168 C4 PSU A 6 -2.753 1.685 1.411 1.00 0.00 C HETATM 169 C5 PSU A 6 -3.169 0.976 2.604 1.00 0.00 C HETATM 170 C6 PSU A 6 -3.606 -0.299 2.485 1.00 0.00 C HETATM 171 O2 PSU A 6 -3.339 -0.929 -1.001 1.00 0.00 O HETATM 172 O4 PSU A 6 -2.337 2.834 1.354 1.00 0.00 O HETATM 173 C1' PSU A 6 -3.087 1.711 3.957 1.00 0.00 C HETATM 174 C2' PSU A 6 -4.103 2.844 4.131 1.00 0.00 C HETATM 175 O2' PSU A 6 -3.479 3.871 4.883 1.00 0.00 O HETATM 176 C3' PSU A 6 -5.195 2.147 4.933 1.00 0.00 C HETATM 177 C4' PSU A 6 -4.387 1.239 5.848 1.00 0.00 C HETATM 178 O3' PSU A 6 -5.994 3.060 5.680 1.00 0.00 O HETATM 179 O4' PSU A 6 -3.311 0.770 4.996 1.00 0.00 O HETATM 180 C5' PSU A 6 -5.133 0.057 6.420 1.00 0.00 C HETATM 181 O5' PSU A 6 -5.409 -0.896 5.400 1.00 0.00 O HETATM 182 P PSU A 6 -5.853 -2.378 5.774 1.00 0.00 P HETATM 183 OP1 PSU A 6 -7.000 -2.304 6.714 1.00 0.00 O HETATM 184 OP2 PSU A 6 -5.987 -3.152 4.509 1.00 0.00 O HETATM 0 HO2' PSU A 6 -3.544 4.719 4.396 1.00 0.00 H new HETATM 0 H5'' PSU A 6 -4.542 -0.407 7.210 1.00 0.00 H new HETATM 0 HN3 PSU A 6 -2.557 1.420 -0.639 1.00 0.00 H new HETATM 0 HN1 PSU A 6 -4.004 -1.904 1.212 1.00 0.00 H new HETATM 0 H6 PSU A 6 -3.921 -0.838 3.379 1.00 0.00 H new HETATM 0 H5' PSU A 6 -6.065 0.393 6.875 1.00 0.00 H new HETATM 0 H4' PSU A 6 -4.078 1.795 6.733 1.00 0.00 H new HETATM 0 H3' PSU A 6 -5.915 1.622 4.305 1.00 0.00 H new HETATM 0 H2' PSU A 6 -4.478 3.302 3.216 1.00 0.00 H new HETATM 0 H1' PSU A 6 -2.096 2.164 3.993 1.00 0.00 H new ATOM 195 P A A 7 -7.345 3.651 5.041 1.00 0.00 P ATOM 196 OP1 A A 7 -8.250 3.993 6.167 1.00 0.00 O ATOM 197 OP2 A A 7 -7.819 2.728 3.978 1.00 0.00 O ATOM 198 O5' A A 7 -6.885 5.010 4.350 1.00 0.00 O ATOM 199 C5' A A 7 -6.296 6.057 5.120 1.00 0.00 C ATOM 200 C4' A A 7 -5.147 6.674 4.358 1.00 0.00 C ATOM 201 O4' A A 7 -4.498 5.638 3.568 1.00 0.00 O ATOM 202 C3' A A 7 -5.536 7.752 3.355 1.00 0.00 C ATOM 203 O3' A A 7 -5.562 9.041 3.961 1.00 0.00 O ATOM 204 C2' A A 7 -4.453 7.634 2.292 1.00 0.00 C ATOM 205 O2' A A 7 -3.255 8.269 2.699 1.00 0.00 O ATOM 206 C1' A A 7 -4.230 6.123 2.268 1.00 0.00 C ATOM 207 N9 A A 7 -5.095 5.412 1.323 1.00 0.00 N ATOM 208 C8 A A 7 -6.135 4.562 1.605 1.00 0.00 C ATOM 209 N7 A A 7 -6.725 4.079 0.539 1.00 0.00 N ATOM 210 C5 A A 7 -6.025 4.648 -0.510 1.00 0.00 C ATOM 211 C6 A A 7 -6.159 4.530 -1.908 1.00 0.00 C ATOM 212 N6 A A 7 -7.083 3.776 -2.501 1.00 0.00 N ATOM 213 N1 A A 7 -5.298 5.231 -2.681 1.00 0.00 N ATOM 214 C2 A A 7 -4.371 5.993 -2.083 1.00 0.00 C ATOM 215 N3 A A 7 -4.148 6.180 -0.785 1.00 0.00 N ATOM 216 C4 A A 7 -5.018 5.469 -0.046 1.00 0.00 C ATOM 0 H5' A A 7 -5.942 5.664 6.073 1.00 0.00 H new ATOM 0 H5'' A A 7 -7.043 6.818 5.347 1.00 0.00 H new ATOM 0 H4' A A 7 -4.519 7.128 5.125 1.00 0.00 H new ATOM 0 H3' A A 7 -6.539 7.626 2.947 1.00 0.00 H new ATOM 0 H2' A A 7 -4.728 8.088 1.340 1.00 0.00 H new ATOM 0 HO2' A A 7 -3.459 8.953 3.370 1.00 0.00 H new ATOM 0 H1' A A 7 -3.204 5.945 1.946 1.00 0.00 H new ATOM 0 H8 A A 7 -6.439 4.314 2.611 1.00 0.00 H new ATOM 0 H61 A A 7 -7.129 3.732 -3.519 1.00 0.00 H new ATOM 0 H62 A A 7 -7.745 3.243 -1.937 1.00 0.00 H new ATOM 0 H2 A A 7 -3.713 6.531 -2.749 1.00 0.00 H new ATOM 228 P A A 8 -6.557 10.166 3.391 1.00 0.00 P ATOM 229 OP1 A A 8 -5.916 11.490 3.571 1.00 0.00 O ATOM 230 OP2 A A 8 -7.899 9.916 3.986 1.00 0.00 O ATOM 231 O5' A A 8 -6.641 9.857 1.834 1.00 0.00 O ATOM 232 C5' A A 8 -5.782 10.518 0.912 1.00 0.00 C ATOM 233 C4' A A 8 -6.067 10.052 -0.492 1.00 0.00 C ATOM 234 O4' A A 8 -6.149 8.603 -0.516 1.00 0.00 O ATOM 235 C3' A A 8 -7.400 10.486 -1.073 1.00 0.00 C ATOM 236 O3' A A 8 -7.353 11.816 -1.579 1.00 0.00 O ATOM 237 C2' A A 8 -7.639 9.458 -2.173 1.00 0.00 C ATOM 238 O2' A A 8 -6.916 9.792 -3.344 1.00 0.00 O ATOM 239 C1' A A 8 -7.023 8.201 -1.556 1.00 0.00 C ATOM 240 N9 A A 8 -8.025 7.292 -1.004 1.00 0.00 N ATOM 241 C8 A A 8 -8.481 7.226 0.286 1.00 0.00 C ATOM 242 N7 A A 8 -9.388 6.299 0.476 1.00 0.00 N ATOM 243 C5 A A 8 -9.541 5.721 -0.772 1.00 0.00 C ATOM 244 C6 A A 8 -10.359 4.679 -1.238 1.00 0.00 C ATOM 245 N6 A A 8 -11.216 4.004 -0.463 1.00 0.00 N ATOM 246 N1 A A 8 -10.271 4.347 -2.543 1.00 0.00 N ATOM 247 C2 A A 8 -9.411 5.026 -3.318 1.00 0.00 C ATOM 248 N3 A A 8 -8.588 6.019 -2.996 1.00 0.00 N ATOM 249 C4 A A 8 -8.707 6.321 -1.694 1.00 0.00 C ATOM 0 H5' A A 8 -4.741 10.317 1.165 1.00 0.00 H new ATOM 0 H5'' A A 8 -5.924 11.597 0.981 1.00 0.00 H new ATOM 0 H4' A A 8 -5.255 10.491 -1.072 1.00 0.00 H new ATOM 0 H3' A A 8 -8.202 10.514 -0.335 1.00 0.00 H new ATOM 0 H2' A A 8 -8.686 9.371 -2.465 1.00 0.00 H new ATOM 0 HO2' A A 8 -6.710 10.750 -3.339 1.00 0.00 H new ATOM 0 H1' A A 8 -6.498 7.663 -2.345 1.00 0.00 H new ATOM 0 H8 A A 8 -8.127 7.876 1.072 1.00 0.00 H new ATOM 0 H61 A A 8 -11.784 3.256 -0.862 1.00 0.00 H new ATOM 0 H62 A A 8 -11.302 4.237 0.526 1.00 0.00 H new ATOM 0 H2 A A 8 -9.384 4.721 -4.354 1.00 0.00 H new ATOM 261 P C A 9 -8.714 12.540 -2.034 1.00 0.00 P ATOM 262 OP1 C A 9 -8.374 13.459 -3.149 1.00 0.00 O ATOM 263 OP2 C A 9 -9.381 13.078 -0.821 1.00 0.00 O ATOM 264 O5' C A 9 -9.606 11.358 -2.618 1.00 0.00 O ATOM 265 C5' C A 9 -9.651 11.102 -4.018 1.00 0.00 C ATOM 266 C4' C A 9 -10.737 10.099 -4.330 1.00 0.00 C ATOM 267 O4' C A 9 -10.726 9.048 -3.337 1.00 0.00 O ATOM 268 C3' C A 9 -12.159 10.635 -4.266 1.00 0.00 C ATOM 269 O3' C A 9 -12.520 11.285 -5.479 1.00 0.00 O ATOM 270 C2' C A 9 -12.995 9.375 -4.017 1.00 0.00 C ATOM 271 O2' C A 9 -13.330 8.732 -5.230 1.00 0.00 O ATOM 272 C1' C A 9 -12.020 8.480 -3.243 1.00 0.00 C ATOM 273 N1 C A 9 -12.355 8.346 -1.819 1.00 0.00 N ATOM 274 C2 C A 9 -13.145 7.266 -1.407 1.00 0.00 C ATOM 275 O2 C A 9 -13.531 6.451 -2.260 1.00 0.00 O ATOM 276 N3 C A 9 -13.458 7.137 -0.102 1.00 0.00 N ATOM 277 C4 C A 9 -13.022 8.035 0.783 1.00 0.00 C ATOM 278 N4 C A 9 -13.355 7.867 2.064 1.00 0.00 N ATOM 279 C5 C A 9 -12.217 9.147 0.391 1.00 0.00 C ATOM 280 C6 C A 9 -11.913 9.261 -0.905 1.00 0.00 C ATOM 0 H5' C A 9 -8.687 10.723 -4.357 1.00 0.00 H new ATOM 0 H5'' C A 9 -9.836 12.030 -4.559 1.00 0.00 H new ATOM 0 H4' C A 9 -10.510 9.784 -5.348 1.00 0.00 H new ATOM 0 H3' C A 9 -12.302 11.391 -3.494 1.00 0.00 H new ATOM 0 H2' C A 9 -13.933 9.590 -3.505 1.00 0.00 H new ATOM 0 HO2' C A 9 -12.601 8.134 -5.495 1.00 0.00 H new ATOM 0 H1' C A 9 -12.075 7.486 -3.686 1.00 0.00 H new ATOM 0 H41 C A 9 -13.037 8.536 2.765 1.00 0.00 H new ATOM 0 H42 C A 9 -13.927 7.070 2.342 1.00 0.00 H new ATOM 0 H5 C A 9 -11.867 9.869 1.114 1.00 0.00 H new ATOM 0 H6 C A 9 -11.307 10.091 -1.236 1.00 0.00 H new HETATM 292 N1 PSU A 10 -11.031 10.232 -8.376 1.00 0.00 N HETATM 293 C2 PSU A 10 -10.446 9.882 -9.544 1.00 0.00 C HETATM 294 N3 PSU A 10 -11.311 9.730 -10.606 1.00 0.00 N HETATM 295 C4 PSU A 10 -12.708 9.905 -10.577 1.00 0.00 C HETATM 296 C5 PSU A 10 -13.253 10.279 -9.289 1.00 0.00 C HETATM 297 C6 PSU A 10 -12.406 10.428 -8.241 1.00 0.00 C HETATM 298 O2 PSU A 10 -9.226 9.708 -9.658 1.00 0.00 O HETATM 299 O4 PSU A 10 -13.334 9.733 -11.611 1.00 0.00 O HETATM 300 C1' PSU A 10 -14.773 10.488 -9.168 1.00 0.00 C HETATM 301 C2' PSU A 10 -15.546 9.244 -8.739 1.00 0.00 C HETATM 302 O2' PSU A 10 -16.819 9.269 -9.362 1.00 0.00 O HETATM 303 C3' PSU A 10 -15.678 9.461 -7.235 1.00 0.00 C HETATM 304 C4' PSU A 10 -15.824 10.975 -7.126 1.00 0.00 C HETATM 305 O3' PSU A 10 -16.810 8.794 -6.692 1.00 0.00 O HETATM 306 O4' PSU A 10 -15.008 11.499 -8.203 1.00 0.00 O HETATM 307 C5' PSU A 10 -15.355 11.584 -5.823 1.00 0.00 C HETATM 308 O5' PSU A 10 -14.515 12.710 -6.082 1.00 0.00 O HETATM 309 P PSU A 10 -13.056 12.805 -5.453 1.00 0.00 P HETATM 310 OP1 PSU A 10 -12.209 13.601 -6.375 1.00 0.00 O HETATM 311 OP2 PSU A 10 -13.197 13.227 -4.039 1.00 0.00 O HETATM 0 HO2' PSU A 10 -17.502 8.977 -8.723 1.00 0.00 H new HETATM 0 H5'' PSU A 10 -16.214 11.891 -5.226 1.00 0.00 H new HETATM 0 HN3 PSU A 10 -10.899 9.465 -11.501 1.00 0.00 H new HETATM 0 HN1 PSU A 10 -10.439 10.359 -7.555 1.00 0.00 H new HETATM 0 H6 PSU A 10 -12.809 10.708 -7.268 1.00 0.00 H new HETATM 0 H5' PSU A 10 -14.811 10.841 -5.240 1.00 0.00 H new HETATM 0 H4' PSU A 10 -16.884 11.225 -7.177 1.00 0.00 H new HETATM 0 H3' PSU A 10 -14.832 9.061 -6.676 1.00 0.00 H new HETATM 0 H2' PSU A 10 -15.080 8.293 -8.998 1.00 0.00 H new HETATM 0 H1' PSU A 10 -15.128 10.756 -10.163 1.00 0.00 H new ATOM 322 P A A 11 -16.841 7.186 -6.644 1.00 0.00 P ATOM 323 OP1 A A 11 -18.234 6.763 -6.934 1.00 0.00 O ATOM 324 OP2 A A 11 -16.188 6.746 -5.382 1.00 0.00 O ATOM 325 O5' A A 11 -15.923 6.743 -7.866 1.00 0.00 O ATOM 326 C5' A A 11 -16.495 6.262 -9.079 1.00 0.00 C ATOM 327 C4' A A 11 -15.412 6.052 -10.116 1.00 0.00 C ATOM 328 O4' A A 11 -14.196 6.709 -9.658 1.00 0.00 O ATOM 329 C3' A A 11 -14.997 4.603 -10.340 1.00 0.00 C ATOM 330 O3' A A 11 -14.424 4.434 -11.640 1.00 0.00 O ATOM 331 C2' A A 11 -13.976 4.400 -9.234 1.00 0.00 C ATOM 332 O2' A A 11 -13.103 3.340 -9.546 1.00 0.00 O ATOM 333 C1' A A 11 -13.229 5.731 -9.310 1.00 0.00 C ATOM 334 N9 A A 11 -12.587 6.132 -8.060 1.00 0.00 N ATOM 335 C8 A A 11 -13.160 6.224 -6.816 1.00 0.00 C ATOM 336 N7 A A 11 -12.318 6.585 -5.876 1.00 0.00 N ATOM 337 C5 A A 11 -11.119 6.761 -6.548 1.00 0.00 C ATOM 338 C6 A A 11 -9.838 7.149 -6.121 1.00 0.00 C ATOM 339 N6 A A 11 -9.535 7.442 -4.856 1.00 0.00 N ATOM 340 N1 A A 11 -8.861 7.222 -7.050 1.00 0.00 N ATOM 341 C2 A A 11 -9.160 6.926 -8.318 1.00 0.00 C ATOM 342 N3 A A 11 -10.320 6.546 -8.845 1.00 0.00 N ATOM 343 C4 A A 11 -11.271 6.483 -7.897 1.00 0.00 C ATOM 0 H5' A A 11 -17.232 6.974 -9.450 1.00 0.00 H new ATOM 0 H5'' A A 11 -17.021 5.325 -8.896 1.00 0.00 H new ATOM 0 H4' A A 11 -15.837 6.443 -11.040 1.00 0.00 H new ATOM 0 H3' A A 11 -15.818 3.886 -10.306 1.00 0.00 H new ATOM 0 H2' A A 11 -14.401 4.155 -8.261 1.00 0.00 H new ATOM 0 HO2' A A 11 -12.195 3.689 -9.667 1.00 0.00 H new ATOM 0 H1' A A 11 -12.423 5.629 -10.037 1.00 0.00 H new ATOM 0 H8 A A 11 -14.204 6.019 -6.629 1.00 0.00 H new ATOM 0 H61 A A 11 -8.584 7.718 -4.610 1.00 0.00 H new ATOM 0 H62 A A 11 -10.254 7.390 -4.134 1.00 0.00 H new ATOM 0 H2 A A 11 -8.340 7.007 -9.016 1.00 0.00 H new HETATM 355 N1 PSU A 12 -12.400 1.353 -6.353 1.00 0.00 N HETATM 356 C2 PSU A 12 -11.821 1.372 -5.136 1.00 0.00 C HETATM 357 N3 PSU A 12 -10.633 2.068 -5.069 1.00 0.00 N HETATM 358 C4 PSU A 12 -9.996 2.737 -6.131 1.00 0.00 C HETATM 359 C5 PSU A 12 -10.687 2.666 -7.399 1.00 0.00 C HETATM 360 C6 PSU A 12 -11.852 1.988 -7.471 1.00 0.00 C HETATM 361 O2 PSU A 12 -12.313 0.812 -4.149 1.00 0.00 O HETATM 362 O4 PSU A 12 -8.941 3.307 -5.906 1.00 0.00 O HETATM 363 C1' PSU A 12 -10.055 3.364 -8.616 1.00 0.00 C HETATM 364 C2' PSU A 12 -8.829 2.634 -9.171 1.00 0.00 C HETATM 365 O2' PSU A 12 -7.743 3.539 -9.164 1.00 0.00 O HETATM 366 C3' PSU A 12 -9.244 2.290 -10.605 1.00 0.00 C HETATM 367 C4' PSU A 12 -10.348 3.286 -10.915 1.00 0.00 C HETATM 368 O3' PSU A 12 -8.170 2.452 -11.531 1.00 0.00 O HETATM 369 O4' PSU A 12 -11.012 3.455 -9.646 1.00 0.00 O HETATM 370 C5' PSU A 12 -11.362 2.861 -11.959 1.00 0.00 C HETATM 371 O5' PSU A 12 -12.642 2.662 -11.350 1.00 0.00 O HETATM 372 P PSU A 12 -13.991 2.971 -12.145 1.00 0.00 P HETATM 373 OP1 PSU A 12 -13.662 3.081 -13.586 1.00 0.00 O HETATM 374 OP2 PSU A 12 -15.024 2.001 -11.699 1.00 0.00 O HETATM 0 HO2' PSU A 12 -6.973 3.129 -9.611 1.00 0.00 H new HETATM 0 H5'' PSU A 12 -11.435 3.621 -12.737 1.00 0.00 H new HETATM 0 HN3 PSU A 12 -10.170 2.101 -4.161 1.00 0.00 H new HETATM 0 HN1 PSU A 12 -13.281 0.851 -6.463 1.00 0.00 H new HETATM 0 H6 PSU A 12 -12.378 1.934 -8.424 1.00 0.00 H new HETATM 0 H5' PSU A 12 -11.034 1.941 -12.442 1.00 0.00 H new HETATM 0 H4' PSU A 12 -9.907 4.184 -11.348 1.00 0.00 H new HETATM 0 H3' PSU A 12 -9.555 1.249 -10.692 1.00 0.00 H new HETATM 0 H2' PSU A 12 -8.529 1.750 -8.608 1.00 0.00 H new HETATM 0 H1' PSU A 12 -9.727 4.345 -8.273 1.00 0.00 H new ATOM 385 P A A 13 -7.394 1.169 -12.115 1.00 0.00 P ATOM 386 OP1 A A 13 -7.438 1.231 -13.594 1.00 0.00 O ATOM 387 OP2 A A 13 -7.912 -0.035 -11.414 1.00 0.00 O ATOM 388 O5' A A 13 -5.890 1.395 -11.649 1.00 0.00 O ATOM 389 C5' A A 13 -5.019 2.266 -12.369 1.00 0.00 C ATOM 390 C4' A A 13 -4.400 3.288 -11.437 1.00 0.00 C ATOM 391 O4' A A 13 -5.408 3.714 -10.473 1.00 0.00 O ATOM 392 C3' A A 13 -3.234 2.785 -10.595 1.00 0.00 C ATOM 393 O3' A A 13 -1.985 2.982 -11.247 1.00 0.00 O ATOM 394 C2' A A 13 -3.349 3.618 -9.326 1.00 0.00 C ATOM 395 O2' A A 13 -2.844 4.929 -9.510 1.00 0.00 O ATOM 396 C1' A A 13 -4.866 3.687 -9.169 1.00 0.00 C ATOM 397 N9 A A 13 -5.424 2.538 -8.458 1.00 0.00 N ATOM 398 C8 A A 13 -6.199 1.540 -8.993 1.00 0.00 C ATOM 399 N7 A A 13 -6.547 0.624 -8.127 1.00 0.00 N ATOM 400 C5 A A 13 -5.980 1.055 -6.938 1.00 0.00 C ATOM 401 C6 A A 13 -5.986 0.518 -5.638 1.00 0.00 C ATOM 402 N6 A A 13 -6.609 -0.607 -5.302 1.00 0.00 N ATOM 403 N1 A A 13 -5.318 1.197 -4.678 1.00 0.00 N ATOM 404 C2 A A 13 -4.693 2.331 -5.012 1.00 0.00 C ATOM 405 N3 A A 13 -4.609 2.933 -6.197 1.00 0.00 N ATOM 406 C4 A A 13 -5.284 2.235 -7.128 1.00 0.00 C ATOM 0 H5' A A 13 -5.574 2.774 -13.158 1.00 0.00 H new ATOM 0 H5'' A A 13 -4.234 1.685 -12.854 1.00 0.00 H new ATOM 0 H4' A A 13 -4.031 4.073 -12.097 1.00 0.00 H new ATOM 0 H3' A A 13 -3.273 1.712 -10.408 1.00 0.00 H new ATOM 0 H2' A A 13 -2.798 3.203 -8.482 1.00 0.00 H new ATOM 0 HO2' A A 13 -2.181 5.124 -8.816 1.00 0.00 H new ATOM 0 H1' A A 13 -5.114 4.571 -8.582 1.00 0.00 H new ATOM 0 H8 A A 13 -6.494 1.513 -10.032 1.00 0.00 H new ATOM 0 H61 A A 13 -6.574 -0.942 -4.339 1.00 0.00 H new ATOM 0 H62 A A 13 -7.122 -1.136 -6.007 1.00 0.00 H new ATOM 0 H2 A A 13 -4.182 2.832 -4.203 1.00 0.00 H new ATOM 418 P A A 14 -0.667 2.266 -10.670 1.00 0.00 P ATOM 419 OP1 A A 14 0.389 2.383 -11.705 1.00 0.00 O ATOM 420 OP2 A A 14 -1.049 0.925 -10.162 1.00 0.00 O ATOM 421 O5' A A 14 -0.245 3.170 -9.424 1.00 0.00 O ATOM 422 C5' A A 14 0.276 4.478 -9.621 1.00 0.00 C ATOM 423 C4' A A 14 0.365 5.210 -8.298 1.00 0.00 C ATOM 424 O4' A A 14 -0.876 5.034 -7.566 1.00 0.00 O ATOM 425 C3' A A 14 1.428 4.706 -7.334 1.00 0.00 C ATOM 426 O3' A A 14 2.716 5.243 -7.629 1.00 0.00 O ATOM 427 C2' A A 14 0.894 5.185 -5.995 1.00 0.00 C ATOM 428 O2' A A 14 1.104 6.573 -5.829 1.00 0.00 O ATOM 429 C1' A A 14 -0.599 4.938 -6.179 1.00 0.00 C ATOM 430 N9 A A 14 -1.046 3.627 -5.712 1.00 0.00 N ATOM 431 C8 A A 14 -1.238 2.478 -6.444 1.00 0.00 C ATOM 432 N7 A A 14 -1.652 1.458 -5.736 1.00 0.00 N ATOM 433 C5 A A 14 -1.735 1.966 -4.442 1.00 0.00 C ATOM 434 C6 A A 14 -2.112 1.378 -3.225 1.00 0.00 C ATOM 435 N6 A A 14 -2.488 0.107 -3.103 1.00 0.00 N ATOM 436 N1 A A 14 -2.085 2.159 -2.121 1.00 0.00 N ATOM 437 C2 A A 14 -1.703 3.434 -2.245 1.00 0.00 C ATOM 438 N3 A A 14 -1.321 4.099 -3.335 1.00 0.00 N ATOM 439 C4 A A 14 -1.360 3.295 -4.413 1.00 0.00 C ATOM 0 H5' A A 14 -0.363 5.032 -10.309 1.00 0.00 H new ATOM 0 H5'' A A 14 1.263 4.419 -10.079 1.00 0.00 H new ATOM 0 H4' A A 14 0.600 6.234 -8.588 1.00 0.00 H new ATOM 0 H3' A A 14 1.583 3.628 -7.377 1.00 0.00 H new ATOM 0 H2' A A 14 1.358 4.696 -5.138 1.00 0.00 H new ATOM 0 HO2' A A 14 1.087 6.795 -4.875 1.00 0.00 H new ATOM 0 H1' A A 14 -1.130 5.679 -5.581 1.00 0.00 H new ATOM 0 H8 A A 14 -1.063 2.423 -7.508 1.00 0.00 H new ATOM 0 H61 A A 14 -2.751 -0.262 -2.189 1.00 0.00 H new ATOM 0 H62 A A 14 -2.513 -0.498 -3.924 1.00 0.00 H new ATOM 0 H2 A A 14 -1.704 4.008 -1.330 1.00 0.00 H new ATOM 451 P C A 15 4.031 4.522 -7.050 1.00 0.00 P ATOM 452 OP1 C A 15 5.204 5.305 -7.511 1.00 0.00 O ATOM 453 OP2 C A 15 3.946 3.076 -7.358 1.00 0.00 O ATOM 454 O5' C A 15 3.907 4.707 -5.469 1.00 0.00 O ATOM 455 C5' C A 15 3.892 6.005 -4.887 1.00 0.00 C ATOM 456 C4' C A 15 3.817 5.900 -3.379 1.00 0.00 C ATOM 457 O4' C A 15 2.583 5.231 -3.005 1.00 0.00 O ATOM 458 C3' C A 15 4.897 5.054 -2.727 1.00 0.00 C ATOM 459 O3' C A 15 6.103 5.790 -2.552 1.00 0.00 O ATOM 460 C2' C A 15 4.253 4.672 -1.395 1.00 0.00 C ATOM 461 O2' C A 15 4.359 5.726 -0.455 1.00 0.00 O ATOM 462 C1' C A 15 2.783 4.523 -1.792 1.00 0.00 C ATOM 463 N1 C A 15 2.353 3.134 -1.992 1.00 0.00 N ATOM 464 C2 C A 15 1.849 2.415 -0.901 1.00 0.00 C ATOM 465 O2 C A 15 1.793 2.973 0.205 1.00 0.00 O ATOM 466 N3 C A 15 1.431 1.143 -1.082 1.00 0.00 N ATOM 467 C4 C A 15 1.507 0.580 -2.290 1.00 0.00 C ATOM 468 N4 C A 15 1.072 -0.671 -2.425 1.00 0.00 N ATOM 469 C5 C A 15 2.032 1.283 -3.414 1.00 0.00 C ATOM 470 C6 C A 15 2.440 2.542 -3.221 1.00 0.00 C ATOM 0 H5' C A 15 3.039 6.570 -5.262 1.00 0.00 H new ATOM 0 H5'' C A 15 4.789 6.552 -5.177 1.00 0.00 H new ATOM 0 H4' C A 15 3.914 6.932 -3.042 1.00 0.00 H new ATOM 0 H3' C A 15 5.196 4.190 -3.320 1.00 0.00 H new ATOM 0 H2' C A 15 4.708 3.794 -0.937 1.00 0.00 H new ATOM 0 HO2' C A 15 3.938 5.456 0.388 1.00 0.00 H new ATOM 0 H1' C A 15 2.189 4.917 -0.967 1.00 0.00 H new ATOM 0 H41 C A 15 1.116 -1.131 -3.334 1.00 0.00 H new ATOM 0 H42 C A 15 0.695 -1.170 -1.619 1.00 0.00 H new ATOM 0 H5 C A 15 2.098 0.816 -4.386 1.00 0.00 H new ATOM 0 H6 C A 15 2.846 3.101 -4.051 1.00 0.00 H new ATOM 482 P G A 16 7.463 5.017 -2.199 1.00 0.00 P ATOM 483 OP1 G A 16 8.563 6.012 -2.143 1.00 0.00 O ATOM 484 OP2 G A 16 7.569 3.856 -3.121 1.00 0.00 O ATOM 485 O5' G A 16 7.216 4.457 -0.729 1.00 0.00 O ATOM 486 C5' G A 16 6.855 5.335 0.330 1.00 0.00 C ATOM 487 C4' G A 16 6.252 4.547 1.469 1.00 0.00 C ATOM 488 O4' G A 16 5.281 3.629 0.931 1.00 0.00 O ATOM 489 C3' G A 16 7.227 3.673 2.243 1.00 0.00 C ATOM 490 O3' G A 16 7.819 4.404 3.309 1.00 0.00 O ATOM 491 C2' G A 16 6.375 2.498 2.738 1.00 0.00 C ATOM 492 O2' G A 16 5.885 2.735 4.045 1.00 0.00 O ATOM 493 C1' G A 16 5.197 2.491 1.763 1.00 0.00 C ATOM 494 N9 G A 16 5.176 1.302 0.920 1.00 0.00 N ATOM 495 C8 G A 16 5.527 1.215 -0.402 1.00 0.00 C ATOM 496 N7 G A 16 5.432 0.006 -0.883 1.00 0.00 N ATOM 497 C5 G A 16 4.981 -0.751 0.188 1.00 0.00 C ATOM 498 C6 G A 16 4.687 -2.136 0.277 1.00 0.00 C ATOM 499 O6 G A 16 4.783 -3.005 -0.596 1.00 0.00 O ATOM 500 N1 G A 16 4.241 -2.481 1.546 1.00 0.00 N ATOM 501 C2 G A 16 4.108 -1.611 2.600 1.00 0.00 C ATOM 502 N2 G A 16 3.667 -2.143 3.755 1.00 0.00 N ATOM 503 N3 G A 16 4.380 -0.320 2.532 1.00 0.00 N ATOM 504 C4 G A 16 4.810 0.037 1.305 1.00 0.00 C ATOM 0 H5' G A 16 6.141 6.077 -0.028 1.00 0.00 H new ATOM 0 H5'' G A 16 7.733 5.879 0.678 1.00 0.00 H new ATOM 0 H4' G A 16 5.852 5.302 2.146 1.00 0.00 H new ATOM 0 H3' G A 16 8.065 3.327 1.638 1.00 0.00 H new ATOM 0 H2' G A 16 6.938 1.565 2.775 1.00 0.00 H new ATOM 0 HO2' G A 16 6.138 1.990 4.629 1.00 0.00 H new ATOM 0 H1' G A 16 4.283 2.497 2.357 1.00 0.00 H new ATOM 0 H8 G A 16 5.850 2.063 -0.987 1.00 0.00 H new ATOM 0 H1 G A 16 3.993 -3.457 1.708 1.00 0.00 H new ATOM 0 H21 G A 16 3.546 -1.550 4.576 1.00 0.00 H new ATOM 0 H22 G A 16 3.453 -3.139 3.809 1.00 0.00 H new ATOM 516 P G A 17 9.040 3.773 4.142 1.00 0.00 P ATOM 517 OP1 G A 17 9.701 4.883 4.875 1.00 0.00 O ATOM 518 OP2 G A 17 9.839 2.926 3.218 1.00 0.00 O ATOM 519 O5' G A 17 8.337 2.821 5.211 1.00 0.00 O ATOM 520 C5' G A 17 7.627 3.375 6.315 1.00 0.00 C ATOM 521 C4' G A 17 7.107 2.282 7.221 1.00 0.00 C ATOM 522 O4' G A 17 6.177 1.442 6.474 1.00 0.00 O ATOM 523 C3' G A 17 8.162 1.318 7.756 1.00 0.00 C ATOM 524 O3' G A 17 8.729 1.780 8.976 1.00 0.00 O ATOM 525 C2' G A 17 7.368 0.033 7.947 1.00 0.00 C ATOM 526 O2' G A 17 6.580 0.076 9.125 1.00 0.00 O ATOM 527 C1' G A 17 6.449 0.080 6.733 1.00 0.00 C ATOM 528 N9 G A 17 7.028 -0.498 5.523 1.00 0.00 N ATOM 529 C8 G A 17 7.688 0.169 4.525 1.00 0.00 C ATOM 530 N7 G A 17 8.085 -0.604 3.555 1.00 0.00 N ATOM 531 C5 G A 17 7.662 -1.873 3.940 1.00 0.00 C ATOM 532 C6 G A 17 7.802 -3.126 3.287 1.00 0.00 C ATOM 533 O6 G A 17 8.348 -3.373 2.206 1.00 0.00 O ATOM 534 N1 G A 17 7.224 -4.154 4.025 1.00 0.00 N ATOM 535 C2 G A 17 6.595 -4.000 5.237 1.00 0.00 C ATOM 536 N2 G A 17 6.113 -5.118 5.798 1.00 0.00 N ATOM 537 N3 G A 17 6.458 -2.839 5.857 1.00 0.00 N ATOM 538 C4 G A 17 7.011 -1.825 5.155 1.00 0.00 C ATOM 0 H5' G A 17 6.796 3.979 5.952 1.00 0.00 H new ATOM 0 H5'' G A 17 8.282 4.040 6.878 1.00 0.00 H new ATOM 0 H4' G A 17 6.667 2.818 8.062 1.00 0.00 H new ATOM 0 H3' G A 17 9.018 1.200 7.091 1.00 0.00 H new ATOM 0 H2' G A 17 7.994 -0.855 8.037 1.00 0.00 H new ATOM 0 HO2' G A 17 6.083 -0.763 9.217 1.00 0.00 H new ATOM 0 H1' G A 17 5.563 -0.510 6.969 1.00 0.00 H new ATOM 0 H8 G A 17 7.863 1.235 4.541 1.00 0.00 H new ATOM 0 H1 G A 17 7.271 -5.096 3.636 1.00 0.00 H new ATOM 0 H21 G A 17 5.635 -5.072 6.698 1.00 0.00 H new ATOM 0 H22 G A 17 6.224 -6.015 5.325 1.00 0.00 H new ATOM 550 P U A 18 10.063 1.085 9.541 1.00 0.00 P ATOM 551 OP1 U A 18 10.372 1.687 10.866 1.00 0.00 O ATOM 552 OP2 U A 18 11.079 1.125 8.459 1.00 0.00 O ATOM 553 O5' U A 18 9.641 -0.431 9.771 1.00 0.00 O ATOM 554 C5' U A 18 8.673 -0.785 10.757 1.00 0.00 C ATOM 555 C4' U A 18 8.460 -2.280 10.770 1.00 0.00 C ATOM 556 O4' U A 18 8.031 -2.708 9.444 1.00 0.00 O ATOM 557 C3' U A 18 9.708 -3.108 11.060 1.00 0.00 C ATOM 558 O3' U A 18 9.897 -3.316 12.450 1.00 0.00 O ATOM 559 C2' U A 18 9.423 -4.410 10.327 1.00 0.00 C ATOM 560 O2' U A 18 8.553 -5.248 11.074 1.00 0.00 O ATOM 561 C1' U A 18 8.688 -3.913 9.092 1.00 0.00 C ATOM 562 N1 U A 18 9.560 -3.644 7.942 1.00 0.00 N ATOM 563 C2 U A 18 9.871 -4.702 7.105 1.00 0.00 C ATOM 564 O2 U A 18 9.445 -5.831 7.285 1.00 0.00 O ATOM 565 N3 U A 18 10.689 -4.384 6.049 1.00 0.00 N ATOM 566 C4 U A 18 11.217 -3.149 5.750 1.00 0.00 C ATOM 567 O4 U A 18 11.928 -3.018 4.752 1.00 0.00 O ATOM 568 C5 U A 18 10.853 -2.113 6.664 1.00 0.00 C ATOM 569 C6 U A 18 10.058 -2.381 7.703 1.00 0.00 C ATOM 0 H5' U A 18 7.730 -0.278 10.549 1.00 0.00 H new ATOM 0 H5'' U A 18 9.005 -0.450 11.739 1.00 0.00 H new ATOM 0 H4' U A 18 7.734 -2.448 11.565 1.00 0.00 H new ATOM 0 H3' U A 18 10.628 -2.623 10.735 1.00 0.00 H new ATOM 0 H2' U A 18 10.321 -4.996 10.133 1.00 0.00 H new ATOM 0 HO2' U A 18 8.388 -6.076 10.576 1.00 0.00 H new ATOM 0 H1' U A 18 8.003 -4.702 8.782 1.00 0.00 H new ATOM 0 H3 U A 18 10.932 -5.147 5.417 1.00 0.00 H new ATOM 0 H5 U A 18 11.222 -1.109 6.514 1.00 0.00 H new ATOM 0 H6 U A 18 9.796 -1.581 8.379 1.00 0.00 H new ATOM 580 P C A 19 11.272 -3.964 12.979 1.00 0.00 P ATOM 581 OP1 C A 19 11.205 -4.005 14.458 1.00 0.00 O ATOM 582 OP2 C A 19 12.398 -3.262 12.312 1.00 0.00 O ATOM 583 O5' C A 19 11.224 -5.459 12.435 1.00 0.00 O ATOM 584 C5' C A 19 10.205 -6.359 12.866 1.00 0.00 C ATOM 585 C4' C A 19 10.354 -7.696 12.170 1.00 0.00 C ATOM 586 O4' C A 19 10.256 -7.505 10.737 1.00 0.00 O ATOM 587 C3' C A 19 11.701 -8.381 12.341 1.00 0.00 C ATOM 588 O3' C A 19 11.808 -9.071 13.592 1.00 0.00 O ATOM 589 C2' C A 19 11.738 -9.330 11.147 1.00 0.00 C ATOM 590 O2' C A 19 10.996 -10.504 11.407 1.00 0.00 O ATOM 591 C1' C A 19 11.000 -8.516 10.079 1.00 0.00 C ATOM 592 N1 C A 19 11.897 -7.879 9.106 1.00 0.00 N ATOM 593 C2 C A 19 12.427 -8.651 8.070 1.00 0.00 C ATOM 594 O2 C A 19 12.123 -9.852 8.000 1.00 0.00 O ATOM 595 N3 C A 19 13.262 -8.074 7.175 1.00 0.00 N ATOM 596 C4 C A 19 13.566 -6.780 7.288 1.00 0.00 C ATOM 597 N4 C A 19 14.397 -6.251 6.384 1.00 0.00 N ATOM 598 C5 C A 19 13.039 -5.967 8.331 1.00 0.00 C ATOM 599 C6 C A 19 12.211 -6.550 9.207 1.00 0.00 C ATOM 0 H5' C A 19 9.223 -5.937 12.651 1.00 0.00 H new ATOM 0 H5'' C A 19 10.264 -6.495 13.946 1.00 0.00 H new ATOM 0 H4' C A 19 9.573 -8.308 12.622 1.00 0.00 H new ATOM 0 H3' C A 19 12.539 -7.685 12.364 1.00 0.00 H new ATOM 0 H2' C A 19 12.747 -9.646 10.883 1.00 0.00 H new ATOM 0 HO2' C A 19 10.905 -10.626 12.375 1.00 0.00 H new ATOM 0 HO3' C A 19 12.688 -9.497 13.657 1.00 0.00 H new ATOM 0 H1' C A 19 10.365 -9.205 9.521 1.00 0.00 H new ATOM 0 H41 C A 19 14.651 -5.265 6.440 1.00 0.00 H new ATOM 0 H42 C A 19 14.777 -6.834 5.638 1.00 0.00 H new ATOM 0 H5 C A 19 13.297 -4.921 8.412 1.00 0.00 H new ATOM 0 H6 C A 19 11.784 -5.962 10.006 1.00 0.00 H new TER 612 C A 19