USER MOD reduce.3.24.130724 H: found=0, std=0, add=260, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 260 hydrogens (20 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= 0 USER MOD Single : A 1 G O5' : rot 19:sc= -1! USER MOD Single : A 2 C O2' : rot 180:sc= -1.36 USER MOD Single : A 3 G O2' : rot -150:sc= -2.09! USER MOD Single : A 4 G O2' : rot -112:sc= 0.985 USER MOD Single : A 5 U O2' : rot -24:sc= -0.0128 USER MOD Single : A 6 G O2' : rot -20:sc= -0.129 USER MOD Single : A 7 U O2' : rot 180:sc= -0.248 USER MOD Single : A 8 A O2' : rot 180:sc= -1.83! USER MOD Single : A 9 A O2' : rot 180:sc= -1.29 USER MOD Single : A 10 A O2' : rot 180:sc= -2.19! USER MOD Single : A 11 A O2' : rot -113:sc= 0.499 USER MOD Single : A 12 G O2' : rot -24:sc= 0.122 USER MOD Single : A 12 G O3' : rot 180:sc= 0.127 USER MOD Single : B 1 C O2' : rot 180:sc= -0.119 USER MOD Single : B 1 C O5' : rot 180:sc= -1.56! USER MOD Single : B 2 U O2' : rot -124:sc= 0.527 USER MOD Single : B 3 SUR O2' : rot 177:sc= -0.927 USER MOD Single : B 4 U O2' : rot 180:sc= -1.86! USER MOD Single : B 5 U O2' : rot -170:sc= -2.11! USER MOD Single : B 6 A O2' : rot -111:sc= 0.504 USER MOD Single : B 7 A O2' : rot 180:sc= -1.19 USER MOD Single : B 8 PSU O2' : rot 90:sc= -1.57! USER MOD Single : B 9 C O2' : rot 180:sc= -0.349 USER MOD Single : B 10 U O2' : rot 180:sc= -0.404 USER MOD Single : B 11 G O2' : rot -20:sc= 0.0742 USER MOD Single : B 12 C O2' : rot -28:sc= 0.102 USER MOD Single : B 12 C O3' : rot 180:sc= 0.106 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -10.032 12.014 2.584 1.00 0.00 O ATOM 2 C5' G A 1 -11.334 12.052 3.177 1.00 0.00 C ATOM 3 C4' G A 1 -12.389 11.640 2.177 1.00 0.00 C ATOM 4 O4' G A 1 -12.667 12.774 1.308 1.00 0.00 O ATOM 5 C3' G A 1 -11.985 10.495 1.253 1.00 0.00 C ATOM 6 O3' G A 1 -12.441 9.245 1.761 1.00 0.00 O ATOM 7 C2' G A 1 -12.652 10.861 -0.069 1.00 0.00 C ATOM 8 O2' G A 1 -14.022 10.507 -0.066 1.00 0.00 O ATOM 9 C1' G A 1 -12.539 12.382 -0.043 1.00 0.00 C ATOM 10 N9 G A 1 -11.273 12.900 -0.553 1.00 0.00 N ATOM 11 C8 G A 1 -10.218 13.380 0.185 1.00 0.00 C ATOM 12 N7 G A 1 -9.221 13.791 -0.548 1.00 0.00 N ATOM 13 C5 G A 1 -9.640 13.565 -1.852 1.00 0.00 C ATOM 14 C6 G A 1 -8.983 13.813 -3.084 1.00 0.00 C ATOM 15 O6 G A 1 -7.861 14.295 -3.276 1.00 0.00 O ATOM 16 N1 G A 1 -9.769 13.438 -4.168 1.00 0.00 N ATOM 17 C2 G A 1 -11.024 12.889 -4.079 1.00 0.00 C ATOM 18 N2 G A 1 -11.623 12.590 -5.236 1.00 0.00 N ATOM 19 N3 G A 1 -11.647 12.650 -2.938 1.00 0.00 N ATOM 20 C4 G A 1 -10.903 13.012 -1.872 1.00 0.00 C ATOM 0 H5' G A 1 -11.544 13.058 3.541 1.00 0.00 H new ATOM 0 H5'' G A 1 -11.365 11.388 4.041 1.00 0.00 H new ATOM 0 H4' G A 1 -13.239 11.308 2.773 1.00 0.00 H new ATOM 0 H3' G A 1 -10.906 10.376 1.152 1.00 0.00 H new ATOM 0 H2' G A 1 -12.207 10.367 -0.932 1.00 0.00 H new ATOM 0 HO2' G A 1 -14.426 10.754 -0.924 1.00 0.00 H new ATOM 0 HO5' G A 1 -10.117 12.028 1.608 1.00 0.00 H new ATOM 0 H1' G A 1 -13.315 12.785 -0.694 1.00 0.00 H new ATOM 0 H8 G A 1 -10.215 13.414 1.264 1.00 0.00 H new ATOM 0 H1 G A 1 -9.383 13.582 -5.101 1.00 0.00 H new ATOM 0 H21 G A 1 -12.557 12.179 -5.236 1.00 0.00 H new ATOM 0 H22 G A 1 -11.146 12.772 -6.119 1.00 0.00 H new ATOM 33 P C A 2 -11.482 7.955 1.694 1.00 0.00 P ATOM 34 OP1 C A 2 -11.998 6.975 2.684 1.00 0.00 O ATOM 35 OP2 C A 2 -10.069 8.405 1.775 1.00 0.00 O ATOM 36 O5' C A 2 -11.736 7.365 0.236 1.00 0.00 O ATOM 37 C5' C A 2 -13.057 7.082 -0.221 1.00 0.00 C ATOM 38 C4' C A 2 -13.044 6.811 -1.706 1.00 0.00 C ATOM 39 O4' C A 2 -12.916 8.076 -2.413 1.00 0.00 O ATOM 40 C3' C A 2 -11.877 5.966 -2.199 1.00 0.00 C ATOM 41 O3' C A 2 -12.174 4.575 -2.127 1.00 0.00 O ATOM 42 C2' C A 2 -11.696 6.456 -3.629 1.00 0.00 C ATOM 43 O2' C A 2 -12.680 5.908 -4.487 1.00 0.00 O ATOM 44 C1' C A 2 -11.969 7.948 -3.459 1.00 0.00 C ATOM 45 N1 C A 2 -10.775 8.738 -3.109 1.00 0.00 N ATOM 46 C2 C A 2 -9.989 9.265 -4.137 1.00 0.00 C ATOM 47 O2 C A 2 -10.317 9.050 -5.312 1.00 0.00 O ATOM 48 N3 C A 2 -8.894 9.994 -3.824 1.00 0.00 N ATOM 49 C4 C A 2 -8.575 10.204 -2.545 1.00 0.00 C ATOM 50 N4 C A 2 -7.484 10.925 -2.281 1.00 0.00 N ATOM 51 C5 C A 2 -9.360 9.681 -1.477 1.00 0.00 C ATOM 52 C6 C A 2 -10.439 8.958 -1.802 1.00 0.00 C ATOM 0 H5' C A 2 -13.714 7.924 -0.003 1.00 0.00 H new ATOM 0 H5'' C A 2 -13.457 6.219 0.311 1.00 0.00 H new ATOM 0 H4' C A 2 -13.971 6.270 -1.897 1.00 0.00 H new ATOM 0 H3' C A 2 -10.972 6.072 -1.601 1.00 0.00 H new ATOM 0 H2' C A 2 -10.730 6.195 -4.062 1.00 0.00 H new ATOM 0 HO2' C A 2 -12.541 6.240 -5.398 1.00 0.00 H new ATOM 0 H1' C A 2 -12.323 8.336 -4.414 1.00 0.00 H new ATOM 0 H41 C A 2 -7.213 11.104 -1.314 1.00 0.00 H new ATOM 0 H42 C A 2 -6.921 11.297 -3.046 1.00 0.00 H new ATOM 0 H5 C A 2 -9.095 9.861 -0.446 1.00 0.00 H new ATOM 0 H6 C A 2 -11.055 8.541 -1.018 1.00 0.00 H new ATOM 64 P G A 3 -10.976 3.503 -2.096 1.00 0.00 P ATOM 65 OP1 G A 3 -11.557 2.169 -1.800 1.00 0.00 O ATOM 66 OP2 G A 3 -9.908 4.048 -1.219 1.00 0.00 O ATOM 67 O5' G A 3 -10.436 3.494 -3.594 1.00 0.00 O ATOM 68 C5' G A 3 -11.283 3.109 -4.675 1.00 0.00 C ATOM 69 C4' G A 3 -10.483 3.004 -5.951 1.00 0.00 C ATOM 70 O4' G A 3 -10.260 4.340 -6.487 1.00 0.00 O ATOM 71 C3' G A 3 -9.088 2.415 -5.798 1.00 0.00 C ATOM 72 O3' G A 3 -9.109 0.993 -5.853 1.00 0.00 O ATOM 73 C2' G A 3 -8.345 3.044 -6.967 1.00 0.00 C ATOM 74 O2' G A 3 -8.703 2.435 -8.194 1.00 0.00 O ATOM 75 C1' G A 3 -8.921 4.457 -6.937 1.00 0.00 C ATOM 76 N9 G A 3 -8.215 5.366 -6.040 1.00 0.00 N ATOM 77 C8 G A 3 -8.479 5.584 -4.710 1.00 0.00 C ATOM 78 N7 G A 3 -7.697 6.476 -4.168 1.00 0.00 N ATOM 79 C5 G A 3 -6.856 6.866 -5.202 1.00 0.00 C ATOM 80 C6 G A 3 -5.796 7.807 -5.218 1.00 0.00 C ATOM 81 O6 G A 3 -5.376 8.509 -4.292 1.00 0.00 O ATOM 82 N1 G A 3 -5.205 7.892 -6.474 1.00 0.00 N ATOM 83 C2 G A 3 -5.584 7.162 -7.572 1.00 0.00 C ATOM 84 N2 G A 3 -4.889 7.382 -8.694 1.00 0.00 N ATOM 85 N3 G A 3 -6.568 6.280 -7.572 1.00 0.00 N ATOM 86 C4 G A 3 -7.159 6.185 -6.362 1.00 0.00 C ATOM 0 H5' G A 3 -12.083 3.839 -4.798 1.00 0.00 H new ATOM 0 H5'' G A 3 -11.756 2.152 -4.454 1.00 0.00 H new ATOM 0 H4' G A 3 -11.076 2.345 -6.586 1.00 0.00 H new ATOM 0 H3' G A 3 -8.619 2.625 -4.837 1.00 0.00 H new ATOM 0 H2' G A 3 -7.261 2.964 -6.891 1.00 0.00 H new ATOM 0 HO2' G A 3 -7.946 2.479 -8.814 1.00 0.00 H new ATOM 0 H1' G A 3 -8.830 4.880 -7.938 1.00 0.00 H new ATOM 0 H8 G A 3 -9.257 5.068 -4.167 1.00 0.00 H new ATOM 0 H1 G A 3 -4.431 8.547 -6.587 1.00 0.00 H new ATOM 0 H21 G A 3 -5.121 6.871 -9.546 1.00 0.00 H new ATOM 0 H22 G A 3 -4.127 8.061 -8.697 1.00 0.00 H new ATOM 98 P G A 4 -7.918 0.152 -5.174 1.00 0.00 P ATOM 99 OP1 G A 4 -8.278 -1.286 -5.277 1.00 0.00 O ATOM 100 OP2 G A 4 -7.619 0.739 -3.842 1.00 0.00 O ATOM 101 O5' G A 4 -6.673 0.422 -6.129 1.00 0.00 O ATOM 102 C5' G A 4 -6.764 0.197 -7.535 1.00 0.00 C ATOM 103 C4' G A 4 -5.541 0.748 -8.231 1.00 0.00 C ATOM 104 O4' G A 4 -5.581 2.200 -8.177 1.00 0.00 O ATOM 105 C3' G A 4 -4.212 0.370 -7.596 1.00 0.00 C ATOM 106 O3' G A 4 -3.744 -0.881 -8.089 1.00 0.00 O ATOM 107 C2' G A 4 -3.310 1.533 -7.990 1.00 0.00 C ATOM 108 O2' G A 4 -2.861 1.407 -9.327 1.00 0.00 O ATOM 109 C1' G A 4 -4.285 2.706 -7.911 1.00 0.00 C ATOM 110 N9 G A 4 -4.314 3.371 -6.611 1.00 0.00 N ATOM 111 C8 G A 4 -5.186 3.130 -5.577 1.00 0.00 C ATOM 112 N7 G A 4 -4.988 3.901 -4.544 1.00 0.00 N ATOM 113 C5 G A 4 -3.909 4.693 -4.913 1.00 0.00 C ATOM 114 C6 G A 4 -3.236 5.715 -4.198 1.00 0.00 C ATOM 115 O6 G A 4 -3.466 6.139 -3.062 1.00 0.00 O ATOM 116 N1 G A 4 -2.194 6.258 -4.941 1.00 0.00 N ATOM 117 C2 G A 4 -1.843 5.867 -6.208 1.00 0.00 C ATOM 118 N2 G A 4 -0.807 6.512 -6.757 1.00 0.00 N ATOM 119 N3 G A 4 -2.460 4.914 -6.886 1.00 0.00 N ATOM 120 C4 G A 4 -3.478 4.374 -6.183 1.00 0.00 C ATOM 0 H5' G A 4 -7.662 0.673 -7.930 1.00 0.00 H new ATOM 0 H5'' G A 4 -6.855 -0.871 -7.735 1.00 0.00 H new ATOM 0 H4' G A 4 -5.582 0.325 -9.235 1.00 0.00 H new ATOM 0 H3' G A 4 -4.261 0.229 -6.516 1.00 0.00 H new ATOM 0 H2' G A 4 -2.417 1.615 -7.370 1.00 0.00 H new ATOM 0 HO2' G A 4 -1.895 1.241 -9.333 1.00 0.00 H new ATOM 0 H1' G A 4 -3.955 3.451 -8.635 1.00 0.00 H new ATOM 0 H8 G A 4 -5.959 2.377 -5.616 1.00 0.00 H new ATOM 0 H1 G A 4 -1.648 7.005 -4.511 1.00 0.00 H new ATOM 0 H21 G A 4 -0.495 6.269 -7.697 1.00 0.00 H new ATOM 0 H22 G A 4 -0.329 7.247 -6.235 1.00 0.00 H new ATOM 132 P U A 5 -2.695 -1.739 -7.226 1.00 0.00 P ATOM 133 OP1 U A 5 -2.760 -3.148 -7.694 1.00 0.00 O ATOM 134 OP2 U A 5 -2.925 -1.432 -5.791 1.00 0.00 O ATOM 135 O5' U A 5 -1.278 -1.138 -7.641 1.00 0.00 O ATOM 136 C5' U A 5 -0.721 -1.399 -8.927 1.00 0.00 C ATOM 137 C4' U A 5 0.384 -0.412 -9.230 1.00 0.00 C ATOM 138 O4' U A 5 -0.097 0.940 -9.000 1.00 0.00 O ATOM 139 C3' U A 5 1.618 -0.509 -8.348 1.00 0.00 C ATOM 140 O3' U A 5 2.498 -1.545 -8.774 1.00 0.00 O ATOM 141 C2' U A 5 2.226 0.878 -8.505 1.00 0.00 C ATOM 142 O2' U A 5 2.885 1.013 -9.751 1.00 0.00 O ATOM 143 C1' U A 5 0.968 1.746 -8.520 1.00 0.00 C ATOM 144 N1 U A 5 0.603 2.267 -7.194 1.00 0.00 N ATOM 145 C2 U A 5 1.247 3.409 -6.753 1.00 0.00 C ATOM 146 O2 U A 5 2.092 3.989 -7.412 1.00 0.00 O ATOM 147 N3 U A 5 0.865 3.848 -5.511 1.00 0.00 N ATOM 148 C4 U A 5 -0.078 3.281 -4.684 1.00 0.00 C ATOM 149 O4 U A 5 -0.324 3.806 -3.598 1.00 0.00 O ATOM 150 C5 U A 5 -0.698 2.105 -5.210 1.00 0.00 C ATOM 151 C6 U A 5 -0.347 1.644 -6.414 1.00 0.00 C ATOM 0 H5' U A 5 -1.498 -1.330 -9.688 1.00 0.00 H new ATOM 0 H5'' U A 5 -0.330 -2.416 -8.962 1.00 0.00 H new ATOM 0 H4' U A 5 0.658 -0.646 -10.259 1.00 0.00 H new ATOM 0 H3' U A 5 1.402 -0.770 -7.312 1.00 0.00 H new ATOM 0 H2' U A 5 2.963 1.119 -7.739 1.00 0.00 H new ATOM 0 HO2' U A 5 3.146 0.128 -10.080 1.00 0.00 H new ATOM 0 H1' U A 5 1.162 2.611 -9.154 1.00 0.00 H new ATOM 0 H3 U A 5 1.330 4.686 -5.162 1.00 0.00 H new ATOM 0 H5 U A 5 -1.451 1.589 -4.633 1.00 0.00 H new ATOM 0 H6 U A 5 -0.825 0.751 -6.789 1.00 0.00 H new ATOM 162 P G A 6 3.355 -2.365 -7.687 1.00 0.00 P ATOM 163 OP1 G A 6 4.052 -3.458 -8.411 1.00 0.00 O ATOM 164 OP2 G A 6 2.470 -2.693 -6.540 1.00 0.00 O ATOM 165 O5' G A 6 4.450 -1.319 -7.191 1.00 0.00 O ATOM 166 C5' G A 6 5.396 -0.760 -8.100 1.00 0.00 C ATOM 167 C4' G A 6 6.350 0.151 -7.363 1.00 0.00 C ATOM 168 O4' G A 6 5.684 1.424 -7.111 1.00 0.00 O ATOM 169 C3' G A 6 6.784 -0.341 -5.987 1.00 0.00 C ATOM 170 O3' G A 6 7.934 -1.177 -6.055 1.00 0.00 O ATOM 171 C2' G A 6 7.041 0.965 -5.249 1.00 0.00 C ATOM 172 O2' G A 6 8.247 1.576 -5.670 1.00 0.00 O ATOM 173 C1' G A 6 5.868 1.795 -5.756 1.00 0.00 C ATOM 174 N9 G A 6 4.622 1.545 -5.037 1.00 0.00 N ATOM 175 C8 G A 6 3.618 0.682 -5.401 1.00 0.00 C ATOM 176 N7 G A 6 2.621 0.666 -4.561 1.00 0.00 N ATOM 177 C5 G A 6 2.990 1.572 -3.577 1.00 0.00 C ATOM 178 C6 G A 6 2.312 1.973 -2.402 1.00 0.00 C ATOM 179 O6 G A 6 1.214 1.596 -1.982 1.00 0.00 O ATOM 180 N1 G A 6 3.044 2.912 -1.685 1.00 0.00 N ATOM 181 C2 G A 6 4.271 3.404 -2.052 1.00 0.00 C ATOM 182 N2 G A 6 4.815 4.308 -1.229 1.00 0.00 N ATOM 183 N3 G A 6 4.917 3.037 -3.145 1.00 0.00 N ATOM 184 C4 G A 6 4.223 2.125 -3.857 1.00 0.00 C ATOM 0 H5' G A 6 4.877 -0.202 -8.879 1.00 0.00 H new ATOM 0 H5'' G A 6 5.951 -1.557 -8.595 1.00 0.00 H new ATOM 0 H4' G A 6 7.228 0.209 -8.006 1.00 0.00 H new ATOM 0 H3' G A 6 6.047 -0.973 -5.491 1.00 0.00 H new ATOM 0 H2' G A 6 7.125 0.851 -4.168 1.00 0.00 H new ATOM 0 HO2' G A 6 8.818 0.908 -6.104 1.00 0.00 H new ATOM 0 H1' G A 6 6.098 2.851 -5.614 1.00 0.00 H new ATOM 0 H8 G A 6 3.651 0.076 -6.295 1.00 0.00 H new ATOM 0 H1 G A 6 2.637 3.263 -0.818 1.00 0.00 H new ATOM 0 H21 G A 6 5.726 4.712 -1.446 1.00 0.00 H new ATOM 0 H22 G A 6 4.319 4.593 -0.385 1.00 0.00 H new ATOM 196 P U A 7 8.150 -2.321 -4.946 1.00 0.00 P ATOM 197 OP1 U A 7 9.489 -2.921 -5.179 1.00 0.00 O ATOM 198 OP2 U A 7 6.947 -3.193 -4.932 1.00 0.00 O ATOM 199 O5' U A 7 8.196 -1.514 -3.573 1.00 0.00 O ATOM 200 C5' U A 7 9.233 -0.570 -3.315 1.00 0.00 C ATOM 201 C4' U A 7 8.834 0.348 -2.182 1.00 0.00 C ATOM 202 O4' U A 7 7.548 0.958 -2.486 1.00 0.00 O ATOM 203 C3' U A 7 8.609 -0.322 -0.836 1.00 0.00 C ATOM 204 O3' U A 7 9.831 -0.532 -0.138 1.00 0.00 O ATOM 205 C2' U A 7 7.698 0.676 -0.137 1.00 0.00 C ATOM 206 O2' U A 7 8.421 1.810 0.304 1.00 0.00 O ATOM 207 C1' U A 7 6.791 1.091 -1.293 1.00 0.00 C ATOM 208 N1 U A 7 5.577 0.268 -1.411 1.00 0.00 N ATOM 209 C2 U A 7 4.618 0.393 -0.420 1.00 0.00 C ATOM 210 O2 U A 7 4.741 1.146 0.530 1.00 0.00 O ATOM 211 N3 U A 7 3.509 -0.397 -0.584 1.00 0.00 N ATOM 212 C4 U A 7 3.263 -1.279 -1.612 1.00 0.00 C ATOM 213 O4 U A 7 2.218 -1.931 -1.612 1.00 0.00 O ATOM 214 C5 U A 7 4.298 -1.350 -2.595 1.00 0.00 C ATOM 215 C6 U A 7 5.395 -0.597 -2.468 1.00 0.00 C ATOM 0 H5' U A 7 9.434 0.015 -4.213 1.00 0.00 H new ATOM 0 H5'' U A 7 10.155 -1.092 -3.062 1.00 0.00 H new ATOM 0 H4' U A 7 9.675 1.037 -2.102 1.00 0.00 H new ATOM 0 H3' U A 7 8.179 -1.321 -0.904 1.00 0.00 H new ATOM 0 H2' U A 7 7.197 0.271 0.742 1.00 0.00 H new ATOM 0 HO2' U A 7 7.810 2.435 0.748 1.00 0.00 H new ATOM 0 H1' U A 7 6.457 2.113 -1.112 1.00 0.00 H new ATOM 0 H3 U A 7 2.788 -0.323 0.134 1.00 0.00 H new ATOM 0 H5 U A 7 4.194 -2.013 -3.441 1.00 0.00 H new ATOM 0 H6 U A 7 6.166 -0.669 -3.221 1.00 0.00 H new ATOM 226 P A A 8 9.957 -1.754 0.900 1.00 0.00 P ATOM 227 OP1 A A 8 11.406 -1.966 1.152 1.00 0.00 O ATOM 228 OP2 A A 8 9.126 -2.881 0.405 1.00 0.00 O ATOM 229 O5' A A 8 9.296 -1.193 2.236 1.00 0.00 O ATOM 230 C5' A A 8 9.767 0.010 2.842 1.00 0.00 C ATOM 231 C4' A A 8 9.064 0.237 4.160 1.00 0.00 C ATOM 232 O4' A A 8 7.739 0.784 3.898 1.00 0.00 O ATOM 233 C3' A A 8 8.821 -1.022 4.986 1.00 0.00 C ATOM 234 O3' A A 8 9.898 -1.279 5.880 1.00 0.00 O ATOM 235 C2' A A 8 7.523 -0.696 5.710 1.00 0.00 C ATOM 236 O2' A A 8 7.743 0.195 6.787 1.00 0.00 O ATOM 237 C1' A A 8 6.769 0.040 4.609 1.00 0.00 C ATOM 238 N9 A A 8 6.082 -0.842 3.665 1.00 0.00 N ATOM 239 C8 A A 8 6.522 -1.240 2.428 1.00 0.00 C ATOM 240 N7 A A 8 5.677 -2.010 1.788 1.00 0.00 N ATOM 241 C5 A A 8 4.615 -2.141 2.670 1.00 0.00 C ATOM 242 C6 A A 8 3.401 -2.839 2.586 1.00 0.00 C ATOM 243 N6 A A 8 3.035 -3.566 1.528 1.00 0.00 N ATOM 244 N1 A A 8 2.562 -2.765 3.641 1.00 0.00 N ATOM 245 C2 A A 8 2.930 -2.040 4.705 1.00 0.00 C ATOM 246 N3 A A 8 4.045 -1.343 4.903 1.00 0.00 N ATOM 247 C4 A A 8 4.854 -1.433 3.834 1.00 0.00 C ATOM 0 H5' A A 8 9.590 0.855 2.176 1.00 0.00 H new ATOM 0 H5'' A A 8 10.844 -0.051 3.001 1.00 0.00 H new ATOM 0 H4' A A 8 9.727 0.896 4.721 1.00 0.00 H new ATOM 0 H3' A A 8 8.754 -1.932 4.390 1.00 0.00 H new ATOM 0 H2' A A 8 7.025 -1.568 6.134 1.00 0.00 H new ATOM 0 HO2' A A 8 6.891 0.387 7.232 1.00 0.00 H new ATOM 0 H1' A A 8 5.994 0.650 5.073 1.00 0.00 H new ATOM 0 H8 A A 8 7.477 -0.946 2.019 1.00 0.00 H new ATOM 0 H61 A A 8 2.138 -4.051 1.528 1.00 0.00 H new ATOM 0 H62 A A 8 3.653 -3.637 0.719 1.00 0.00 H new ATOM 0 H2 A A 8 2.220 -2.018 5.518 1.00 0.00 H new ATOM 259 P A A 9 10.194 -2.785 6.360 1.00 0.00 P ATOM 260 OP1 A A 9 11.421 -2.767 7.196 1.00 0.00 O ATOM 261 OP2 A A 9 10.137 -3.661 5.161 1.00 0.00 O ATOM 262 O5' A A 9 8.956 -3.141 7.297 1.00 0.00 O ATOM 263 C5' A A 9 8.590 -2.291 8.383 1.00 0.00 C ATOM 264 C4' A A 9 7.238 -2.691 8.924 1.00 0.00 C ATOM 265 O4' A A 9 6.227 -2.397 7.923 1.00 0.00 O ATOM 266 C3' A A 9 7.081 -4.174 9.225 1.00 0.00 C ATOM 267 O3' A A 9 7.501 -4.464 10.555 1.00 0.00 O ATOM 268 C2' A A 9 5.589 -4.408 9.016 1.00 0.00 C ATOM 269 O2' A A 9 4.846 -3.990 10.145 1.00 0.00 O ATOM 270 C1' A A 9 5.290 -3.456 7.858 1.00 0.00 C ATOM 271 N9 A A 9 5.381 -4.061 6.528 1.00 0.00 N ATOM 272 C8 A A 9 6.422 -3.964 5.638 1.00 0.00 C ATOM 273 N7 A A 9 6.197 -4.559 4.492 1.00 0.00 N ATOM 274 C5 A A 9 4.930 -5.105 4.645 1.00 0.00 C ATOM 275 C6 A A 9 4.119 -5.865 3.785 1.00 0.00 C ATOM 276 N6 A A 9 4.477 -6.220 2.548 1.00 0.00 N ATOM 277 N1 A A 9 2.910 -6.254 4.243 1.00 0.00 N ATOM 278 C2 A A 9 2.554 -5.908 5.485 1.00 0.00 C ATOM 279 N3 A A 9 3.228 -5.198 6.389 1.00 0.00 N ATOM 280 C4 A A 9 4.421 -4.819 5.899 1.00 0.00 C ATOM 0 H5' A A 9 8.564 -1.253 8.050 1.00 0.00 H new ATOM 0 H5'' A A 9 9.339 -2.354 9.172 1.00 0.00 H new ATOM 0 H4' A A 9 7.133 -2.135 9.855 1.00 0.00 H new ATOM 0 H3' A A 9 7.691 -4.823 8.596 1.00 0.00 H new ATOM 0 H2' A A 9 5.337 -5.454 8.843 1.00 0.00 H new ATOM 0 HO2' A A 9 3.892 -4.149 9.986 1.00 0.00 H new ATOM 0 H1' A A 9 4.256 -3.132 7.976 1.00 0.00 H new ATOM 0 H8 A A 9 7.342 -3.445 5.862 1.00 0.00 H new ATOM 0 H61 A A 9 3.842 -6.773 1.972 1.00 0.00 H new ATOM 0 H62 A A 9 5.385 -5.938 2.179 1.00 0.00 H new ATOM 0 H2 A A 9 1.581 -6.254 5.800 1.00 0.00 H new ATOM 292 P A A 10 7.892 -5.968 10.961 1.00 0.00 P ATOM 293 OP1 A A 10 8.516 -5.911 12.307 1.00 0.00 O ATOM 294 OP2 A A 10 8.637 -6.586 9.834 1.00 0.00 O ATOM 295 O5' A A 10 6.486 -6.704 11.098 1.00 0.00 O ATOM 296 C5' A A 10 5.542 -6.302 12.089 1.00 0.00 C ATOM 297 C4' A A 10 4.409 -7.298 12.162 1.00 0.00 C ATOM 298 O4' A A 10 3.491 -7.040 11.063 1.00 0.00 O ATOM 299 C3' A A 10 4.824 -8.758 12.012 1.00 0.00 C ATOM 300 O3' A A 10 5.090 -9.349 13.280 1.00 0.00 O ATOM 301 C2' A A 10 3.622 -9.381 11.314 1.00 0.00 C ATOM 302 O2' A A 10 2.569 -9.624 12.229 1.00 0.00 O ATOM 303 C1' A A 10 3.209 -8.246 10.381 1.00 0.00 C ATOM 304 N9 A A 10 3.921 -8.225 9.103 1.00 0.00 N ATOM 305 C8 A A 10 5.158 -7.688 8.843 1.00 0.00 C ATOM 306 N7 A A 10 5.530 -7.798 7.592 1.00 0.00 N ATOM 307 C5 A A 10 4.471 -8.458 6.987 1.00 0.00 C ATOM 308 C6 A A 10 4.255 -8.879 5.667 1.00 0.00 C ATOM 309 N6 A A 10 5.131 -8.685 4.681 1.00 0.00 N ATOM 310 N1 A A 10 3.096 -9.514 5.390 1.00 0.00 N ATOM 311 C2 A A 10 2.221 -9.711 6.386 1.00 0.00 C ATOM 312 N3 A A 10 2.314 -9.366 7.669 1.00 0.00 N ATOM 313 C4 A A 10 3.476 -8.734 7.906 1.00 0.00 C ATOM 0 H5' A A 10 5.152 -5.313 11.850 1.00 0.00 H new ATOM 0 H5'' A A 10 6.032 -6.226 13.059 1.00 0.00 H new ATOM 0 H4' A A 10 3.978 -7.165 13.155 1.00 0.00 H new ATOM 0 H3' A A 10 5.748 -8.899 11.451 1.00 0.00 H new ATOM 0 H2' A A 10 3.841 -10.335 10.834 1.00 0.00 H new ATOM 0 HO2' A A 10 1.809 -10.023 11.755 1.00 0.00 H new ATOM 0 H1' A A 10 2.155 -8.382 10.138 1.00 0.00 H new ATOM 0 H8 A A 10 5.768 -7.218 9.600 1.00 0.00 H new ATOM 0 H61 A A 10 4.919 -9.014 3.739 1.00 0.00 H new ATOM 0 H62 A A 10 6.013 -8.208 4.869 1.00 0.00 H new ATOM 0 H2 A A 10 1.311 -10.222 6.109 1.00 0.00 H new ATOM 325 P A A 11 6.118 -10.582 13.389 1.00 0.00 P ATOM 326 OP1 A A 11 6.313 -10.898 14.826 1.00 0.00 O ATOM 327 OP2 A A 11 7.295 -10.265 12.541 1.00 0.00 O ATOM 328 O5' A A 11 5.334 -11.792 12.712 1.00 0.00 O ATOM 329 C5' A A 11 4.019 -12.144 13.138 1.00 0.00 C ATOM 330 C4' A A 11 3.433 -13.182 12.211 1.00 0.00 C ATOM 331 O4' A A 11 3.076 -12.547 10.954 1.00 0.00 O ATOM 332 C3' A A 11 4.380 -14.305 11.817 1.00 0.00 C ATOM 333 O3' A A 11 4.379 -15.344 12.792 1.00 0.00 O ATOM 334 C2' A A 11 3.820 -14.752 10.472 1.00 0.00 C ATOM 335 O2' A A 11 2.679 -15.575 10.633 1.00 0.00 O ATOM 336 C1' A A 11 3.378 -13.416 9.876 1.00 0.00 C ATOM 337 N9 A A 11 4.395 -12.776 9.041 1.00 0.00 N ATOM 338 C8 A A 11 5.366 -11.887 9.431 1.00 0.00 C ATOM 339 N7 A A 11 6.129 -11.474 8.449 1.00 0.00 N ATOM 340 C5 A A 11 5.631 -12.139 7.337 1.00 0.00 C ATOM 341 C6 A A 11 6.008 -12.132 5.983 1.00 0.00 C ATOM 342 N6 A A 11 7.015 -11.402 5.500 1.00 0.00 N ATOM 343 N1 A A 11 5.306 -12.909 5.131 1.00 0.00 N ATOM 344 C2 A A 11 4.294 -13.642 5.617 1.00 0.00 C ATOM 345 N3 A A 11 3.846 -13.732 6.868 1.00 0.00 N ATOM 346 C4 A A 11 4.564 -12.947 7.688 1.00 0.00 C ATOM 0 H5' A A 11 3.384 -11.258 13.152 1.00 0.00 H new ATOM 0 H5'' A A 11 4.050 -12.531 14.157 1.00 0.00 H new ATOM 0 H4' A A 11 2.597 -13.604 12.769 1.00 0.00 H new ATOM 0 H3' A A 11 5.426 -14.005 11.753 1.00 0.00 H new ATOM 0 H2' A A 11 4.532 -15.326 9.879 1.00 0.00 H new ATOM 0 HO2' A A 11 2.886 -16.484 10.332 1.00 0.00 H new ATOM 0 H1' A A 11 2.521 -13.612 9.231 1.00 0.00 H new ATOM 0 H8 A A 11 5.489 -11.559 10.452 1.00 0.00 H new ATOM 0 H61 A A 11 7.241 -11.439 4.506 1.00 0.00 H new ATOM 0 H62 A A 11 7.559 -10.807 6.125 1.00 0.00 H new ATOM 0 H2 A A 11 3.768 -14.245 4.892 1.00 0.00 H new ATOM 358 P G A 12 5.735 -16.149 13.108 1.00 0.00 P ATOM 359 OP1 G A 12 5.575 -16.776 14.445 1.00 0.00 O ATOM 360 OP2 G A 12 6.894 -15.255 12.852 1.00 0.00 O ATOM 361 O5' G A 12 5.754 -17.311 12.018 1.00 0.00 O ATOM 362 C5' G A 12 4.646 -18.197 11.871 1.00 0.00 C ATOM 363 C4' G A 12 4.554 -18.683 10.444 1.00 0.00 C ATOM 364 O4' G A 12 4.422 -17.535 9.566 1.00 0.00 O ATOM 365 C3' G A 12 5.780 -19.421 9.926 1.00 0.00 C ATOM 366 O3' G A 12 5.753 -20.812 10.254 1.00 0.00 O ATOM 367 C2' G A 12 5.705 -19.188 8.421 1.00 0.00 C ATOM 368 O2' G A 12 4.801 -20.087 7.806 1.00 0.00 O ATOM 369 C1' G A 12 5.111 -17.780 8.354 1.00 0.00 C ATOM 370 N9 G A 12 6.112 -16.733 8.174 1.00 0.00 N ATOM 371 C8 G A 12 6.709 -15.973 9.149 1.00 0.00 C ATOM 372 N7 G A 12 7.567 -15.111 8.677 1.00 0.00 N ATOM 373 C5 G A 12 7.537 -15.317 7.304 1.00 0.00 C ATOM 374 C6 G A 12 8.260 -14.681 6.263 1.00 0.00 C ATOM 375 O6 G A 12 9.096 -13.775 6.346 1.00 0.00 O ATOM 376 N1 G A 12 7.926 -15.202 5.017 1.00 0.00 N ATOM 377 C2 G A 12 7.013 -16.203 4.801 1.00 0.00 C ATOM 378 N2 G A 12 6.823 -16.565 3.528 1.00 0.00 N ATOM 379 N3 G A 12 6.335 -16.805 5.761 1.00 0.00 N ATOM 380 C4 G A 12 6.645 -16.316 6.979 1.00 0.00 C ATOM 0 H5' G A 12 3.724 -17.687 12.150 1.00 0.00 H new ATOM 0 H5'' G A 12 4.757 -19.046 12.546 1.00 0.00 H new ATOM 0 H4' G A 12 3.707 -19.369 10.445 1.00 0.00 H new ATOM 0 H3' G A 12 6.709 -19.064 10.370 1.00 0.00 H new ATOM 0 H2' G A 12 6.665 -19.318 7.921 1.00 0.00 H new ATOM 0 HO2' G A 12 4.710 -20.890 8.361 1.00 0.00 H new ATOM 0 HO3' G A 12 6.557 -21.247 9.901 1.00 0.00 H new ATOM 0 H1' G A 12 4.454 -17.746 7.485 1.00 0.00 H new ATOM 0 H8 G A 12 6.490 -16.078 10.201 1.00 0.00 H new ATOM 0 H1 G A 12 8.396 -14.810 4.201 1.00 0.00 H new ATOM 0 H21 G A 12 6.157 -17.304 3.302 1.00 0.00 H new ATOM 0 H22 G A 12 7.344 -16.102 2.783 1.00 0.00 H new TER 393 G A 12 ATOM 394 O5' C B 1 12.320 -12.197 -1.549 1.00 0.00 O ATOM 395 C5' C B 1 12.539 -13.346 -2.373 1.00 0.00 C ATOM 396 C4' C B 1 11.379 -14.308 -2.270 1.00 0.00 C ATOM 397 O4' C B 1 11.505 -15.061 -1.032 1.00 0.00 O ATOM 398 C3' C B 1 10.003 -13.657 -2.200 1.00 0.00 C ATOM 399 O3' C B 1 9.461 -13.448 -3.500 1.00 0.00 O ATOM 400 C2' C B 1 9.196 -14.663 -1.389 1.00 0.00 C ATOM 401 O2' C B 1 8.788 -15.756 -2.190 1.00 0.00 O ATOM 402 C1' C B 1 10.245 -15.151 -0.393 1.00 0.00 C ATOM 403 N1 C B 1 10.299 -14.369 0.854 1.00 0.00 N ATOM 404 C2 C B 1 9.475 -14.740 1.919 1.00 0.00 C ATOM 405 O2 C B 1 8.713 -15.708 1.780 1.00 0.00 O ATOM 406 N3 C B 1 9.526 -14.036 3.072 1.00 0.00 N ATOM 407 C4 C B 1 10.355 -12.996 3.182 1.00 0.00 C ATOM 408 N4 C B 1 10.371 -12.329 4.337 1.00 0.00 N ATOM 409 C5 C B 1 11.204 -12.592 2.111 1.00 0.00 C ATOM 410 C6 C B 1 11.144 -13.299 0.976 1.00 0.00 C ATOM 0 H5' C B 1 13.460 -13.846 -2.071 1.00 0.00 H new ATOM 0 H5'' C B 1 12.670 -13.036 -3.410 1.00 0.00 H new ATOM 0 H4' C B 1 11.432 -14.907 -3.179 1.00 0.00 H new ATOM 0 H3' C B 1 10.011 -12.664 -1.750 1.00 0.00 H new ATOM 0 H2' C B 1 8.290 -14.242 -0.954 1.00 0.00 H new ATOM 0 HO2' C B 1 8.273 -16.387 -1.645 1.00 0.00 H new ATOM 0 HO5' C B 1 13.083 -11.587 -1.628 1.00 0.00 H new ATOM 0 H1' C B 1 9.978 -16.168 -0.107 1.00 0.00 H new ATOM 0 H41 C B 1 10.993 -11.529 4.455 1.00 0.00 H new ATOM 0 H42 C B 1 9.762 -12.619 5.102 1.00 0.00 H new ATOM 0 H5 C B 1 11.870 -11.748 2.211 1.00 0.00 H new ATOM 0 H6 C B 1 11.772 -13.021 0.143 1.00 0.00 H new ATOM 423 P U B 2 8.315 -12.342 -3.718 1.00 0.00 P ATOM 424 OP1 U B 2 8.081 -12.224 -5.179 1.00 0.00 O ATOM 425 OP2 U B 2 8.676 -11.132 -2.934 1.00 0.00 O ATOM 426 O5' U B 2 7.021 -12.991 -3.053 1.00 0.00 O ATOM 427 C5' U B 2 6.365 -14.106 -3.654 1.00 0.00 C ATOM 428 C4' U B 2 5.160 -14.507 -2.833 1.00 0.00 C ATOM 429 O4' U B 2 5.614 -15.047 -1.560 1.00 0.00 O ATOM 430 C3' U B 2 4.221 -13.372 -2.449 1.00 0.00 C ATOM 431 O3' U B 2 3.270 -13.100 -3.474 1.00 0.00 O ATOM 432 C2' U B 2 3.573 -13.903 -1.177 1.00 0.00 C ATOM 433 O2' U B 2 2.575 -14.865 -1.464 1.00 0.00 O ATOM 434 C1' U B 2 4.759 -14.606 -0.520 1.00 0.00 C ATOM 435 N1 U B 2 5.528 -13.734 0.380 1.00 0.00 N ATOM 436 C2 U B 2 5.211 -13.753 1.726 1.00 0.00 C ATOM 437 O2 U B 2 4.332 -14.458 2.189 1.00 0.00 O ATOM 438 N3 U B 2 5.962 -12.916 2.511 1.00 0.00 N ATOM 439 C4 U B 2 6.978 -12.082 2.098 1.00 0.00 C ATOM 440 O4 U B 2 7.566 -11.388 2.927 1.00 0.00 O ATOM 441 C5 U B 2 7.246 -12.122 0.695 1.00 0.00 C ATOM 442 C6 U B 2 6.531 -12.922 -0.100 1.00 0.00 C ATOM 0 H5' U B 2 7.056 -14.945 -3.733 1.00 0.00 H new ATOM 0 H5'' U B 2 6.055 -13.852 -4.668 1.00 0.00 H new ATOM 0 H4' U B 2 4.622 -15.207 -3.472 1.00 0.00 H new ATOM 0 H3' U B 2 4.725 -12.416 -2.304 1.00 0.00 H new ATOM 0 H2' U B 2 3.087 -13.129 -0.583 1.00 0.00 H new ATOM 0 HO2' U B 2 1.727 -14.588 -1.058 1.00 0.00 H new ATOM 0 H1' U B 2 4.373 -15.424 0.089 1.00 0.00 H new ATOM 0 H3 U B 2 5.745 -12.910 3.508 1.00 0.00 H new ATOM 0 H5 U B 2 8.028 -11.505 0.277 1.00 0.00 H new ATOM 0 H6 U B 2 6.747 -12.932 -1.158 1.00 0.00 H new HETATM 453 P SUR B 3 2.451 -11.715 -3.456 1.00 0.00 P HETATM 454 OP1 SUR B 3 1.708 -11.597 -4.736 1.00 0.00 O HETATM 455 OP2 SUR B 3 3.394 -10.641 -3.053 1.00 0.00 O HETATM 456 O5' SUR B 3 1.396 -11.907 -2.276 1.00 0.00 O HETATM 457 C5' SUR B 3 0.275 -12.776 -2.425 1.00 0.00 C HETATM 458 C4' SUR B 3 -0.426 -12.959 -1.098 1.00 0.00 C HETATM 459 O4' SUR B 3 0.561 -13.289 -0.081 1.00 0.00 O HETATM 460 C3' SUR B 3 -1.137 -11.725 -0.558 1.00 0.00 C HETATM 461 C1' SUR B 3 0.256 -12.607 1.124 1.00 0.00 C HETATM 462 N1 SUR B 3 1.332 -11.652 1.397 1.00 0.00 N HETATM 463 C2' SUR B 3 -1.118 -11.965 0.946 1.00 0.00 C HETATM 464 C6 SUR B 3 2.178 -11.227 0.397 1.00 0.00 C HETATM 465 C2 SUR B 3 1.481 -11.200 2.697 1.00 0.00 C HETATM 466 C5 SUR B 3 3.190 -10.388 0.624 1.00 0.00 C HETATM 467 S2 SUR B 3 0.322 -11.454 3.872 1.00 0.00 S HETATM 468 N3 SUR B 3 2.529 -10.333 2.890 1.00 0.00 N HETATM 469 C4 SUR B 3 3.421 -9.884 1.939 1.00 0.00 C HETATM 470 O4 SUR B 3 4.320 -9.111 2.269 1.00 0.00 O HETATM 471 O2' SUR B 3 -2.105 -12.900 1.337 1.00 0.00 O HETATM 472 O3' SUR B 3 -2.459 -11.619 -1.079 1.00 0.00 O HETATM 0 H5'2 SUR B 3 -0.419 -12.363 -3.157 1.00 0.00 H new HETATM 0 H5'1 SUR B 3 0.604 -13.743 -2.807 1.00 0.00 H new HETATM 0 HO2 SUR B 3 -2.030 -13.072 2.299 1.00 0.00 H new HETATM 0 HN3 SUR B 3 2.662 -9.984 3.839 1.00 0.00 H new HETATM 0 HC6 SUR B 3 2.015 -11.590 -0.618 1.00 0.00 H new HETATM 0 HC5 SUR B 3 3.842 -10.087 -0.196 1.00 0.00 H new HETATM 0 H4' SUR B 3 -1.168 -13.733 -1.291 1.00 0.00 H new HETATM 0 H3' SUR B 3 -0.665 -10.784 -0.840 1.00 0.00 H new HETATM 0 H2' SUR B 3 -1.303 -11.062 1.527 1.00 0.00 H new HETATM 0 H1' SUR B 3 0.200 -13.265 1.991 1.00 0.00 H new ATOM 483 P U B 4 -3.130 -10.170 -1.272 1.00 0.00 P ATOM 484 OP1 U B 4 -4.425 -10.368 -1.970 1.00 0.00 O ATOM 485 OP2 U B 4 -2.117 -9.253 -1.854 1.00 0.00 O ATOM 486 O5' U B 4 -3.438 -9.687 0.215 1.00 0.00 O ATOM 487 C5' U B 4 -4.183 -10.504 1.114 1.00 0.00 C ATOM 488 C4' U B 4 -3.995 -10.018 2.531 1.00 0.00 C ATOM 489 O4' U B 4 -2.632 -10.306 2.947 1.00 0.00 O ATOM 490 C3' U B 4 -4.154 -8.517 2.725 1.00 0.00 C ATOM 491 O3' U B 4 -5.514 -8.166 2.958 1.00 0.00 O ATOM 492 C2' U B 4 -3.261 -8.239 3.928 1.00 0.00 C ATOM 493 O2' U B 4 -3.892 -8.603 5.142 1.00 0.00 O ATOM 494 C1' U B 4 -2.109 -9.209 3.673 1.00 0.00 C ATOM 495 N1 U B 4 -0.994 -8.634 2.905 1.00 0.00 N ATOM 496 C2 U B 4 -0.008 -7.968 3.608 1.00 0.00 C ATOM 497 O2 U B 4 -0.043 -7.814 4.816 1.00 0.00 O ATOM 498 N3 U B 4 1.023 -7.486 2.843 1.00 0.00 N ATOM 499 C4 U B 4 1.169 -7.598 1.481 1.00 0.00 C ATOM 500 O4 U B 4 2.174 -7.133 0.940 1.00 0.00 O ATOM 501 C5 U B 4 0.105 -8.288 0.825 1.00 0.00 C ATOM 502 C6 U B 4 -0.921 -8.765 1.536 1.00 0.00 C ATOM 0 H5' U B 4 -3.858 -11.541 1.030 1.00 0.00 H new ATOM 0 H5'' U B 4 -5.240 -10.479 0.850 1.00 0.00 H new ATOM 0 H4' U B 4 -4.769 -10.528 3.105 1.00 0.00 H new ATOM 0 H3' U B 4 -3.874 -7.928 1.852 1.00 0.00 H new ATOM 0 H2' U B 4 -2.990 -7.188 4.025 1.00 0.00 H new ATOM 0 HO2' U B 4 -3.292 -8.413 5.893 1.00 0.00 H new ATOM 0 H1' U B 4 -1.700 -9.490 4.644 1.00 0.00 H new ATOM 0 H3 U B 4 1.763 -6.990 3.339 1.00 0.00 H new ATOM 0 H5 U B 4 0.129 -8.424 -0.246 1.00 0.00 H new ATOM 0 H6 U B 4 -1.722 -9.272 1.018 1.00 0.00 H new ATOM 513 P U B 5 -6.000 -6.652 2.722 1.00 0.00 P ATOM 514 OP1 U B 5 -7.445 -6.595 3.060 1.00 0.00 O ATOM 515 OP2 U B 5 -5.543 -6.213 1.378 1.00 0.00 O ATOM 516 O5' U B 5 -5.200 -5.818 3.817 1.00 0.00 O ATOM 517 C5' U B 5 -5.441 -6.011 5.210 1.00 0.00 C ATOM 518 C4' U B 5 -4.536 -5.115 6.021 1.00 0.00 C ATOM 519 O4' U B 5 -3.168 -5.580 5.883 1.00 0.00 O ATOM 520 C3' U B 5 -4.496 -3.662 5.570 1.00 0.00 C ATOM 521 O3' U B 5 -5.547 -2.908 6.164 1.00 0.00 O ATOM 522 C2' U B 5 -3.116 -3.204 6.029 1.00 0.00 C ATOM 523 O2' U B 5 -3.104 -2.888 7.408 1.00 0.00 O ATOM 524 C1' U B 5 -2.289 -4.472 5.818 1.00 0.00 C ATOM 525 N1 U B 5 -1.585 -4.511 4.528 1.00 0.00 N ATOM 526 C2 U B 5 -0.307 -3.990 4.481 1.00 0.00 C ATOM 527 O2 U B 5 0.245 -3.500 5.450 1.00 0.00 O ATOM 528 N3 U B 5 0.305 -4.065 3.257 1.00 0.00 N ATOM 529 C4 U B 5 -0.212 -4.602 2.102 1.00 0.00 C ATOM 530 O4 U B 5 0.474 -4.608 1.079 1.00 0.00 O ATOM 531 C5 U B 5 -1.537 -5.119 2.230 1.00 0.00 C ATOM 532 C6 U B 5 -2.171 -5.052 3.405 1.00 0.00 C ATOM 0 H5' U B 5 -5.267 -7.054 5.476 1.00 0.00 H new ATOM 0 H5'' U B 5 -6.484 -5.793 5.440 1.00 0.00 H new ATOM 0 H4' U B 5 -4.939 -5.160 7.033 1.00 0.00 H new ATOM 0 H3' U B 5 -4.644 -3.530 4.498 1.00 0.00 H new ATOM 0 H2' U B 5 -2.767 -2.315 5.504 1.00 0.00 H new ATOM 0 HO2' U B 5 -2.257 -2.451 7.636 1.00 0.00 H new ATOM 0 H1' U B 5 -1.524 -4.495 6.594 1.00 0.00 H new ATOM 0 H3 U B 5 1.248 -3.680 3.196 1.00 0.00 H new ATOM 0 H5 U B 5 -2.027 -5.564 1.377 1.00 0.00 H new ATOM 0 H6 U B 5 -3.178 -5.436 3.476 1.00 0.00 H new ATOM 543 P A B 6 -5.912 -1.455 5.583 1.00 0.00 P ATOM 544 OP1 A B 6 -7.001 -0.904 6.430 1.00 0.00 O ATOM 545 OP2 A B 6 -6.114 -1.574 4.116 1.00 0.00 O ATOM 546 O5' A B 6 -4.596 -0.594 5.840 1.00 0.00 O ATOM 547 C5' A B 6 -4.197 -0.238 7.163 1.00 0.00 C ATOM 548 C4' A B 6 -2.850 0.446 7.136 1.00 0.00 C ATOM 549 O4' A B 6 -1.896 -0.419 6.470 1.00 0.00 O ATOM 550 C3' A B 6 -2.801 1.750 6.354 1.00 0.00 C ATOM 551 O3' A B 6 -3.188 2.846 7.177 1.00 0.00 O ATOM 552 C2' A B 6 -1.343 1.836 5.911 1.00 0.00 C ATOM 553 O2' A B 6 -0.524 2.372 6.934 1.00 0.00 O ATOM 554 C1' A B 6 -0.983 0.361 5.721 1.00 0.00 C ATOM 555 N9 A B 6 -1.035 -0.088 4.329 1.00 0.00 N ATOM 556 C8 A B 6 -2.108 -0.615 3.654 1.00 0.00 C ATOM 557 N7 A B 6 -1.840 -0.953 2.416 1.00 0.00 N ATOM 558 C5 A B 6 -0.503 -0.616 2.261 1.00 0.00 C ATOM 559 C6 A B 6 0.382 -0.720 1.172 1.00 0.00 C ATOM 560 N6 A B 6 0.041 -1.216 -0.019 1.00 0.00 N ATOM 561 N1 A B 6 1.649 -0.291 1.350 1.00 0.00 N ATOM 562 C2 A B 6 1.995 0.211 2.542 1.00 0.00 C ATOM 563 N3 A B 6 1.257 0.361 3.639 1.00 0.00 N ATOM 564 C4 A B 6 0.004 -0.077 3.430 1.00 0.00 C ATOM 0 H5' A B 6 -4.148 -1.130 7.788 1.00 0.00 H new ATOM 0 H5'' A B 6 -4.940 0.423 7.609 1.00 0.00 H new ATOM 0 H4' A B 6 -2.630 0.656 8.183 1.00 0.00 H new ATOM 0 H3' A B 6 -3.488 1.783 5.508 1.00 0.00 H new ATOM 0 H2' A B 6 -1.203 2.469 5.035 1.00 0.00 H new ATOM 0 HO2' A B 6 -0.204 3.259 6.666 1.00 0.00 H new ATOM 0 H1' A B 6 0.047 0.242 6.056 1.00 0.00 H new ATOM 0 H8 A B 6 -3.083 -0.740 4.102 1.00 0.00 H new ATOM 0 H61 A B 6 0.731 -1.264 -0.768 1.00 0.00 H new ATOM 0 H62 A B 6 -0.910 -1.547 -0.180 1.00 0.00 H new ATOM 0 H2 A B 6 3.020 0.542 2.625 1.00 0.00 H new ATOM 576 P A B 7 -3.628 4.238 6.503 1.00 0.00 P ATOM 577 OP1 A B 7 -4.426 4.983 7.510 1.00 0.00 O ATOM 578 OP2 A B 7 -4.212 3.958 5.167 1.00 0.00 O ATOM 579 O5' A B 7 -2.252 5.014 6.289 1.00 0.00 O ATOM 580 C5' A B 7 -1.540 5.568 7.393 1.00 0.00 C ATOM 581 C4' A B 7 -0.231 6.158 6.924 1.00 0.00 C ATOM 582 O4' A B 7 0.609 5.081 6.420 1.00 0.00 O ATOM 583 C3' A B 7 -0.342 7.147 5.769 1.00 0.00 C ATOM 584 O3' A B 7 -0.545 8.479 6.235 1.00 0.00 O ATOM 585 C2' A B 7 0.993 6.975 5.056 1.00 0.00 C ATOM 586 O2' A B 7 2.042 7.640 5.734 1.00 0.00 O ATOM 587 C1' A B 7 1.202 5.470 5.195 1.00 0.00 C ATOM 588 N9 A B 7 0.591 4.694 4.117 1.00 0.00 N ATOM 589 C8 A B 7 -0.719 4.301 4.000 1.00 0.00 C ATOM 590 N7 A B 7 -0.969 3.612 2.915 1.00 0.00 N ATOM 591 C5 A B 7 0.259 3.544 2.273 1.00 0.00 C ATOM 592 C6 A B 7 0.662 2.948 1.068 1.00 0.00 C ATOM 593 N6 A B 7 -0.164 2.276 0.265 1.00 0.00 N ATOM 594 N1 A B 7 1.959 3.066 0.711 1.00 0.00 N ATOM 595 C2 A B 7 2.787 3.740 1.522 1.00 0.00 C ATOM 596 N3 A B 7 2.526 4.344 2.679 1.00 0.00 N ATOM 597 C4 A B 7 1.229 4.207 3.002 1.00 0.00 C ATOM 0 H5' A B 7 -1.353 4.796 8.139 1.00 0.00 H new ATOM 0 H5'' A B 7 -2.143 6.338 7.875 1.00 0.00 H new ATOM 0 H4' A B 7 0.166 6.685 7.792 1.00 0.00 H new ATOM 0 H3' A B 7 -1.196 6.964 5.117 1.00 0.00 H new ATOM 0 H2' A B 7 0.991 7.370 4.040 1.00 0.00 H new ATOM 0 HO2' A B 7 2.882 7.506 5.248 1.00 0.00 H new ATOM 0 H1' A B 7 2.273 5.271 5.154 1.00 0.00 H new ATOM 0 H8 A B 7 -1.474 4.538 4.735 1.00 0.00 H new ATOM 0 H61 A B 7 0.188 1.864 -0.599 1.00 0.00 H new ATOM 0 H62 A B 7 -1.148 2.174 0.515 1.00 0.00 H new ATOM 0 H2 A B 7 3.812 3.802 1.189 1.00 0.00 H new HETATM 609 N1 PSU B 8 -1.197 6.992 1.433 1.00 0.00 N HETATM 610 C2 PSU B 8 -1.183 6.087 0.391 1.00 0.00 C HETATM 611 N3 PSU B 8 0.023 5.962 -0.250 1.00 0.00 N HETATM 612 C4 PSU B 8 1.190 6.632 0.042 1.00 0.00 C HETATM 613 C5 PSU B 8 1.093 7.550 1.135 1.00 0.00 C HETATM 614 C6 PSU B 8 -0.070 7.699 1.779 1.00 0.00 C HETATM 615 O2 PSU B 8 -2.160 5.440 0.066 1.00 0.00 O HETATM 616 O4 PSU B 8 2.199 6.407 -0.628 1.00 0.00 O HETATM 617 C1' PSU B 8 2.292 8.300 1.513 1.00 0.00 C HETATM 618 C2' PSU B 8 2.408 9.659 0.823 1.00 0.00 C HETATM 619 O2' PSU B 8 3.781 9.965 0.666 1.00 0.00 O HETATM 620 C3' PSU B 8 1.742 10.568 1.848 1.00 0.00 C HETATM 621 C4' PSU B 8 2.196 9.963 3.168 1.00 0.00 C HETATM 622 O3' PSU B 8 2.153 11.927 1.730 1.00 0.00 O HETATM 623 O4' PSU B 8 2.254 8.534 2.911 1.00 0.00 O HETATM 624 C5' PSU B 8 1.281 10.216 4.344 1.00 0.00 C HETATM 625 O5' PSU B 8 -0.016 9.685 4.081 1.00 0.00 O HETATM 626 P PSU B 8 -1.116 9.599 5.231 1.00 0.00 P HETATM 627 OP1 PSU B 8 -1.140 10.898 5.950 1.00 0.00 O HETATM 628 OP2 PSU B 8 -2.368 9.069 4.634 1.00 0.00 O HETATM 0 HO2' PSU B 8 4.098 9.616 -0.193 1.00 0.00 H new HETATM 0 H5'' PSU B 8 1.695 9.757 5.242 1.00 0.00 H new HETATM 0 HN3 PSU B 8 0.059 5.302 -1.027 1.00 0.00 H new HETATM 0 HN1 PSU B 8 -2.060 7.139 1.956 1.00 0.00 H new HETATM 0 H6 PSU B 8 -0.126 8.406 2.607 1.00 0.00 H new HETATM 0 H5' PSU B 8 1.212 11.287 4.537 1.00 0.00 H new HETATM 0 H4' PSU B 8 3.141 10.421 3.459 1.00 0.00 H new HETATM 0 H3' PSU B 8 0.659 10.611 1.730 1.00 0.00 H new HETATM 0 H2' PSU B 8 1.961 9.734 -0.168 1.00 0.00 H new HETATM 0 H1' PSU B 8 3.147 7.698 1.206 1.00 0.00 H new ATOM 639 P C B 9 1.305 12.942 0.815 1.00 0.00 P ATOM 640 OP1 C B 9 1.854 14.303 1.037 1.00 0.00 O ATOM 641 OP2 C B 9 -0.141 12.688 1.042 1.00 0.00 O ATOM 642 O5' C B 9 1.659 12.501 -0.675 1.00 0.00 O ATOM 643 C5' C B 9 3.012 12.439 -1.120 1.00 0.00 C ATOM 644 C4' C B 9 3.064 11.982 -2.558 1.00 0.00 C ATOM 645 O4' C B 9 2.882 10.539 -2.603 1.00 0.00 O ATOM 646 C3' C B 9 1.964 12.543 -3.449 1.00 0.00 C ATOM 647 O3' C B 9 2.339 13.801 -3.999 1.00 0.00 O ATOM 648 C2' C B 9 1.801 11.454 -4.501 1.00 0.00 C ATOM 649 O2' C B 9 2.833 11.502 -5.468 1.00 0.00 O ATOM 650 C1' C B 9 1.988 10.200 -3.650 1.00 0.00 C ATOM 651 N1 C B 9 0.741 9.696 -3.049 1.00 0.00 N ATOM 652 C2 C B 9 0.015 8.708 -3.722 1.00 0.00 C ATOM 653 O2 C B 9 0.434 8.289 -4.811 1.00 0.00 O ATOM 654 N3 C B 9 -1.125 8.235 -3.169 1.00 0.00 N ATOM 655 C4 C B 9 -1.543 8.711 -1.994 1.00 0.00 C ATOM 656 N4 C B 9 -2.670 8.215 -1.484 1.00 0.00 N ATOM 657 C5 C B 9 -0.824 9.717 -1.288 1.00 0.00 C ATOM 658 C6 C B 9 0.299 10.180 -1.849 1.00 0.00 C ATOM 0 H5' C B 9 3.579 11.752 -0.491 1.00 0.00 H new ATOM 0 H5'' C B 9 3.480 13.419 -1.024 1.00 0.00 H new ATOM 0 H4' C B 9 4.028 12.333 -2.926 1.00 0.00 H new ATOM 0 H3' C B 9 1.031 12.755 -2.927 1.00 0.00 H new ATOM 0 H2' C B 9 0.864 11.525 -5.053 1.00 0.00 H new ATOM 0 HO2' C B 9 2.698 10.789 -6.126 1.00 0.00 H new ATOM 0 H1' C B 9 2.361 9.408 -4.300 1.00 0.00 H new ATOM 0 H41 C B 9 -3.018 8.556 -0.588 1.00 0.00 H new ATOM 0 H42 C B 9 -3.185 7.494 -1.990 1.00 0.00 H new ATOM 0 H5 C B 9 -1.172 10.092 -0.337 1.00 0.00 H new ATOM 0 H6 C B 9 0.866 10.949 -1.345 1.00 0.00 H new ATOM 670 P U B 10 1.209 14.888 -4.351 1.00 0.00 P ATOM 671 OP1 U B 10 1.895 16.184 -4.583 1.00 0.00 O ATOM 672 OP2 U B 10 0.133 14.800 -3.330 1.00 0.00 O ATOM 673 O5' U B 10 0.619 14.379 -5.741 1.00 0.00 O ATOM 674 C5' U B 10 1.480 14.106 -6.844 1.00 0.00 C ATOM 675 C4' U B 10 0.760 13.262 -7.868 1.00 0.00 C ATOM 676 O4' U B 10 0.544 11.931 -7.317 1.00 0.00 O ATOM 677 C3' U B 10 -0.628 13.755 -8.250 1.00 0.00 C ATOM 678 O3' U B 10 -0.570 14.704 -9.309 1.00 0.00 O ATOM 679 C2' U B 10 -1.332 12.466 -8.650 1.00 0.00 C ATOM 680 O2' U B 10 -0.918 12.035 -9.933 1.00 0.00 O ATOM 681 C1' U B 10 -0.777 11.503 -7.604 1.00 0.00 C ATOM 682 N1 U B 10 -1.539 11.477 -6.345 1.00 0.00 N ATOM 683 C2 U B 10 -2.543 10.534 -6.212 1.00 0.00 C ATOM 684 O2 U B 10 -2.837 9.743 -7.093 1.00 0.00 O ATOM 685 N3 U B 10 -3.194 10.551 -5.005 1.00 0.00 N ATOM 686 C4 U B 10 -2.954 11.392 -3.942 1.00 0.00 C ATOM 687 O4 U B 10 -3.610 11.264 -2.909 1.00 0.00 O ATOM 688 C5 U B 10 -1.911 12.341 -4.161 1.00 0.00 C ATOM 689 C6 U B 10 -1.256 12.358 -5.325 1.00 0.00 C ATOM 0 H5' U B 10 2.374 13.587 -6.498 1.00 0.00 H new ATOM 0 H5'' U B 10 1.809 15.041 -7.298 1.00 0.00 H new ATOM 0 H4' U B 10 1.399 13.296 -8.750 1.00 0.00 H new ATOM 0 H3' U B 10 -1.146 14.287 -7.452 1.00 0.00 H new ATOM 0 H2' U B 10 -2.418 12.552 -8.690 1.00 0.00 H new ATOM 0 HO2' U B 10 -1.384 11.205 -10.165 1.00 0.00 H new ATOM 0 H1' U B 10 -0.832 10.495 -8.014 1.00 0.00 H new ATOM 0 H3 U B 10 -3.938 9.865 -4.881 1.00 0.00 H new ATOM 0 H5 U B 10 -1.651 13.046 -3.385 1.00 0.00 H new ATOM 0 H6 U B 10 -0.475 13.090 -5.472 1.00 0.00 H new ATOM 700 P G B 11 -1.697 15.845 -9.423 1.00 0.00 P ATOM 701 OP1 G B 11 -1.197 16.904 -10.336 1.00 0.00 O ATOM 702 OP2 G B 11 -2.122 16.205 -8.045 1.00 0.00 O ATOM 703 O5' G B 11 -2.916 15.106 -10.133 1.00 0.00 O ATOM 704 C5' G B 11 -2.737 14.410 -11.364 1.00 0.00 C ATOM 705 C4' G B 11 -4.007 13.687 -11.743 1.00 0.00 C ATOM 706 O4' G B 11 -4.106 12.465 -10.961 1.00 0.00 O ATOM 707 C3' G B 11 -5.295 14.445 -11.447 1.00 0.00 C ATOM 708 O3' G B 11 -5.651 15.302 -12.527 1.00 0.00 O ATOM 709 C2' G B 11 -6.299 13.319 -11.236 1.00 0.00 C ATOM 710 O2' G B 11 -6.715 12.766 -12.470 1.00 0.00 O ATOM 711 C1' G B 11 -5.435 12.295 -10.503 1.00 0.00 C ATOM 712 N9 G B 11 -5.439 12.444 -9.051 1.00 0.00 N ATOM 713 C8 G B 11 -4.616 13.245 -8.297 1.00 0.00 C ATOM 714 N7 G B 11 -4.841 13.154 -7.015 1.00 0.00 N ATOM 715 C5 G B 11 -5.884 12.243 -6.916 1.00 0.00 C ATOM 716 C6 G B 11 -6.564 11.746 -5.776 1.00 0.00 C ATOM 717 O6 G B 11 -6.372 12.017 -4.586 1.00 0.00 O ATOM 718 N1 G B 11 -7.561 10.844 -6.128 1.00 0.00 N ATOM 719 C2 G B 11 -7.864 10.465 -7.411 1.00 0.00 C ATOM 720 N2 G B 11 -8.855 9.579 -7.548 1.00 0.00 N ATOM 721 N3 G B 11 -7.240 10.921 -8.483 1.00 0.00 N ATOM 722 C4 G B 11 -6.268 11.800 -8.164 1.00 0.00 C ATOM 0 H5' G B 11 -1.918 13.697 -11.271 1.00 0.00 H new ATOM 0 H5'' G B 11 -2.461 15.112 -12.151 1.00 0.00 H new ATOM 0 H4' G B 11 -3.928 13.538 -12.820 1.00 0.00 H new ATOM 0 H3' G B 11 -5.228 15.114 -10.589 1.00 0.00 H new ATOM 0 H2' G B 11 -7.206 13.633 -10.719 1.00 0.00 H new ATOM 0 HO2' G B 11 -6.535 13.404 -13.192 1.00 0.00 H new ATOM 0 H1' G B 11 -5.845 11.307 -10.715 1.00 0.00 H new ATOM 0 H8 G B 11 -3.858 13.886 -8.723 1.00 0.00 H new ATOM 0 H1 G B 11 -8.110 10.432 -5.374 1.00 0.00 H new ATOM 0 H21 G B 11 -9.127 9.258 -8.477 1.00 0.00 H new ATOM 0 H22 G B 11 -9.339 9.224 -6.723 1.00 0.00 H new ATOM 734 P C B 12 -6.069 16.828 -12.234 1.00 0.00 P ATOM 735 OP1 C B 12 -5.899 17.581 -13.502 1.00 0.00 O ATOM 736 OP2 C B 12 -5.371 17.291 -11.007 1.00 0.00 O ATOM 737 O5' C B 12 -7.628 16.742 -11.916 1.00 0.00 O ATOM 738 C5' C B 12 -8.527 16.101 -12.819 1.00 0.00 C ATOM 739 C4' C B 12 -9.642 15.428 -12.053 1.00 0.00 C ATOM 740 O4' C B 12 -9.070 14.448 -11.148 1.00 0.00 O ATOM 741 C3' C B 12 -10.458 16.342 -11.151 1.00 0.00 C ATOM 742 O3' C B 12 -11.500 17.015 -11.863 1.00 0.00 O ATOM 743 C2' C B 12 -11.002 15.375 -10.105 1.00 0.00 C ATOM 744 O2' C B 12 -12.127 14.672 -10.597 1.00 0.00 O ATOM 745 C1' C B 12 -9.838 14.392 -9.959 1.00 0.00 C ATOM 746 N1 C B 12 -8.956 14.689 -8.818 1.00 0.00 N ATOM 747 C2 C B 12 -9.323 14.234 -7.549 1.00 0.00 C ATOM 748 O2 C B 12 -10.375 13.592 -7.424 1.00 0.00 O ATOM 749 N3 C B 12 -8.524 14.503 -6.493 1.00 0.00 N ATOM 750 C4 C B 12 -7.397 15.194 -6.669 1.00 0.00 C ATOM 751 N4 C B 12 -6.641 15.436 -5.599 1.00 0.00 N ATOM 752 C5 C B 12 -6.995 15.668 -7.952 1.00 0.00 C ATOM 753 C6 C B 12 -7.799 15.397 -8.988 1.00 0.00 C ATOM 0 H5' C B 12 -7.990 15.364 -13.417 1.00 0.00 H new ATOM 0 H5'' C B 12 -8.942 16.833 -13.512 1.00 0.00 H new ATOM 0 H4' C B 12 -10.293 15.023 -12.828 1.00 0.00 H new ATOM 0 H3' C B 12 -9.874 17.155 -10.720 1.00 0.00 H new ATOM 0 H2' C B 12 -11.317 15.869 -9.186 1.00 0.00 H new ATOM 0 HO2' C B 12 -12.584 15.217 -11.272 1.00 0.00 H new ATOM 0 HO3' C B 12 -12.000 17.589 -11.246 1.00 0.00 H new ATOM 0 H1' C B 12 -10.263 13.404 -9.780 1.00 0.00 H new ATOM 0 H41 C B 12 -5.772 15.962 -5.697 1.00 0.00 H new ATOM 0 H42 C B 12 -6.931 15.096 -4.682 1.00 0.00 H new ATOM 0 H5 C B 12 -6.078 16.224 -8.083 1.00 0.00 H new ATOM 0 H6 C B 12 -7.529 15.744 -9.975 1.00 0.00 H new TER 766 C B 12