USER MOD reduce.3.24.130724 H: found=0, std=0, add=136, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 136 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 C O2' : rot 12:sc= 0.23 USER MOD Single : A 1 C O5' : rot 55:sc= -0.0837! USER MOD Single : A 2 G O2' : rot -29:sc= 0.224 USER MOD Single : A 3 C O2' : rot 135:sc= 0.787 USER MOD Single : A 4 G O2' : rot -11:sc= 0.229 USER MOD Single : A 5 C O2' : rot 17:sc= 0.0585 USER MOD Single : A 6 G O2' : rot -19:sc= 0.133 USER MOD Single : A 6 G O3' : rot 180:sc= 0.127 USER MOD Single : B 7 C O2' : rot 13:sc= 0.231 USER MOD Single : B 7 C O5' : rot 61:sc= -0.087! USER MOD Single : B 8 G O2' : rot -33:sc= 0.2 USER MOD Single : B 9 C O2' : rot 134:sc= 0.798 USER MOD Single : B 10 G O2' : rot -19:sc= 0.257 USER MOD Single : B 11 C O2' : rot 27:sc= -0.0357 USER MOD Single : B 12 G O2' : rot -23:sc= 0.131 USER MOD Single : B 12 G O3' : rot 180:sc= 0.147 USER MOD ----------------------------------------------------------------- ATOM 1 O5' C A 1 21.220 -3.714 6.706 1.00 0.00 O ATOM 2 C5' C A 1 20.030 -3.185 7.300 1.00 0.00 C ATOM 3 C4' C A 1 18.796 -3.818 6.702 1.00 0.00 C ATOM 4 O4' C A 1 18.601 -3.296 5.365 1.00 0.00 O ATOM 5 C3' C A 1 18.847 -5.329 6.521 1.00 0.00 C ATOM 6 O3' C A 1 17.543 -5.901 6.529 1.00 0.00 O ATOM 7 C2' C A 1 19.530 -5.486 5.165 1.00 0.00 C ATOM 8 O2' C A 1 19.065 -6.641 4.493 1.00 0.00 O ATOM 9 C1' C A 1 19.021 -4.254 4.410 1.00 0.00 C ATOM 10 N1 C A 1 20.047 -3.631 3.559 1.00 0.00 N ATOM 11 C2 C A 1 20.185 -4.062 2.236 1.00 0.00 C ATOM 12 O2 C A 1 19.426 -4.943 1.806 1.00 0.00 O ATOM 13 N3 C A 1 21.142 -3.507 1.459 1.00 0.00 N ATOM 14 C4 C A 1 21.938 -2.559 1.957 1.00 0.00 C ATOM 15 N4 C A 1 22.870 -2.042 1.156 1.00 0.00 N ATOM 16 C5 C A 1 21.814 -2.096 3.298 1.00 0.00 C ATOM 17 C6 C A 1 20.861 -2.652 4.054 1.00 0.00 C ATOM 0 H5' C A 1 19.996 -2.105 7.154 1.00 0.00 H new ATOM 0 H5'' C A 1 20.048 -3.361 8.376 1.00 0.00 H new ATOM 0 H4' C A 1 18.006 -3.583 7.415 1.00 0.00 H new ATOM 0 H3' C A 1 19.375 -5.842 7.325 1.00 0.00 H new ATOM 0 H2' C A 1 20.614 -5.575 5.243 1.00 0.00 H new ATOM 0 HO2' C A 1 18.271 -6.988 4.950 1.00 0.00 H new ATOM 0 HO5' C A 1 21.174 -3.610 5.733 1.00 0.00 H new ATOM 0 H1' C A 1 18.210 -4.581 3.759 1.00 0.00 H new ATOM 0 H41 C A 1 23.496 -1.315 1.504 1.00 0.00 H new ATOM 0 H42 C A 1 22.957 -2.373 0.195 1.00 0.00 H new ATOM 0 H5 C A 1 22.463 -1.327 3.689 1.00 0.00 H new ATOM 0 H6 C A 1 20.733 -2.321 5.074 1.00 0.00 H new ATOM 30 P G A 2 16.684 -5.911 7.889 1.00 0.00 P ATOM 31 OP1 G A 2 17.614 -6.179 9.015 1.00 0.00 O ATOM 32 OP2 G A 2 15.506 -6.792 7.683 1.00 0.00 O ATOM 33 O5' G A 2 16.166 -4.409 8.016 1.00 0.00 O ATOM 34 C5' G A 2 15.578 -3.742 6.901 1.00 0.00 C ATOM 35 C4' G A 2 15.558 -2.252 7.132 1.00 0.00 C ATOM 36 O4' G A 2 16.890 -1.724 7.011 1.00 0.00 O ATOM 37 C3' G A 2 14.790 -1.430 6.108 1.00 0.00 C ATOM 38 O3' G A 2 13.390 -1.438 6.370 1.00 0.00 O ATOM 39 C2' G A 2 15.385 -0.032 6.281 1.00 0.00 C ATOM 40 O2' G A 2 14.687 0.693 7.275 1.00 0.00 O ATOM 41 C1' G A 2 16.793 -0.336 6.805 1.00 0.00 C ATOM 42 N9 G A 2 17.854 0.076 5.894 1.00 0.00 N ATOM 43 C8 G A 2 18.834 1.003 6.139 1.00 0.00 C ATOM 44 N7 G A 2 19.638 1.185 5.127 1.00 0.00 N ATOM 45 C5 G A 2 19.162 0.315 4.154 1.00 0.00 C ATOM 46 C6 G A 2 19.626 0.065 2.837 1.00 0.00 C ATOM 47 O6 G A 2 20.579 0.581 2.243 1.00 0.00 O ATOM 48 N1 G A 2 18.854 -0.899 2.200 1.00 0.00 N ATOM 49 C2 G A 2 17.777 -1.543 2.756 1.00 0.00 C ATOM 50 N2 G A 2 17.175 -2.457 1.990 1.00 0.00 N ATOM 51 N3 G A 2 17.329 -1.313 3.976 1.00 0.00 N ATOM 52 C4 G A 2 18.065 -0.381 4.615 1.00 0.00 C ATOM 0 H5' G A 2 14.563 -4.106 6.745 1.00 0.00 H new ATOM 0 H5'' G A 2 16.140 -3.969 5.995 1.00 0.00 H new ATOM 0 H4' G A 2 15.090 -2.165 8.113 1.00 0.00 H new ATOM 0 H3' G A 2 14.883 -1.815 5.093 1.00 0.00 H new ATOM 0 H2' G A 2 15.350 0.558 5.365 1.00 0.00 H new ATOM 0 HO2' G A 2 13.759 0.382 7.315 1.00 0.00 H new ATOM 0 H1' G A 2 16.930 0.232 7.725 1.00 0.00 H new ATOM 0 H8 G A 2 18.931 1.530 7.076 1.00 0.00 H new ATOM 0 H1 G A 2 19.108 -1.148 1.244 1.00 0.00 H new ATOM 0 H21 G A 2 16.369 -2.970 2.346 1.00 0.00 H new ATOM 0 H22 G A 2 17.522 -2.642 1.049 1.00 0.00 H new ATOM 64 P C A 3 12.408 -2.340 5.472 1.00 0.00 P ATOM 65 OP1 C A 3 11.024 -1.880 5.756 1.00 0.00 O ATOM 66 OP2 C A 3 12.756 -3.770 5.657 1.00 0.00 O ATOM 67 O5' C A 3 12.754 -1.935 3.971 1.00 0.00 O ATOM 68 C5' C A 3 11.736 -1.916 2.975 1.00 0.00 C ATOM 69 C4' C A 3 12.264 -1.312 1.699 1.00 0.00 C ATOM 70 O4' C A 3 12.961 -0.075 2.015 1.00 0.00 O ATOM 71 C3' C A 3 13.276 -2.178 0.942 1.00 0.00 C ATOM 72 O3' C A 3 12.902 -2.353 -0.419 1.00 0.00 O ATOM 73 C2' C A 3 14.587 -1.406 1.060 1.00 0.00 C ATOM 74 O2' C A 3 15.365 -1.527 -0.115 1.00 0.00 O ATOM 75 C1' C A 3 14.077 0.023 1.173 1.00 0.00 C ATOM 76 N1 C A 3 15.057 0.960 1.744 1.00 0.00 N ATOM 77 C2 C A 3 15.992 1.531 0.885 1.00 0.00 C ATOM 78 O2 C A 3 15.941 1.262 -0.323 1.00 0.00 O ATOM 79 N3 C A 3 16.929 2.364 1.380 1.00 0.00 N ATOM 80 C4 C A 3 16.945 2.649 2.680 1.00 0.00 C ATOM 81 N4 C A 3 17.898 3.472 3.116 1.00 0.00 N ATOM 82 C5 C A 3 15.990 2.099 3.585 1.00 0.00 C ATOM 83 C6 C A 3 15.074 1.259 3.079 1.00 0.00 C ATOM 0 H5' C A 3 10.881 -1.342 3.331 1.00 0.00 H new ATOM 0 H5'' C A 3 11.383 -2.930 2.787 1.00 0.00 H new ATOM 0 H4' C A 3 11.386 -1.183 1.066 1.00 0.00 H new ATOM 0 H3' C A 3 13.344 -3.186 1.352 1.00 0.00 H new ATOM 0 H2' C A 3 15.220 -1.748 1.879 1.00 0.00 H new ATOM 0 HO2' C A 3 15.712 -0.647 -0.369 1.00 0.00 H new ATOM 0 H1' C A 3 13.855 0.425 0.184 1.00 0.00 H new ATOM 0 H41 C A 3 17.947 3.717 4.105 1.00 0.00 H new ATOM 0 H42 C A 3 18.578 3.857 2.461 1.00 0.00 H new ATOM 0 H5 C A 3 16.003 2.349 4.636 1.00 0.00 H new ATOM 0 H6 C A 3 14.340 0.813 3.734 1.00 0.00 H new ATOM 95 P G A 4 11.645 -3.281 -0.787 1.00 0.00 P ATOM 96 OP1 G A 4 11.683 -4.465 0.108 1.00 0.00 O ATOM 97 OP2 G A 4 11.633 -3.477 -2.259 1.00 0.00 O ATOM 98 O5' G A 4 10.383 -2.395 -0.382 1.00 0.00 O ATOM 99 C5' G A 4 10.009 -1.251 -1.147 1.00 0.00 C ATOM 100 C4' G A 4 9.149 -0.328 -0.320 1.00 0.00 C ATOM 101 O4' G A 4 9.855 0.018 0.893 1.00 0.00 O ATOM 102 C3' G A 4 8.855 1.017 -0.964 1.00 0.00 C ATOM 103 O3' G A 4 7.713 0.943 -1.813 1.00 0.00 O ATOM 104 C2' G A 4 8.616 1.949 0.226 1.00 0.00 C ATOM 105 O2' G A 4 7.246 1.986 0.573 1.00 0.00 O ATOM 106 C1' G A 4 9.388 1.265 1.359 1.00 0.00 C ATOM 107 N9 G A 4 10.531 2.048 1.820 1.00 0.00 N ATOM 108 C8 G A 4 10.762 2.517 3.091 1.00 0.00 C ATOM 109 N7 G A 4 11.874 3.192 3.196 1.00 0.00 N ATOM 110 C5 G A 4 12.409 3.172 1.916 1.00 0.00 C ATOM 111 C6 G A 4 13.607 3.742 1.407 1.00 0.00 C ATOM 112 O6 G A 4 14.470 4.403 2.006 1.00 0.00 O ATOM 113 N1 G A 4 13.758 3.480 0.050 1.00 0.00 N ATOM 114 C2 G A 4 12.877 2.764 -0.719 1.00 0.00 C ATOM 115 N2 G A 4 13.202 2.622 -2.009 1.00 0.00 N ATOM 116 N3 G A 4 11.762 2.226 -0.261 1.00 0.00 N ATOM 117 C4 G A 4 11.592 2.468 1.055 1.00 0.00 C ATOM 0 H5' G A 4 9.466 -1.563 -2.039 1.00 0.00 H new ATOM 0 H5'' G A 4 10.901 -0.723 -1.485 1.00 0.00 H new ATOM 0 H4' G A 4 8.219 -0.879 -0.177 1.00 0.00 H new ATOM 0 H3' G A 4 9.665 1.364 -1.606 1.00 0.00 H new ATOM 0 H2' G A 4 8.924 2.974 0.020 1.00 0.00 H new ATOM 0 HO2' G A 4 6.719 1.551 -0.129 1.00 0.00 H new ATOM 0 H1' G A 4 8.706 1.155 2.202 1.00 0.00 H new ATOM 0 H8 G A 4 10.091 2.344 3.919 1.00 0.00 H new ATOM 0 H1 G A 4 14.590 3.850 -0.410 1.00 0.00 H new ATOM 0 H21 G A 4 12.589 2.100 -2.635 1.00 0.00 H new ATOM 0 H22 G A 4 14.063 3.036 -2.366 1.00 0.00 H new ATOM 129 P C A 5 7.902 0.893 -3.409 1.00 0.00 P ATOM 130 OP1 C A 5 6.545 0.787 -4.005 1.00 0.00 O ATOM 131 OP2 C A 5 8.927 -0.130 -3.737 1.00 0.00 O ATOM 132 O5' C A 5 8.496 2.327 -3.772 1.00 0.00 O ATOM 133 C5' C A 5 8.002 3.066 -4.886 1.00 0.00 C ATOM 134 C4' C A 5 9.044 4.053 -5.356 1.00 0.00 C ATOM 135 O4' C A 5 9.279 5.021 -4.291 1.00 0.00 O ATOM 136 C3' C A 5 10.413 3.451 -5.667 1.00 0.00 C ATOM 137 O3' C A 5 11.066 4.137 -6.733 1.00 0.00 O ATOM 138 C2' C A 5 11.160 3.631 -4.353 1.00 0.00 C ATOM 139 O2' C A 5 12.558 3.710 -4.558 1.00 0.00 O ATOM 140 C1' C A 5 10.644 5.001 -3.934 1.00 0.00 C ATOM 141 N1 C A 5 10.761 5.295 -2.498 1.00 0.00 N ATOM 142 C2 C A 5 11.798 6.124 -2.075 1.00 0.00 C ATOM 143 O2 C A 5 12.585 6.571 -2.918 1.00 0.00 O ATOM 144 N3 C A 5 11.919 6.420 -0.763 1.00 0.00 N ATOM 145 C4 C A 5 11.046 5.925 0.112 1.00 0.00 C ATOM 146 N4 C A 5 11.201 6.247 1.395 1.00 0.00 N ATOM 147 C5 C A 5 9.974 5.077 -0.289 1.00 0.00 C ATOM 148 C6 C A 5 9.877 4.780 -1.592 1.00 0.00 C ATOM 0 H5' C A 5 7.090 3.593 -4.607 1.00 0.00 H new ATOM 0 H5'' C A 5 7.742 2.386 -5.697 1.00 0.00 H new ATOM 0 H4' C A 5 8.640 4.475 -6.277 1.00 0.00 H new ATOM 0 H3' C A 5 10.358 2.415 -6.000 1.00 0.00 H new ATOM 0 H2' C A 5 11.007 2.819 -3.642 1.00 0.00 H new ATOM 0 HO2' C A 5 12.740 3.898 -5.502 1.00 0.00 H new ATOM 0 H1' C A 5 11.251 5.759 -4.430 1.00 0.00 H new ATOM 0 H41 C A 5 10.551 5.886 2.093 1.00 0.00 H new ATOM 0 H42 C A 5 11.970 6.854 1.679 1.00 0.00 H new ATOM 0 H5 C A 5 9.267 4.689 0.429 1.00 0.00 H new ATOM 0 H6 C A 5 9.089 4.124 -1.931 1.00 0.00 H new ATOM 160 P G A 6 10.704 3.774 -8.257 1.00 0.00 P ATOM 161 OP1 G A 6 10.635 2.295 -8.365 1.00 0.00 O ATOM 162 OP2 G A 6 11.623 4.532 -9.144 1.00 0.00 O ATOM 163 O5' G A 6 9.233 4.351 -8.453 1.00 0.00 O ATOM 164 C5' G A 6 8.961 5.744 -8.304 1.00 0.00 C ATOM 165 C4' G A 6 7.475 5.968 -8.166 1.00 0.00 C ATOM 166 O4' G A 6 7.045 5.486 -6.869 1.00 0.00 O ATOM 167 C3' G A 6 7.024 7.421 -8.188 1.00 0.00 C ATOM 168 O3' G A 6 6.866 7.925 -9.519 1.00 0.00 O ATOM 169 C2' G A 6 5.697 7.373 -7.436 1.00 0.00 C ATOM 170 O2' G A 6 4.644 6.962 -8.288 1.00 0.00 O ATOM 171 C1' G A 6 5.954 6.263 -6.413 1.00 0.00 C ATOM 172 N9 G A 6 6.270 6.757 -5.077 1.00 0.00 N ATOM 173 C8 G A 6 5.456 6.726 -3.971 1.00 0.00 C ATOM 174 N7 G A 6 6.019 7.224 -2.904 1.00 0.00 N ATOM 175 C5 G A 6 7.279 7.616 -3.333 1.00 0.00 C ATOM 176 C6 G A 6 8.342 8.229 -2.622 1.00 0.00 C ATOM 177 O6 G A 6 8.385 8.554 -1.430 1.00 0.00 O ATOM 178 N1 G A 6 9.441 8.459 -3.442 1.00 0.00 N ATOM 179 C2 G A 6 9.509 8.142 -4.776 1.00 0.00 C ATOM 180 N2 G A 6 10.657 8.441 -5.395 1.00 0.00 N ATOM 181 N3 G A 6 8.526 7.575 -5.453 1.00 0.00 N ATOM 182 C4 G A 6 7.449 7.340 -4.674 1.00 0.00 C ATOM 0 H5' G A 6 9.341 6.291 -9.167 1.00 0.00 H new ATOM 0 H5'' G A 6 9.479 6.132 -7.427 1.00 0.00 H new ATOM 0 H4' G A 6 7.048 5.452 -9.026 1.00 0.00 H new ATOM 0 H3' G A 6 7.752 8.097 -7.738 1.00 0.00 H new ATOM 0 H2' G A 6 5.409 8.338 -7.018 1.00 0.00 H new ATOM 0 HO2' G A 6 4.912 7.087 -9.222 1.00 0.00 H new ATOM 0 HO3' G A 6 6.574 8.860 -9.482 1.00 0.00 H new ATOM 0 H1' G A 6 5.033 5.685 -6.329 1.00 0.00 H new ATOM 0 H8 G A 6 4.451 6.330 -3.983 1.00 0.00 H new ATOM 0 H1 G A 6 10.260 8.897 -3.020 1.00 0.00 H new ATOM 0 H21 G A 6 10.772 8.231 -6.387 1.00 0.00 H new ATOM 0 H22 G A 6 11.418 8.879 -4.875 1.00 0.00 H new TER 195 G A 6 ATOM 196 O5' C B 7 14.247 13.667 -0.234 1.00 0.00 O ATOM 197 C5' C B 7 15.649 13.430 -0.401 1.00 0.00 C ATOM 198 C4' C B 7 15.951 12.904 -1.785 1.00 0.00 C ATOM 199 O4' C B 7 15.478 11.537 -1.881 1.00 0.00 O ATOM 200 C3' C B 7 15.264 13.630 -2.933 1.00 0.00 C ATOM 201 O3' C B 7 16.009 13.513 -4.142 1.00 0.00 O ATOM 202 C2' C B 7 13.911 12.929 -3.025 1.00 0.00 C ATOM 203 O2' C B 7 13.443 12.899 -4.359 1.00 0.00 O ATOM 204 C1' C B 7 14.265 11.499 -2.608 1.00 0.00 C ATOM 205 N1 C B 7 13.239 10.876 -1.756 1.00 0.00 N ATOM 206 C2 C B 7 12.189 10.178 -2.359 1.00 0.00 C ATOM 207 O2 C B 7 12.161 10.080 -3.595 1.00 0.00 O ATOM 208 N3 C B 7 11.231 9.628 -1.580 1.00 0.00 N ATOM 209 C4 C B 7 11.297 9.753 -0.252 1.00 0.00 C ATOM 210 N4 C B 7 10.326 9.202 0.474 1.00 0.00 N ATOM 211 C5 C B 7 12.362 10.449 0.387 1.00 0.00 C ATOM 212 C6 C B 7 13.305 10.985 -0.396 1.00 0.00 C ATOM 0 H5' C B 7 15.991 12.714 0.346 1.00 0.00 H new ATOM 0 H5'' C B 7 16.200 14.355 -0.232 1.00 0.00 H new ATOM 0 H4' C B 7 17.028 13.034 -1.890 1.00 0.00 H new ATOM 0 H3' C B 7 15.171 14.704 -2.770 1.00 0.00 H new ATOM 0 H2' C B 7 13.140 13.415 -2.427 1.00 0.00 H new ATOM 0 HO2' C B 7 14.170 13.150 -4.966 1.00 0.00 H new ATOM 0 HO5' C B 7 13.757 12.826 -0.348 1.00 0.00 H new ATOM 0 H1' C B 7 14.343 10.903 -3.517 1.00 0.00 H new ATOM 0 H41 C B 7 10.344 9.278 1.491 1.00 0.00 H new ATOM 0 H42 C B 7 9.564 8.704 0.013 1.00 0.00 H new ATOM 0 H5 C B 7 12.407 10.541 1.462 1.00 0.00 H new ATOM 0 H6 C B 7 14.132 11.513 0.055 1.00 0.00 H new ATOM 225 P G B 8 17.430 14.254 -4.279 1.00 0.00 P ATOM 226 OP1 G B 8 17.316 15.583 -3.626 1.00 0.00 O ATOM 227 OP2 G B 8 17.861 14.166 -5.697 1.00 0.00 O ATOM 228 O5' G B 8 18.407 13.350 -3.402 1.00 0.00 O ATOM 229 C5' G B 8 18.473 11.940 -3.604 1.00 0.00 C ATOM 230 C4' G B 8 19.147 11.273 -2.433 1.00 0.00 C ATOM 231 O4' G B 8 18.302 11.349 -1.272 1.00 0.00 O ATOM 232 C3' G B 8 19.378 9.776 -2.564 1.00 0.00 C ATOM 233 O3' G B 8 20.531 9.488 -3.350 1.00 0.00 O ATOM 234 C2' G B 8 19.563 9.337 -1.111 1.00 0.00 C ATOM 235 O2' G B 8 20.915 9.461 -0.714 1.00 0.00 O ATOM 236 C1' G B 8 18.737 10.379 -0.348 1.00 0.00 C ATOM 237 N9 G B 8 17.568 9.820 0.321 1.00 0.00 N ATOM 238 C8 G B 8 17.318 9.815 1.668 1.00 0.00 C ATOM 239 N7 G B 8 16.200 9.222 1.984 1.00 0.00 N ATOM 240 C5 G B 8 15.675 8.816 0.763 1.00 0.00 C ATOM 241 C6 G B 8 14.476 8.118 0.464 1.00 0.00 C ATOM 242 O6 G B 8 13.609 7.702 1.241 1.00 0.00 O ATOM 243 N1 G B 8 14.332 7.917 -0.905 1.00 0.00 N ATOM 244 C2 G B 8 15.223 8.334 -1.861 1.00 0.00 C ATOM 245 N2 G B 8 14.897 8.067 -3.128 1.00 0.00 N ATOM 246 N3 G B 8 16.346 8.974 -1.595 1.00 0.00 N ATOM 247 C4 G B 8 16.507 9.182 -0.273 1.00 0.00 C ATOM 0 H5' G B 8 19.022 11.723 -4.520 1.00 0.00 H new ATOM 0 H5'' G B 8 17.468 11.537 -3.732 1.00 0.00 H new ATOM 0 H4' G B 8 20.099 11.800 -2.373 1.00 0.00 H new ATOM 0 H3' G B 8 18.564 9.258 -3.071 1.00 0.00 H new ATOM 0 H2' G B 8 19.272 8.300 -0.942 1.00 0.00 H new ATOM 0 HO2' G B 8 21.499 9.281 -1.480 1.00 0.00 H new ATOM 0 H1' G B 8 19.376 10.798 0.429 1.00 0.00 H new ATOM 0 H8 G B 8 17.981 10.258 2.396 1.00 0.00 H new ATOM 0 H1 G B 8 13.499 7.421 -1.223 1.00 0.00 H new ATOM 0 H21 G B 8 15.518 8.351 -3.885 1.00 0.00 H new ATOM 0 H22 G B 8 14.027 7.579 -3.339 1.00 0.00 H new ATOM 259 P C B 9 20.362 8.983 -4.868 1.00 0.00 P ATOM 260 OP1 C B 9 21.698 8.509 -5.313 1.00 0.00 O ATOM 261 OP2 C B 9 19.658 10.028 -5.652 1.00 0.00 O ATOM 262 O5' C B 9 19.405 7.717 -4.761 1.00 0.00 O ATOM 263 C5' C B 9 19.579 6.604 -5.631 1.00 0.00 C ATOM 264 C4' C B 9 18.675 5.471 -5.215 1.00 0.00 C ATOM 265 O4' C B 9 18.805 5.267 -3.782 1.00 0.00 O ATOM 266 C3' C B 9 17.183 5.712 -5.469 1.00 0.00 C ATOM 267 O3' C B 9 16.597 4.643 -6.201 1.00 0.00 O ATOM 268 C2' C B 9 16.582 5.824 -4.071 1.00 0.00 C ATOM 269 O2' C B 9 15.287 5.254 -4.019 1.00 0.00 O ATOM 270 C1' C B 9 17.539 4.952 -3.271 1.00 0.00 C ATOM 271 N1 C B 9 17.503 5.211 -1.823 1.00 0.00 N ATOM 272 C2 C B 9 16.528 4.566 -1.068 1.00 0.00 C ATOM 273 O2 C B 9 15.757 3.778 -1.633 1.00 0.00 O ATOM 274 N3 C B 9 16.442 4.806 0.255 1.00 0.00 N ATOM 275 C4 C B 9 17.297 5.643 0.835 1.00 0.00 C ATOM 276 N4 C B 9 17.162 5.848 2.144 1.00 0.00 N ATOM 277 C5 C B 9 18.324 6.305 0.098 1.00 0.00 C ATOM 278 C6 C B 9 18.386 6.067 -1.222 1.00 0.00 C ATOM 0 H5' C B 9 20.618 6.276 -5.610 1.00 0.00 H new ATOM 0 H5'' C B 9 19.358 6.897 -6.657 1.00 0.00 H new ATOM 0 H4' C B 9 18.990 4.620 -5.818 1.00 0.00 H new ATOM 0 H3' C B 9 17.005 6.602 -6.073 1.00 0.00 H new ATOM 0 H2' C B 9 16.476 6.852 -3.724 1.00 0.00 H new ATOM 0 HO2' C B 9 15.211 4.686 -3.224 1.00 0.00 H new ATOM 0 H1' C B 9 17.269 3.901 -3.372 1.00 0.00 H new ATOM 0 H41 C B 9 17.797 6.482 2.629 1.00 0.00 H new ATOM 0 H42 C B 9 16.424 5.371 2.661 1.00 0.00 H new ATOM 0 H5 C B 9 19.023 6.971 0.582 1.00 0.00 H new ATOM 0 H6 C B 9 19.142 6.557 -1.817 1.00 0.00 H new ATOM 290 P G B 10 16.935 4.465 -7.761 1.00 0.00 P ATOM 291 OP1 G B 10 17.016 5.822 -8.361 1.00 0.00 O ATOM 292 OP2 G B 10 15.988 3.470 -8.325 1.00 0.00 O ATOM 293 O5' G B 10 18.399 3.835 -7.768 1.00 0.00 O ATOM 294 C5' G B 10 18.627 2.493 -7.343 1.00 0.00 C ATOM 295 C4' G B 10 20.072 2.307 -6.952 1.00 0.00 C ATOM 296 O4' G B 10 20.417 3.281 -5.940 1.00 0.00 O ATOM 297 C3' G B 10 20.387 0.972 -6.297 1.00 0.00 C ATOM 298 O3' G B 10 20.680 -0.022 -7.275 1.00 0.00 O ATOM 299 C2' G B 10 21.601 1.272 -5.416 1.00 0.00 C ATOM 300 O2' G B 10 22.807 1.040 -6.116 1.00 0.00 O ATOM 301 C1' G B 10 21.473 2.775 -5.151 1.00 0.00 C ATOM 302 N9 G B 10 21.193 3.082 -3.752 1.00 0.00 N ATOM 303 C8 G B 10 21.948 3.855 -2.902 1.00 0.00 C ATOM 304 N7 G B 10 21.444 3.944 -1.702 1.00 0.00 N ATOM 305 C5 G B 10 20.285 3.178 -1.761 1.00 0.00 C ATOM 306 C6 G B 10 19.315 2.893 -0.762 1.00 0.00 C ATOM 307 O6 G B 10 19.281 3.274 0.418 1.00 0.00 O ATOM 308 N1 G B 10 18.306 2.073 -1.254 1.00 0.00 N ATOM 309 C2 G B 10 18.235 1.590 -2.535 1.00 0.00 C ATOM 310 N2 G B 10 17.182 0.814 -2.815 1.00 0.00 N ATOM 311 N3 G B 10 19.126 1.847 -3.473 1.00 0.00 N ATOM 312 C4 G B 10 20.118 2.642 -3.021 1.00 0.00 C ATOM 0 H5' G B 10 18.368 1.801 -8.145 1.00 0.00 H new ATOM 0 H5'' G B 10 17.981 2.257 -6.497 1.00 0.00 H new ATOM 0 H4' G B 10 20.623 2.395 -7.889 1.00 0.00 H new ATOM 0 H3' G B 10 19.549 0.574 -5.725 1.00 0.00 H new ATOM 0 H2' G B 10 21.625 0.652 -4.520 1.00 0.00 H new ATOM 0 HO2' G B 10 22.632 0.460 -6.886 1.00 0.00 H new ATOM 0 H1' G B 10 22.428 3.235 -5.404 1.00 0.00 H new ATOM 0 H8 G B 10 22.866 4.340 -3.198 1.00 0.00 H new ATOM 0 H1 G B 10 17.559 1.810 -0.611 1.00 0.00 H new ATOM 0 H21 G B 10 17.071 0.423 -3.751 1.00 0.00 H new ATOM 0 H22 G B 10 16.490 0.613 -2.093 1.00 0.00 H new ATOM 324 P C B 11 19.591 -1.156 -7.618 1.00 0.00 P ATOM 325 OP1 C B 11 20.188 -2.027 -8.663 1.00 0.00 O ATOM 326 OP2 C B 11 18.283 -0.501 -7.871 1.00 0.00 O ATOM 327 O5' C B 11 19.476 -1.998 -6.272 1.00 0.00 O ATOM 328 C5' C B 11 19.424 -3.422 -6.299 1.00 0.00 C ATOM 329 C4' C B 11 18.784 -3.942 -5.036 1.00 0.00 C ATOM 330 O4' C B 11 19.611 -3.549 -3.902 1.00 0.00 O ATOM 331 C3' C B 11 17.394 -3.381 -4.738 1.00 0.00 C ATOM 332 O3' C B 11 16.561 -4.343 -4.100 1.00 0.00 O ATOM 333 C2' C B 11 17.699 -2.209 -3.816 1.00 0.00 C ATOM 334 O2' C B 11 16.606 -1.926 -2.962 1.00 0.00 O ATOM 335 C1' C B 11 18.831 -2.806 -2.990 1.00 0.00 C ATOM 336 N1 C B 11 19.694 -1.826 -2.314 1.00 0.00 N ATOM 337 C2 C B 11 19.489 -1.592 -0.957 1.00 0.00 C ATOM 338 O2 C B 11 18.587 -2.206 -0.374 1.00 0.00 O ATOM 339 N3 C B 11 20.278 -0.708 -0.310 1.00 0.00 N ATOM 340 C4 C B 11 21.244 -0.073 -0.969 1.00 0.00 C ATOM 341 N4 C B 11 21.999 0.786 -0.287 1.00 0.00 N ATOM 342 C5 C B 11 21.478 -0.290 -2.357 1.00 0.00 C ATOM 343 C6 C B 11 20.678 -1.160 -2.989 1.00 0.00 C ATOM 0 H5' C B 11 20.430 -3.828 -6.400 1.00 0.00 H new ATOM 0 H5'' C B 11 18.857 -3.756 -7.168 1.00 0.00 H new ATOM 0 H4' C B 11 18.694 -5.018 -5.185 1.00 0.00 H new ATOM 0 H3' C B 11 16.846 -3.096 -5.636 1.00 0.00 H new ATOM 0 H2' C B 11 17.921 -1.278 -4.338 1.00 0.00 H new ATOM 0 HO2' C B 11 16.078 -2.740 -2.825 1.00 0.00 H new ATOM 0 H1' C B 11 18.393 -3.394 -2.184 1.00 0.00 H new ATOM 0 H41 C B 11 22.749 1.291 -0.758 1.00 0.00 H new ATOM 0 H42 C B 11 21.827 0.939 0.707 1.00 0.00 H new ATOM 0 H5 C B 11 22.269 0.226 -2.880 1.00 0.00 H new ATOM 0 H6 C B 11 20.813 -1.337 -4.046 1.00 0.00 H new ATOM 355 P G B 12 15.762 -5.422 -4.984 1.00 0.00 P ATOM 356 OP1 G B 12 15.172 -4.708 -6.145 1.00 0.00 O ATOM 357 OP2 G B 12 14.880 -6.201 -4.077 1.00 0.00 O ATOM 358 O5' G B 12 16.899 -6.394 -5.531 1.00 0.00 O ATOM 359 C5' G B 12 17.692 -7.174 -4.640 1.00 0.00 C ATOM 360 C4' G B 12 18.910 -7.704 -5.360 1.00 0.00 C ATOM 361 O4' G B 12 19.806 -6.600 -5.638 1.00 0.00 O ATOM 362 C3' G B 12 19.760 -8.688 -4.570 1.00 0.00 C ATOM 363 O3' G B 12 19.271 -10.028 -4.671 1.00 0.00 O ATOM 364 C2' G B 12 21.140 -8.532 -5.205 1.00 0.00 C ATOM 365 O2' G B 12 21.245 -9.302 -6.388 1.00 0.00 O ATOM 366 C1' G B 12 21.146 -7.051 -5.590 1.00 0.00 C ATOM 367 N9 G B 12 21.877 -6.206 -4.650 1.00 0.00 N ATOM 368 C8 G B 12 23.109 -5.629 -4.841 1.00 0.00 C ATOM 369 N7 G B 12 23.501 -4.907 -3.827 1.00 0.00 N ATOM 370 C5 G B 12 22.468 -5.020 -2.906 1.00 0.00 C ATOM 371 C6 G B 12 22.327 -4.459 -1.612 1.00 0.00 C ATOM 372 O6 G B 12 23.111 -3.724 -1.001 1.00 0.00 O ATOM 373 N1 G B 12 21.125 -4.831 -1.021 1.00 0.00 N ATOM 374 C2 G B 12 20.181 -5.641 -1.600 1.00 0.00 C ATOM 375 N2 G B 12 19.086 -5.884 -0.871 1.00 0.00 N ATOM 376 N3 G B 12 20.299 -6.173 -2.804 1.00 0.00 N ATOM 377 C4 G B 12 21.460 -5.823 -3.397 1.00 0.00 C ATOM 0 H5' G B 12 17.103 -8.002 -4.247 1.00 0.00 H new ATOM 0 H5'' G B 12 17.999 -6.568 -3.788 1.00 0.00 H new ATOM 0 H4' G B 12 18.506 -8.212 -6.236 1.00 0.00 H new ATOM 0 H3' G B 12 19.757 -8.488 -3.499 1.00 0.00 H new ATOM 0 H2' G B 12 21.949 -8.847 -4.547 1.00 0.00 H new ATOM 0 HO2' G B 12 20.588 -10.029 -6.364 1.00 0.00 H new ATOM 0 HO3' G B 12 19.847 -10.626 -4.151 1.00 0.00 H new ATOM 0 H1' G B 12 21.650 -6.972 -6.553 1.00 0.00 H new ATOM 0 H8 G B 12 23.694 -5.760 -5.739 1.00 0.00 H new ATOM 0 H1 G B 12 20.930 -4.475 -0.085 1.00 0.00 H new ATOM 0 H21 G B 12 18.346 -6.479 -1.244 1.00 0.00 H new ATOM 0 H22 G B 12 18.991 -5.474 0.058 1.00 0.00 H new TER 390 G B 12