USER MOD reduce.3.24.130724 H: found=0, std=0, add=154, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 154 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 G O2' : rot -19:sc= 0.095 USER MOD Single : A 1 G O5' : rot 26:sc= 0.15 USER MOD Single : A 2 G O2' : rot -20:sc= 0.015 USER MOD Single : A 3 C O2' : rot -27:sc= 0.0957 USER MOD Single : A 4 G O2' : rot -20:sc= 0.152 USER MOD Single : A 5 G O2' : rot -116:sc= 0.0622 USER MOD Single : A 6 U O2' : rot -141:sc= 1.35 USER MOD Single : A 7 G O2' : rot -23:sc= 0.258 USER MOD Single : A 8 A O2' : rot -23:sc= 0.116 USER MOD Single : A 9 A O2' : rot -25:sc= 0.162 USER MOD Single : A 10 A O2' : rot -19:sc= 0.262 USER MOD Single : A 11 U O2' : rot -17:sc= 0.227 USER MOD Single : A 12 G O2' : rot -16:sc= 0.127 USER MOD Single : A 13 C O2' : rot -18:sc= 0.0864 USER MOD Single : A 14 C O2' : rot -26:sc= 0.132 USER MOD Single : A 14 C O3' : rot 180:sc= 0.141 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 1.159 -11.495 -12.063 1.00 10.00 O ATOM 2 C5' G A 1 1.355 -12.177 -10.833 1.00 10.00 C ATOM 3 C4' G A 1 0.052 -12.832 -10.375 1.00 10.00 C ATOM 4 O4' G A 1 0.257 -13.719 -9.286 1.00 10.00 O ATOM 5 C3' G A 1 -0.946 -11.789 -9.883 1.00 10.00 C ATOM 6 O3' G A 1 -1.604 -11.171 -10.972 1.00 10.00 O ATOM 7 C2' G A 1 -1.873 -12.675 -9.062 1.00 10.00 C ATOM 8 O2' G A 1 -2.763 -13.402 -9.897 1.00 10.00 O ATOM 9 C1' G A 1 -0.872 -13.632 -8.419 1.00 10.00 C ATOM 10 N9 G A 1 -0.430 -13.152 -7.090 1.00 10.00 N ATOM 11 C8 G A 1 0.789 -12.646 -6.720 1.00 10.00 C ATOM 12 N7 G A 1 0.902 -12.382 -5.444 1.00 10.00 N ATOM 13 C5 G A 1 -0.360 -12.729 -4.923 1.00 10.00 C ATOM 14 C6 G A 1 -0.904 -12.709 -3.582 1.00 10.00 C ATOM 15 O6 G A 1 -0.359 -12.409 -2.516 1.00 10.00 O ATOM 16 N1 G A 1 -2.224 -13.118 -3.520 1.00 10.00 N ATOM 17 C2 G A 1 -2.928 -13.567 -4.591 1.00 10.00 C ATOM 18 N2 G A 1 -4.136 -14.004 -4.385 1.00 10.00 N ATOM 19 N3 G A 1 -2.456 -13.647 -5.834 1.00 10.00 N ATOM 20 C4 G A 1 -1.172 -13.196 -5.937 1.00 10.00 C ATOM 0 H5' G A 1 1.705 -11.478 -10.074 1.00 10.00 H new ATOM 0 H5'' G A 1 2.130 -12.935 -10.949 1.00 10.00 H new ATOM 0 H4' G A 1 -0.325 -13.369 -11.245 1.00 10.00 H new ATOM 0 H3' G A 1 -0.523 -10.953 -9.325 1.00 10.00 H new ATOM 0 H2' G A 1 -2.504 -12.125 -8.364 1.00 10.00 H new ATOM 0 HO2' G A 1 -2.811 -12.972 -10.776 1.00 10.00 H new ATOM 0 HO5' G A 1 0.218 -11.233 -12.145 1.00 10.00 H new ATOM 0 H1' G A 1 -1.346 -14.603 -8.276 1.00 10.00 H new ATOM 0 H8 G A 1 1.590 -12.479 -7.424 1.00 10.00 H new ATOM 0 H1 G A 1 -2.696 -13.080 -2.617 1.00 10.00 H new ATOM 0 H21 G A 1 -4.694 -14.349 -5.166 1.00 10.00 H new ATOM 0 H22 G A 1 -4.525 -14.002 -3.442 1.00 10.00 H new ATOM 33 P G A 2 -2.199 -9.709 -10.873 1.00 10.00 P ATOM 34 OP1 G A 2 -2.729 -9.417 -12.220 1.00 10.00 O ATOM 35 OP2 G A 2 -1.141 -8.831 -10.326 1.00 10.00 O ATOM 36 O5' G A 2 -3.433 -9.817 -9.854 1.00 10.00 O ATOM 37 C5' G A 2 -4.635 -10.475 -10.252 1.00 10.00 C ATOM 38 C4' G A 2 -5.532 -10.922 -9.093 1.00 10.00 C ATOM 39 O4' G A 2 -4.801 -11.676 -8.132 1.00 10.00 O ATOM 40 C3' G A 2 -6.239 -9.803 -8.334 1.00 10.00 C ATOM 41 O3' G A 2 -7.398 -9.335 -9.006 1.00 10.00 O ATOM 42 C2' G A 2 -6.574 -10.555 -7.043 1.00 10.00 C ATOM 43 O2' G A 2 -7.646 -11.485 -7.179 1.00 10.00 O ATOM 44 C1' G A 2 -5.310 -11.389 -6.830 1.00 10.00 C ATOM 45 N9 G A 2 -4.300 -10.663 -6.020 1.00 10.00 N ATOM 46 C8 G A 2 -3.106 -10.109 -6.410 1.00 10.00 C ATOM 47 N7 G A 2 -2.428 -9.553 -5.443 1.00 10.00 N ATOM 48 C5 G A 2 -3.230 -9.764 -4.311 1.00 10.00 C ATOM 49 C6 G A 2 -3.060 -9.403 -2.925 1.00 10.00 C ATOM 50 O6 G A 2 -2.147 -8.782 -2.383 1.00 10.00 O ATOM 51 N1 G A 2 -4.095 -9.826 -2.118 1.00 10.00 N ATOM 52 C2 G A 2 -5.170 -10.516 -2.562 1.00 10.00 C ATOM 53 N2 G A 2 -6.100 -10.810 -1.695 1.00 10.00 N ATOM 54 N3 G A 2 -5.378 -10.857 -3.832 1.00 10.00 N ATOM 55 C4 G A 2 -4.371 -10.454 -4.663 1.00 10.00 C ATOM 0 H5' G A 2 -4.375 -11.348 -10.850 1.00 10.00 H new ATOM 0 H5'' G A 2 -5.204 -9.805 -10.897 1.00 10.00 H new ATOM 0 H4' G A 2 -6.296 -11.517 -9.593 1.00 10.00 H new ATOM 0 H3' G A 2 -5.656 -8.891 -8.204 1.00 10.00 H new ATOM 0 H2' G A 2 -6.863 -9.859 -6.256 1.00 10.00 H new ATOM 0 HO2' G A 2 -8.181 -11.254 -7.967 1.00 10.00 H new ATOM 0 H1' G A 2 -5.540 -12.300 -6.277 1.00 10.00 H new ATOM 0 H8 G A 2 -2.757 -10.131 -7.432 1.00 10.00 H new ATOM 0 H1 G A 2 -4.047 -9.605 -1.124 1.00 10.00 H new ATOM 0 H21 G A 2 -6.927 -11.329 -1.990 1.00 10.00 H new ATOM 0 H22 G A 2 -6.000 -10.520 -0.722 1.00 10.00 H new ATOM 67 P C A 3 -7.948 -7.860 -8.757 1.00 10.00 P ATOM 68 OP1 C A 3 -9.209 -7.747 -9.515 1.00 10.00 O ATOM 69 OP2 C A 3 -6.850 -6.934 -9.093 1.00 10.00 O ATOM 70 O5' C A 3 -8.286 -7.758 -7.193 1.00 10.00 O ATOM 71 C5' C A 3 -9.400 -8.454 -6.646 1.00 10.00 C ATOM 72 C4' C A 3 -9.458 -8.460 -5.112 1.00 10.00 C ATOM 73 O4' C A 3 -8.233 -8.936 -4.563 1.00 10.00 O ATOM 74 C3' C A 3 -9.776 -7.118 -4.446 1.00 10.00 C ATOM 75 O3' C A 3 -11.169 -6.849 -4.354 1.00 10.00 O ATOM 76 C2' C A 3 -9.216 -7.411 -3.054 1.00 10.00 C ATOM 77 O2' C A 3 -10.085 -8.199 -2.258 1.00 10.00 O ATOM 78 C1' C A 3 -7.999 -8.291 -3.317 1.00 10.00 C ATOM 79 N1 C A 3 -6.752 -7.479 -3.289 1.00 10.00 N ATOM 80 C2 C A 3 -6.299 -7.048 -2.037 1.00 10.00 C ATOM 81 O2 C A 3 -6.928 -7.274 -1.007 1.00 10.00 O ATOM 82 N3 C A 3 -5.159 -6.342 -1.911 1.00 10.00 N ATOM 83 C4 C A 3 -4.476 -6.071 -3.003 1.00 10.00 C ATOM 84 N4 C A 3 -3.366 -5.417 -2.841 1.00 10.00 N ATOM 85 C5 C A 3 -4.898 -6.439 -4.317 1.00 10.00 C ATOM 86 C6 C A 3 -6.050 -7.148 -4.425 1.00 10.00 C ATOM 0 H5' C A 3 -9.377 -9.485 -7.000 1.00 10.00 H new ATOM 0 H5'' C A 3 -10.316 -8.005 -7.030 1.00 10.00 H new ATOM 0 H4' C A 3 -10.296 -9.123 -4.895 1.00 10.00 H new ATOM 0 H3' C A 3 -9.377 -6.254 -4.977 1.00 10.00 H new ATOM 0 H2' C A 3 -9.035 -6.471 -2.533 1.00 10.00 H new ATOM 0 HO2' C A 3 -11.011 -8.056 -2.545 1.00 10.00 H new ATOM 0 H1' C A 3 -7.858 -9.047 -2.544 1.00 10.00 H new ATOM 0 H41 C A 3 -2.792 -5.178 -3.650 1.00 10.00 H new ATOM 0 H42 C A 3 -3.068 -5.143 -1.905 1.00 10.00 H new ATOM 0 H5 C A 3 -4.324 -6.164 -5.189 1.00 10.00 H new ATOM 0 H6 C A 3 -6.413 -7.450 -5.396 1.00 10.00 H new ATOM 98 P G A 4 -11.744 -5.378 -4.116 1.00 10.00 P ATOM 99 OP1 G A 4 -13.147 -5.568 -3.699 1.00 10.00 O ATOM 100 OP2 G A 4 -11.457 -4.608 -5.341 1.00 10.00 O ATOM 101 O5' G A 4 -10.935 -4.703 -2.908 1.00 10.00 O ATOM 102 C5' G A 4 -11.250 -4.933 -1.541 1.00 10.00 C ATOM 103 C4' G A 4 -10.190 -4.332 -0.599 1.00 10.00 C ATOM 104 O4' G A 4 -8.885 -4.815 -0.893 1.00 10.00 O ATOM 105 C3' G A 4 -10.120 -2.798 -0.559 1.00 10.00 C ATOM 106 O3' G A 4 -11.044 -2.302 0.398 1.00 10.00 O ATOM 107 C2' G A 4 -8.678 -2.597 -0.082 1.00 10.00 C ATOM 108 O2' G A 4 -8.560 -2.766 1.327 1.00 10.00 O ATOM 109 C1' G A 4 -7.941 -3.764 -0.736 1.00 10.00 C ATOM 110 N9 G A 4 -7.351 -3.403 -2.044 1.00 10.00 N ATOM 111 C8 G A 4 -7.838 -3.610 -3.312 1.00 10.00 C ATOM 112 N7 G A 4 -7.039 -3.226 -4.269 1.00 10.00 N ATOM 113 C5 G A 4 -5.928 -2.721 -3.578 1.00 10.00 C ATOM 114 C6 G A 4 -4.685 -2.169 -4.045 1.00 10.00 C ATOM 115 O6 G A 4 -4.289 -2.028 -5.199 1.00 10.00 O ATOM 116 N1 G A 4 -3.832 -1.783 -3.031 1.00 10.00 N ATOM 117 C2 G A 4 -4.101 -1.975 -1.717 1.00 10.00 C ATOM 118 N2 G A 4 -3.170 -1.642 -0.871 1.00 10.00 N ATOM 119 N3 G A 4 -5.228 -2.499 -1.236 1.00 10.00 N ATOM 120 C4 G A 4 -6.110 -2.842 -2.219 1.00 10.00 C ATOM 0 H5' G A 4 -11.329 -6.005 -1.362 1.00 10.00 H new ATOM 0 H5'' G A 4 -12.224 -4.500 -1.315 1.00 10.00 H new ATOM 0 H4' G A 4 -10.530 -4.665 0.382 1.00 10.00 H new ATOM 0 H3' G A 4 -10.359 -2.293 -1.495 1.00 10.00 H new ATOM 0 H2' G A 4 -8.309 -1.601 -0.327 1.00 10.00 H new ATOM 0 HO2' G A 4 -9.441 -2.664 1.744 1.00 10.00 H new ATOM 0 H1' G A 4 -7.106 -4.064 -0.103 1.00 10.00 H new ATOM 0 H8 G A 4 -8.804 -4.055 -3.501 1.00 10.00 H new ATOM 0 H1 G A 4 -2.954 -1.330 -3.284 1.00 10.00 H new ATOM 0 H21 G A 4 -3.322 -1.766 0.130 1.00 10.00 H new ATOM 0 H22 G A 4 -2.288 -1.257 -1.209 1.00 10.00 H new ATOM 132 P G A 5 -11.596 -0.818 0.386 1.00 10.00 P ATOM 133 OP1 G A 5 -12.349 -0.698 1.652 1.00 10.00 O ATOM 134 OP2 G A 5 -12.321 -0.620 -0.883 1.00 10.00 O ATOM 135 O5' G A 5 -10.351 0.189 0.436 1.00 10.00 O ATOM 136 C5' G A 5 -9.668 0.450 1.659 1.00 10.00 C ATOM 137 C4' G A 5 -8.327 1.179 1.498 1.00 10.00 C ATOM 138 O4' G A 5 -7.414 0.464 0.677 1.00 10.00 O ATOM 139 C3' G A 5 -8.394 2.588 0.912 1.00 10.00 C ATOM 140 O3' G A 5 -8.940 3.492 1.860 1.00 10.00 O ATOM 141 C2' G A 5 -6.897 2.790 0.623 1.00 10.00 C ATOM 142 O2' G A 5 -6.166 3.161 1.782 1.00 10.00 O ATOM 143 C1' G A 5 -6.421 1.383 0.233 1.00 10.00 C ATOM 144 N9 G A 5 -6.219 1.251 -1.225 1.00 10.00 N ATOM 145 C8 G A 5 -7.149 0.965 -2.193 1.00 10.00 C ATOM 146 N7 G A 5 -6.688 1.046 -3.415 1.00 10.00 N ATOM 147 C5 G A 5 -5.324 1.336 -3.237 1.00 10.00 C ATOM 148 C6 G A 5 -4.245 1.513 -4.177 1.00 10.00 C ATOM 149 O6 G A 5 -4.284 1.543 -5.405 1.00 10.00 O ATOM 150 N1 G A 5 -3.004 1.656 -3.584 1.00 10.00 N ATOM 151 C2 G A 5 -2.816 1.706 -2.240 1.00 10.00 C ATOM 152 N2 G A 5 -1.583 1.694 -1.805 1.00 10.00 N ATOM 153 N3 G A 5 -3.793 1.618 -1.337 1.00 10.00 N ATOM 154 C4 G A 5 -5.027 1.421 -1.894 1.00 10.00 C ATOM 0 H5' G A 5 -9.493 -0.496 2.172 1.00 10.00 H new ATOM 0 H5'' G A 5 -10.316 1.046 2.302 1.00 10.00 H new ATOM 0 H4' G A 5 -7.994 1.246 2.534 1.00 10.00 H new ATOM 0 H3' G A 5 -9.031 2.743 0.042 1.00 10.00 H new ATOM 0 H2' G A 5 -6.749 3.571 -0.123 1.00 10.00 H new ATOM 0 HO2' G A 5 -5.796 4.060 1.661 1.00 10.00 H new ATOM 0 H1' G A 5 -5.456 1.182 0.699 1.00 10.00 H new ATOM 0 H8 G A 5 -8.170 0.697 -1.966 1.00 10.00 H new ATOM 0 H1 G A 5 -2.186 1.728 -4.189 1.00 10.00 H new ATOM 0 H21 G A 5 -1.395 1.730 -0.803 1.00 10.00 H new ATOM 0 H22 G A 5 -0.809 1.648 -2.468 1.00 10.00 H new ATOM 166 P U A 6 -9.564 4.887 1.450 1.00 10.00 P ATOM 167 OP1 U A 6 -10.089 5.486 2.695 1.00 10.00 O ATOM 168 OP2 U A 6 -10.522 4.672 0.353 1.00 10.00 O ATOM 169 O5' U A 6 -8.370 5.807 0.925 1.00 10.00 O ATOM 170 C5' U A 6 -7.494 6.443 1.844 1.00 10.00 C ATOM 171 C4' U A 6 -6.245 7.020 1.167 1.00 10.00 C ATOM 172 O4' U A 6 -5.496 5.992 0.518 1.00 10.00 O ATOM 173 C3' U A 6 -6.519 8.103 0.117 1.00 10.00 C ATOM 174 O3' U A 6 -6.824 9.392 0.653 1.00 10.00 O ATOM 175 C2' U A 6 -5.151 8.053 -0.564 1.00 10.00 C ATOM 176 O2' U A 6 -4.168 8.809 0.150 1.00 10.00 O ATOM 177 C1' U A 6 -4.768 6.574 -0.568 1.00 10.00 C ATOM 178 N1 U A 6 -5.074 5.926 -1.882 1.00 10.00 N ATOM 179 C2 U A 6 -4.076 5.932 -2.872 1.00 10.00 C ATOM 180 O2 U A 6 -2.964 6.424 -2.716 1.00 10.00 O ATOM 181 N3 U A 6 -4.372 5.355 -4.088 1.00 10.00 N ATOM 182 C4 U A 6 -5.606 4.872 -4.444 1.00 10.00 C ATOM 183 O4 U A 6 -5.817 4.476 -5.588 1.00 10.00 O ATOM 184 C5 U A 6 -6.586 4.866 -3.378 1.00 10.00 C ATOM 185 C6 U A 6 -6.310 5.374 -2.148 1.00 10.00 C ATOM 0 H5' U A 6 -7.191 5.726 2.607 1.00 10.00 H new ATOM 0 H5'' U A 6 -8.029 7.244 2.355 1.00 10.00 H new ATOM 0 H4' U A 6 -5.694 7.479 1.988 1.00 10.00 H new ATOM 0 H3' U A 6 -7.395 7.937 -0.509 1.00 10.00 H new ATOM 0 H2' U A 6 -5.197 8.485 -1.564 1.00 10.00 H new ATOM 0 HO2' U A 6 -3.586 9.273 -0.487 1.00 10.00 H new ATOM 0 H1' U A 6 -3.695 6.431 -0.438 1.00 10.00 H new ATOM 0 H3 U A 6 -3.620 5.282 -4.773 1.00 10.00 H new ATOM 0 H5 U A 6 -7.563 4.446 -3.566 1.00 10.00 H new ATOM 0 H6 U A 6 -7.063 5.345 -1.374 1.00 10.00 H new ATOM 196 P G A 7 -7.552 10.522 -0.218 1.00 10.00 P ATOM 197 OP1 G A 7 -7.552 11.763 0.590 1.00 10.00 O ATOM 198 OP2 G A 7 -8.868 9.995 -0.635 1.00 10.00 O ATOM 199 O5' G A 7 -6.722 10.876 -1.546 1.00 10.00 O ATOM 200 C5' G A 7 -7.335 11.617 -2.604 1.00 10.00 C ATOM 201 C4' G A 7 -6.389 12.180 -3.685 1.00 10.00 C ATOM 202 O4' G A 7 -5.563 13.247 -3.223 1.00 10.00 O ATOM 203 C3' G A 7 -5.472 11.117 -4.272 1.00 10.00 C ATOM 204 O3' G A 7 -5.961 10.428 -5.412 1.00 10.00 O ATOM 205 C2' G A 7 -4.182 11.849 -4.572 1.00 10.00 C ATOM 206 O2' G A 7 -4.184 12.320 -5.914 1.00 10.00 O ATOM 207 C1' G A 7 -4.205 13.009 -3.588 1.00 10.00 C ATOM 208 N9 G A 7 -3.410 12.672 -2.388 1.00 10.00 N ATOM 209 C8 G A 7 -3.847 12.301 -1.149 1.00 10.00 C ATOM 210 N7 G A 7 -2.905 12.190 -0.251 1.00 10.00 N ATOM 211 C5 G A 7 -1.735 12.426 -0.983 1.00 10.00 C ATOM 212 C6 G A 7 -0.349 12.423 -0.601 1.00 10.00 C ATOM 213 O6 G A 7 0.148 12.304 0.517 1.00 10.00 O ATOM 214 N1 G A 7 0.516 12.573 -1.668 1.00 10.00 N ATOM 215 C2 G A 7 0.104 12.800 -2.941 1.00 10.00 C ATOM 216 N2 G A 7 1.000 12.852 -3.885 1.00 10.00 N ATOM 217 N3 G A 7 -1.165 12.927 -3.319 1.00 10.00 N ATOM 218 C4 G A 7 -2.042 12.694 -2.298 1.00 10.00 C ATOM 0 H5' G A 7 -7.885 12.449 -2.164 1.00 10.00 H new ATOM 0 H5'' G A 7 -8.067 10.974 -3.092 1.00 10.00 H new ATOM 0 H4' G A 7 -7.069 12.557 -4.449 1.00 10.00 H new ATOM 0 H3' G A 7 -5.361 10.305 -3.554 1.00 10.00 H new ATOM 0 H2' G A 7 -3.294 11.225 -4.471 1.00 10.00 H new ATOM 0 HO2' G A 7 -4.810 11.787 -6.447 1.00 10.00 H new ATOM 0 H1' G A 7 -3.773 13.900 -4.043 1.00 10.00 H new ATOM 0 H8 G A 7 -4.888 12.114 -0.929 1.00 10.00 H new ATOM 0 H1 G A 7 1.518 12.510 -1.489 1.00 10.00 H new ATOM 0 H21 G A 7 0.715 13.021 -4.850 1.00 10.00 H new ATOM 0 H22 G A 7 1.986 12.723 -3.659 1.00 10.00 H new ATOM 230 P A A 8 -5.761 8.854 -5.505 1.00 10.00 P ATOM 231 OP1 A A 8 -6.307 8.410 -6.810 1.00 10.00 O ATOM 232 OP2 A A 8 -6.280 8.250 -4.270 1.00 10.00 O ATOM 233 O5' A A 8 -4.175 8.705 -5.539 1.00 10.00 O ATOM 234 C5' A A 8 -3.450 8.916 -6.737 1.00 10.00 C ATOM 235 C4' A A 8 -1.945 8.999 -6.473 1.00 10.00 C ATOM 236 O4' A A 8 -1.609 10.064 -5.586 1.00 10.00 O ATOM 237 C3' A A 8 -1.333 7.730 -5.883 1.00 10.00 C ATOM 238 O3' A A 8 -1.086 6.761 -6.878 1.00 10.00 O ATOM 239 C2' A A 8 -0.023 8.311 -5.332 1.00 10.00 C ATOM 240 O2' A A 8 0.931 8.513 -6.371 1.00 10.00 O ATOM 241 C1' A A 8 -0.500 9.654 -4.790 1.00 10.00 C ATOM 242 N9 A A 8 -0.858 9.468 -3.366 1.00 10.00 N ATOM 243 C8 A A 8 -2.078 9.267 -2.770 1.00 10.00 C ATOM 244 N7 A A 8 -2.016 9.135 -1.468 1.00 10.00 N ATOM 245 C5 A A 8 -0.645 9.204 -1.196 1.00 10.00 C ATOM 246 C6 A A 8 0.165 9.088 -0.040 1.00 10.00 C ATOM 247 N6 A A 8 -0.282 8.840 1.174 1.00 10.00 N ATOM 248 N1 A A 8 1.496 9.173 -0.113 1.00 10.00 N ATOM 249 C2 A A 8 2.029 9.356 -1.316 1.00 10.00 C ATOM 250 N3 A A 8 1.411 9.467 -2.483 1.00 10.00 N ATOM 251 C4 A A 8 0.061 9.382 -2.352 1.00 10.00 C ATOM 0 H5' A A 8 -3.789 9.837 -7.211 1.00 10.00 H new ATOM 0 H5'' A A 8 -3.654 8.104 -7.435 1.00 10.00 H new ATOM 0 H4' A A 8 -1.532 9.164 -7.468 1.00 10.00 H new ATOM 0 H3' A A 8 -1.957 7.211 -5.155 1.00 10.00 H new ATOM 0 H2' A A 8 0.471 7.670 -4.603 1.00 10.00 H new ATOM 0 HO2' A A 8 0.724 7.922 -7.125 1.00 10.00 H new ATOM 0 H1' A A 8 0.264 10.430 -4.842 1.00 10.00 H new ATOM 0 H8 A A 8 -3.004 9.222 -3.324 1.00 10.00 H new ATOM 0 H61 A A 8 0.372 8.772 1.954 1.00 10.00 H new ATOM 0 H62 A A 8 -1.282 8.716 1.334 1.00 10.00 H new ATOM 0 H2 A A 8 3.106 9.423 -1.347 1.00 10.00 H new ATOM 263 P A A 9 -0.818 5.260 -6.477 1.00 10.00 P ATOM 264 OP1 A A 9 -0.283 4.594 -7.685 1.00 10.00 O ATOM 265 OP2 A A 9 -2.025 4.711 -5.834 1.00 10.00 O ATOM 266 O5' A A 9 0.387 5.334 -5.434 1.00 10.00 O ATOM 267 C5' A A 9 0.344 4.594 -4.228 1.00 10.00 C ATOM 268 C4' A A 9 1.531 4.960 -3.327 1.00 10.00 C ATOM 269 O4' A A 9 1.310 6.143 -2.547 1.00 10.00 O ATOM 270 C3' A A 9 1.822 3.837 -2.336 1.00 10.00 C ATOM 271 O3' A A 9 2.726 2.870 -2.840 1.00 10.00 O ATOM 272 C2' A A 9 2.464 4.608 -1.191 1.00 10.00 C ATOM 273 O2' A A 9 3.834 4.890 -1.464 1.00 10.00 O ATOM 274 C1' A A 9 1.659 5.893 -1.180 1.00 10.00 C ATOM 275 N9 A A 9 0.468 5.674 -0.326 1.00 10.00 N ATOM 276 C8 A A 9 -0.815 5.437 -0.728 1.00 10.00 C ATOM 277 N7 A A 9 -1.666 5.238 0.237 1.00 10.00 N ATOM 278 C5 A A 9 -0.865 5.302 1.378 1.00 10.00 C ATOM 279 C6 A A 9 -1.105 5.141 2.759 1.00 10.00 C ATOM 280 N6 A A 9 -2.298 4.926 3.272 1.00 10.00 N ATOM 281 N1 A A 9 -0.099 5.184 3.643 1.00 10.00 N ATOM 282 C2 A A 9 1.117 5.398 3.162 1.00 10.00 C ATOM 283 N3 A A 9 1.497 5.601 1.906 1.00 10.00 N ATOM 284 C4 A A 9 0.441 5.542 1.047 1.00 10.00 C ATOM 0 H5' A A 9 0.364 3.527 -4.449 1.00 10.00 H new ATOM 0 H5'' A A 9 -0.591 4.794 -3.705 1.00 10.00 H new ATOM 0 H4' A A 9 2.363 5.129 -4.011 1.00 10.00 H new ATOM 0 H3' A A 9 0.932 3.264 -2.077 1.00 10.00 H new ATOM 0 H2' A A 9 2.455 4.064 -0.246 1.00 10.00 H new ATOM 0 HO2' A A 9 4.184 4.228 -2.096 1.00 10.00 H new ATOM 0 H1' A A 9 2.199 6.750 -0.778 1.00 10.00 H new ATOM 0 H8 A A 9 -1.103 5.416 -1.769 1.00 10.00 H new ATOM 0 H61 A A 9 -2.408 4.818 4.280 1.00 10.00 H new ATOM 0 H62 A A 9 -3.113 4.868 2.661 1.00 10.00 H new ATOM 0 H2 A A 9 1.911 5.409 3.894 1.00 10.00 H new ATOM 296 P A A 10 2.512 1.331 -2.511 1.00 10.00 P ATOM 297 OP1 A A 10 3.549 0.586 -3.260 1.00 10.00 O ATOM 298 OP2 A A 10 1.087 1.020 -2.691 1.00 10.00 O ATOM 299 O5' A A 10 2.851 1.192 -0.955 1.00 10.00 O ATOM 300 C5' A A 10 4.151 1.394 -0.434 1.00 10.00 C ATOM 301 C4' A A 10 4.127 1.431 1.103 1.00 10.00 C ATOM 302 O4' A A 10 3.259 2.463 1.563 1.00 10.00 O ATOM 303 C3' A A 10 3.710 0.106 1.755 1.00 10.00 C ATOM 304 O3' A A 10 4.836 -0.702 2.098 1.00 10.00 O ATOM 305 C2' A A 10 3.026 0.611 3.027 1.00 10.00 C ATOM 306 O2' A A 10 3.975 0.784 4.072 1.00 10.00 O ATOM 307 C1' A A 10 2.467 1.977 2.639 1.00 10.00 C ATOM 308 N9 A A 10 1.040 1.867 2.259 1.00 10.00 N ATOM 309 C8 A A 10 0.471 1.926 1.011 1.00 10.00 C ATOM 310 N7 A A 10 -0.827 1.835 1.010 1.00 10.00 N ATOM 311 C5 A A 10 -1.148 1.723 2.363 1.00 10.00 C ATOM 312 C6 A A 10 -2.358 1.644 3.088 1.00 10.00 C ATOM 313 N6 A A 10 -3.551 1.683 2.532 1.00 10.00 N ATOM 314 N1 A A 10 -2.344 1.557 4.422 1.00 10.00 N ATOM 315 C2 A A 10 -1.167 1.554 5.032 1.00 10.00 C ATOM 316 N3 A A 10 0.049 1.626 4.494 1.00 10.00 N ATOM 317 C4 A A 10 -0.016 1.722 3.133 1.00 10.00 C ATOM 0 H5' A A 10 4.560 2.329 -0.818 1.00 10.00 H new ATOM 0 H5'' A A 10 4.811 0.595 -0.772 1.00 10.00 H new ATOM 0 H4' A A 10 5.157 1.625 1.403 1.00 10.00 H new ATOM 0 H3' A A 10 3.097 -0.522 1.108 1.00 10.00 H new ATOM 0 H2' A A 10 2.267 -0.086 3.383 1.00 10.00 H new ATOM 0 HO2' A A 10 4.785 0.273 3.866 1.00 10.00 H new ATOM 0 H1' A A 10 2.512 2.671 3.478 1.00 10.00 H new ATOM 0 H8 A A 10 1.051 2.038 0.107 1.00 10.00 H new ATOM 0 H61 A A 10 -4.387 1.621 3.113 1.00 10.00 H new ATOM 0 H62 A A 10 -3.639 1.775 1.520 1.00 10.00 H new ATOM 0 H2 A A 10 -1.199 1.484 6.109 1.00 10.00 H new ATOM 329 P U A 11 4.738 -2.301 2.142 1.00 10.00 P ATOM 330 OP1 U A 11 6.043 -2.813 2.626 1.00 10.00 O ATOM 331 OP2 U A 11 4.279 -2.751 0.821 1.00 10.00 O ATOM 332 O5' U A 11 3.628 -2.636 3.247 1.00 10.00 O ATOM 333 C5' U A 11 3.949 -2.596 4.628 1.00 10.00 C ATOM 334 C4' U A 11 2.716 -2.540 5.540 1.00 10.00 C ATOM 335 O4' U A 11 1.774 -1.572 5.093 1.00 10.00 O ATOM 336 C3' U A 11 1.943 -3.846 5.717 1.00 10.00 C ATOM 337 O3' U A 11 2.521 -4.676 6.717 1.00 10.00 O ATOM 338 C2' U A 11 0.618 -3.284 6.245 1.00 10.00 C ATOM 339 O2' U A 11 0.698 -3.034 7.647 1.00 10.00 O ATOM 340 C1' U A 11 0.469 -1.943 5.521 1.00 10.00 C ATOM 341 N1 U A 11 -0.534 -2.051 4.425 1.00 10.00 N ATOM 342 C2 U A 11 -1.887 -1.935 4.787 1.00 10.00 C ATOM 343 O2 U A 11 -2.249 -1.626 5.926 1.00 10.00 O ATOM 344 N3 U A 11 -2.822 -2.191 3.805 1.00 10.00 N ATOM 345 C4 U A 11 -2.537 -2.474 2.501 1.00 10.00 C ATOM 346 O4 U A 11 -3.467 -2.650 1.732 1.00 10.00 O ATOM 347 C5 U A 11 -1.129 -2.546 2.183 1.00 10.00 C ATOM 348 C6 U A 11 -0.172 -2.347 3.128 1.00 10.00 C ATOM 0 H5' U A 11 4.575 -1.725 4.823 1.00 10.00 H new ATOM 0 H5'' U A 11 4.539 -3.476 4.882 1.00 10.00 H new ATOM 0 H4' U A 11 3.159 -2.284 6.503 1.00 10.00 H new ATOM 0 H3' U A 11 1.897 -4.461 4.818 1.00 10.00 H new ATOM 0 H2' U A 11 -0.210 -3.973 6.078 1.00 10.00 H new ATOM 0 HO2' U A 11 1.466 -3.514 8.022 1.00 10.00 H new ATOM 0 H1' U A 11 0.078 -1.156 6.166 1.00 10.00 H new ATOM 0 H3 U A 11 -3.805 -2.167 4.076 1.00 10.00 H new ATOM 0 H5 U A 11 -0.829 -2.764 1.168 1.00 10.00 H new ATOM 0 H6 U A 11 0.872 -2.421 2.863 1.00 10.00 H new ATOM 359 P G A 12 2.325 -6.251 6.712 1.00 10.00 P ATOM 360 OP1 G A 12 2.795 -6.664 8.051 1.00 10.00 O ATOM 361 OP2 G A 12 3.020 -6.765 5.525 1.00 10.00 O ATOM 362 O5' G A 12 0.751 -6.536 6.608 1.00 10.00 O ATOM 363 C5' G A 12 -0.093 -6.540 7.752 1.00 10.00 C ATOM 364 C4' G A 12 -1.592 -6.559 7.405 1.00 10.00 C ATOM 365 O4' G A 12 -1.964 -5.459 6.579 1.00 10.00 O ATOM 366 C3' G A 12 -2.139 -7.855 6.786 1.00 10.00 C ATOM 367 O3' G A 12 -2.462 -8.757 7.840 1.00 10.00 O ATOM 368 C2' G A 12 -3.369 -7.297 6.062 1.00 10.00 C ATOM 369 O2' G A 12 -4.489 -7.184 6.921 1.00 10.00 O ATOM 370 C1' G A 12 -2.932 -5.900 5.634 1.00 10.00 C ATOM 371 N9 G A 12 -2.349 -5.904 4.274 1.00 10.00 N ATOM 372 C8 G A 12 -1.032 -5.895 3.906 1.00 10.00 C ATOM 373 N7 G A 12 -0.822 -5.805 2.623 1.00 10.00 N ATOM 374 C5 G A 12 -2.117 -5.763 2.086 1.00 10.00 C ATOM 375 C6 G A 12 -2.589 -5.633 0.732 1.00 10.00 C ATOM 376 O6 G A 12 -1.947 -5.469 -0.305 1.00 10.00 O ATOM 377 N1 G A 12 -3.960 -5.719 0.633 1.00 10.00 N ATOM 378 C2 G A 12 -4.796 -5.850 1.687 1.00 10.00 C ATOM 379 N2 G A 12 -6.046 -6.071 1.402 1.00 10.00 N ATOM 380 N3 G A 12 -4.410 -5.902 2.963 1.00 10.00 N ATOM 381 C4 G A 12 -3.052 -5.861 3.096 1.00 10.00 C ATOM 0 H5' G A 12 0.122 -5.658 8.356 1.00 10.00 H new ATOM 0 H5'' G A 12 0.142 -7.411 8.365 1.00 10.00 H new ATOM 0 H4' G A 12 -2.056 -6.482 8.388 1.00 10.00 H new ATOM 0 H3' G A 12 -1.478 -8.419 6.128 1.00 10.00 H new ATOM 0 H2' G A 12 -3.675 -7.946 5.242 1.00 10.00 H new ATOM 0 HO2' G A 12 -4.335 -7.714 7.731 1.00 10.00 H new ATOM 0 H1' G A 12 -3.794 -5.234 5.606 1.00 10.00 H new ATOM 0 H8 G A 12 -0.227 -5.958 4.624 1.00 10.00 H new ATOM 0 H1 G A 12 -4.373 -5.681 -0.299 1.00 10.00 H new ATOM 0 H21 G A 12 -6.729 -6.179 2.152 1.00 10.00 H new ATOM 0 H22 G A 12 -6.343 -6.136 0.428 1.00 10.00 H new ATOM 393 P C A 13 -2.553 -10.333 7.625 1.00 10.00 P ATOM 394 OP1 C A 13 -2.851 -10.914 8.950 1.00 10.00 O ATOM 395 OP2 C A 13 -1.379 -10.787 6.860 1.00 10.00 O ATOM 396 O5' C A 13 -3.821 -10.552 6.694 1.00 10.00 O ATOM 397 C5' C A 13 -5.154 -10.564 7.172 1.00 10.00 C ATOM 398 C4' C A 13 -6.114 -10.567 5.976 1.00 10.00 C ATOM 399 O4' C A 13 -5.831 -9.489 5.095 1.00 10.00 O ATOM 400 C3' C A 13 -6.044 -11.844 5.138 1.00 10.00 C ATOM 401 O3' C A 13 -6.860 -12.849 5.725 1.00 10.00 O ATOM 402 C2' C A 13 -6.611 -11.348 3.806 1.00 10.00 C ATOM 403 O2' C A 13 -8.029 -11.270 3.790 1.00 10.00 O ATOM 404 C1' C A 13 -6.080 -9.909 3.754 1.00 10.00 C ATOM 405 N1 C A 13 -4.848 -9.810 2.917 1.00 10.00 N ATOM 406 C2 C A 13 -5.032 -9.663 1.534 1.00 10.00 C ATOM 407 O2 C A 13 -6.120 -9.856 0.990 1.00 10.00 O ATOM 408 N3 C A 13 -4.002 -9.314 0.737 1.00 10.00 N ATOM 409 C4 C A 13 -2.822 -9.129 1.288 1.00 10.00 C ATOM 410 N4 C A 13 -1.857 -8.770 0.496 1.00 10.00 N ATOM 411 C5 C A 13 -2.541 -9.334 2.673 1.00 10.00 C ATOM 412 C6 C A 13 -3.586 -9.700 3.461 1.00 10.00 C ATOM 0 H5' C A 13 -5.337 -9.691 7.799 1.00 10.00 H new ATOM 0 H5'' C A 13 -5.323 -11.444 7.793 1.00 10.00 H new ATOM 0 H4' C A 13 -7.107 -10.482 6.419 1.00 10.00 H new ATOM 0 H3' C A 13 -5.056 -12.295 5.048 1.00 10.00 H new ATOM 0 H2' C A 13 -6.331 -12.011 2.987 1.00 10.00 H new ATOM 0 HO2' C A 13 -8.395 -11.811 4.521 1.00 10.00 H new ATOM 0 H1' C A 13 -6.819 -9.257 3.288 1.00 10.00 H new ATOM 0 H41 C A 13 -0.921 -8.613 0.871 1.00 10.00 H new ATOM 0 H42 C A 13 -2.035 -8.645 -0.501 1.00 10.00 H new ATOM 0 H5 C A 13 -1.547 -9.205 3.075 1.00 10.00 H new ATOM 0 H6 C A 13 -3.428 -9.904 4.510 1.00 10.00 H new ATOM 424 P C A 14 -6.370 -14.342 5.869 1.00 10.00 P ATOM 425 OP1 C A 14 -7.413 -15.098 6.591 1.00 10.00 O ATOM 426 OP2 C A 14 -4.988 -14.353 6.387 1.00 10.00 O ATOM 427 O5' C A 14 -6.336 -14.887 4.388 1.00 10.00 O ATOM 428 C5' C A 14 -7.498 -15.403 3.762 1.00 10.00 C ATOM 429 C4' C A 14 -7.153 -15.870 2.350 1.00 10.00 C ATOM 430 O4' C A 14 -6.895 -14.742 1.538 1.00 10.00 O ATOM 431 C3' C A 14 -5.892 -16.748 2.277 1.00 10.00 C ATOM 432 O3' C A 14 -6.120 -18.114 2.613 1.00 10.00 O ATOM 433 C2' C A 14 -5.485 -16.554 0.817 1.00 10.00 C ATOM 434 O2' C A 14 -6.169 -17.469 -0.030 1.00 10.00 O ATOM 435 C1' C A 14 -5.952 -15.111 0.549 1.00 10.00 C ATOM 436 N1 C A 14 -4.804 -14.159 0.573 1.00 10.00 N ATOM 437 C2 C A 14 -4.215 -13.848 -0.654 1.00 10.00 C ATOM 438 O2 C A 14 -4.716 -14.219 -1.709 1.00 10.00 O ATOM 439 N3 C A 14 -3.067 -13.143 -0.717 1.00 10.00 N ATOM 440 C4 C A 14 -2.513 -12.748 0.402 1.00 10.00 C ATOM 441 N4 C A 14 -1.412 -12.074 0.257 1.00 10.00 N ATOM 442 C5 C A 14 -3.075 -12.993 1.689 1.00 10.00 C ATOM 443 C6 C A 14 -4.238 -13.693 1.743 1.00 10.00 C ATOM 0 H5' C A 14 -8.273 -14.638 3.724 1.00 10.00 H new ATOM 0 H5'' C A 14 -7.898 -16.234 4.343 1.00 10.00 H new ATOM 0 H4' C A 14 -8.008 -16.457 2.016 1.00 10.00 H new ATOM 0 H3' C A 14 -5.125 -16.468 2.999 1.00 10.00 H new ATOM 0 H2' C A 14 -4.425 -16.722 0.629 1.00 10.00 H new ATOM 0 HO2' C A 14 -6.410 -18.270 0.481 1.00 10.00 H new ATOM 0 HO3' C A 14 -5.279 -18.613 2.544 1.00 10.00 H new ATOM 0 H1' C A 14 -6.405 -15.069 -0.441 1.00 10.00 H new ATOM 0 H41 C A 14 -0.914 -11.728 1.077 1.00 10.00 H new ATOM 0 H42 C A 14 -1.045 -11.891 -0.677 1.00 10.00 H new ATOM 0 H5 C A 14 -2.594 -12.635 2.588 1.00 10.00 H new ATOM 0 H6 C A 14 -4.716 -13.883 2.693 1.00 10.00 H new TER 456 C A 14