USER MOD reduce.3.24.130724 H: found=0, std=0, add=164, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 164 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= 0.312 USER MOD Single : A 1 G O5' : rot 180:sc= -0.346 USER MOD Single : A 2 G O2' : rot -7:sc= -3.13! USER MOD Single : A 3 C O2' : rot -125:sc= 0.616 USER MOD Single : A 4 U O2' : rot -6:sc= -7.47! USER MOD Single : A 5 C O2' : rot -2:sc= -6.25! USER MOD Single : A 6 U O2' : rot 155:sc= 0.318 USER MOD Single : A 7 C O2' : rot 149:sc= 0.913 USER MOD Single : A 8 A O2' : rot 19:sc= 0.199 USER MOD Single : A 9 G O2' : rot -12:sc= 0.528 USER MOD Single : A 10 U O2' : rot 27:sc= 0.251 USER MOD Single : A 11 G O2' : rot -17:sc= 0.365 USER MOD Single : A 12 A O2' : rot -24:sc= 0.34 USER MOD Single : A 13 G O2' : rot -16:sc= 0.266 USER MOD Single : A 14 C O2' : rot 0:sc= -0.122 USER MOD Single : A 15 C O2' : rot -29:sc= 0.162 USER MOD Single : A 15 C O3' : rot 180:sc= 0.165 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -8.278 3.171 5.811 1.00 0.00 O ATOM 2 C5' G A 1 -9.439 3.148 6.645 1.00 0.00 C ATOM 3 C4' G A 1 -10.594 3.921 6.018 1.00 0.00 C ATOM 4 O4' G A 1 -10.603 5.289 6.457 1.00 0.00 O ATOM 5 C3' G A 1 -10.453 3.977 4.503 1.00 0.00 C ATOM 6 O3' G A 1 -11.238 2.926 3.935 1.00 0.00 O ATOM 7 C2' G A 1 -11.102 5.306 4.155 1.00 0.00 C ATOM 8 O2' G A 1 -12.527 5.191 4.077 1.00 0.00 O ATOM 9 C1' G A 1 -10.679 6.168 5.323 1.00 0.00 C ATOM 10 N9 G A 1 -9.381 6.824 5.055 1.00 0.00 N ATOM 11 C8 G A 1 -8.235 6.823 5.781 1.00 0.00 C ATOM 12 N7 G A 1 -7.228 7.480 5.312 1.00 0.00 N ATOM 13 C5 G A 1 -7.752 7.992 4.123 1.00 0.00 C ATOM 14 C6 G A 1 -7.137 8.811 3.137 1.00 0.00 C ATOM 15 O6 G A 1 -5.989 9.251 3.121 1.00 0.00 O ATOM 16 N1 G A 1 -8.011 9.101 2.098 1.00 0.00 N ATOM 17 C2 G A 1 -9.318 8.662 2.011 1.00 0.00 C ATOM 18 N2 G A 1 -10.001 9.049 0.933 1.00 0.00 N ATOM 19 N3 G A 1 -9.903 7.892 2.934 1.00 0.00 N ATOM 20 C4 G A 1 -9.070 7.595 3.957 1.00 0.00 C ATOM 0 H5' G A 1 -9.198 3.577 7.617 1.00 0.00 H new ATOM 0 H5'' G A 1 -9.743 2.116 6.819 1.00 0.00 H new ATOM 0 H4' G A 1 -11.504 3.401 6.318 1.00 0.00 H new ATOM 0 H3' G A 1 -9.427 3.878 4.149 1.00 0.00 H new ATOM 0 H2' G A 1 -10.806 5.701 3.183 1.00 0.00 H new ATOM 0 HO2' G A 1 -12.773 4.249 3.963 1.00 0.00 H new ATOM 0 HO5' G A 1 -7.556 2.668 6.242 1.00 0.00 H new ATOM 0 H1' G A 1 -11.390 6.974 5.503 1.00 0.00 H new ATOM 0 H8 G A 1 -8.168 6.291 6.719 1.00 0.00 H new ATOM 0 H1 G A 1 -7.660 9.685 1.339 1.00 0.00 H new ATOM 0 H21 G A 1 -10.971 8.757 0.812 1.00 0.00 H new ATOM 0 H22 G A 1 -9.554 9.637 0.230 1.00 0.00 H new ATOM 33 P G A 2 -10.554 1.828 2.978 1.00 0.00 P ATOM 34 OP1 G A 2 -11.353 0.585 3.052 1.00 0.00 O ATOM 35 OP2 G A 2 -9.105 1.792 3.278 1.00 0.00 O ATOM 36 O5' G A 2 -10.748 2.467 1.513 1.00 0.00 O ATOM 37 C5' G A 2 -12.034 2.465 0.886 1.00 0.00 C ATOM 38 C4' G A 2 -12.069 3.389 -0.329 1.00 0.00 C ATOM 39 O4' G A 2 -11.722 4.735 0.028 1.00 0.00 O ATOM 40 C3' G A 2 -11.054 2.951 -1.378 1.00 0.00 C ATOM 41 O3' G A 2 -11.736 2.185 -2.375 1.00 0.00 O ATOM 42 C2' G A 2 -10.612 4.260 -2.002 1.00 0.00 C ATOM 43 O2' G A 2 -11.496 4.662 -3.057 1.00 0.00 O ATOM 44 C1' G A 2 -10.678 5.222 -0.828 1.00 0.00 C ATOM 45 N9 G A 2 -9.390 5.296 -0.107 1.00 0.00 N ATOM 46 C8 G A 2 -9.076 4.903 1.155 1.00 0.00 C ATOM 47 N7 G A 2 -7.864 5.095 1.557 1.00 0.00 N ATOM 48 C5 G A 2 -7.281 5.690 0.436 1.00 0.00 C ATOM 49 C6 G A 2 -5.949 6.146 0.236 1.00 0.00 C ATOM 50 O6 G A 2 -5.006 6.112 1.023 1.00 0.00 O ATOM 51 N1 G A 2 -5.778 6.683 -1.033 1.00 0.00 N ATOM 52 C2 G A 2 -6.762 6.772 -1.998 1.00 0.00 C ATOM 53 N2 G A 2 -6.403 7.320 -3.159 1.00 0.00 N ATOM 54 N3 G A 2 -8.018 6.344 -1.819 1.00 0.00 N ATOM 55 C4 G A 2 -8.209 5.818 -0.588 1.00 0.00 C ATOM 0 H5' G A 2 -12.790 2.780 1.605 1.00 0.00 H new ATOM 0 H5'' G A 2 -12.288 1.450 0.580 1.00 0.00 H new ATOM 0 H4' G A 2 -13.086 3.339 -0.718 1.00 0.00 H new ATOM 0 H3' G A 2 -10.234 2.358 -0.973 1.00 0.00 H new ATOM 0 H2' G A 2 -9.627 4.208 -2.466 1.00 0.00 H new ATOM 0 HO2' G A 2 -12.140 3.945 -3.235 1.00 0.00 H new ATOM 0 H1' G A 2 -10.884 6.236 -1.170 1.00 0.00 H new ATOM 0 H8 G A 2 -9.813 4.447 1.799 1.00 0.00 H new ATOM 0 H1 G A 2 -4.853 7.040 -1.271 1.00 0.00 H new ATOM 0 H21 G A 2 -7.085 7.414 -3.911 1.00 0.00 H new ATOM 0 H22 G A 2 -5.446 7.646 -3.295 1.00 0.00 H new ATOM 67 P C A 3 -10.980 0.985 -3.136 1.00 0.00 P ATOM 68 OP1 C A 3 -11.928 0.373 -4.093 1.00 0.00 O ATOM 69 OP2 C A 3 -10.309 0.143 -2.120 1.00 0.00 O ATOM 70 O5' C A 3 -9.846 1.761 -3.976 1.00 0.00 O ATOM 71 C5' C A 3 -10.210 2.774 -4.917 1.00 0.00 C ATOM 72 C4' C A 3 -8.985 3.391 -5.588 1.00 0.00 C ATOM 73 O4' C A 3 -8.297 4.275 -4.708 1.00 0.00 O ATOM 74 C3' C A 3 -7.964 2.333 -5.962 1.00 0.00 C ATOM 75 O3' C A 3 -8.252 1.866 -7.284 1.00 0.00 O ATOM 76 C2' C A 3 -6.660 3.116 -6.005 1.00 0.00 C ATOM 77 O2' C A 3 -6.415 3.652 -7.310 1.00 0.00 O ATOM 78 C1' C A 3 -6.887 4.230 -4.979 1.00 0.00 C ATOM 79 N1 C A 3 -6.121 3.964 -3.749 1.00 0.00 N ATOM 80 C2 C A 3 -4.778 4.296 -3.752 1.00 0.00 C ATOM 81 O2 C A 3 -4.273 4.803 -4.750 1.00 0.00 O ATOM 82 N3 C A 3 -4.048 4.042 -2.631 1.00 0.00 N ATOM 83 C4 C A 3 -4.616 3.486 -1.553 1.00 0.00 C ATOM 84 N4 C A 3 -3.870 3.248 -0.474 1.00 0.00 N ATOM 85 C5 C A 3 -6.006 3.144 -1.549 1.00 0.00 C ATOM 86 C6 C A 3 -6.716 3.400 -2.661 1.00 0.00 C ATOM 0 H5' C A 3 -10.778 3.554 -4.410 1.00 0.00 H new ATOM 0 H5'' C A 3 -10.864 2.346 -5.677 1.00 0.00 H new ATOM 0 H4' C A 3 -9.368 3.912 -6.466 1.00 0.00 H new ATOM 0 H3' C A 3 -7.947 1.480 -5.283 1.00 0.00 H new ATOM 0 H2' C A 3 -5.788 2.502 -5.782 1.00 0.00 H new ATOM 0 HO2' C A 3 -5.536 3.354 -7.626 1.00 0.00 H new ATOM 0 H1' C A 3 -6.544 5.190 -5.366 1.00 0.00 H new ATOM 0 H41 C A 3 -4.290 2.825 0.353 1.00 0.00 H new ATOM 0 H42 C A 3 -2.879 3.489 -0.476 1.00 0.00 H new ATOM 0 H5 C A 3 -6.468 2.696 -0.682 1.00 0.00 H new ATOM 0 H6 C A 3 -7.768 3.156 -2.692 1.00 0.00 H new ATOM 98 P U A 4 -7.899 0.351 -7.711 1.00 0.00 P ATOM 99 OP1 U A 4 -8.569 0.067 -8.999 1.00 0.00 O ATOM 100 OP2 U A 4 -8.144 -0.527 -6.545 1.00 0.00 O ATOM 101 O5' U A 4 -6.309 0.413 -7.971 1.00 0.00 O ATOM 102 C5' U A 4 -5.787 1.097 -9.114 1.00 0.00 C ATOM 103 C4' U A 4 -4.356 1.583 -8.885 1.00 0.00 C ATOM 104 O4' U A 4 -4.172 2.073 -7.561 1.00 0.00 O ATOM 105 C3' U A 4 -3.348 0.458 -9.016 1.00 0.00 C ATOM 106 O3' U A 4 -2.975 0.331 -10.391 1.00 0.00 O ATOM 107 C2' U A 4 -2.153 0.993 -8.244 1.00 0.00 C ATOM 108 O2' U A 4 -1.289 1.764 -9.087 1.00 0.00 O ATOM 109 C1' U A 4 -2.804 1.867 -7.166 1.00 0.00 C ATOM 110 N1 U A 4 -2.720 1.213 -5.848 1.00 0.00 N ATOM 111 C2 U A 4 -1.585 1.450 -5.100 1.00 0.00 C ATOM 112 O2 U A 4 -0.685 2.188 -5.494 1.00 0.00 O ATOM 113 N3 U A 4 -1.518 0.809 -3.878 1.00 0.00 N ATOM 114 C4 U A 4 -2.475 -0.039 -3.347 1.00 0.00 C ATOM 115 O4 U A 4 -2.314 -0.560 -2.246 1.00 0.00 O ATOM 116 C5 U A 4 -3.629 -0.229 -4.196 1.00 0.00 C ATOM 117 C6 U A 4 -3.717 0.390 -5.398 1.00 0.00 C ATOM 0 H5' U A 4 -6.426 1.948 -9.350 1.00 0.00 H new ATOM 0 H5'' U A 4 -5.810 0.432 -9.977 1.00 0.00 H new ATOM 0 H4' U A 4 -4.202 2.358 -9.636 1.00 0.00 H new ATOM 0 H3' U A 4 -3.715 -0.506 -8.664 1.00 0.00 H new ATOM 0 H2' U A 4 -1.520 0.205 -7.835 1.00 0.00 H new ATOM 0 HO2' U A 4 -1.600 1.706 -10.014 1.00 0.00 H new ATOM 0 H1' U A 4 -2.289 2.823 -7.074 1.00 0.00 H new ATOM 0 H3 U A 4 -0.685 0.976 -3.314 1.00 0.00 H new ATOM 0 H5 U A 4 -4.432 -0.873 -3.868 1.00 0.00 H new ATOM 0 H6 U A 4 -4.591 0.231 -6.013 1.00 0.00 H new ATOM 128 P C A 5 -2.053 -0.897 -10.876 1.00 0.00 P ATOM 129 OP1 C A 5 -1.553 -0.592 -12.235 1.00 0.00 O ATOM 130 OP2 C A 5 -2.790 -2.156 -10.627 1.00 0.00 O ATOM 131 O5' C A 5 -0.809 -0.831 -9.855 1.00 0.00 O ATOM 132 C5' C A 5 0.243 0.116 -10.058 1.00 0.00 C ATOM 133 C4' C A 5 1.475 -0.211 -9.216 1.00 0.00 C ATOM 134 O4' C A 5 1.255 0.046 -7.833 1.00 0.00 O ATOM 135 C3' C A 5 1.819 -1.686 -9.278 1.00 0.00 C ATOM 136 O3' C A 5 2.673 -1.909 -10.404 1.00 0.00 O ATOM 137 C2' C A 5 2.634 -1.895 -8.010 1.00 0.00 C ATOM 138 O2' C A 5 4.031 -1.696 -8.250 1.00 0.00 O ATOM 139 C1' C A 5 2.076 -0.837 -7.051 1.00 0.00 C ATOM 140 N1 C A 5 1.299 -1.471 -5.970 1.00 0.00 N ATOM 141 C2 C A 5 1.919 -1.616 -4.740 1.00 0.00 C ATOM 142 O2 C A 5 3.068 -1.208 -4.578 1.00 0.00 O ATOM 143 N3 C A 5 1.227 -2.213 -3.733 1.00 0.00 N ATOM 144 C4 C A 5 -0.025 -2.652 -3.924 1.00 0.00 C ATOM 145 N4 C A 5 -0.671 -3.232 -2.913 1.00 0.00 N ATOM 146 C5 C A 5 -0.672 -2.505 -5.192 1.00 0.00 C ATOM 147 C6 C A 5 0.024 -1.911 -6.183 1.00 0.00 C ATOM 0 H5' C A 5 -0.114 1.115 -9.806 1.00 0.00 H new ATOM 0 H5'' C A 5 0.518 0.132 -11.113 1.00 0.00 H new ATOM 0 H4' C A 5 2.268 0.414 -9.626 1.00 0.00 H new ATOM 0 H3' C A 5 0.950 -2.338 -9.362 1.00 0.00 H new ATOM 0 H2' C A 5 2.554 -2.908 -7.616 1.00 0.00 H new ATOM 0 HO2' C A 5 4.174 -1.490 -9.197 1.00 0.00 H new ATOM 0 H1' C A 5 2.882 -0.282 -6.572 1.00 0.00 H new ATOM 0 H41 C A 5 -1.624 -3.571 -3.044 1.00 0.00 H new ATOM 0 H42 C A 5 -0.212 -3.337 -2.008 1.00 0.00 H new ATOM 0 H5 C A 5 -1.681 -2.857 -5.350 1.00 0.00 H new ATOM 0 H6 C A 5 -0.431 -1.782 -7.154 1.00 0.00 H new ATOM 159 P U A 6 2.970 -3.407 -10.918 1.00 0.00 P ATOM 160 OP1 U A 6 4.113 -3.356 -11.857 1.00 0.00 O ATOM 161 OP2 U A 6 1.690 -4.012 -11.346 1.00 0.00 O ATOM 162 O5' U A 6 3.454 -4.152 -9.575 1.00 0.00 O ATOM 163 C5' U A 6 4.777 -3.951 -9.071 1.00 0.00 C ATOM 164 C4' U A 6 4.967 -4.602 -7.704 1.00 0.00 C ATOM 165 O4' U A 6 3.833 -4.404 -6.862 1.00 0.00 O ATOM 166 C3' U A 6 5.096 -6.108 -7.817 1.00 0.00 C ATOM 167 O3' U A 6 6.469 -6.433 -8.053 1.00 0.00 O ATOM 168 C2' U A 6 4.718 -6.579 -6.422 1.00 0.00 C ATOM 169 O2' U A 6 5.861 -6.627 -5.559 1.00 0.00 O ATOM 170 C1' U A 6 3.715 -5.517 -5.957 1.00 0.00 C ATOM 171 N1 U A 6 2.343 -6.061 -5.948 1.00 0.00 N ATOM 172 C2 U A 6 1.932 -6.712 -4.801 1.00 0.00 C ATOM 173 O2 U A 6 2.665 -6.833 -3.821 1.00 0.00 O ATOM 174 N3 U A 6 0.647 -7.222 -4.815 1.00 0.00 N ATOM 175 C4 U A 6 -0.253 -7.138 -5.864 1.00 0.00 C ATOM 176 O4 U A 6 -1.375 -7.628 -5.766 1.00 0.00 O ATOM 177 C5 U A 6 0.259 -6.442 -7.023 1.00 0.00 C ATOM 178 C6 U A 6 1.516 -5.933 -7.033 1.00 0.00 C ATOM 0 H5' U A 6 4.979 -2.883 -8.996 1.00 0.00 H new ATOM 0 H5'' U A 6 5.501 -4.364 -9.774 1.00 0.00 H new ATOM 0 H4' U A 6 5.866 -4.141 -7.295 1.00 0.00 H new ATOM 0 H3' U A 6 4.494 -6.547 -8.613 1.00 0.00 H new ATOM 0 H2' U A 6 4.309 -7.589 -6.409 1.00 0.00 H new ATOM 0 HO2' U A 6 5.572 -6.530 -4.628 1.00 0.00 H new ATOM 0 H1' U A 6 3.928 -5.199 -4.936 1.00 0.00 H new ATOM 0 H3 U A 6 0.332 -7.705 -3.974 1.00 0.00 H new ATOM 0 H5 U A 6 -0.369 -6.326 -7.894 1.00 0.00 H new ATOM 0 H6 U A 6 1.872 -5.417 -7.913 1.00 0.00 H new ATOM 189 P C A 7 6.882 -7.389 -9.282 1.00 0.00 P ATOM 190 OP1 C A 7 7.402 -6.539 -10.376 1.00 0.00 O ATOM 191 OP2 C A 7 5.763 -8.321 -9.541 1.00 0.00 O ATOM 192 O5' C A 7 8.111 -8.236 -8.675 1.00 0.00 O ATOM 193 C5' C A 7 9.290 -7.573 -8.210 1.00 0.00 C ATOM 194 C4' C A 7 9.818 -8.208 -6.927 1.00 0.00 C ATOM 195 O4' C A 7 10.770 -7.357 -6.290 1.00 0.00 O ATOM 196 C3' C A 7 8.686 -8.432 -5.922 1.00 0.00 C ATOM 197 O3' C A 7 8.659 -9.822 -5.588 1.00 0.00 O ATOM 198 C2' C A 7 9.096 -7.652 -4.673 1.00 0.00 C ATOM 199 O2' C A 7 8.848 -8.408 -3.482 1.00 0.00 O ATOM 200 C1' C A 7 10.584 -7.419 -4.879 1.00 0.00 C ATOM 201 N1 C A 7 11.021 -6.168 -4.232 1.00 0.00 N ATOM 202 C2 C A 7 11.171 -6.182 -2.856 1.00 0.00 C ATOM 203 O2 C A 7 10.947 -7.210 -2.222 1.00 0.00 O ATOM 204 N3 C A 7 11.570 -5.036 -2.239 1.00 0.00 N ATOM 205 C4 C A 7 11.811 -3.924 -2.947 1.00 0.00 C ATOM 206 N4 C A 7 12.202 -2.817 -2.315 1.00 0.00 N ATOM 207 C5 C A 7 11.655 -3.907 -4.369 1.00 0.00 C ATOM 208 C6 C A 7 11.261 -5.045 -4.967 1.00 0.00 C ATOM 0 H5' C A 7 9.071 -6.520 -8.033 1.00 0.00 H new ATOM 0 H5'' C A 7 10.060 -7.613 -8.981 1.00 0.00 H new ATOM 0 H4' C A 7 10.276 -9.155 -7.214 1.00 0.00 H new ATOM 0 H3' C A 7 7.715 -8.122 -6.309 1.00 0.00 H new ATOM 0 H2' C A 7 8.534 -6.727 -4.546 1.00 0.00 H new ATOM 0 HO2' C A 7 9.506 -8.166 -2.798 1.00 0.00 H new ATOM 0 H1' C A 7 11.179 -8.215 -4.431 1.00 0.00 H new ATOM 0 H41 C A 7 12.388 -1.966 -2.845 1.00 0.00 H new ATOM 0 H42 C A 7 12.315 -2.822 -1.301 1.00 0.00 H new ATOM 0 H5 C A 7 11.847 -3.012 -4.942 1.00 0.00 H new ATOM 0 H6 C A 7 11.133 -5.070 -6.039 1.00 0.00 H new ATOM 220 P A A 8 7.450 -10.762 -6.086 1.00 0.00 P ATOM 221 OP1 A A 8 8.022 -11.867 -6.885 1.00 0.00 O ATOM 222 OP2 A A 8 6.400 -9.896 -6.667 1.00 0.00 O ATOM 223 O5' A A 8 6.892 -11.375 -4.705 1.00 0.00 O ATOM 224 C5' A A 8 6.697 -10.537 -3.563 1.00 0.00 C ATOM 225 C4' A A 8 5.401 -10.878 -2.832 1.00 0.00 C ATOM 226 O4' A A 8 4.265 -10.314 -3.500 1.00 0.00 O ATOM 227 C3' A A 8 5.172 -12.383 -2.812 1.00 0.00 C ATOM 228 O3' A A 8 4.408 -12.704 -1.647 1.00 0.00 O ATOM 229 C2' A A 8 4.303 -12.621 -4.033 1.00 0.00 C ATOM 230 O2' A A 8 3.487 -13.788 -3.877 1.00 0.00 O ATOM 231 C1' A A 8 3.462 -11.353 -4.083 1.00 0.00 C ATOM 232 N9 A A 8 3.088 -11.017 -5.471 1.00 0.00 N ATOM 233 C8 A A 8 3.788 -10.346 -6.418 1.00 0.00 C ATOM 234 N7 A A 8 3.222 -10.169 -7.565 1.00 0.00 N ATOM 235 C5 A A 8 1.987 -10.795 -7.369 1.00 0.00 C ATOM 236 C6 A A 8 0.876 -10.979 -8.200 1.00 0.00 C ATOM 237 N6 A A 8 0.820 -10.529 -9.454 1.00 0.00 N ATOM 238 N1 A A 8 -0.176 -11.643 -7.688 1.00 0.00 N ATOM 239 C2 A A 8 -0.140 -12.100 -6.434 1.00 0.00 C ATOM 240 N3 A A 8 0.857 -11.982 -5.563 1.00 0.00 N ATOM 241 C4 A A 8 1.898 -11.314 -6.098 1.00 0.00 C ATOM 0 H5' A A 8 6.675 -9.493 -3.876 1.00 0.00 H new ATOM 0 H5'' A A 8 7.540 -10.648 -2.881 1.00 0.00 H new ATOM 0 H4' A A 8 5.503 -10.476 -1.824 1.00 0.00 H new ATOM 0 H3' A A 8 6.092 -12.967 -2.809 1.00 0.00 H new ATOM 0 H2' A A 8 4.872 -12.802 -4.945 1.00 0.00 H new ATOM 0 HO2' A A 8 3.428 -14.022 -2.927 1.00 0.00 H new ATOM 0 H1' A A 8 2.528 -11.481 -3.537 1.00 0.00 H new ATOM 0 H8 A A 8 4.782 -9.973 -6.221 1.00 0.00 H new ATOM 0 H61 A A 8 -0.015 -10.691 -10.017 1.00 0.00 H new ATOM 0 H62 A A 8 1.612 -10.023 -9.850 1.00 0.00 H new ATOM 0 H2 A A 8 -1.019 -12.624 -6.089 1.00 0.00 H new ATOM 253 P G A 9 5.128 -12.861 -0.215 1.00 0.00 P ATOM 254 OP1 G A 9 6.328 -11.997 -0.204 1.00 0.00 O ATOM 255 OP2 G A 9 5.255 -14.306 0.080 1.00 0.00 O ATOM 256 O5' G A 9 4.043 -12.233 0.795 1.00 0.00 O ATOM 257 C5' G A 9 3.962 -10.818 0.988 1.00 0.00 C ATOM 258 C4' G A 9 4.562 -10.407 2.339 1.00 0.00 C ATOM 259 O4' G A 9 5.992 -10.438 2.260 1.00 0.00 O ATOM 260 C3' G A 9 4.178 -8.971 2.746 1.00 0.00 C ATOM 261 O3' G A 9 3.332 -9.053 3.897 1.00 0.00 O ATOM 262 C2' G A 9 5.497 -8.346 3.228 1.00 0.00 C ATOM 263 O2' G A 9 5.654 -8.494 4.643 1.00 0.00 O ATOM 264 C1' G A 9 6.541 -9.134 2.476 1.00 0.00 C ATOM 265 N9 G A 9 6.882 -8.449 1.216 1.00 0.00 N ATOM 266 C8 G A 9 8.046 -7.866 0.856 1.00 0.00 C ATOM 267 N7 G A 9 8.097 -7.275 -0.289 1.00 0.00 N ATOM 268 C5 G A 9 6.802 -7.482 -0.772 1.00 0.00 C ATOM 269 C6 G A 9 6.213 -7.071 -1.998 1.00 0.00 C ATOM 270 O6 G A 9 6.727 -6.434 -2.914 1.00 0.00 O ATOM 271 N1 G A 9 4.890 -7.483 -2.090 1.00 0.00 N ATOM 272 C2 G A 9 4.212 -8.200 -1.124 1.00 0.00 C ATOM 273 N2 G A 9 2.943 -8.504 -1.398 1.00 0.00 N ATOM 274 N3 G A 9 4.761 -8.590 0.032 1.00 0.00 N ATOM 275 C4 G A 9 6.049 -8.202 0.144 1.00 0.00 C ATOM 0 H5' G A 9 2.920 -10.501 0.938 1.00 0.00 H new ATOM 0 H5'' G A 9 4.490 -10.308 0.182 1.00 0.00 H new ATOM 0 H4' G A 9 4.170 -11.110 3.074 1.00 0.00 H new ATOM 0 H3' G A 9 3.691 -8.421 1.940 1.00 0.00 H new ATOM 0 H2' G A 9 5.556 -7.273 3.044 1.00 0.00 H new ATOM 0 HO2' G A 9 4.806 -8.788 5.037 1.00 0.00 H new ATOM 0 H1' G A 9 7.473 -9.218 3.036 1.00 0.00 H new ATOM 0 H8 G A 9 8.907 -7.894 1.507 1.00 0.00 H new ATOM 0 H1 G A 9 4.379 -7.237 -2.938 1.00 0.00 H new ATOM 0 H21 G A 9 2.388 -9.032 -0.725 1.00 0.00 H new ATOM 0 H22 G A 9 2.527 -8.208 -2.281 1.00 0.00 H new ATOM 287 P U A 10 1.779 -8.631 3.802 1.00 0.00 P ATOM 288 OP1 U A 10 1.046 -9.313 4.892 1.00 0.00 O ATOM 289 OP2 U A 10 1.339 -8.798 2.399 1.00 0.00 O ATOM 290 O5' U A 10 1.821 -7.055 4.130 1.00 0.00 O ATOM 291 C5' U A 10 0.908 -6.482 5.071 1.00 0.00 C ATOM 292 C4' U A 10 0.307 -5.176 4.543 1.00 0.00 C ATOM 293 O4' U A 10 -1.010 -5.389 4.022 1.00 0.00 O ATOM 294 C3' U A 10 0.165 -4.129 5.646 1.00 0.00 C ATOM 295 O3' U A 10 0.315 -2.837 5.050 1.00 0.00 O ATOM 296 C2' U A 10 -1.283 -4.274 6.091 1.00 0.00 C ATOM 297 O2' U A 10 -1.799 -3.041 6.607 1.00 0.00 O ATOM 298 C1' U A 10 -1.980 -4.672 4.799 1.00 0.00 C ATOM 299 N1 U A 10 -3.156 -5.517 5.071 1.00 0.00 N ATOM 300 C2 U A 10 -4.368 -4.885 5.274 1.00 0.00 C ATOM 301 O2 U A 10 -4.485 -3.663 5.231 1.00 0.00 O ATOM 302 N3 U A 10 -5.447 -5.713 5.529 1.00 0.00 N ATOM 303 C4 U A 10 -5.417 -7.097 5.596 1.00 0.00 C ATOM 304 O4 U A 10 -6.439 -7.736 5.833 1.00 0.00 O ATOM 305 C5 U A 10 -4.108 -7.667 5.371 1.00 0.00 C ATOM 306 C6 U A 10 -3.039 -6.876 5.121 1.00 0.00 C ATOM 0 H5' U A 10 1.424 -6.292 6.012 1.00 0.00 H new ATOM 0 H5'' U A 10 0.109 -7.192 5.284 1.00 0.00 H new ATOM 0 H4' U A 10 0.990 -4.828 3.768 1.00 0.00 H new ATOM 0 H3' U A 10 0.886 -4.246 6.455 1.00 0.00 H new ATOM 0 H2' U A 10 -1.421 -4.992 6.899 1.00 0.00 H new ATOM 0 HO2' U A 10 -1.325 -2.289 6.194 1.00 0.00 H new ATOM 0 H1' U A 10 -2.344 -3.794 4.266 1.00 0.00 H new ATOM 0 H3 U A 10 -6.349 -5.262 5.682 1.00 0.00 H new ATOM 0 H5 U A 10 -3.981 -8.739 5.403 1.00 0.00 H new ATOM 0 H6 U A 10 -2.073 -7.330 4.958 1.00 0.00 H new ATOM 317 P G A 11 1.458 -1.828 5.569 1.00 0.00 P ATOM 318 OP1 G A 11 1.560 -1.962 7.040 1.00 0.00 O ATOM 319 OP2 G A 11 1.212 -0.499 4.965 1.00 0.00 O ATOM 320 O5' G A 11 2.795 -2.441 4.911 1.00 0.00 O ATOM 321 C5' G A 11 3.844 -2.950 5.738 1.00 0.00 C ATOM 322 C4' G A 11 5.205 -2.810 5.064 1.00 0.00 C ATOM 323 O4' G A 11 5.534 -3.990 4.314 1.00 0.00 O ATOM 324 C3' G A 11 5.201 -1.652 4.066 1.00 0.00 C ATOM 325 O3' G A 11 5.946 -0.566 4.628 1.00 0.00 O ATOM 326 C2' G A 11 5.974 -2.200 2.878 1.00 0.00 C ATOM 327 O2' G A 11 7.386 -2.016 3.037 1.00 0.00 O ATOM 328 C1' G A 11 5.595 -3.665 2.924 1.00 0.00 C ATOM 329 N9 G A 11 4.294 -3.896 2.269 1.00 0.00 N ATOM 330 C8 G A 11 3.185 -4.510 2.749 1.00 0.00 C ATOM 331 N7 G A 11 2.155 -4.577 1.975 1.00 0.00 N ATOM 332 C5 G A 11 2.620 -3.929 0.827 1.00 0.00 C ATOM 333 C6 G A 11 1.955 -3.670 -0.402 1.00 0.00 C ATOM 334 O6 G A 11 0.808 -3.967 -0.722 1.00 0.00 O ATOM 335 N1 G A 11 2.778 -2.993 -1.295 1.00 0.00 N ATOM 336 C2 G A 11 4.081 -2.612 -1.041 1.00 0.00 C ATOM 337 N2 G A 11 4.712 -1.970 -2.026 1.00 0.00 N ATOM 338 N3 G A 11 4.713 -2.852 0.113 1.00 0.00 N ATOM 339 C4 G A 11 3.931 -3.510 0.998 1.00 0.00 C ATOM 0 H5' G A 11 3.655 -4.000 5.963 1.00 0.00 H new ATOM 0 H5'' G A 11 3.851 -2.416 6.688 1.00 0.00 H new ATOM 0 H4' G A 11 5.929 -2.641 5.861 1.00 0.00 H new ATOM 0 H3' G A 11 4.200 -1.303 3.810 1.00 0.00 H new ATOM 0 H2' G A 11 5.742 -1.710 1.932 1.00 0.00 H new ATOM 0 HO2' G A 11 7.552 -1.342 3.729 1.00 0.00 H new ATOM 0 H1' G A 11 6.315 -4.288 2.392 1.00 0.00 H new ATOM 0 H8 G A 11 3.164 -4.928 3.744 1.00 0.00 H new ATOM 0 H1 G A 11 2.389 -2.760 -2.209 1.00 0.00 H new ATOM 0 H21 G A 11 5.676 -1.663 -1.899 1.00 0.00 H new ATOM 0 H22 G A 11 4.230 -1.786 -2.906 1.00 0.00 H new ATOM 351 P A A 12 5.204 0.800 5.055 1.00 0.00 P ATOM 352 OP1 A A 12 6.020 1.462 6.098 1.00 0.00 O ATOM 353 OP2 A A 12 3.781 0.491 5.318 1.00 0.00 O ATOM 354 O5' A A 12 5.289 1.685 3.709 1.00 0.00 O ATOM 355 C5' A A 12 6.448 2.478 3.433 1.00 0.00 C ATOM 356 C4' A A 12 6.676 2.644 1.932 1.00 0.00 C ATOM 357 O4' A A 12 6.395 1.435 1.225 1.00 0.00 O ATOM 358 C3' A A 12 5.735 3.680 1.340 1.00 0.00 C ATOM 359 O3' A A 12 6.381 4.957 1.387 1.00 0.00 O ATOM 360 C2' A A 12 5.637 3.246 -0.117 1.00 0.00 C ATOM 361 O2' A A 12 6.708 3.789 -0.898 1.00 0.00 O ATOM 362 C1' A A 12 5.732 1.731 -0.018 1.00 0.00 C ATOM 363 N9 A A 12 4.388 1.124 -0.069 1.00 0.00 N ATOM 364 C8 A A 12 3.789 0.273 0.799 1.00 0.00 C ATOM 365 N7 A A 12 2.598 -0.130 0.513 1.00 0.00 N ATOM 366 C5 A A 12 2.358 0.531 -0.696 1.00 0.00 C ATOM 367 C6 A A 12 1.261 0.550 -1.562 1.00 0.00 C ATOM 368 N6 A A 12 0.147 -0.148 -1.340 1.00 0.00 N ATOM 369 N1 A A 12 1.358 1.311 -2.668 1.00 0.00 N ATOM 370 C2 A A 12 2.468 2.014 -2.908 1.00 0.00 C ATOM 371 N3 A A 12 3.563 2.068 -2.156 1.00 0.00 N ATOM 372 C4 A A 12 3.443 1.298 -1.056 1.00 0.00 C ATOM 0 H5' A A 12 7.324 2.012 3.884 1.00 0.00 H new ATOM 0 H5'' A A 12 6.336 3.459 3.895 1.00 0.00 H new ATOM 0 H4' A A 12 7.720 2.940 1.826 1.00 0.00 H new ATOM 0 H3' A A 12 4.774 3.751 1.850 1.00 0.00 H new ATOM 0 H2' A A 12 4.729 3.591 -0.612 1.00 0.00 H new ATOM 0 HO2' A A 12 7.047 4.602 -0.468 1.00 0.00 H new ATOM 0 H1' A A 12 6.294 1.316 -0.855 1.00 0.00 H new ATOM 0 H8 A A 12 4.291 -0.056 1.697 1.00 0.00 H new ATOM 0 H61 A A 12 -0.626 -0.100 -2.004 1.00 0.00 H new ATOM 0 H62 A A 12 0.068 -0.730 -0.506 1.00 0.00 H new ATOM 0 H2 A A 12 2.477 2.604 -3.813 1.00 0.00 H new ATOM 384 P G A 13 5.522 6.299 1.625 1.00 0.00 P ATOM 385 OP1 G A 13 6.445 7.366 2.072 1.00 0.00 O ATOM 386 OP2 G A 13 4.342 5.952 2.447 1.00 0.00 O ATOM 387 O5' G A 13 5.013 6.662 0.140 1.00 0.00 O ATOM 388 C5' G A 13 5.772 7.542 -0.696 1.00 0.00 C ATOM 389 C4' G A 13 5.136 7.691 -2.077 1.00 0.00 C ATOM 390 O4' G A 13 4.741 6.418 -2.608 1.00 0.00 O ATOM 391 C3' G A 13 3.868 8.533 -2.013 1.00 0.00 C ATOM 392 O3' G A 13 4.194 9.876 -2.381 1.00 0.00 O ATOM 393 C2' G A 13 3.001 7.932 -3.104 1.00 0.00 C ATOM 394 O2' G A 13 3.316 8.476 -4.391 1.00 0.00 O ATOM 395 C1' G A 13 3.365 6.462 -3.015 1.00 0.00 C ATOM 396 N9 G A 13 2.500 5.774 -2.040 1.00 0.00 N ATOM 397 C8 G A 13 2.782 5.351 -0.785 1.00 0.00 C ATOM 398 N7 G A 13 1.829 4.802 -0.110 1.00 0.00 N ATOM 399 C5 G A 13 0.768 4.857 -1.017 1.00 0.00 C ATOM 400 C6 G A 13 -0.574 4.410 -0.879 1.00 0.00 C ATOM 401 O6 G A 13 -1.100 3.868 0.090 1.00 0.00 O ATOM 402 N1 G A 13 -1.314 4.656 -2.029 1.00 0.00 N ATOM 403 C2 G A 13 -0.829 5.258 -3.173 1.00 0.00 C ATOM 404 N2 G A 13 -1.695 5.408 -4.173 1.00 0.00 N ATOM 405 N3 G A 13 0.431 5.681 -3.311 1.00 0.00 N ATOM 406 C4 G A 13 1.171 5.452 -2.204 1.00 0.00 C ATOM 0 H5' G A 13 6.787 7.160 -0.801 1.00 0.00 H new ATOM 0 H5'' G A 13 5.848 8.521 -0.222 1.00 0.00 H new ATOM 0 H4' G A 13 5.891 8.163 -2.706 1.00 0.00 H new ATOM 0 H3' G A 13 3.396 8.542 -1.030 1.00 0.00 H new ATOM 0 H2' G A 13 1.937 8.131 -2.979 1.00 0.00 H new ATOM 0 HO2' G A 13 3.836 9.299 -4.280 1.00 0.00 H new ATOM 0 H1' G A 13 3.223 5.954 -3.969 1.00 0.00 H new ATOM 0 H8 G A 13 3.769 5.469 -0.364 1.00 0.00 H new ATOM 0 H1 G A 13 -2.293 4.369 -2.028 1.00 0.00 H new ATOM 0 H21 G A 13 -1.397 5.846 -5.045 1.00 0.00 H new ATOM 0 H22 G A 13 -2.657 5.085 -4.067 1.00 0.00 H new ATOM 418 P C A 14 3.579 11.117 -1.561 1.00 0.00 P ATOM 419 OP1 C A 14 4.258 12.353 -2.010 1.00 0.00 O ATOM 420 OP2 C A 14 3.566 10.762 -0.124 1.00 0.00 O ATOM 421 O5' C A 14 2.056 11.160 -2.082 1.00 0.00 O ATOM 422 C5' C A 14 1.752 11.661 -3.385 1.00 0.00 C ATOM 423 C4' C A 14 0.438 11.095 -3.917 1.00 0.00 C ATOM 424 O4' C A 14 0.296 9.710 -3.614 1.00 0.00 O ATOM 425 C3' C A 14 -0.752 11.755 -3.255 1.00 0.00 C ATOM 426 O3' C A 14 -1.086 12.932 -3.994 1.00 0.00 O ATOM 427 C2' C A 14 -1.859 10.729 -3.451 1.00 0.00 C ATOM 428 O2' C A 14 -2.568 10.956 -4.675 1.00 0.00 O ATOM 429 C1' C A 14 -1.102 9.397 -3.484 1.00 0.00 C ATOM 430 N1 C A 14 -1.363 8.620 -2.257 1.00 0.00 N ATOM 431 C2 C A 14 -2.610 8.029 -2.136 1.00 0.00 C ATOM 432 O2 C A 14 -3.437 8.149 -3.036 1.00 0.00 O ATOM 433 N3 C A 14 -2.882 7.322 -1.005 1.00 0.00 N ATOM 434 C4 C A 14 -1.968 7.200 -0.034 1.00 0.00 C ATOM 435 N4 C A 14 -2.264 6.501 1.061 1.00 0.00 N ATOM 436 C5 C A 14 -0.679 7.810 -0.156 1.00 0.00 C ATOM 437 C6 C A 14 -0.419 8.506 -1.278 1.00 0.00 C ATOM 0 H5' C A 14 2.561 11.407 -4.070 1.00 0.00 H new ATOM 0 H5'' C A 14 1.692 12.749 -3.351 1.00 0.00 H new ATOM 0 H4' C A 14 0.465 11.273 -4.992 1.00 0.00 H new ATOM 0 H3' C A 14 -0.584 12.031 -2.214 1.00 0.00 H new ATOM 0 H2' C A 14 -2.618 10.767 -2.670 1.00 0.00 H new ATOM 0 HO2' C A 14 -2.186 11.732 -5.135 1.00 0.00 H new ATOM 0 H1' C A 14 -1.432 8.782 -4.321 1.00 0.00 H new ATOM 0 H41 C A 14 -1.574 6.403 1.806 1.00 0.00 H new ATOM 0 H42 C A 14 -3.181 6.064 1.155 1.00 0.00 H new ATOM 0 H5 C A 14 0.060 7.715 0.626 1.00 0.00 H new ATOM 0 H6 C A 14 0.544 8.978 -1.405 1.00 0.00 H new ATOM 449 P C A 15 -2.011 14.072 -3.335 1.00 0.00 P ATOM 450 OP1 C A 15 -1.965 15.268 -4.206 1.00 0.00 O ATOM 451 OP2 C A 15 -1.653 14.187 -1.903 1.00 0.00 O ATOM 452 O5' C A 15 -3.483 13.430 -3.435 1.00 0.00 O ATOM 453 C5' C A 15 -4.242 13.536 -4.642 1.00 0.00 C ATOM 454 C4' C A 15 -5.728 13.312 -4.386 1.00 0.00 C ATOM 455 O4' C A 15 -5.978 11.975 -3.938 1.00 0.00 O ATOM 456 C3' C A 15 -6.232 14.234 -3.283 1.00 0.00 C ATOM 457 O3' C A 15 -6.738 15.462 -3.816 1.00 0.00 O ATOM 458 C2' C A 15 -7.333 13.410 -2.641 1.00 0.00 C ATOM 459 O2' C A 15 -8.577 13.562 -3.337 1.00 0.00 O ATOM 460 C1' C A 15 -6.794 11.995 -2.761 1.00 0.00 C ATOM 461 N1 C A 15 -6.011 11.627 -1.566 1.00 0.00 N ATOM 462 C2 C A 15 -6.676 10.957 -0.552 1.00 0.00 C ATOM 463 O2 C A 15 -7.870 10.688 -0.673 1.00 0.00 O ATOM 464 N3 C A 15 -5.976 10.613 0.561 1.00 0.00 N ATOM 465 C4 C A 15 -4.675 10.914 0.677 1.00 0.00 C ATOM 466 N4 C A 15 -4.020 10.564 1.782 1.00 0.00 N ATOM 467 C5 C A 15 -3.984 11.606 -0.367 1.00 0.00 C ATOM 468 C6 C A 15 -4.687 11.943 -1.466 1.00 0.00 C ATOM 0 H5' C A 15 -3.882 12.805 -5.366 1.00 0.00 H new ATOM 0 H5'' C A 15 -4.092 14.521 -5.083 1.00 0.00 H new ATOM 0 H4' C A 15 -6.238 13.509 -5.329 1.00 0.00 H new ATOM 0 H3' C A 15 -5.454 14.536 -2.582 1.00 0.00 H new ATOM 0 H2' C A 15 -7.554 13.704 -1.615 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.614 14.449 -3.751 1.00 0.00 H new ATOM 0 HO3' C A 15 -7.055 16.031 -3.083 1.00 0.00 H new ATOM 0 H1' C A 15 -7.604 11.269 -2.834 1.00 0.00 H new ATOM 0 H41 C A 15 -3.030 10.788 1.881 1.00 0.00 H new ATOM 0 H42 C A 15 -4.508 10.072 2.530 1.00 0.00 H new ATOM 0 H5 C A 15 -2.936 11.850 -0.277 1.00 0.00 H new ATOM 0 H6 C A 15 -4.199 12.467 -2.274 1.00 0.00 H new TER 481 C A 15