USER MOD reduce.3.24.130724 H: found=0, std=0, add=133, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 133 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 -14:sc= 0.146 USER MOD Single : A 1 G O5' : rot 180:sc= -1.36 USER MOD Single : A 2 G O2' : rot -12:sc= 0.186 USER MOD Single : A 3 G O2' : rot -15:sc= 0.309 USER MOD Single : A 4 C O2' : rot -18:sc= 0.227 USER MOD Single : A 5 G O2' : rot -72:sc= 0.641! USER MOD Single : A 6 C O2' : rot -16:sc= 0.254 USER MOD Single : A 7 A O2' : rot -18:sc= 0.235 USER MOD Single : A 8 A O2' : rot -28:sc= 0.297 USER MOD Single : A 9 G O2' : rot -139:sc= -0.968 USER MOD Single : A 10 C O2' : rot -10:sc= -1.28! USER MOD Single : A 11 C O2' : rot -13:sc= -0.221 USER MOD Single : A 12 U O2' : rot -24:sc= 0.107 USER MOD Single : A 12 U O3' : rot 180:sc= 0.133 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -10.178 -5.188 -2.094 1.00 0.00 O ATOM 2 C5' G A 1 -10.742 -5.852 -3.230 1.00 0.00 C ATOM 3 C4' G A 1 -10.796 -4.938 -4.453 1.00 0.00 C ATOM 4 O4' G A 1 -11.581 -3.762 -4.197 1.00 0.00 O ATOM 5 C3' G A 1 -9.409 -4.426 -4.823 1.00 0.00 C ATOM 6 O3' G A 1 -8.816 -5.323 -5.769 1.00 0.00 O ATOM 7 C2' G A 1 -9.742 -3.126 -5.522 1.00 0.00 C ATOM 8 O2' G A 1 -10.204 -3.345 -6.861 1.00 0.00 O ATOM 9 C1' G A 1 -10.848 -2.599 -4.624 1.00 0.00 C ATOM 10 N9 G A 1 -10.284 -1.871 -3.472 1.00 0.00 N ATOM 11 C8 G A 1 -10.155 -2.264 -2.183 1.00 0.00 C ATOM 12 N7 G A 1 -9.602 -1.441 -1.357 1.00 0.00 N ATOM 13 C5 G A 1 -9.319 -0.353 -2.189 1.00 0.00 C ATOM 14 C6 G A 1 -8.702 0.890 -1.887 1.00 0.00 C ATOM 15 O6 G A 1 -8.276 1.293 -0.807 1.00 0.00 O ATOM 16 N1 G A 1 -8.610 1.695 -3.011 1.00 0.00 N ATOM 17 C2 G A 1 -9.052 1.358 -4.270 1.00 0.00 C ATOM 18 N2 G A 1 -8.874 2.269 -5.219 1.00 0.00 N ATOM 19 N3 G A 1 -9.633 0.195 -4.565 1.00 0.00 N ATOM 20 C4 G A 1 -9.735 -0.611 -3.486 1.00 0.00 C ATOM 0 H5' G A 1 -11.748 -6.195 -2.988 1.00 0.00 H new ATOM 0 H5'' G A 1 -10.151 -6.737 -3.464 1.00 0.00 H new ATOM 0 H4' G A 1 -11.229 -5.541 -5.251 1.00 0.00 H new ATOM 0 H3' G A 1 -8.724 -4.327 -3.981 1.00 0.00 H new ATOM 0 H2' G A 1 -8.896 -2.449 -5.643 1.00 0.00 H new ATOM 0 HO2' G A 1 -10.000 -4.265 -7.131 1.00 0.00 H new ATOM 0 HO5' G A 1 -10.161 -5.803 -1.331 1.00 0.00 H new ATOM 0 H1' G A 1 -11.492 -1.891 -5.145 1.00 0.00 H new ATOM 0 H8 G A 1 -10.503 -3.233 -1.857 1.00 0.00 H new ATOM 0 H1 G A 1 -8.179 2.612 -2.896 1.00 0.00 H new ATOM 0 H21 G A 1 -9.181 2.078 -6.173 1.00 0.00 H new ATOM 0 H22 G A 1 -8.431 3.160 -4.994 1.00 0.00 H new ATOM 33 P G A 2 -7.217 -5.522 -5.818 1.00 0.00 P ATOM 34 OP1 G A 2 -6.904 -6.500 -6.884 1.00 0.00 O ATOM 35 OP2 G A 2 -6.737 -5.757 -4.437 1.00 0.00 O ATOM 36 O5' G A 2 -6.693 -4.072 -6.293 1.00 0.00 O ATOM 37 C5' G A 2 -6.955 -3.597 -7.619 1.00 0.00 C ATOM 38 C4' G A 2 -6.782 -2.082 -7.726 1.00 0.00 C ATOM 39 O4' G A 2 -7.566 -1.394 -6.742 1.00 0.00 O ATOM 40 C3' G A 2 -5.346 -1.661 -7.453 1.00 0.00 C ATOM 41 O3' G A 2 -4.613 -1.667 -8.684 1.00 0.00 O ATOM 42 C2' G A 2 -5.522 -0.227 -7.003 1.00 0.00 C ATOM 43 O2' G A 2 -5.693 0.659 -8.116 1.00 0.00 O ATOM 44 C1' G A 2 -6.788 -0.327 -6.166 1.00 0.00 C ATOM 45 N9 G A 2 -6.456 -0.601 -4.756 1.00 0.00 N ATOM 46 C8 G A 2 -6.659 -1.721 -4.025 1.00 0.00 C ATOM 47 N7 G A 2 -6.271 -1.712 -2.794 1.00 0.00 N ATOM 48 C5 G A 2 -5.732 -0.426 -2.675 1.00 0.00 C ATOM 49 C6 G A 2 -5.131 0.214 -1.559 1.00 0.00 C ATOM 50 O6 G A 2 -4.954 -0.227 -0.426 1.00 0.00 O ATOM 51 N1 G A 2 -4.723 1.500 -1.870 1.00 0.00 N ATOM 52 C2 G A 2 -4.872 2.106 -3.097 1.00 0.00 C ATOM 53 N2 G A 2 -4.395 3.339 -3.201 1.00 0.00 N ATOM 54 N3 G A 2 -5.437 1.518 -4.151 1.00 0.00 N ATOM 55 C4 G A 2 -5.843 0.259 -3.875 1.00 0.00 C ATOM 0 H5' G A 2 -7.971 -3.868 -7.908 1.00 0.00 H new ATOM 0 H5'' G A 2 -6.282 -4.090 -8.321 1.00 0.00 H new ATOM 0 H4' G A 2 -7.090 -1.828 -8.740 1.00 0.00 H new ATOM 0 H3' G A 2 -4.820 -2.300 -6.743 1.00 0.00 H new ATOM 0 H2' G A 2 -4.665 0.178 -6.465 1.00 0.00 H new ATOM 0 HO2' G A 2 -5.468 0.189 -8.946 1.00 0.00 H new ATOM 0 H1' G A 2 -7.350 0.607 -6.173 1.00 0.00 H new ATOM 0 H8 G A 2 -7.129 -2.592 -4.456 1.00 0.00 H new ATOM 0 H1 G A 2 -4.276 2.042 -1.130 1.00 0.00 H new ATOM 0 H21 G A 2 -4.474 3.844 -4.084 1.00 0.00 H new ATOM 0 H22 G A 2 -3.949 3.783 -2.398 1.00 0.00 H new ATOM 67 P G A 3 -3.029 -1.969 -8.693 1.00 0.00 P ATOM 68 OP1 G A 3 -2.590 -2.104 -10.101 1.00 0.00 O ATOM 69 OP2 G A 3 -2.755 -3.056 -7.727 1.00 0.00 O ATOM 70 O5' G A 3 -2.411 -0.602 -8.101 1.00 0.00 O ATOM 71 C5' G A 3 -2.408 0.599 -8.886 1.00 0.00 C ATOM 72 C4' G A 3 -1.827 1.783 -8.115 1.00 0.00 C ATOM 73 O4' G A 3 -2.576 2.059 -6.929 1.00 0.00 O ATOM 74 C3' G A 3 -0.416 1.493 -7.636 1.00 0.00 C ATOM 75 O3' G A 3 0.499 1.877 -8.672 1.00 0.00 O ATOM 76 C2' G A 3 -0.269 2.451 -6.466 1.00 0.00 C ATOM 77 O2' G A 3 0.133 3.757 -6.901 1.00 0.00 O ATOM 78 C1' G A 3 -1.682 2.467 -5.877 1.00 0.00 C ATOM 79 N9 G A 3 -1.793 1.564 -4.716 1.00 0.00 N ATOM 80 C8 G A 3 -2.285 0.301 -4.648 1.00 0.00 C ATOM 81 N7 G A 3 -2.305 -0.271 -3.491 1.00 0.00 N ATOM 82 C5 G A 3 -1.759 0.723 -2.672 1.00 0.00 C ATOM 83 C6 G A 3 -1.512 0.716 -1.274 1.00 0.00 C ATOM 84 O6 G A 3 -1.727 -0.182 -0.467 1.00 0.00 O ATOM 85 N1 G A 3 -0.954 1.912 -0.850 1.00 0.00 N ATOM 86 C2 G A 3 -0.668 2.986 -1.661 1.00 0.00 C ATOM 87 N2 G A 3 -0.131 4.045 -1.065 1.00 0.00 N ATOM 88 N3 G A 3 -0.897 3.006 -2.976 1.00 0.00 N ATOM 89 C4 G A 3 -1.442 1.849 -3.415 1.00 0.00 C ATOM 0 H5' G A 3 -3.427 0.832 -9.196 1.00 0.00 H new ATOM 0 H5'' G A 3 -1.828 0.437 -9.794 1.00 0.00 H new ATOM 0 H4' G A 3 -1.854 2.622 -8.810 1.00 0.00 H new ATOM 0 H3' G A 3 -0.229 0.450 -7.380 1.00 0.00 H new ATOM 0 H2' G A 3 0.498 2.150 -5.752 1.00 0.00 H new ATOM 0 HO2' G A 3 0.455 3.709 -7.825 1.00 0.00 H new ATOM 0 H1' G A 3 -1.932 3.465 -5.515 1.00 0.00 H new ATOM 0 H8 G A 3 -2.647 -0.207 -5.530 1.00 0.00 H new ATOM 0 H1 G A 3 -0.738 2.003 0.143 1.00 0.00 H new ATOM 0 H21 G A 3 0.104 4.873 -1.612 1.00 0.00 H new ATOM 0 H22 G A 3 0.046 4.030 -0.061 1.00 0.00 H new ATOM 101 P C A 4 1.998 1.292 -8.714 1.00 0.00 P ATOM 102 OP1 C A 4 2.600 1.653 -10.017 1.00 0.00 O ATOM 103 OP2 C A 4 1.955 -0.126 -8.288 1.00 0.00 O ATOM 104 O5' C A 4 2.734 2.147 -7.564 1.00 0.00 O ATOM 105 C5' C A 4 3.631 1.517 -6.643 1.00 0.00 C ATOM 106 C4' C A 4 3.822 2.359 -5.383 1.00 0.00 C ATOM 107 O4' C A 4 2.576 2.576 -4.704 1.00 0.00 O ATOM 108 C3' C A 4 4.715 1.647 -4.378 1.00 0.00 C ATOM 109 O3' C A 4 6.074 2.037 -4.614 1.00 0.00 O ATOM 110 C2' C A 4 4.251 2.251 -3.068 1.00 0.00 C ATOM 111 O2' C A 4 4.819 3.548 -2.853 1.00 0.00 O ATOM 112 C1' C A 4 2.745 2.329 -3.298 1.00 0.00 C ATOM 113 N1 C A 4 2.073 1.074 -2.891 1.00 0.00 N ATOM 114 C2 C A 4 1.870 0.864 -1.534 1.00 0.00 C ATOM 115 O2 C A 4 2.245 1.698 -0.716 1.00 0.00 O ATOM 116 N3 C A 4 1.243 -0.279 -1.144 1.00 0.00 N ATOM 117 C4 C A 4 0.833 -1.179 -2.046 1.00 0.00 C ATOM 118 N4 C A 4 0.214 -2.280 -1.630 1.00 0.00 N ATOM 119 C5 C A 4 1.042 -0.971 -3.444 1.00 0.00 C ATOM 120 C6 C A 4 1.661 0.163 -3.821 1.00 0.00 C ATOM 0 H5' C A 4 4.596 1.357 -7.125 1.00 0.00 H new ATOM 0 H5'' C A 4 3.244 0.535 -6.371 1.00 0.00 H new ATOM 0 H4' C A 4 4.262 3.299 -5.717 1.00 0.00 H new ATOM 0 H3' C A 4 4.663 0.559 -4.416 1.00 0.00 H new ATOM 0 H2' C A 4 4.541 1.681 -2.185 1.00 0.00 H new ATOM 0 HO2' C A 4 5.602 3.662 -3.432 1.00 0.00 H new ATOM 0 H1' C A 4 2.293 3.119 -2.698 1.00 0.00 H new ATOM 0 H41 C A 4 -0.103 -2.973 -2.307 1.00 0.00 H new ATOM 0 H42 C A 4 0.057 -2.431 -0.634 1.00 0.00 H new ATOM 0 H5 C A 4 0.715 -1.698 -4.172 1.00 0.00 H new ATOM 0 H6 C A 4 1.834 0.354 -4.870 1.00 0.00 H new ATOM 132 P G A 5 7.265 0.955 -4.518 1.00 0.00 P ATOM 133 OP1 G A 5 8.527 1.619 -4.916 1.00 0.00 O ATOM 134 OP2 G A 5 6.828 -0.278 -5.211 1.00 0.00 O ATOM 135 O5' G A 5 7.331 0.649 -2.937 1.00 0.00 O ATOM 136 C5' G A 5 7.919 1.591 -2.034 1.00 0.00 C ATOM 137 C4' G A 5 7.591 1.265 -0.579 1.00 0.00 C ATOM 138 O4' G A 5 6.176 1.285 -0.342 1.00 0.00 O ATOM 139 C3' G A 5 8.054 -0.138 -0.208 1.00 0.00 C ATOM 140 O3' G A 5 9.400 -0.050 0.296 1.00 0.00 O ATOM 141 C2' G A 5 7.099 -0.491 0.920 1.00 0.00 C ATOM 142 O2' G A 5 7.499 0.095 2.168 1.00 0.00 O ATOM 143 C1' G A 5 5.798 0.119 0.409 1.00 0.00 C ATOM 144 N9 G A 5 5.047 -0.832 -0.434 1.00 0.00 N ATOM 145 C8 G A 5 5.004 -0.950 -1.784 1.00 0.00 C ATOM 146 N7 G A 5 4.258 -1.880 -2.280 1.00 0.00 N ATOM 147 C5 G A 5 3.731 -2.467 -1.125 1.00 0.00 C ATOM 148 C6 G A 5 2.832 -3.558 -0.983 1.00 0.00 C ATOM 149 O6 G A 5 2.310 -4.237 -1.862 1.00 0.00 O ATOM 150 N1 G A 5 2.563 -3.823 0.350 1.00 0.00 N ATOM 151 C2 G A 5 3.088 -3.129 1.418 1.00 0.00 C ATOM 152 N2 G A 5 2.703 -3.524 2.622 1.00 0.00 N ATOM 153 N3 G A 5 3.930 -2.106 1.298 1.00 0.00 N ATOM 154 C4 G A 5 4.210 -1.827 0.007 1.00 0.00 C ATOM 0 H5' G A 5 7.562 2.593 -2.271 1.00 0.00 H new ATOM 0 H5'' G A 5 9.000 1.598 -2.170 1.00 0.00 H new ATOM 0 H4' G A 5 8.102 2.023 0.016 1.00 0.00 H new ATOM 0 H3' G A 5 8.052 -0.860 -1.025 1.00 0.00 H new ATOM 0 H2' G A 5 7.044 -1.558 1.133 1.00 0.00 H new ATOM 0 HO2' G A 5 8.291 -0.371 2.509 1.00 0.00 H new ATOM 0 H1' G A 5 5.136 0.373 1.236 1.00 0.00 H new ATOM 0 H8 G A 5 5.573 -0.290 -2.422 1.00 0.00 H new ATOM 0 H1 G A 5 1.926 -4.592 0.557 1.00 0.00 H new ATOM 0 H21 G A 5 3.058 -3.049 3.452 1.00 0.00 H new ATOM 0 H22 G A 5 2.052 -4.303 2.719 1.00 0.00 H new ATOM 166 P C A 6 10.043 -1.205 1.223 1.00 0.00 P ATOM 167 OP1 C A 6 9.548 -1.010 2.606 1.00 0.00 O ATOM 168 OP2 C A 6 11.500 -1.250 0.963 1.00 0.00 O ATOM 169 O5' C A 6 9.385 -2.557 0.643 1.00 0.00 O ATOM 170 C5' C A 6 9.902 -3.200 -0.530 1.00 0.00 C ATOM 171 C4' C A 6 9.953 -4.717 -0.355 1.00 0.00 C ATOM 172 O4' C A 6 10.922 -5.101 0.632 1.00 0.00 O ATOM 173 C3' C A 6 8.628 -5.244 0.163 1.00 0.00 C ATOM 174 O3' C A 6 7.781 -5.573 -0.944 1.00 0.00 O ATOM 175 C2' C A 6 9.037 -6.523 0.858 1.00 0.00 C ATOM 176 O2' C A 6 9.207 -7.597 -0.076 1.00 0.00 O ATOM 177 C1' C A 6 10.361 -6.116 1.489 1.00 0.00 C ATOM 178 N1 C A 6 10.173 -5.612 2.868 1.00 0.00 N ATOM 179 C2 C A 6 10.044 -6.550 3.883 1.00 0.00 C ATOM 180 O2 C A 6 10.070 -7.751 3.624 1.00 0.00 O ATOM 181 N3 C A 6 9.890 -6.103 5.159 1.00 0.00 N ATOM 182 C4 C A 6 9.864 -4.794 5.430 1.00 0.00 C ATOM 183 N4 C A 6 9.718 -4.394 6.690 1.00 0.00 N ATOM 184 C5 C A 6 9.994 -3.823 4.389 1.00 0.00 C ATOM 185 C6 C A 6 10.146 -4.273 3.130 1.00 0.00 C ATOM 0 H5' C A 6 10.902 -2.823 -0.743 1.00 0.00 H new ATOM 0 H5'' C A 6 9.278 -2.952 -1.388 1.00 0.00 H new ATOM 0 H4' C A 6 10.202 -5.122 -1.336 1.00 0.00 H new ATOM 0 H3' C A 6 8.092 -4.538 0.798 1.00 0.00 H new ATOM 0 H2' C A 6 8.302 -6.896 1.571 1.00 0.00 H new ATOM 0 HO2' C A 6 8.782 -7.361 -0.927 1.00 0.00 H new ATOM 0 H1' C A 6 11.031 -6.972 1.574 1.00 0.00 H new ATOM 0 H41 C A 6 9.697 -3.398 6.910 1.00 0.00 H new ATOM 0 H42 C A 6 9.627 -5.083 7.437 1.00 0.00 H new ATOM 0 H5 C A 6 9.971 -2.765 4.605 1.00 0.00 H new ATOM 0 H6 C A 6 10.248 -3.567 2.319 1.00 0.00 H new ATOM 197 P A A 7 6.234 -5.128 -0.930 1.00 0.00 P ATOM 198 OP1 A A 7 5.511 -5.919 -1.951 1.00 0.00 O ATOM 199 OP2 A A 7 6.187 -3.653 -0.965 1.00 0.00 O ATOM 200 O5' A A 7 5.751 -5.617 0.531 1.00 0.00 O ATOM 201 C5' A A 7 5.578 -7.013 0.814 1.00 0.00 C ATOM 202 C4' A A 7 5.613 -7.306 2.316 1.00 0.00 C ATOM 203 O4' A A 7 6.820 -6.812 2.916 1.00 0.00 O ATOM 204 C3' A A 7 4.472 -6.616 3.058 1.00 0.00 C ATOM 205 O3' A A 7 3.360 -7.522 3.125 1.00 0.00 O ATOM 206 C2' A A 7 5.059 -6.453 4.448 1.00 0.00 C ATOM 207 O2' A A 7 4.979 -7.669 5.201 1.00 0.00 O ATOM 208 C1' A A 7 6.502 -6.094 4.120 1.00 0.00 C ATOM 209 N9 A A 7 6.666 -4.640 3.927 1.00 0.00 N ATOM 210 C8 A A 7 6.707 -3.920 2.780 1.00 0.00 C ATOM 211 N7 A A 7 6.879 -2.646 2.880 1.00 0.00 N ATOM 212 C5 A A 7 6.966 -2.482 4.265 1.00 0.00 C ATOM 213 C6 A A 7 7.152 -1.358 5.076 1.00 0.00 C ATOM 214 N6 A A 7 7.287 -0.125 4.594 1.00 0.00 N ATOM 215 N1 A A 7 7.190 -1.552 6.405 1.00 0.00 N ATOM 216 C2 A A 7 7.051 -2.780 6.911 1.00 0.00 C ATOM 217 N3 A A 7 6.869 -3.911 6.238 1.00 0.00 N ATOM 218 C4 A A 7 6.836 -3.690 4.909 1.00 0.00 C ATOM 0 H5' A A 7 6.362 -7.583 0.316 1.00 0.00 H new ATOM 0 H5'' A A 7 4.627 -7.351 0.401 1.00 0.00 H new ATOM 0 H4' A A 7 5.536 -8.390 2.401 1.00 0.00 H new ATOM 0 H3' A A 7 4.129 -5.686 2.604 1.00 0.00 H new ATOM 0 H2' A A 7 4.544 -5.718 5.066 1.00 0.00 H new ATOM 0 HO2' A A 7 4.320 -8.266 4.789 1.00 0.00 H new ATOM 0 H1' A A 7 7.170 -6.365 4.937 1.00 0.00 H new ATOM 0 H8 A A 7 6.599 -4.396 1.817 1.00 0.00 H new ATOM 0 H61 A A 7 7.420 0.660 5.231 1.00 0.00 H new ATOM 0 H62 A A 7 7.257 0.035 3.587 1.00 0.00 H new ATOM 0 H2 A A 7 7.091 -2.863 7.987 1.00 0.00 H new ATOM 230 P A A 8 1.906 -7.024 3.619 1.00 0.00 P ATOM 231 OP1 A A 8 0.949 -8.136 3.428 1.00 0.00 O ATOM 232 OP2 A A 8 1.635 -5.704 3.002 1.00 0.00 O ATOM 233 O5' A A 8 2.118 -6.812 5.204 1.00 0.00 O ATOM 234 C5' A A 8 1.391 -5.797 5.907 1.00 0.00 C ATOM 235 C4' A A 8 1.961 -5.554 7.305 1.00 0.00 C ATOM 236 O4' A A 8 3.375 -5.299 7.256 1.00 0.00 O ATOM 237 C3' A A 8 1.326 -4.316 7.937 1.00 0.00 C ATOM 238 O3' A A 8 0.322 -4.735 8.872 1.00 0.00 O ATOM 239 C2' A A 8 2.473 -3.693 8.708 1.00 0.00 C ATOM 240 O2' A A 8 2.627 -4.285 10.003 1.00 0.00 O ATOM 241 C1' A A 8 3.647 -4.004 7.803 1.00 0.00 C ATOM 242 N9 A A 8 3.766 -2.995 6.736 1.00 0.00 N ATOM 243 C8 A A 8 3.533 -3.124 5.416 1.00 0.00 C ATOM 244 N7 A A 8 3.688 -2.081 4.674 1.00 0.00 N ATOM 245 C5 A A 8 4.075 -1.125 5.617 1.00 0.00 C ATOM 246 C6 A A 8 4.406 0.230 5.514 1.00 0.00 C ATOM 247 N6 A A 8 4.403 0.894 4.360 1.00 0.00 N ATOM 248 N1 A A 8 4.741 0.874 6.645 1.00 0.00 N ATOM 249 C2 A A 8 4.752 0.226 7.811 1.00 0.00 C ATOM 250 N3 A A 8 4.457 -1.053 8.024 1.00 0.00 N ATOM 251 C4 A A 8 4.125 -1.675 6.877 1.00 0.00 C ATOM 0 H5' A A 8 0.344 -6.090 5.987 1.00 0.00 H new ATOM 0 H5'' A A 8 1.420 -4.869 5.337 1.00 0.00 H new ATOM 0 H4' A A 8 1.749 -6.452 7.885 1.00 0.00 H new ATOM 0 H3' A A 8 0.867 -3.644 7.211 1.00 0.00 H new ATOM 0 H2' A A 8 2.343 -2.631 8.916 1.00 0.00 H new ATOM 0 HO2' A A 8 1.760 -4.617 10.316 1.00 0.00 H new ATOM 0 H1' A A 8 4.592 -3.989 8.346 1.00 0.00 H new ATOM 0 H8 A A 8 3.227 -4.069 4.993 1.00 0.00 H new ATOM 0 H61 A A 8 4.653 1.883 4.340 1.00 0.00 H new ATOM 0 H62 A A 8 4.151 0.414 3.496 1.00 0.00 H new ATOM 0 H2 A A 8 5.032 0.805 8.679 1.00 0.00 H new ATOM 263 P G A 9 -1.246 -4.567 8.531 1.00 0.00 P ATOM 264 OP1 G A 9 -2.024 -5.045 9.697 1.00 0.00 O ATOM 265 OP2 G A 9 -1.493 -5.147 7.192 1.00 0.00 O ATOM 266 O5' G A 9 -1.428 -2.966 8.427 1.00 0.00 O ATOM 267 C5' G A 9 -0.862 -2.092 9.413 1.00 0.00 C ATOM 268 C4' G A 9 -0.068 -0.952 8.774 1.00 0.00 C ATOM 269 O4' G A 9 0.885 -1.442 7.825 1.00 0.00 O ATOM 270 C3' G A 9 -0.971 -0.022 7.982 1.00 0.00 C ATOM 271 O3' G A 9 -1.479 0.991 8.862 1.00 0.00 O ATOM 272 C2' G A 9 0.009 0.612 7.012 1.00 0.00 C ATOM 273 O2' G A 9 0.731 1.696 7.612 1.00 0.00 O ATOM 274 C1' G A 9 0.929 -0.559 6.689 1.00 0.00 C ATOM 275 N9 G A 9 0.496 -1.245 5.456 1.00 0.00 N ATOM 276 C8 G A 9 -0.262 -2.359 5.302 1.00 0.00 C ATOM 277 N7 G A 9 -0.498 -2.760 4.098 1.00 0.00 N ATOM 278 C5 G A 9 0.182 -1.800 3.341 1.00 0.00 C ATOM 279 C6 G A 9 0.313 -1.674 1.931 1.00 0.00 C ATOM 280 O6 G A 9 -0.147 -2.401 1.055 1.00 0.00 O ATOM 281 N1 G A 9 1.078 -0.570 1.587 1.00 0.00 N ATOM 282 C2 G A 9 1.650 0.308 2.483 1.00 0.00 C ATOM 283 N2 G A 9 2.348 1.311 1.963 1.00 0.00 N ATOM 284 N3 G A 9 1.535 0.200 3.806 1.00 0.00 N ATOM 285 C4 G A 9 0.793 -0.870 4.167 1.00 0.00 C ATOM 0 H5' G A 9 -0.210 -2.663 10.073 1.00 0.00 H new ATOM 0 H5'' G A 9 -1.658 -1.678 10.032 1.00 0.00 H new ATOM 0 H4' G A 9 0.417 -0.437 9.604 1.00 0.00 H new ATOM 0 H3' G A 9 -1.821 -0.512 7.507 1.00 0.00 H new ATOM 0 H2' G A 9 -0.468 1.057 6.138 1.00 0.00 H new ATOM 0 HO2' G A 9 0.810 2.432 6.969 1.00 0.00 H new ATOM 0 H1' G A 9 1.948 -0.219 6.507 1.00 0.00 H new ATOM 0 H8 G A 9 -0.654 -2.891 6.156 1.00 0.00 H new ATOM 0 H1 G A 9 1.229 -0.394 0.594 1.00 0.00 H new ATOM 0 H21 G A 9 2.795 1.993 2.576 1.00 0.00 H new ATOM 0 H22 G A 9 2.437 1.399 0.951 1.00 0.00 H new ATOM 297 P C A 10 -2.618 2.020 8.369 1.00 0.00 P ATOM 298 OP1 C A 10 -3.063 2.816 9.536 1.00 0.00 O ATOM 299 OP2 C A 10 -3.610 1.267 7.570 1.00 0.00 O ATOM 300 O5' C A 10 -1.811 2.997 7.371 1.00 0.00 O ATOM 301 C5' C A 10 -0.894 3.972 7.881 1.00 0.00 C ATOM 302 C4' C A 10 -0.185 4.725 6.757 1.00 0.00 C ATOM 303 O4' C A 10 0.534 3.831 5.888 1.00 0.00 O ATOM 304 C3' C A 10 -1.181 5.439 5.852 1.00 0.00 C ATOM 305 O3' C A 10 -1.433 6.752 6.369 1.00 0.00 O ATOM 306 C2' C A 10 -0.378 5.564 4.577 1.00 0.00 C ATOM 307 O2' C A 10 0.603 6.605 4.675 1.00 0.00 O ATOM 308 C1' C A 10 0.272 4.193 4.516 1.00 0.00 C ATOM 309 N1 C A 10 -0.599 3.192 3.858 1.00 0.00 N ATOM 310 C2 C A 10 -0.431 2.987 2.493 1.00 0.00 C ATOM 311 O2 C A 10 0.382 3.657 1.862 1.00 0.00 O ATOM 312 N3 C A 10 -1.190 2.037 1.884 1.00 0.00 N ATOM 313 C4 C A 10 -2.079 1.318 2.580 1.00 0.00 C ATOM 314 N4 C A 10 -2.805 0.398 1.951 1.00 0.00 N ATOM 315 C5 C A 10 -2.260 1.525 3.982 1.00 0.00 C ATOM 316 C6 C A 10 -1.506 2.468 4.577 1.00 0.00 C ATOM 0 H5' C A 10 -0.154 3.480 8.512 1.00 0.00 H new ATOM 0 H5'' C A 10 -1.430 4.681 8.512 1.00 0.00 H new ATOM 0 H4' C A 10 0.485 5.424 7.257 1.00 0.00 H new ATOM 0 H3' C A 10 -2.141 4.935 5.746 1.00 0.00 H new ATOM 0 H2' C A 10 -0.965 5.826 3.697 1.00 0.00 H new ATOM 0 HO2' C A 10 0.446 7.127 5.489 1.00 0.00 H new ATOM 0 H1' C A 10 1.184 4.219 3.919 1.00 0.00 H new ATOM 0 H41 C A 10 -3.486 -0.157 2.470 1.00 0.00 H new ATOM 0 H42 C A 10 -2.681 0.247 0.950 1.00 0.00 H new ATOM 0 H5 C A 10 -2.977 0.945 4.545 1.00 0.00 H new ATOM 0 H6 C A 10 -1.620 2.654 5.635 1.00 0.00 H new ATOM 328 P C A 11 -2.762 7.554 5.937 1.00 0.00 P ATOM 329 OP1 C A 11 -2.633 8.953 6.404 1.00 0.00 O ATOM 330 OP2 C A 11 -3.940 6.749 6.332 1.00 0.00 O ATOM 331 O5' C A 11 -2.668 7.546 4.326 1.00 0.00 O ATOM 332 C5' C A 11 -1.709 8.367 3.649 1.00 0.00 C ATOM 333 C4' C A 11 -1.661 8.079 2.147 1.00 0.00 C ATOM 334 O4' C A 11 -1.319 6.716 1.868 1.00 0.00 O ATOM 335 C3' C A 11 -3.016 8.268 1.494 1.00 0.00 C ATOM 336 O3' C A 11 -3.200 9.658 1.194 1.00 0.00 O ATOM 337 C2' C A 11 -2.814 7.508 0.199 1.00 0.00 C ATOM 338 O2' C A 11 -2.067 8.282 -0.748 1.00 0.00 O ATOM 339 C1' C A 11 -2.017 6.294 0.677 1.00 0.00 C ATOM 340 N1 C A 11 -2.891 5.127 0.946 1.00 0.00 N ATOM 341 C2 C A 11 -3.392 4.432 -0.148 1.00 0.00 C ATOM 342 O2 C A 11 -3.122 4.793 -1.290 1.00 0.00 O ATOM 343 N3 C A 11 -4.183 3.350 0.082 1.00 0.00 N ATOM 344 C4 C A 11 -4.476 2.963 1.327 1.00 0.00 C ATOM 345 N4 C A 11 -5.257 1.901 1.511 1.00 0.00 N ATOM 346 C5 C A 11 -3.965 3.673 2.458 1.00 0.00 C ATOM 347 C6 C A 11 -3.180 4.742 2.224 1.00 0.00 C ATOM 0 H5' C A 11 -0.722 8.202 4.081 1.00 0.00 H new ATOM 0 H5'' C A 11 -1.955 9.417 3.808 1.00 0.00 H new ATOM 0 H4' C A 11 -0.915 8.773 1.760 1.00 0.00 H new ATOM 0 H3' C A 11 -3.867 7.943 2.093 1.00 0.00 H new ATOM 0 H2' C A 11 -3.740 7.256 -0.317 1.00 0.00 H new ATOM 0 HO2' C A 11 -2.014 9.211 -0.442 1.00 0.00 H new ATOM 0 H1' C A 11 -1.321 5.962 -0.093 1.00 0.00 H new ATOM 0 H41 C A 11 -5.488 1.595 2.456 1.00 0.00 H new ATOM 0 H42 C A 11 -5.624 1.393 0.707 1.00 0.00 H new ATOM 0 H5 C A 11 -4.200 3.363 3.465 1.00 0.00 H new ATOM 0 H6 C A 11 -2.775 5.300 3.055 1.00 0.00 H new ATOM 359 P U A 12 -4.679 10.300 1.149 1.00 0.00 P ATOM 360 OP1 U A 12 -4.560 11.717 0.737 1.00 0.00 O ATOM 361 OP2 U A 12 -5.373 9.954 2.410 1.00 0.00 O ATOM 362 O5' U A 12 -5.379 9.482 -0.050 1.00 0.00 O ATOM 363 C5' U A 12 -4.918 9.623 -1.398 1.00 0.00 C ATOM 364 C4' U A 12 -5.353 8.448 -2.269 1.00 0.00 C ATOM 365 O4' U A 12 -4.888 7.201 -1.753 1.00 0.00 O ATOM 366 C3' U A 12 -6.861 8.305 -2.302 1.00 0.00 C ATOM 367 O3' U A 12 -7.474 9.249 -3.190 1.00 0.00 O ATOM 368 C2' U A 12 -6.994 6.883 -2.807 1.00 0.00 C ATOM 369 O2' U A 12 -6.823 6.815 -4.229 1.00 0.00 O ATOM 370 C1' U A 12 -5.849 6.179 -2.073 1.00 0.00 C ATOM 371 N1 U A 12 -6.341 5.491 -0.856 1.00 0.00 N ATOM 372 C2 U A 12 -7.145 4.383 -1.040 1.00 0.00 C ATOM 373 O2 U A 12 -7.438 3.969 -2.156 1.00 0.00 O ATOM 374 N3 U A 12 -7.603 3.766 0.105 1.00 0.00 N ATOM 375 C4 U A 12 -7.336 4.152 1.403 1.00 0.00 C ATOM 376 O4 U A 12 -7.799 3.523 2.348 1.00 0.00 O ATOM 377 C5 U A 12 -6.487 5.318 1.508 1.00 0.00 C ATOM 378 C6 U A 12 -6.021 5.941 0.399 1.00 0.00 C ATOM 0 H5' U A 12 -3.831 9.698 -1.405 1.00 0.00 H new ATOM 0 H5'' U A 12 -5.304 10.551 -1.820 1.00 0.00 H new ATOM 0 H4' U A 12 -4.937 8.662 -3.254 1.00 0.00 H new ATOM 0 H3' U A 12 -7.353 8.495 -1.348 1.00 0.00 H new ATOM 0 H2' U A 12 -7.973 6.440 -2.623 1.00 0.00 H new ATOM 0 HO2' U A 12 -7.039 7.684 -4.626 1.00 0.00 H new ATOM 0 HO3' U A 12 -8.446 9.122 -3.183 1.00 0.00 H new ATOM 0 H1' U A 12 -5.397 5.404 -2.692 1.00 0.00 H new ATOM 0 H3 U A 12 -8.196 2.946 -0.019 1.00 0.00 H new ATOM 0 H5 U A 12 -6.221 5.697 2.484 1.00 0.00 H new ATOM 0 H6 U A 12 -5.386 6.808 0.505 1.00 0.00 H new TER 390 U A 12