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=-0.00778! USER MOD Single : A 2 G O2' : rot -28:sc= 0.217 USER MOD Single : A 3 C O2' : rot 133:sc= 0.84 USER MOD Single : A 4 G O2' : rot -12:sc= 0.221 USER MOD Single : A 5 C O2' : rot 17:sc= 0.00848 USER MOD Single : A 6 G O2' : rot -20:sc= 0.132 USER MOD Single : A 6 G O3' : rot 180:sc= 0.135 USER MOD Single : B 7 C O2' : rot 24:sc= 0.239 USER MOD Single : B 7 C O5' : rot 59:sc= -0.127! USER MOD Single : B 8 G O2' : rot -13:sc= 0.188 USER MOD Single : B 9 C O2' : rot 133:sc= 0.737 USER MOD Single : B 10 G O2' : rot -21:sc= 0.262 USER MOD Single : B 11 C O2' : rot 26:sc= 0.0857 USER MOD Single : B 12 G O2' : rot -23:sc= 0.13 USER MOD Single : B 12 G O3' : rot 180:sc= 0.147 USER MOD ----------------------------------------------------------------- ATOM 1 O5' C A 1 21.236 -3.850 6.741 1.00 0.00 O ATOM 2 C5' C A 1 20.046 -3.308 7.324 1.00 0.00 C ATOM 3 C4' C A 1 18.811 -3.928 6.714 1.00 0.00 C ATOM 4 O4' C A 1 18.625 -3.390 5.380 1.00 0.00 O ATOM 5 C3' C A 1 18.855 -5.437 6.516 1.00 0.00 C ATOM 6 O3' C A 1 17.546 -6.000 6.517 1.00 0.00 O ATOM 7 C2' C A 1 19.540 -5.584 5.159 1.00 0.00 C ATOM 8 O2' C A 1 19.068 -6.728 4.475 1.00 0.00 O ATOM 9 C1' C A 1 19.041 -4.340 4.418 1.00 0.00 C ATOM 10 N1 C A 1 20.072 -3.716 3.575 1.00 0.00 N ATOM 11 C2 C A 1 20.205 -4.128 2.245 1.00 0.00 C ATOM 12 O2 C A 1 19.437 -4.995 1.803 1.00 0.00 O ATOM 13 N3 C A 1 21.166 -3.571 1.475 1.00 0.00 N ATOM 14 C4 C A 1 21.972 -2.637 1.986 1.00 0.00 C ATOM 15 N4 C A 1 22.907 -2.117 1.192 1.00 0.00 N ATOM 16 C5 C A 1 21.854 -2.194 3.334 1.00 0.00 C ATOM 17 C6 C A 1 20.897 -2.753 4.083 1.00 0.00 C ATOM 0 H5' C A 1 20.025 -2.228 7.178 1.00 0.00 H new ATOM 0 H5'' C A 1 20.052 -3.484 8.400 1.00 0.00 H new ATOM 0 H4' C A 1 18.019 -3.697 7.426 1.00 0.00 H new ATOM 0 H3' C A 1 19.380 -5.963 7.313 1.00 0.00 H new ATOM 0 H2' C A 1 20.623 -5.681 5.236 1.00 0.00 H new ATOM 0 HO2' C A 1 18.271 -7.074 4.928 1.00 0.00 H new ATOM 0 HO5' C A 1 21.202 -3.741 5.768 1.00 0.00 H new ATOM 0 H1' C A 1 18.228 -4.654 3.763 1.00 0.00 H new ATOM 0 H41 C A 1 23.540 -1.401 1.550 1.00 0.00 H new ATOM 0 H42 C A 1 22.990 -2.435 0.226 1.00 0.00 H new ATOM 0 H5 C A 1 22.511 -1.437 3.736 1.00 0.00 H new ATOM 0 H6 C A 1 20.774 -2.437 5.108 1.00 0.00 H new ATOM 30 P G A 2 16.685 -6.015 7.875 1.00 0.00 P ATOM 31 OP1 G A 2 17.610 -6.309 8.999 1.00 0.00 O ATOM 32 OP2 G A 2 15.498 -6.880 7.656 1.00 0.00 O ATOM 33 O5' G A 2 16.187 -4.509 8.018 1.00 0.00 O ATOM 34 C5' G A 2 15.592 -3.829 6.914 1.00 0.00 C ATOM 35 C4' G A 2 15.585 -2.340 7.156 1.00 0.00 C ATOM 36 O4' G A 2 16.922 -1.822 7.044 1.00 0.00 O ATOM 37 C3' G A 2 14.829 -1.502 6.136 1.00 0.00 C ATOM 38 O3' G A 2 13.427 -1.508 6.385 1.00 0.00 O ATOM 39 C2' G A 2 15.428 -0.110 6.335 1.00 0.00 C ATOM 40 O2' G A 2 14.735 0.600 7.343 1.00 0.00 O ATOM 41 C1' G A 2 16.836 -0.430 6.852 1.00 0.00 C ATOM 42 N9 G A 2 17.898 -0.019 5.941 1.00 0.00 N ATOM 43 C8 G A 2 18.882 0.902 6.191 1.00 0.00 C ATOM 44 N7 G A 2 19.684 1.087 5.178 1.00 0.00 N ATOM 45 C5 G A 2 19.201 0.227 4.201 1.00 0.00 C ATOM 46 C6 G A 2 19.659 -0.016 2.880 1.00 0.00 C ATOM 47 O6 G A 2 20.614 0.500 2.287 1.00 0.00 O ATOM 48 N1 G A 2 18.880 -0.972 2.237 1.00 0.00 N ATOM 49 C2 G A 2 17.803 -1.613 2.792 1.00 0.00 C ATOM 50 N2 G A 2 17.192 -2.519 2.022 1.00 0.00 N ATOM 51 N3 G A 2 17.359 -1.390 4.015 1.00 0.00 N ATOM 52 C4 G A 2 18.102 -0.467 4.659 1.00 0.00 C ATOM 0 H5' G A 2 14.572 -4.185 6.766 1.00 0.00 H new ATOM 0 H5'' G A 2 16.143 -4.053 6.001 1.00 0.00 H new ATOM 0 H4' G A 2 15.114 -2.258 8.135 1.00 0.00 H new ATOM 0 H3' G A 2 14.929 -1.874 5.116 1.00 0.00 H new ATOM 0 H2' G A 2 15.392 0.497 5.431 1.00 0.00 H new ATOM 0 HO2' G A 2 13.808 0.284 7.387 1.00 0.00 H new ATOM 0 H1' G A 2 16.980 0.128 7.777 1.00 0.00 H new ATOM 0 H8 G A 2 18.983 1.422 7.132 1.00 0.00 H new ATOM 0 H1 G A 2 19.129 -1.215 1.278 1.00 0.00 H new ATOM 0 H21 G A 2 16.384 -3.030 2.378 1.00 0.00 H new ATOM 0 H22 G A 2 17.534 -2.700 1.078 1.00 0.00 H new ATOM 64 P C A 3 12.451 -2.403 5.473 1.00 0.00 P ATOM 65 OP1 C A 3 11.065 -1.952 5.759 1.00 0.00 O ATOM 66 OP2 C A 3 12.803 -3.834 5.642 1.00 0.00 O ATOM 67 O5' C A 3 12.801 -1.979 3.979 1.00 0.00 O ATOM 68 C5' C A 3 11.782 -1.931 2.985 1.00 0.00 C ATOM 69 C4' C A 3 12.309 -1.291 1.726 1.00 0.00 C ATOM 70 O4' C A 3 13.008 -0.065 2.076 1.00 0.00 O ATOM 71 C3' C A 3 13.319 -2.138 0.944 1.00 0.00 C ATOM 72 O3' C A 3 12.927 -2.298 -0.414 1.00 0.00 O ATOM 73 C2' C A 3 14.626 -1.356 1.054 1.00 0.00 C ATOM 74 O2' C A 3 15.378 -1.436 -0.143 1.00 0.00 O ATOM 75 C1' C A 3 14.109 0.065 1.218 1.00 0.00 C ATOM 76 N1 C A 3 15.092 0.992 1.801 1.00 0.00 N ATOM 77 C2 C A 3 16.016 1.586 0.946 1.00 0.00 C ATOM 78 O2 C A 3 15.951 1.343 -0.267 1.00 0.00 O ATOM 79 N3 C A 3 16.954 2.412 1.448 1.00 0.00 N ATOM 80 C4 C A 3 16.984 2.667 2.753 1.00 0.00 C ATOM 81 N4 C A 3 17.937 3.486 3.196 1.00 0.00 N ATOM 82 C5 C A 3 16.041 2.093 3.657 1.00 0.00 C ATOM 83 C6 C A 3 15.122 1.260 3.143 1.00 0.00 C ATOM 0 H5' C A 3 10.927 -1.367 3.358 1.00 0.00 H new ATOM 0 H5'' C A 3 11.428 -2.939 2.768 1.00 0.00 H new ATOM 0 H4' C A 3 11.431 -1.142 1.097 1.00 0.00 H new ATOM 0 H3' C A 3 13.403 -3.150 1.340 1.00 0.00 H new ATOM 0 H2' C A 3 15.279 -1.715 1.849 1.00 0.00 H new ATOM 0 HO2' C A 3 15.694 -0.542 -0.391 1.00 0.00 H new ATOM 0 H1' C A 3 13.869 0.494 0.245 1.00 0.00 H new ATOM 0 H41 C A 3 17.997 3.709 4.190 1.00 0.00 H new ATOM 0 H42 C A 3 18.607 3.890 2.542 1.00 0.00 H new ATOM 0 H5 C A 3 16.066 2.320 4.713 1.00 0.00 H new ATOM 0 H6 C A 3 14.398 0.796 3.796 1.00 0.00 H new ATOM 95 P G A 4 11.690 -3.254 -0.778 1.00 0.00 P ATOM 96 OP1 G A 4 11.752 -4.433 0.123 1.00 0.00 O ATOM 97 OP2 G A 4 11.685 -3.457 -2.249 1.00 0.00 O ATOM 98 O5' G A 4 10.408 -2.394 -0.380 1.00 0.00 O ATOM 99 C5' G A 4 10.030 -1.243 -1.132 1.00 0.00 C ATOM 100 C4' G A 4 9.152 -0.341 -0.298 1.00 0.00 C ATOM 101 O4' G A 4 9.842 -0.011 0.927 1.00 0.00 O ATOM 102 C3' G A 4 8.850 1.011 -0.924 1.00 0.00 C ATOM 103 O3' G A 4 7.714 0.938 -1.781 1.00 0.00 O ATOM 104 C2' G A 4 8.594 1.921 0.278 1.00 0.00 C ATOM 105 O2' G A 4 7.223 1.937 0.621 1.00 0.00 O ATOM 106 C1' G A 4 9.372 1.232 1.404 1.00 0.00 C ATOM 107 N9 G A 4 10.513 2.015 1.866 1.00 0.00 N ATOM 108 C8 G A 4 10.745 2.482 3.137 1.00 0.00 C ATOM 109 N7 G A 4 11.855 3.160 3.244 1.00 0.00 N ATOM 110 C5 G A 4 12.389 3.142 1.961 1.00 0.00 C ATOM 111 C6 G A 4 13.584 3.717 1.452 1.00 0.00 C ATOM 112 O6 G A 4 14.445 4.378 2.052 1.00 0.00 O ATOM 113 N1 G A 4 13.733 3.458 0.095 1.00 0.00 N ATOM 114 C2 G A 4 12.854 2.742 -0.675 1.00 0.00 C ATOM 115 N2 G A 4 13.176 2.602 -1.966 1.00 0.00 N ATOM 116 N3 G A 4 11.741 2.201 -0.216 1.00 0.00 N ATOM 117 C4 G A 4 11.572 2.439 1.100 1.00 0.00 C ATOM 0 H5' G A 4 9.499 -1.547 -2.034 1.00 0.00 H new ATOM 0 H5'' G A 4 10.920 -0.701 -1.453 1.00 0.00 H new ATOM 0 H4' G A 4 8.225 -0.901 -0.173 1.00 0.00 H new ATOM 0 H3' G A 4 9.660 1.376 -1.555 1.00 0.00 H new ATOM 0 H2' G A 4 8.888 2.953 0.087 1.00 0.00 H new ATOM 0 HO2' G A 4 6.701 1.522 -0.097 1.00 0.00 H new ATOM 0 H1' G A 4 8.693 1.114 2.249 1.00 0.00 H new ATOM 0 H8 G A 4 10.075 2.306 3.966 1.00 0.00 H new ATOM 0 H1 G A 4 14.563 3.831 -0.365 1.00 0.00 H new ATOM 0 H21 G A 4 12.562 2.080 -2.591 1.00 0.00 H new ATOM 0 H22 G A 4 14.035 3.018 -2.325 1.00 0.00 H new ATOM 129 P C A 5 7.912 0.918 -3.377 1.00 0.00 P ATOM 130 OP1 C A 5 6.559 0.807 -3.982 1.00 0.00 O ATOM 131 OP2 C A 5 8.951 -0.088 -3.715 1.00 0.00 O ATOM 132 O5' C A 5 8.490 2.365 -3.711 1.00 0.00 O ATOM 133 C5' C A 5 8.013 3.108 -4.832 1.00 0.00 C ATOM 134 C4' C A 5 9.044 4.124 -5.257 1.00 0.00 C ATOM 135 O4' C A 5 9.254 5.059 -4.159 1.00 0.00 O ATOM 136 C3' C A 5 10.424 3.550 -5.571 1.00 0.00 C ATOM 137 O3' C A 5 11.073 4.272 -6.614 1.00 0.00 O ATOM 138 C2' C A 5 11.158 3.707 -4.247 1.00 0.00 C ATOM 139 O2' C A 5 12.556 3.812 -4.439 1.00 0.00 O ATOM 140 C1' C A 5 10.619 5.059 -3.801 1.00 0.00 C ATOM 141 N1 C A 5 10.731 5.328 -2.359 1.00 0.00 N ATOM 142 C2 C A 5 11.761 6.155 -1.921 1.00 0.00 C ATOM 143 O2 C A 5 12.545 6.623 -2.754 1.00 0.00 O ATOM 144 N3 C A 5 11.878 6.429 -0.605 1.00 0.00 N ATOM 145 C4 C A 5 11.010 5.912 0.262 1.00 0.00 C ATOM 146 N4 C A 5 11.165 6.214 1.551 1.00 0.00 N ATOM 147 C5 C A 5 9.944 5.064 -0.153 1.00 0.00 C ATOM 148 C6 C A 5 9.849 4.789 -1.463 1.00 0.00 C ATOM 0 H5' C A 5 7.080 3.610 -4.575 1.00 0.00 H new ATOM 0 H5'' C A 5 7.794 2.433 -5.659 1.00 0.00 H new ATOM 0 H4' C A 5 8.644 4.571 -6.167 1.00 0.00 H new ATOM 0 H3' C A 5 10.388 2.521 -5.930 1.00 0.00 H new ATOM 0 H2' C A 5 11.011 2.876 -3.557 1.00 0.00 H new ATOM 0 HO2' C A 5 12.742 4.027 -5.377 1.00 0.00 H new ATOM 0 H1' C A 5 11.212 5.838 -4.280 1.00 0.00 H new ATOM 0 H41 C A 5 10.519 5.836 2.244 1.00 0.00 H new ATOM 0 H42 C A 5 11.929 6.823 1.844 1.00 0.00 H new ATOM 0 H5 C A 5 9.240 4.658 0.558 1.00 0.00 H new ATOM 0 H6 C A 5 9.066 4.134 -1.815 1.00 0.00 H new ATOM 160 P G A 6 10.787 3.892 -8.149 1.00 0.00 P ATOM 161 OP1 G A 6 10.779 2.411 -8.254 1.00 0.00 O ATOM 162 OP2 G A 6 11.711 4.682 -9.002 1.00 0.00 O ATOM 163 O5' G A 6 9.302 4.409 -8.408 1.00 0.00 O ATOM 164 C5' G A 6 8.971 5.789 -8.278 1.00 0.00 C ATOM 165 C4' G A 6 7.472 5.957 -8.209 1.00 0.00 C ATOM 166 O4' G A 6 7.007 5.454 -6.932 1.00 0.00 O ATOM 167 C3' G A 6 6.974 7.394 -8.254 1.00 0.00 C ATOM 168 O3' G A 6 6.831 7.880 -9.593 1.00 0.00 O ATOM 169 C2' G A 6 5.631 7.311 -7.532 1.00 0.00 C ATOM 170 O2' G A 6 4.610 6.869 -8.406 1.00 0.00 O ATOM 171 C1' G A 6 5.894 6.212 -6.499 1.00 0.00 C ATOM 172 N9 G A 6 6.184 6.722 -5.163 1.00 0.00 N ATOM 173 C8 G A 6 5.354 6.697 -4.070 1.00 0.00 C ATOM 174 N7 G A 6 5.895 7.211 -3.000 1.00 0.00 N ATOM 175 C5 G A 6 7.160 7.609 -3.414 1.00 0.00 C ATOM 176 C6 G A 6 8.207 8.238 -2.692 1.00 0.00 C ATOM 177 O6 G A 6 8.228 8.578 -1.504 1.00 0.00 O ATOM 178 N1 G A 6 9.316 8.467 -3.497 1.00 0.00 N ATOM 179 C2 G A 6 9.408 8.136 -4.827 1.00 0.00 C ATOM 180 N2 G A 6 10.562 8.437 -5.431 1.00 0.00 N ATOM 181 N3 G A 6 8.439 7.553 -5.512 1.00 0.00 N ATOM 182 C4 G A 6 7.352 7.319 -4.748 1.00 0.00 C ATOM 0 H5' G A 6 9.369 6.348 -9.125 1.00 0.00 H new ATOM 0 H5'' G A 6 9.433 6.199 -7.380 1.00 0.00 H new ATOM 0 H4' G A 6 7.097 5.428 -9.085 1.00 0.00 H new ATOM 0 H3' G A 6 7.669 8.096 -7.793 1.00 0.00 H new ATOM 0 H2' G A 6 5.308 8.269 -7.124 1.00 0.00 H new ATOM 0 HO2' G A 6 4.890 7.011 -9.334 1.00 0.00 H new ATOM 0 HO3' G A 6 6.508 8.805 -9.573 1.00 0.00 H new ATOM 0 H1' G A 6 4.983 5.617 -6.426 1.00 0.00 H new ATOM 0 H8 G A 6 4.353 6.292 -4.094 1.00 0.00 H new ATOM 0 H1 G A 6 10.125 8.916 -3.067 1.00 0.00 H new ATOM 0 H21 G A 6 10.693 8.217 -6.418 1.00 0.00 H new ATOM 0 H22 G A 6 11.311 8.887 -4.905 1.00 0.00 H new TER 195 G A 6 ATOM 196 O5' C B 7 14.231 13.687 -0.392 1.00 0.00 O ATOM 197 C5' C B 7 15.635 13.449 -0.524 1.00 0.00 C ATOM 198 C4' C B 7 15.971 12.925 -1.901 1.00 0.00 C ATOM 199 O4' C B 7 15.494 11.562 -2.014 1.00 0.00 O ATOM 200 C3' C B 7 15.319 13.657 -3.066 1.00 0.00 C ATOM 201 O3' C B 7 16.091 13.534 -4.258 1.00 0.00 O ATOM 202 C2' C B 7 13.964 12.968 -3.191 1.00 0.00 C ATOM 203 O2' C B 7 13.527 12.949 -4.536 1.00 0.00 O ATOM 204 C1' C B 7 14.301 11.533 -2.775 1.00 0.00 C ATOM 205 N1 C B 7 13.251 10.905 -1.958 1.00 0.00 N ATOM 206 C2 C B 7 12.224 10.200 -2.592 1.00 0.00 C ATOM 207 O2 C B 7 12.232 10.105 -3.828 1.00 0.00 O ATOM 208 N3 C B 7 11.248 9.640 -1.843 1.00 0.00 N ATOM 209 C4 C B 7 11.275 9.761 -0.514 1.00 0.00 C ATOM 210 N4 C B 7 10.293 9.196 0.185 1.00 0.00 N ATOM 211 C5 C B 7 12.313 10.468 0.159 1.00 0.00 C ATOM 212 C6 C B 7 13.273 11.015 -0.596 1.00 0.00 C ATOM 0 H5' C B 7 15.958 12.731 0.230 1.00 0.00 H new ATOM 0 H5'' C B 7 16.183 14.373 -0.340 1.00 0.00 H new ATOM 0 H4' C B 7 17.051 13.050 -1.976 1.00 0.00 H new ATOM 0 H3' C B 7 15.233 14.732 -2.905 1.00 0.00 H new ATOM 0 H2' C B 7 13.183 13.455 -2.607 1.00 0.00 H new ATOM 0 HO2' C B 7 14.301 13.021 -5.133 1.00 0.00 H new ATOM 0 HO5' C B 7 13.741 12.854 -0.556 1.00 0.00 H new ATOM 0 H1' C B 7 14.402 10.944 -3.687 1.00 0.00 H new ATOM 0 H41 C B 7 10.283 9.270 1.202 1.00 0.00 H new ATOM 0 H42 C B 7 9.550 8.690 -0.297 1.00 0.00 H new ATOM 0 H5 C B 7 12.325 10.559 1.235 1.00 0.00 H new ATOM 0 H6 C B 7 14.080 11.553 -0.120 1.00 0.00 H new ATOM 225 P G B 8 17.521 14.262 -4.361 1.00 0.00 P ATOM 226 OP1 G B 8 17.405 15.594 -3.714 1.00 0.00 O ATOM 227 OP2 G B 8 17.984 14.167 -5.769 1.00 0.00 O ATOM 228 O5' G B 8 18.470 13.351 -3.460 1.00 0.00 O ATOM 229 C5' G B 8 18.518 11.939 -3.649 1.00 0.00 C ATOM 230 C4' G B 8 19.167 11.273 -2.462 1.00 0.00 C ATOM 231 O4' G B 8 18.303 11.361 -1.315 1.00 0.00 O ATOM 232 C3' G B 8 19.391 9.773 -2.580 1.00 0.00 C ATOM 233 O3' G B 8 20.557 9.472 -3.341 1.00 0.00 O ATOM 234 C2' G B 8 19.543 9.339 -1.121 1.00 0.00 C ATOM 235 O2' G B 8 20.890 9.440 -0.702 1.00 0.00 O ATOM 236 C1' G B 8 18.726 10.401 -0.377 1.00 0.00 C ATOM 237 N9 G B 8 17.552 9.863 0.301 1.00 0.00 N ATOM 238 C8 G B 8 17.298 9.883 1.648 1.00 0.00 C ATOM 239 N7 G B 8 16.176 9.304 1.971 1.00 0.00 N ATOM 240 C5 G B 8 15.649 8.881 0.757 1.00 0.00 C ATOM 241 C6 G B 8 14.445 8.189 0.466 1.00 0.00 C ATOM 242 O6 G B 8 13.574 7.793 1.249 1.00 0.00 O ATOM 243 N1 G B 8 14.302 7.966 -0.899 1.00 0.00 N ATOM 244 C2 G B 8 15.197 8.361 -1.861 1.00 0.00 C ATOM 245 N2 G B 8 14.871 8.074 -3.124 1.00 0.00 N ATOM 246 N3 G B 8 16.325 8.996 -1.604 1.00 0.00 N ATOM 247 C4 G B 8 16.485 9.225 -0.285 1.00 0.00 C ATOM 0 H5' G B 8 19.076 11.706 -4.556 1.00 0.00 H new ATOM 0 H5'' G B 8 17.509 11.549 -3.787 1.00 0.00 H new ATOM 0 H4' G B 8 20.121 11.795 -2.389 1.00 0.00 H new ATOM 0 H3' G B 8 18.584 9.258 -3.101 1.00 0.00 H new ATOM 0 H2' G B 8 19.229 8.309 -0.952 1.00 0.00 H new ATOM 0 HO2' G B 8 21.467 9.568 -1.484 1.00 0.00 H new ATOM 0 H1' G B 8 19.368 10.827 0.394 1.00 0.00 H new ATOM 0 H8 G B 8 17.962 10.334 2.370 1.00 0.00 H new ATOM 0 H1 G B 8 13.466 7.470 -1.209 1.00 0.00 H new ATOM 0 H21 G B 8 15.495 8.341 -3.885 1.00 0.00 H new ATOM 0 H22 G B 8 13.998 7.587 -3.327 1.00 0.00 H new ATOM 259 P C B 9 20.415 8.965 -4.861 1.00 0.00 P ATOM 260 OP1 C B 9 21.749 8.451 -5.266 1.00 0.00 O ATOM 261 OP2 C B 9 19.764 10.024 -5.669 1.00 0.00 O ATOM 262 O5' C B 9 19.420 7.725 -4.775 1.00 0.00 O ATOM 263 C5' C B 9 19.583 6.608 -5.644 1.00 0.00 C ATOM 264 C4' C B 9 18.660 5.489 -5.236 1.00 0.00 C ATOM 265 O4' C B 9 18.777 5.281 -3.802 1.00 0.00 O ATOM 266 C3' C B 9 17.173 5.747 -5.500 1.00 0.00 C ATOM 267 O3' C B 9 16.578 4.683 -6.235 1.00 0.00 O ATOM 268 C2' C B 9 16.565 5.864 -4.105 1.00 0.00 C ATOM 269 O2' C B 9 15.261 5.314 -4.063 1.00 0.00 O ATOM 270 C1' C B 9 17.504 4.977 -3.302 1.00 0.00 C ATOM 271 N1 C B 9 17.461 5.225 -1.852 1.00 0.00 N ATOM 272 C2 C B 9 16.482 4.573 -1.107 1.00 0.00 C ATOM 273 O2 C B 9 15.713 3.791 -1.681 1.00 0.00 O ATOM 274 N3 C B 9 16.393 4.803 0.219 1.00 0.00 N ATOM 275 C4 C B 9 17.247 5.634 0.808 1.00 0.00 C ATOM 276 N4 C B 9 17.110 5.828 2.120 1.00 0.00 N ATOM 277 C5 C B 9 18.274 6.304 0.079 1.00 0.00 C ATOM 278 C6 C B 9 18.341 6.076 -1.242 1.00 0.00 C ATOM 0 H5' C B 9 20.617 6.264 -5.616 1.00 0.00 H new ATOM 0 H5'' C B 9 19.374 6.905 -6.672 1.00 0.00 H new ATOM 0 H4' C B 9 18.968 4.636 -5.840 1.00 0.00 H new ATOM 0 H3' C B 9 17.009 6.638 -6.105 1.00 0.00 H new ATOM 0 H2' C B 9 16.472 6.892 -3.755 1.00 0.00 H new ATOM 0 HO2' C B 9 15.175 4.736 -3.276 1.00 0.00 H new ATOM 0 H1' C B 9 17.221 3.930 -3.411 1.00 0.00 H new ATOM 0 H41 C B 9 17.744 6.458 2.611 1.00 0.00 H new ATOM 0 H42 C B 9 16.371 5.347 2.632 1.00 0.00 H new ATOM 0 H5 C B 9 18.970 6.968 0.570 1.00 0.00 H new ATOM 0 H6 C B 9 19.099 6.571 -1.831 1.00 0.00 H new ATOM 290 P G B 10 16.945 4.483 -7.784 1.00 0.00 P ATOM 291 OP1 G B 10 17.025 5.830 -8.405 1.00 0.00 O ATOM 292 OP2 G B 10 16.016 3.471 -8.349 1.00 0.00 O ATOM 293 O5' G B 10 18.413 3.866 -7.755 1.00 0.00 O ATOM 294 C5' G B 10 18.641 2.523 -7.326 1.00 0.00 C ATOM 295 C4' G B 10 20.082 2.345 -6.916 1.00 0.00 C ATOM 296 O4' G B 10 20.409 3.318 -5.899 1.00 0.00 O ATOM 297 C3' G B 10 20.397 1.011 -6.257 1.00 0.00 C ATOM 298 O3' G B 10 20.703 0.017 -7.230 1.00 0.00 O ATOM 299 C2' G B 10 21.601 1.318 -5.365 1.00 0.00 C ATOM 300 O2' G B 10 22.813 1.085 -6.053 1.00 0.00 O ATOM 301 C1' G B 10 21.467 2.823 -5.108 1.00 0.00 C ATOM 302 N9 G B 10 21.188 3.135 -3.710 1.00 0.00 N ATOM 303 C8 G B 10 21.941 3.910 -2.862 1.00 0.00 C ATOM 304 N7 G B 10 21.438 4.001 -1.662 1.00 0.00 N ATOM 305 C5 G B 10 20.280 3.236 -1.718 1.00 0.00 C ATOM 306 C6 G B 10 19.311 2.954 -0.719 1.00 0.00 C ATOM 307 O6 G B 10 19.276 3.337 0.461 1.00 0.00 O ATOM 308 N1 G B 10 18.301 2.132 -1.207 1.00 0.00 N ATOM 309 C2 G B 10 18.228 1.646 -2.488 1.00 0.00 C ATOM 310 N2 G B 10 17.176 0.870 -2.765 1.00 0.00 N ATOM 311 N3 G B 10 19.119 1.901 -3.427 1.00 0.00 N ATOM 312 C4 G B 10 20.112 2.696 -2.976 1.00 0.00 C ATOM 0 H5' G B 10 18.396 1.830 -8.131 1.00 0.00 H new ATOM 0 H5'' G B 10 17.985 2.284 -6.489 1.00 0.00 H new ATOM 0 H4' G B 10 20.643 2.437 -7.846 1.00 0.00 H new ATOM 0 H3' G B 10 19.556 0.609 -5.693 1.00 0.00 H new ATOM 0 H2' G B 10 21.618 0.703 -4.465 1.00 0.00 H new ATOM 0 HO2' G B 10 22.651 0.477 -6.804 1.00 0.00 H new ATOM 0 H1' G B 10 22.419 3.288 -5.364 1.00 0.00 H new ATOM 0 H8 G B 10 22.859 4.396 -3.159 1.00 0.00 H new ATOM 0 H1 G B 10 17.556 1.870 -0.562 1.00 0.00 H new ATOM 0 H21 G B 10 17.064 0.477 -3.700 1.00 0.00 H new ATOM 0 H22 G B 10 16.485 0.670 -2.042 1.00 0.00 H new ATOM 324 P C B 11 19.615 -1.111 -7.595 1.00 0.00 P ATOM 325 OP1 C B 11 20.219 -1.976 -8.640 1.00 0.00 O ATOM 326 OP2 C B 11 18.311 -0.449 -7.854 1.00 0.00 O ATOM 327 O5' C B 11 19.482 -1.964 -6.256 1.00 0.00 O ATOM 328 C5' C B 11 19.425 -3.387 -6.295 1.00 0.00 C ATOM 329 C4' C B 11 18.775 -3.916 -5.041 1.00 0.00 C ATOM 330 O4' C B 11 19.595 -3.534 -3.898 1.00 0.00 O ATOM 331 C3' C B 11 17.385 -3.353 -4.747 1.00 0.00 C ATOM 332 O3' C B 11 16.545 -4.319 -4.122 1.00 0.00 O ATOM 333 C2' C B 11 17.687 -2.190 -3.813 1.00 0.00 C ATOM 334 O2' C B 11 16.590 -1.911 -2.964 1.00 0.00 O ATOM 335 C1' C B 11 18.812 -2.797 -2.985 1.00 0.00 C ATOM 336 N1 C B 11 19.672 -1.823 -2.296 1.00 0.00 N ATOM 337 C2 C B 11 19.467 -1.606 -0.937 1.00 0.00 C ATOM 338 O2 C B 11 18.565 -2.226 -0.363 1.00 0.00 O ATOM 339 N3 C B 11 20.252 -0.727 -0.279 1.00 0.00 N ATOM 340 C4 C B 11 21.219 -0.082 -0.930 1.00 0.00 C ATOM 341 N4 C B 11 21.970 0.772 -0.238 1.00 0.00 N ATOM 342 C5 C B 11 21.456 -0.284 -2.320 1.00 0.00 C ATOM 343 C6 C B 11 20.657 -1.149 -2.963 1.00 0.00 C ATOM 0 H5' C B 11 20.431 -3.796 -6.393 1.00 0.00 H new ATOM 0 H5'' C B 11 18.862 -3.712 -7.170 1.00 0.00 H new ATOM 0 H4' C B 11 18.683 -4.990 -5.200 1.00 0.00 H new ATOM 0 H3' C B 11 16.843 -3.058 -5.646 1.00 0.00 H new ATOM 0 H2' C B 11 17.915 -1.256 -4.326 1.00 0.00 H new ATOM 0 HO2' C B 11 16.050 -2.721 -2.850 1.00 0.00 H new ATOM 0 H1' C B 11 18.369 -3.392 -2.187 1.00 0.00 H new ATOM 0 H41 C B 11 22.720 1.284 -0.703 1.00 0.00 H new ATOM 0 H42 C B 11 21.795 0.914 0.757 1.00 0.00 H new ATOM 0 H5 C B 11 22.248 0.239 -2.836 1.00 0.00 H new ATOM 0 H6 C B 11 20.794 -1.315 -4.021 1.00 0.00 H new ATOM 355 P G B 12 15.746 -5.386 -5.019 1.00 0.00 P ATOM 356 OP1 G B 12 15.170 -4.660 -6.180 1.00 0.00 O ATOM 357 OP2 G B 12 14.851 -6.166 -4.126 1.00 0.00 O ATOM 358 O5' G B 12 16.882 -6.361 -5.565 1.00 0.00 O ATOM 359 C5' G B 12 17.672 -7.142 -4.672 1.00 0.00 C ATOM 360 C4' G B 12 18.889 -7.675 -5.390 1.00 0.00 C ATOM 361 O4' G B 12 19.792 -6.574 -5.661 1.00 0.00 O ATOM 362 C3' G B 12 19.732 -8.665 -4.602 1.00 0.00 C ATOM 363 O3' G B 12 19.235 -10.003 -4.704 1.00 0.00 O ATOM 364 C2' G B 12 21.113 -8.517 -5.236 1.00 0.00 C ATOM 365 O2' G B 12 21.212 -9.283 -6.421 1.00 0.00 O ATOM 366 C1' G B 12 21.129 -7.034 -5.613 1.00 0.00 C ATOM 367 N9 G B 12 21.866 -6.199 -4.671 1.00 0.00 N ATOM 368 C8 G B 12 23.100 -5.627 -4.861 1.00 0.00 C ATOM 369 N7 G B 12 23.499 -4.914 -3.845 1.00 0.00 N ATOM 370 C5 G B 12 22.468 -5.026 -2.922 1.00 0.00 C ATOM 371 C6 G B 12 22.333 -4.473 -1.624 1.00 0.00 C ATOM 372 O6 G B 12 23.122 -3.745 -1.010 1.00 0.00 O ATOM 373 N1 G B 12 21.130 -4.842 -1.032 1.00 0.00 N ATOM 374 C2 G B 12 20.180 -5.644 -1.613 1.00 0.00 C ATOM 375 N2 G B 12 19.085 -5.886 -0.883 1.00 0.00 N ATOM 376 N3 G B 12 20.294 -6.169 -2.821 1.00 0.00 N ATOM 377 C4 G B 12 21.454 -5.820 -3.414 1.00 0.00 C ATOM 0 H5' G B 12 17.081 -7.969 -4.279 1.00 0.00 H new ATOM 0 H5'' G B 12 17.979 -6.536 -3.820 1.00 0.00 H new ATOM 0 H4' G B 12 18.484 -8.177 -6.269 1.00 0.00 H new ATOM 0 H3' G B 12 19.729 -8.466 -3.530 1.00 0.00 H new ATOM 0 H2' G B 12 21.921 -8.841 -4.580 1.00 0.00 H new ATOM 0 HO2' G B 12 20.551 -10.006 -6.399 1.00 0.00 H new ATOM 0 HO3' G B 12 19.807 -10.605 -4.184 1.00 0.00 H new ATOM 0 H1' G B 12 21.634 -6.954 -6.576 1.00 0.00 H new ATOM 0 H8 G B 12 23.682 -5.755 -5.762 1.00 0.00 H new ATOM 0 H1 G B 12 20.939 -4.490 -0.094 1.00 0.00 H new ATOM 0 H21 G B 12 18.342 -6.475 -1.258 1.00 0.00 H new ATOM 0 H22 G B 12 18.994 -5.482 0.049 1.00 0.00 H new TER 390 G B 12