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 13:sc= 0.226 USER MOD Single : A 1 C O5' : rot 40:sc= -0.658 USER MOD Single : A 2 G O2' : rot -22:sc= 0.195 USER MOD Single : A 3 C O2' : rot 136:sc= 1.06 USER MOD Single : A 4 G O2' : rot -12:sc= 0.228 USER MOD Single : A 5 C O2' : rot 17:sc= -0.11 USER MOD Single : A 6 G O2' : rot -19:sc= 0.129 USER MOD Single : A 6 G O3' : rot 180:sc= 0.136 USER MOD Single : B 7 C O2' : rot 24:sc= 0.238 USER MOD Single : B 7 C O5' : rot 53:sc= -0.299! USER MOD Single : B 8 G O2' : rot -24:sc= 0.175 USER MOD Single : B 9 C O2' : rot 135:sc= 0.843 USER MOD Single : B 10 G O2' : rot -21:sc= 0.252 USER MOD Single : B 11 C O2' : rot 29:sc= 0.0036 USER MOD Single : B 12 G O2' : rot -29:sc= 0.147 USER MOD Single : B 12 G O3' : rot 180:sc= 0.136 USER MOD ----------------------------------------------------------------- ATOM 1 O5' C A 1 21.320 -3.522 6.558 1.00 0.00 O ATOM 2 C5' C A 1 20.119 -3.097 7.212 1.00 0.00 C ATOM 3 C4' C A 1 18.907 -3.778 6.618 1.00 0.00 C ATOM 4 O4' C A 1 18.715 -3.294 5.264 1.00 0.00 O ATOM 5 C3' C A 1 19.003 -5.292 6.479 1.00 0.00 C ATOM 6 O3' C A 1 17.716 -5.901 6.507 1.00 0.00 O ATOM 7 C2' C A 1 19.688 -5.467 5.127 1.00 0.00 C ATOM 8 O2' C A 1 19.266 -6.659 4.493 1.00 0.00 O ATOM 9 C1' C A 1 19.134 -4.278 4.338 1.00 0.00 C ATOM 10 N1 C A 1 20.125 -3.669 3.438 1.00 0.00 N ATOM 11 C2 C A 1 20.228 -4.136 2.125 1.00 0.00 C ATOM 12 O2 C A 1 19.468 -5.038 1.746 1.00 0.00 O ATOM 13 N3 C A 1 21.153 -3.593 1.303 1.00 0.00 N ATOM 14 C4 C A 1 21.952 -2.620 1.748 1.00 0.00 C ATOM 15 N4 C A 1 22.850 -2.115 0.904 1.00 0.00 N ATOM 16 C5 C A 1 21.864 -2.121 3.079 1.00 0.00 C ATOM 17 C6 C A 1 20.941 -2.667 3.880 1.00 0.00 C ATOM 0 H5' C A 1 20.014 -2.016 7.120 1.00 0.00 H new ATOM 0 H5'' C A 1 20.181 -3.322 8.277 1.00 0.00 H new ATOM 0 H4' C A 1 18.100 -3.547 7.314 1.00 0.00 H new ATOM 0 H3' C A 1 19.548 -5.767 7.295 1.00 0.00 H new ATOM 0 H2' C A 1 20.774 -5.515 5.203 1.00 0.00 H new ATOM 0 HO2' C A 1 18.474 -7.010 4.951 1.00 0.00 H new ATOM 0 HO5' C A 1 21.156 -3.608 5.596 1.00 0.00 H new ATOM 0 H1' C A 1 18.315 -4.647 3.720 1.00 0.00 H new ATOM 0 H41 C A 1 23.476 -1.371 1.211 1.00 0.00 H new ATOM 0 H42 C A 1 22.911 -2.473 -0.049 1.00 0.00 H new ATOM 0 H5 C A 1 22.516 -1.334 3.428 1.00 0.00 H new ATOM 0 H6 C A 1 20.840 -2.309 4.894 1.00 0.00 H new ATOM 30 P G A 2 16.861 -5.898 7.870 1.00 0.00 P ATOM 31 OP1 G A 2 17.790 -6.201 8.989 1.00 0.00 O ATOM 32 OP2 G A 2 15.661 -6.746 7.663 1.00 0.00 O ATOM 33 O5' G A 2 16.388 -4.383 8.013 1.00 0.00 O ATOM 34 C5' G A 2 15.635 -3.756 6.977 1.00 0.00 C ATOM 35 C4' G A 2 15.596 -2.263 7.188 1.00 0.00 C ATOM 36 O4' G A 2 16.922 -1.712 7.094 1.00 0.00 O ATOM 37 C3' G A 2 14.847 -1.464 6.133 1.00 0.00 C ATOM 38 O3' G A 2 13.438 -1.526 6.330 1.00 0.00 O ATOM 39 C2' G A 2 15.391 -0.051 6.341 1.00 0.00 C ATOM 40 O2' G A 2 14.660 0.629 7.342 1.00 0.00 O ATOM 41 C1' G A 2 16.804 -0.326 6.872 1.00 0.00 C ATOM 42 N9 G A 2 17.859 0.091 5.957 1.00 0.00 N ATOM 43 C8 G A 2 18.833 1.025 6.195 1.00 0.00 C ATOM 44 N7 G A 2 19.633 1.207 5.180 1.00 0.00 N ATOM 45 C5 G A 2 19.158 0.331 4.213 1.00 0.00 C ATOM 46 C6 G A 2 19.618 0.079 2.894 1.00 0.00 C ATOM 47 O6 G A 2 20.567 0.599 2.294 1.00 0.00 O ATOM 48 N1 G A 2 18.848 -0.891 2.263 1.00 0.00 N ATOM 49 C2 G A 2 17.777 -1.537 2.825 1.00 0.00 C ATOM 50 N2 G A 2 17.174 -2.455 2.065 1.00 0.00 N ATOM 51 N3 G A 2 17.332 -1.306 4.046 1.00 0.00 N ATOM 52 C4 G A 2 18.066 -0.368 4.679 1.00 0.00 C ATOM 0 H5' G A 2 14.621 -4.155 6.963 1.00 0.00 H new ATOM 0 H5'' G A 2 16.079 -3.982 6.008 1.00 0.00 H new ATOM 0 H4' G A 2 15.106 -2.175 8.157 1.00 0.00 H new ATOM 0 H3' G A 2 14.995 -1.836 5.119 1.00 0.00 H new ATOM 0 H2' G A 2 15.344 0.560 5.440 1.00 0.00 H new ATOM 0 HO2' G A 2 13.774 0.221 7.434 1.00 0.00 H new ATOM 0 H1' G A 2 16.931 0.255 7.786 1.00 0.00 H new ATOM 0 H8 G A 2 18.929 1.558 7.130 1.00 0.00 H new ATOM 0 H1 G A 2 19.099 -1.142 1.307 1.00 0.00 H new ATOM 0 H21 G A 2 16.371 -2.970 2.427 1.00 0.00 H new ATOM 0 H22 G A 2 17.516 -2.641 1.122 1.00 0.00 H new ATOM 64 P C A 3 12.542 -2.495 5.411 1.00 0.00 P ATOM 65 OP1 C A 3 11.123 -2.200 5.731 1.00 0.00 O ATOM 66 OP2 C A 3 13.047 -3.885 5.534 1.00 0.00 O ATOM 67 O5' C A 3 12.824 -1.996 3.927 1.00 0.00 O ATOM 68 C5' C A 3 11.774 -1.946 2.968 1.00 0.00 C ATOM 69 C4' C A 3 12.264 -1.301 1.696 1.00 0.00 C ATOM 70 O4' C A 3 12.959 -0.070 2.035 1.00 0.00 O ATOM 71 C3' C A 3 13.263 -2.139 0.891 1.00 0.00 C ATOM 72 O3' C A 3 12.849 -2.282 -0.461 1.00 0.00 O ATOM 73 C2' C A 3 14.574 -1.365 1.002 1.00 0.00 C ATOM 74 O2' C A 3 15.326 -1.429 -0.196 1.00 0.00 O ATOM 75 C1' C A 3 14.063 0.057 1.179 1.00 0.00 C ATOM 76 N1 C A 3 15.052 0.973 1.768 1.00 0.00 N ATOM 77 C2 C A 3 15.996 1.543 0.919 1.00 0.00 C ATOM 78 O2 C A 3 15.954 1.276 -0.290 1.00 0.00 O ATOM 79 N3 C A 3 16.932 2.370 1.426 1.00 0.00 N ATOM 80 C4 C A 3 16.942 2.647 2.728 1.00 0.00 C ATOM 81 N4 C A 3 17.890 3.470 3.174 1.00 0.00 N ATOM 82 C5 C A 3 15.982 2.090 3.624 1.00 0.00 C ATOM 83 C6 C A 3 15.065 1.257 3.106 1.00 0.00 C ATOM 0 H5' C A 3 10.931 -1.383 3.369 1.00 0.00 H new ATOM 0 H5'' C A 3 11.414 -2.953 2.759 1.00 0.00 H new ATOM 0 H4' C A 3 11.372 -1.159 1.085 1.00 0.00 H new ATOM 0 H3' C A 3 13.353 -3.158 1.268 1.00 0.00 H new ATOM 0 H2' C A 3 15.226 -1.741 1.790 1.00 0.00 H new ATOM 0 HO2' C A 3 15.684 -0.541 -0.406 1.00 0.00 H new ATOM 0 H1' C A 3 13.823 0.493 0.209 1.00 0.00 H new ATOM 0 H41 C A 3 17.934 3.709 4.165 1.00 0.00 H new ATOM 0 H42 C A 3 18.572 3.862 2.525 1.00 0.00 H new ATOM 0 H5 C A 3 15.992 2.329 4.677 1.00 0.00 H new ATOM 0 H6 C A 3 14.328 0.806 3.754 1.00 0.00 H new ATOM 95 P G A 4 11.630 -3.261 -0.821 1.00 0.00 P ATOM 96 OP1 G A 4 11.695 -4.423 0.102 1.00 0.00 O ATOM 97 OP2 G A 4 11.639 -3.491 -2.288 1.00 0.00 O ATOM 98 O5' G A 4 10.332 -2.413 -0.450 1.00 0.00 O ATOM 99 C5' G A 4 9.970 -1.254 -1.199 1.00 0.00 C ATOM 100 C4' G A 4 9.085 -0.355 -0.372 1.00 0.00 C ATOM 101 O4' G A 4 9.762 -0.034 0.864 1.00 0.00 O ATOM 102 C3' G A 4 8.794 1.002 -0.994 1.00 0.00 C ATOM 103 O3' G A 4 7.662 0.938 -1.858 1.00 0.00 O ATOM 104 C2' G A 4 8.532 1.908 0.210 1.00 0.00 C ATOM 105 O2' G A 4 7.157 1.931 0.537 1.00 0.00 O ATOM 106 C1' G A 4 9.293 1.209 1.340 1.00 0.00 C ATOM 107 N9 G A 4 10.434 1.985 1.818 1.00 0.00 N ATOM 108 C8 G A 4 10.650 2.452 3.092 1.00 0.00 C ATOM 109 N7 G A 4 11.761 3.125 3.213 1.00 0.00 N ATOM 110 C5 G A 4 12.314 3.103 1.939 1.00 0.00 C ATOM 111 C6 G A 4 13.519 3.671 1.446 1.00 0.00 C ATOM 112 O6 G A 4 14.375 4.328 2.057 1.00 0.00 O ATOM 113 N1 G A 4 13.688 3.407 0.091 1.00 0.00 N ATOM 114 C2 G A 4 12.817 2.691 -0.690 1.00 0.00 C ATOM 115 N2 G A 4 13.160 2.544 -1.973 1.00 0.00 N ATOM 116 N3 G A 4 11.695 2.158 -0.246 1.00 0.00 N ATOM 117 C4 G A 4 11.506 2.401 1.067 1.00 0.00 C ATOM 0 H5' G A 4 9.451 -1.549 -2.111 1.00 0.00 H new ATOM 0 H5'' G A 4 10.867 -0.714 -1.503 1.00 0.00 H new ATOM 0 H4' G A 4 8.155 -0.913 -0.262 1.00 0.00 H new ATOM 0 H3' G A 4 9.611 1.366 -1.617 1.00 0.00 H new ATOM 0 H2' G A 4 8.836 2.939 0.028 1.00 0.00 H new ATOM 0 HO2' G A 4 6.641 1.521 -0.189 1.00 0.00 H new ATOM 0 H1' G A 4 8.604 1.089 2.176 1.00 0.00 H new ATOM 0 H8 G A 4 9.968 2.279 3.911 1.00 0.00 H new ATOM 0 H1 G A 4 14.527 3.775 -0.358 1.00 0.00 H new ATOM 0 H21 G A 4 12.554 2.022 -2.606 1.00 0.00 H new ATOM 0 H22 G A 4 14.027 2.954 -2.319 1.00 0.00 H new ATOM 129 P C A 5 7.871 0.933 -3.453 1.00 0.00 P ATOM 130 OP1 C A 5 6.519 0.863 -4.066 1.00 0.00 O ATOM 131 OP2 C A 5 8.886 -0.093 -3.799 1.00 0.00 O ATOM 132 O5' C A 5 8.487 2.367 -3.766 1.00 0.00 O ATOM 133 C5' C A 5 8.060 3.118 -4.900 1.00 0.00 C ATOM 134 C4' C A 5 9.100 4.151 -5.261 1.00 0.00 C ATOM 135 O4' C A 5 9.280 5.045 -4.125 1.00 0.00 O ATOM 136 C3' C A 5 10.489 3.590 -5.561 1.00 0.00 C ATOM 137 O3' C A 5 11.148 4.337 -6.579 1.00 0.00 O ATOM 138 C2' C A 5 11.199 3.720 -4.220 1.00 0.00 C ATOM 139 O2' C A 5 12.601 3.837 -4.380 1.00 0.00 O ATOM 140 C1' C A 5 10.641 5.057 -3.753 1.00 0.00 C ATOM 141 N1 C A 5 10.737 5.300 -2.306 1.00 0.00 N ATOM 142 C2 C A 5 11.779 6.093 -1.838 1.00 0.00 C ATOM 143 O2 C A 5 12.595 6.545 -2.651 1.00 0.00 O ATOM 144 N3 C A 5 11.878 6.351 -0.517 1.00 0.00 N ATOM 145 C4 C A 5 10.980 5.847 0.327 1.00 0.00 C ATOM 146 N4 C A 5 11.116 6.135 1.621 1.00 0.00 N ATOM 147 C5 C A 5 9.903 5.028 -0.119 1.00 0.00 C ATOM 148 C6 C A 5 9.827 4.771 -1.433 1.00 0.00 C ATOM 0 H5' C A 5 7.110 3.607 -4.685 1.00 0.00 H new ATOM 0 H5'' C A 5 7.891 2.451 -5.745 1.00 0.00 H new ATOM 0 H4' C A 5 8.723 4.631 -6.164 1.00 0.00 H new ATOM 0 H3' C A 5 10.468 2.568 -5.940 1.00 0.00 H new ATOM 0 H2' C A 5 11.046 2.871 -3.554 1.00 0.00 H new ATOM 0 HO2' C A 5 12.806 4.073 -5.309 1.00 0.00 H new ATOM 0 H1' C A 5 11.229 5.853 -4.209 1.00 0.00 H new ATOM 0 H41 C A 5 10.448 5.767 2.298 1.00 0.00 H new ATOM 0 H42 C A 5 11.888 6.723 1.934 1.00 0.00 H new ATOM 0 H5 C A 5 9.176 4.630 0.574 1.00 0.00 H new ATOM 0 H6 C A 5 9.036 4.138 -1.807 1.00 0.00 H new ATOM 160 P G A 6 10.899 3.979 -8.124 1.00 0.00 P ATOM 161 OP1 G A 6 10.930 2.499 -8.256 1.00 0.00 O ATOM 162 OP2 G A 6 11.819 4.806 -8.946 1.00 0.00 O ATOM 163 O5' G A 6 9.407 4.464 -8.401 1.00 0.00 O ATOM 164 C5' G A 6 9.050 5.841 -8.300 1.00 0.00 C ATOM 165 C4' G A 6 7.547 5.982 -8.240 1.00 0.00 C ATOM 166 O4' G A 6 7.079 5.461 -6.971 1.00 0.00 O ATOM 167 C3' G A 6 7.025 7.411 -8.279 1.00 0.00 C ATOM 168 O3' G A 6 6.885 7.900 -9.616 1.00 0.00 O ATOM 169 C2' G A 6 5.680 7.302 -7.565 1.00 0.00 C ATOM 170 O2' G A 6 4.671 6.850 -8.448 1.00 0.00 O ATOM 171 C1' G A 6 5.953 6.199 -6.539 1.00 0.00 C ATOM 172 N9 G A 6 6.228 6.706 -5.197 1.00 0.00 N ATOM 173 C8 G A 6 5.386 6.677 -4.113 1.00 0.00 C ATOM 174 N7 G A 6 5.916 7.188 -3.036 1.00 0.00 N ATOM 175 C5 G A 6 7.185 7.586 -3.436 1.00 0.00 C ATOM 176 C6 G A 6 8.225 8.211 -2.702 1.00 0.00 C ATOM 177 O6 G A 6 8.235 8.547 -1.513 1.00 0.00 O ATOM 178 N1 G A 6 9.344 8.442 -3.496 1.00 0.00 N ATOM 179 C2 G A 6 9.449 8.114 -4.824 1.00 0.00 C ATOM 180 N2 G A 6 10.609 8.414 -5.416 1.00 0.00 N ATOM 181 N3 G A 6 8.487 7.534 -5.521 1.00 0.00 N ATOM 182 C4 G A 6 7.391 7.299 -4.769 1.00 0.00 C ATOM 0 H5' G A 6 9.441 6.390 -9.156 1.00 0.00 H new ATOM 0 H5'' G A 6 9.500 6.278 -7.409 1.00 0.00 H new ATOM 0 H4' G A 6 7.189 5.452 -9.123 1.00 0.00 H new ATOM 0 H3' G A 6 7.703 8.123 -7.809 1.00 0.00 H new ATOM 0 H2' G A 6 5.340 8.252 -7.152 1.00 0.00 H new ATOM 0 HO2' G A 6 4.962 6.986 -9.374 1.00 0.00 H new ATOM 0 HO3' G A 6 6.546 8.819 -9.594 1.00 0.00 H new ATOM 0 H1' G A 6 5.052 5.589 -6.475 1.00 0.00 H new ATOM 0 H8 G A 6 4.385 6.272 -4.148 1.00 0.00 H new ATOM 0 H1 G A 6 10.148 8.890 -3.057 1.00 0.00 H new ATOM 0 H21 G A 6 10.750 8.195 -6.402 1.00 0.00 H new ATOM 0 H22 G A 6 11.354 8.861 -4.881 1.00 0.00 H new TER 195 G A 6 ATOM 196 O5' C B 7 14.240 13.682 -0.348 1.00 0.00 O ATOM 197 C5' C B 7 15.644 13.445 -0.480 1.00 0.00 C ATOM 198 C4' C B 7 15.980 12.921 -1.857 1.00 0.00 C ATOM 199 O4' C B 7 15.498 11.559 -1.971 1.00 0.00 O ATOM 200 C3' C B 7 15.333 13.657 -3.022 1.00 0.00 C ATOM 201 O3' C B 7 16.110 13.539 -4.210 1.00 0.00 O ATOM 202 C2' C B 7 13.977 12.969 -3.155 1.00 0.00 C ATOM 203 O2' C B 7 13.548 12.954 -4.502 1.00 0.00 O ATOM 204 C1' C B 7 14.310 11.532 -2.738 1.00 0.00 C ATOM 205 N1 C B 7 13.255 10.906 -1.926 1.00 0.00 N ATOM 206 C2 C B 7 12.237 10.192 -2.565 1.00 0.00 C ATOM 207 O2 C B 7 12.259 10.087 -3.801 1.00 0.00 O ATOM 208 N3 C B 7 11.256 9.634 -1.821 1.00 0.00 N ATOM 209 C4 C B 7 11.270 9.765 -0.493 1.00 0.00 C ATOM 210 N4 C B 7 10.283 9.200 0.202 1.00 0.00 N ATOM 211 C5 C B 7 12.298 10.480 0.184 1.00 0.00 C ATOM 212 C6 C B 7 13.264 11.025 -0.564 1.00 0.00 C ATOM 0 H5' C B 7 15.967 12.728 0.274 1.00 0.00 H new ATOM 0 H5'' C B 7 16.191 14.370 -0.296 1.00 0.00 H new ATOM 0 H4' C B 7 17.061 13.042 -1.931 1.00 0.00 H new ATOM 0 H3' C B 7 15.246 14.731 -2.857 1.00 0.00 H new ATOM 0 H2' C B 7 13.193 13.455 -2.575 1.00 0.00 H new ATOM 0 HO2' C B 7 14.326 13.028 -5.094 1.00 0.00 H new ATOM 0 HO5' C B 7 13.746 12.877 -0.610 1.00 0.00 H new ATOM 0 H1' C B 7 14.415 10.943 -3.649 1.00 0.00 H new ATOM 0 H41 C B 7 10.264 9.281 1.219 1.00 0.00 H new ATOM 0 H42 C B 7 9.547 8.686 -0.283 1.00 0.00 H new ATOM 0 H5 C B 7 12.298 10.579 1.259 1.00 0.00 H new ATOM 0 H6 C B 7 14.065 11.568 -0.084 1.00 0.00 H new ATOM 225 P G B 8 17.542 14.264 -4.302 1.00 0.00 P ATOM 226 OP1 G B 8 17.426 15.588 -3.638 1.00 0.00 O ATOM 227 OP2 G B 8 18.008 14.187 -5.710 1.00 0.00 O ATOM 228 O5' G B 8 18.486 13.340 -3.411 1.00 0.00 O ATOM 229 C5' G B 8 18.519 11.928 -3.605 1.00 0.00 C ATOM 230 C4' G B 8 19.158 11.249 -2.421 1.00 0.00 C ATOM 231 O4' G B 8 18.295 11.343 -1.274 1.00 0.00 O ATOM 232 C3' G B 8 19.363 9.748 -2.546 1.00 0.00 C ATOM 233 O3' G B 8 20.520 9.440 -3.318 1.00 0.00 O ATOM 234 C2' G B 8 19.516 9.307 -1.090 1.00 0.00 C ATOM 235 O2' G B 8 20.864 9.400 -0.673 1.00 0.00 O ATOM 236 C1' G B 8 18.704 10.370 -0.341 1.00 0.00 C ATOM 237 N9 G B 8 17.522 9.837 0.325 1.00 0.00 N ATOM 238 C8 G B 8 17.258 9.854 1.670 1.00 0.00 C ATOM 239 N7 G B 8 16.129 9.278 1.982 1.00 0.00 N ATOM 240 C5 G B 8 15.611 8.861 0.763 1.00 0.00 C ATOM 241 C6 G B 8 14.407 8.175 0.458 1.00 0.00 C ATOM 242 O6 G B 8 13.527 7.779 1.232 1.00 0.00 O ATOM 243 N1 G B 8 14.276 7.958 -0.908 1.00 0.00 N ATOM 244 C2 G B 8 15.180 8.351 -1.860 1.00 0.00 C ATOM 245 N2 G B 8 14.865 8.069 -3.128 1.00 0.00 N ATOM 246 N3 G B 8 16.309 8.981 -1.593 1.00 0.00 N ATOM 247 C4 G B 8 16.458 9.205 -0.271 1.00 0.00 C ATOM 0 H5' G B 8 19.076 11.692 -4.512 1.00 0.00 H new ATOM 0 H5'' G B 8 17.506 11.550 -3.746 1.00 0.00 H new ATOM 0 H4' G B 8 20.119 11.758 -2.345 1.00 0.00 H new ATOM 0 H3' G B 8 18.548 9.242 -3.063 1.00 0.00 H new ATOM 0 H2' G B 8 19.198 8.278 -0.924 1.00 0.00 H new ATOM 0 HO2' G B 8 21.452 9.351 -1.455 1.00 0.00 H new ATOM 0 H1' G B 8 19.345 10.783 0.438 1.00 0.00 H new ATOM 0 H8 G B 8 17.918 10.300 2.399 1.00 0.00 H new ATOM 0 H1 G B 8 13.441 7.467 -1.228 1.00 0.00 H new ATOM 0 H21 G B 8 15.498 8.336 -3.882 1.00 0.00 H new ATOM 0 H22 G B 8 13.992 7.587 -3.341 1.00 0.00 H new ATOM 259 P C B 9 20.362 8.941 -4.838 1.00 0.00 P ATOM 260 OP1 C B 9 21.696 8.452 -5.272 1.00 0.00 O ATOM 261 OP2 C B 9 19.678 9.995 -5.628 1.00 0.00 O ATOM 262 O5' C B 9 19.388 7.685 -4.742 1.00 0.00 O ATOM 263 C5' C B 9 19.573 6.560 -5.594 1.00 0.00 C ATOM 264 C4' C B 9 18.659 5.437 -5.178 1.00 0.00 C ATOM 265 O4' C B 9 18.763 5.254 -3.740 1.00 0.00 O ATOM 266 C3' C B 9 17.172 5.674 -5.461 1.00 0.00 C ATOM 267 O3' C B 9 16.605 4.607 -6.210 1.00 0.00 O ATOM 268 C2' C B 9 16.539 5.777 -4.074 1.00 0.00 C ATOM 269 O2' C B 9 15.253 5.183 -4.051 1.00 0.00 O ATOM 270 C1' C B 9 17.493 4.924 -3.250 1.00 0.00 C ATOM 271 N1 C B 9 17.428 5.188 -1.804 1.00 0.00 N ATOM 272 C2 C B 9 16.438 4.546 -1.066 1.00 0.00 C ATOM 273 O2 C B 9 15.677 3.758 -1.642 1.00 0.00 O ATOM 274 N3 C B 9 16.329 4.789 0.254 1.00 0.00 N ATOM 275 C4 C B 9 17.174 5.627 0.848 1.00 0.00 C ATOM 276 N4 C B 9 17.017 5.834 2.155 1.00 0.00 N ATOM 277 C5 C B 9 18.213 6.289 0.127 1.00 0.00 C ATOM 278 C6 C B 9 18.298 6.048 -1.190 1.00 0.00 C ATOM 0 H5' C B 9 20.611 6.229 -5.551 1.00 0.00 H new ATOM 0 H5'' C B 9 19.370 6.840 -6.628 1.00 0.00 H new ATOM 0 H4' C B 9 18.983 4.578 -5.765 1.00 0.00 H new ATOM 0 H3' C B 9 17.004 6.567 -6.064 1.00 0.00 H new ATOM 0 H2' C B 9 16.408 6.803 -3.731 1.00 0.00 H new ATOM 0 HO2' C B 9 15.165 4.625 -3.250 1.00 0.00 H new ATOM 0 H1' C B 9 17.238 3.869 -3.349 1.00 0.00 H new ATOM 0 H41 C B 9 17.643 6.469 2.650 1.00 0.00 H new ATOM 0 H42 C B 9 16.270 5.357 2.661 1.00 0.00 H new ATOM 0 H5 C B 9 18.903 6.957 0.622 1.00 0.00 H new ATOM 0 H6 C B 9 19.063 6.539 -1.773 1.00 0.00 H new ATOM 290 P G B 10 16.981 4.437 -7.762 1.00 0.00 P ATOM 291 OP1 G B 10 17.064 5.795 -8.356 1.00 0.00 O ATOM 292 OP2 G B 10 16.058 3.434 -8.352 1.00 0.00 O ATOM 293 O5' G B 10 18.451 3.820 -7.736 1.00 0.00 O ATOM 294 C5' G B 10 18.684 2.485 -7.291 1.00 0.00 C ATOM 295 C4' G B 10 20.127 2.315 -6.885 1.00 0.00 C ATOM 296 O4' G B 10 20.456 3.307 -5.887 1.00 0.00 O ATOM 297 C3' G B 10 20.450 0.993 -6.208 1.00 0.00 C ATOM 298 O3' G B 10 20.753 -0.017 -7.165 1.00 0.00 O ATOM 299 C2' G B 10 21.660 1.319 -5.332 1.00 0.00 C ATOM 300 O2' G B 10 22.869 1.094 -6.032 1.00 0.00 O ATOM 301 C1' G B 10 21.512 2.822 -5.084 1.00 0.00 C ATOM 302 N9 G B 10 21.220 3.137 -3.689 1.00 0.00 N ATOM 303 C8 G B 10 21.972 3.903 -2.831 1.00 0.00 C ATOM 304 N7 G B 10 21.456 3.994 -1.636 1.00 0.00 N ATOM 305 C5 G B 10 20.291 3.243 -1.708 1.00 0.00 C ATOM 306 C6 G B 10 19.308 2.966 -0.720 1.00 0.00 C ATOM 307 O6 G B 10 19.264 3.344 0.460 1.00 0.00 O ATOM 308 N1 G B 10 18.295 2.159 -1.225 1.00 0.00 N ATOM 309 C2 G B 10 18.230 1.679 -2.509 1.00 0.00 C ATOM 310 N2 G B 10 17.170 0.920 -2.804 1.00 0.00 N ATOM 311 N3 G B 10 19.136 1.927 -3.436 1.00 0.00 N ATOM 312 C4 G B 10 20.131 2.709 -2.971 1.00 0.00 C ATOM 0 H5' G B 10 18.437 1.781 -8.085 1.00 0.00 H new ATOM 0 H5'' G B 10 18.032 2.256 -6.448 1.00 0.00 H new ATOM 0 H4' G B 10 20.683 2.391 -7.819 1.00 0.00 H new ATOM 0 H3' G B 10 19.613 0.598 -5.632 1.00 0.00 H new ATOM 0 H2' G B 10 21.694 0.710 -4.428 1.00 0.00 H new ATOM 0 HO2' G B 10 22.707 0.474 -6.773 1.00 0.00 H new ATOM 0 H1' G B 10 22.462 3.294 -5.335 1.00 0.00 H new ATOM 0 H8 G B 10 22.897 4.382 -3.117 1.00 0.00 H new ATOM 0 H1 G B 10 17.539 1.903 -0.590 1.00 0.00 H new ATOM 0 H21 G B 10 17.065 0.533 -3.742 1.00 0.00 H new ATOM 0 H22 G B 10 16.466 0.727 -2.091 1.00 0.00 H new ATOM 324 P C B 11 19.663 -1.148 -7.511 1.00 0.00 P ATOM 325 OP1 C B 11 20.265 -2.029 -8.546 1.00 0.00 O ATOM 326 OP2 C B 11 18.359 -0.489 -7.779 1.00 0.00 O ATOM 327 O5' C B 11 19.531 -1.983 -6.161 1.00 0.00 O ATOM 328 C5' C B 11 19.434 -3.405 -6.185 1.00 0.00 C ATOM 329 C4' C B 11 18.804 -3.903 -4.907 1.00 0.00 C ATOM 330 O4' C B 11 19.639 -3.491 -3.786 1.00 0.00 O ATOM 331 C3' C B 11 17.417 -3.339 -4.609 1.00 0.00 C ATOM 332 O3' C B 11 16.591 -4.295 -3.950 1.00 0.00 O ATOM 333 C2' C B 11 17.727 -2.153 -3.708 1.00 0.00 C ATOM 334 O2' C B 11 16.642 -1.850 -2.853 1.00 0.00 O ATOM 335 C1' C B 11 18.862 -2.738 -2.879 1.00 0.00 C ATOM 336 N1 C B 11 19.726 -1.750 -2.218 1.00 0.00 N ATOM 337 C2 C B 11 19.511 -1.484 -0.869 1.00 0.00 C ATOM 338 O2 C B 11 18.597 -2.076 -0.282 1.00 0.00 O ATOM 339 N3 C B 11 20.299 -0.593 -0.233 1.00 0.00 N ATOM 340 C4 C B 11 21.277 0.021 -0.896 1.00 0.00 C ATOM 341 N4 C B 11 22.031 0.889 -0.225 1.00 0.00 N ATOM 342 C5 C B 11 21.524 -0.227 -2.277 1.00 0.00 C ATOM 343 C6 C B 11 20.721 -1.106 -2.897 1.00 0.00 C ATOM 0 H5' C B 11 20.425 -3.843 -6.306 1.00 0.00 H new ATOM 0 H5'' C B 11 18.838 -3.722 -7.041 1.00 0.00 H new ATOM 0 H4' C B 11 18.714 -4.982 -5.036 1.00 0.00 H new ATOM 0 H3' C B 11 16.861 -3.067 -5.506 1.00 0.00 H new ATOM 0 H2' C B 11 17.946 -1.232 -4.248 1.00 0.00 H new ATOM 0 HO2' C B 11 16.132 -2.666 -2.670 1.00 0.00 H new ATOM 0 H1' C B 11 18.428 -3.317 -2.064 1.00 0.00 H new ATOM 0 H41 C B 11 22.790 1.379 -0.699 1.00 0.00 H new ATOM 0 H42 C B 11 21.850 1.064 0.763 1.00 0.00 H new ATOM 0 H5 C B 11 22.324 0.272 -2.803 1.00 0.00 H new ATOM 0 H6 C B 11 20.864 -1.307 -3.948 1.00 0.00 H new ATOM 355 P G B 12 15.715 -5.327 -4.815 1.00 0.00 P ATOM 356 OP1 G B 12 15.106 -4.571 -5.940 1.00 0.00 O ATOM 357 OP2 G B 12 14.841 -6.085 -3.883 1.00 0.00 O ATOM 358 O5' G B 12 16.788 -6.334 -5.426 1.00 0.00 O ATOM 359 C5' G B 12 17.589 -7.157 -4.581 1.00 0.00 C ATOM 360 C4' G B 12 18.741 -7.739 -5.365 1.00 0.00 C ATOM 361 O4' G B 12 19.664 -6.672 -5.696 1.00 0.00 O ATOM 362 C3' G B 12 19.587 -8.759 -4.617 1.00 0.00 C ATOM 363 O3' G B 12 19.051 -10.083 -4.710 1.00 0.00 O ATOM 364 C2' G B 12 20.947 -8.647 -5.302 1.00 0.00 C ATOM 365 O2' G B 12 20.982 -9.416 -6.488 1.00 0.00 O ATOM 366 C1' G B 12 20.990 -7.166 -5.684 1.00 0.00 C ATOM 367 N9 G B 12 21.772 -6.346 -4.764 1.00 0.00 N ATOM 368 C8 G B 12 23.023 -5.822 -4.980 1.00 0.00 C ATOM 369 N7 G B 12 23.461 -5.106 -3.982 1.00 0.00 N ATOM 370 C5 G B 12 22.440 -5.169 -3.042 1.00 0.00 C ATOM 371 C6 G B 12 22.341 -4.590 -1.752 1.00 0.00 C ATOM 372 O6 G B 12 23.164 -3.882 -1.161 1.00 0.00 O ATOM 373 N1 G B 12 21.136 -4.909 -1.138 1.00 0.00 N ATOM 374 C2 G B 12 20.151 -5.687 -1.693 1.00 0.00 C ATOM 375 N2 G B 12 19.059 -5.880 -0.945 1.00 0.00 N ATOM 376 N3 G B 12 20.230 -6.235 -2.893 1.00 0.00 N ATOM 377 C4 G B 12 21.392 -5.935 -3.508 1.00 0.00 C ATOM 0 H5' G B 12 16.983 -7.959 -4.161 1.00 0.00 H new ATOM 0 H5'' G B 12 17.968 -6.572 -3.743 1.00 0.00 H new ATOM 0 H4' G B 12 18.272 -8.231 -6.217 1.00 0.00 H new ATOM 0 H3' G B 12 19.629 -8.566 -3.545 1.00 0.00 H new ATOM 0 H2' G B 12 21.769 -8.991 -4.674 1.00 0.00 H new ATOM 0 HO2' G B 12 20.370 -10.177 -6.403 1.00 0.00 H new ATOM 0 HO3' G B 12 19.627 -10.704 -4.217 1.00 0.00 H new ATOM 0 H1' G B 12 21.471 -7.102 -6.660 1.00 0.00 H new ATOM 0 H8 G B 12 23.588 -5.986 -5.886 1.00 0.00 H new ATOM 0 H1 G B 12 20.971 -4.536 -0.203 1.00 0.00 H new ATOM 0 H21 G B 12 18.291 -6.449 -1.301 1.00 0.00 H new ATOM 0 H22 G B 12 18.994 -5.458 -0.019 1.00 0.00 H new TER 390 G B 12