USER MOD reduce.3.24.130724 H: found=0, std=0, add=176, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 176 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 180:sc= -0.466 USER MOD Single : A 1 G O5' : rot 180:sc=-0.00819 USER MOD Single : A 2 G O2' : rot -28:sc=-0.00102 USER MOD Single : A 3 A O2' : rot -13:sc= -0.874 USER MOD Single : A 4 G O2' : rot -17:sc= -0.578 USER MOD Single : A 5 U O2' : rot -5:sc= 0.139 USER MOD Single : A 6 U O2' : rot -16:sc= -0.418 USER MOD Single : A 7 C O2' : rot -9:sc= -0.445 USER MOD Single : A 8 C O2' : rot -34:sc= 0.205 USER MOD Single : A 8 C O3' : rot 180:sc= 0.212 USER MOD Single : B 9 G O2' : rot -19:sc= 0.0719 USER MOD Single : B 9 G O5' : rot 180:sc=-0.00318 USER MOD Single : B 10 G O2' : rot 180:sc= -0.524 USER MOD Single : B 11 A O2' : rot -11:sc= -0.936 USER MOD Single : B 12 G O2' : rot -25:sc= -0.568 USER MOD Single : B 13 U O2' : rot -24:sc= 0.168 USER MOD Single : B 14 U O2' : rot -13:sc= -0.419 USER MOD Single : B 15 C O2' : rot -9:sc= -0.486 USER MOD Single : B 16 C O2' : rot -24:sc= 0.184 USER MOD Single : B 16 C O3' : rot 180:sc= 0.195 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 4.416 -7.927 4.690 1.00 0.00 O ATOM 2 C5' G A 1 5.753 -8.350 4.523 1.00 0.00 C ATOM 3 C4' G A 1 6.625 -7.187 4.037 1.00 0.00 C ATOM 4 O4' G A 1 6.203 -6.714 2.758 1.00 0.00 O ATOM 5 C3' G A 1 6.558 -5.976 4.948 1.00 0.00 C ATOM 6 O3' G A 1 7.337 -6.124 6.118 1.00 0.00 O ATOM 7 C2' G A 1 7.115 -4.925 4.024 1.00 0.00 C ATOM 8 O2' G A 1 8.515 -5.077 3.900 1.00 0.00 O ATOM 9 C1' G A 1 6.464 -5.300 2.702 1.00 0.00 C ATOM 10 N9 G A 1 5.197 -4.558 2.541 1.00 0.00 N ATOM 11 C8 G A 1 3.910 -4.987 2.748 1.00 0.00 C ATOM 12 N7 G A 1 3.005 -4.079 2.509 1.00 0.00 N ATOM 13 C5 G A 1 3.742 -2.966 2.117 1.00 0.00 C ATOM 14 C6 G A 1 3.302 -1.666 1.728 1.00 0.00 C ATOM 15 O6 G A 1 2.152 -1.241 1.657 1.00 0.00 O ATOM 16 N1 G A 1 4.372 -0.839 1.405 1.00 0.00 N ATOM 17 C2 G A 1 5.700 -1.208 1.451 1.00 0.00 C ATOM 18 N2 G A 1 6.596 -0.275 1.116 1.00 0.00 N ATOM 19 N3 G A 1 6.116 -2.426 1.813 1.00 0.00 N ATOM 20 C4 G A 1 5.086 -3.251 2.133 1.00 0.00 C ATOM 0 H5' G A 1 5.795 -9.169 3.805 1.00 0.00 H new ATOM 0 H5'' G A 1 6.140 -8.734 5.467 1.00 0.00 H new ATOM 0 H4' G A 1 7.634 -7.599 4.013 1.00 0.00 H new ATOM 0 H3' G A 1 5.565 -5.765 5.345 1.00 0.00 H new ATOM 0 H2' G A 1 6.928 -3.904 4.357 1.00 0.00 H new ATOM 0 HO2' G A 1 8.866 -4.390 3.296 1.00 0.00 H new ATOM 0 HO5' G A 1 3.871 -8.680 4.999 1.00 0.00 H new ATOM 0 H1' G A 1 7.109 -5.053 1.858 1.00 0.00 H new ATOM 0 H8 G A 1 3.668 -5.986 3.079 1.00 0.00 H new ATOM 0 H1 G A 1 4.158 0.114 1.111 1.00 0.00 H new ATOM 0 H21 G A 1 7.592 -0.495 1.133 1.00 0.00 H new ATOM 0 H22 G A 1 6.284 0.657 0.843 1.00 0.00 H new ATOM 33 P G A 2 7.208 -5.063 7.330 1.00 0.00 P ATOM 34 OP1 G A 2 8.111 -5.499 8.419 1.00 0.00 O ATOM 35 OP2 G A 2 5.768 -4.867 7.607 1.00 0.00 O ATOM 36 O5' G A 2 7.791 -3.688 6.717 1.00 0.00 O ATOM 37 C5' G A 2 9.180 -3.507 6.532 1.00 0.00 C ATOM 38 C4' G A 2 9.464 -2.092 6.013 1.00 0.00 C ATOM 39 O4' G A 2 8.857 -1.835 4.745 1.00 0.00 O ATOM 40 C3' G A 2 8.936 -1.014 6.935 1.00 0.00 C ATOM 41 O3' G A 2 9.743 -0.819 8.080 1.00 0.00 O ATOM 42 C2' G A 2 9.001 0.161 6.003 1.00 0.00 C ATOM 43 O2' G A 2 10.350 0.524 5.790 1.00 0.00 O ATOM 44 C1' G A 2 8.460 -0.449 4.726 1.00 0.00 C ATOM 45 N9 G A 2 6.990 -0.378 4.675 1.00 0.00 N ATOM 46 C8 G A 2 6.089 -1.377 4.909 1.00 0.00 C ATOM 47 N7 G A 2 4.848 -1.034 4.707 1.00 0.00 N ATOM 48 C5 G A 2 4.932 0.295 4.303 1.00 0.00 C ATOM 49 C6 G A 2 3.901 1.204 3.920 1.00 0.00 C ATOM 50 O6 G A 2 2.689 1.004 3.867 1.00 0.00 O ATOM 51 N1 G A 2 4.416 2.449 3.577 1.00 0.00 N ATOM 52 C2 G A 2 5.754 2.780 3.583 1.00 0.00 C ATOM 53 N2 G A 2 6.066 4.029 3.222 1.00 0.00 N ATOM 54 N3 G A 2 6.726 1.927 3.929 1.00 0.00 N ATOM 55 C4 G A 2 6.243 0.707 4.279 1.00 0.00 C ATOM 0 H5' G A 2 9.560 -4.245 5.825 1.00 0.00 H new ATOM 0 H5'' G A 2 9.704 -3.669 7.474 1.00 0.00 H new ATOM 0 H4' G A 2 10.551 -2.057 5.945 1.00 0.00 H new ATOM 0 H3' G A 2 7.956 -1.226 7.363 1.00 0.00 H new ATOM 0 H2' G A 2 8.473 1.046 6.358 1.00 0.00 H new ATOM 0 HO2' G A 2 10.883 0.276 6.574 1.00 0.00 H new ATOM 0 H1' G A 2 8.846 0.089 3.860 1.00 0.00 H new ATOM 0 H8 G A 2 6.379 -2.365 5.233 1.00 0.00 H new ATOM 0 H1 G A 2 3.753 3.173 3.300 1.00 0.00 H new ATOM 0 H21 G A 2 7.041 4.327 3.209 1.00 0.00 H new ATOM 0 H22 G A 2 5.329 4.683 2.960 1.00 0.00 H new ATOM 67 P A A 3 9.181 0.002 9.355 1.00 0.00 P ATOM 68 OP1 A A 3 10.279 0.130 10.339 1.00 0.00 O ATOM 69 OP2 A A 3 7.900 -0.615 9.762 1.00 0.00 O ATOM 70 O5' A A 3 8.861 1.471 8.767 1.00 0.00 O ATOM 71 C5' A A 3 9.895 2.399 8.515 1.00 0.00 C ATOM 72 C4' A A 3 9.298 3.713 8.004 1.00 0.00 C ATOM 73 O4' A A 3 8.575 3.545 6.791 1.00 0.00 O ATOM 74 C3' A A 3 8.331 4.327 8.992 1.00 0.00 C ATOM 75 O3' A A 3 9.007 5.008 10.031 1.00 0.00 O ATOM 76 C2' A A 3 7.584 5.282 8.090 1.00 0.00 C ATOM 77 O2' A A 3 8.389 6.411 7.821 1.00 0.00 O ATOM 78 C1' A A 3 7.476 4.469 6.796 1.00 0.00 C ATOM 79 N9 A A 3 6.231 3.696 6.782 1.00 0.00 N ATOM 80 C8 A A 3 6.067 2.362 7.015 1.00 0.00 C ATOM 81 N7 A A 3 4.832 1.953 6.913 1.00 0.00 N ATOM 82 C5 A A 3 4.133 3.107 6.569 1.00 0.00 C ATOM 83 C6 A A 3 2.776 3.354 6.292 1.00 0.00 C ATOM 84 N6 A A 3 1.833 2.408 6.343 1.00 0.00 N ATOM 85 N1 A A 3 2.428 4.609 5.950 1.00 0.00 N ATOM 86 C2 A A 3 3.367 5.549 5.895 1.00 0.00 C ATOM 87 N3 A A 3 4.666 5.445 6.138 1.00 0.00 N ATOM 88 C4 A A 3 4.984 4.173 6.476 1.00 0.00 C ATOM 0 H5' A A 3 10.589 1.993 7.779 1.00 0.00 H new ATOM 0 H5'' A A 3 10.466 2.578 9.426 1.00 0.00 H new ATOM 0 H4' A A 3 10.160 4.362 7.852 1.00 0.00 H new ATOM 0 H3' A A 3 7.699 3.609 9.515 1.00 0.00 H new ATOM 0 H2' A A 3 6.638 5.628 8.507 1.00 0.00 H new ATOM 0 HO2' A A 3 9.155 6.420 8.432 1.00 0.00 H new ATOM 0 H1' A A 3 7.490 5.134 5.932 1.00 0.00 H new ATOM 0 H8 A A 3 6.886 1.703 7.262 1.00 0.00 H new ATOM 0 H61 A A 3 0.863 2.643 6.132 1.00 0.00 H new ATOM 0 H62 A A 3 2.083 1.451 6.593 1.00 0.00 H new ATOM 0 H2 A A 3 3.024 6.534 5.613 1.00 0.00 H new ATOM 100 P G A 4 8.244 5.405 11.392 1.00 0.00 P ATOM 101 OP1 G A 4 9.158 6.235 12.207 1.00 0.00 O ATOM 102 OP2 G A 4 7.668 4.169 11.966 1.00 0.00 O ATOM 103 O5' G A 4 7.029 6.334 10.895 1.00 0.00 O ATOM 104 C5' G A 4 7.247 7.662 10.466 1.00 0.00 C ATOM 105 C4' G A 4 5.917 8.290 10.119 1.00 0.00 C ATOM 106 O4' G A 4 5.319 7.633 9.016 1.00 0.00 O ATOM 107 C3' G A 4 4.928 8.150 11.229 1.00 0.00 C ATOM 108 O3' G A 4 5.193 9.041 12.299 1.00 0.00 O ATOM 109 C2' G A 4 3.693 8.533 10.465 1.00 0.00 C ATOM 110 O2' G A 4 3.699 9.923 10.213 1.00 0.00 O ATOM 111 C1' G A 4 3.914 7.808 9.148 1.00 0.00 C ATOM 112 N9 G A 4 3.228 6.502 9.140 1.00 0.00 N ATOM 113 C8 G A 4 3.754 5.248 9.306 1.00 0.00 C ATOM 114 N7 G A 4 2.875 4.287 9.199 1.00 0.00 N ATOM 115 C5 G A 4 1.678 4.955 8.946 1.00 0.00 C ATOM 116 C6 G A 4 0.359 4.443 8.734 1.00 0.00 C ATOM 117 O6 G A 4 -0.022 3.273 8.715 1.00 0.00 O ATOM 118 N1 G A 4 -0.554 5.465 8.534 1.00 0.00 N ATOM 119 C2 G A 4 -0.256 6.808 8.518 1.00 0.00 C ATOM 120 N2 G A 4 -1.278 7.644 8.303 1.00 0.00 N ATOM 121 N3 G A 4 0.973 7.293 8.703 1.00 0.00 N ATOM 122 C4 G A 4 1.888 6.313 8.914 1.00 0.00 C ATOM 0 H5' G A 4 7.907 7.674 9.599 1.00 0.00 H new ATOM 0 H5'' G A 4 7.741 8.235 11.251 1.00 0.00 H new ATOM 0 H4' G A 4 6.137 9.337 9.910 1.00 0.00 H new ATOM 0 H3' G A 4 4.901 7.179 11.723 1.00 0.00 H new ATOM 0 H2' G A 4 2.762 8.292 10.979 1.00 0.00 H new ATOM 0 HO2' G A 4 4.345 10.360 10.806 1.00 0.00 H new ATOM 0 H1' G A 4 3.506 8.383 8.317 1.00 0.00 H new ATOM 0 H8 G A 4 4.800 5.070 9.507 1.00 0.00 H new ATOM 0 H1 G A 4 -1.528 5.200 8.386 1.00 0.00 H new ATOM 0 H21 G A 4 -1.117 8.651 8.280 1.00 0.00 H new ATOM 0 H22 G A 4 -2.218 7.274 8.162 1.00 0.00 H new ATOM 134 P U A 5 4.495 8.843 13.738 1.00 0.00 P ATOM 135 OP1 U A 5 4.792 10.034 14.564 1.00 0.00 O ATOM 136 OP2 U A 5 4.854 7.497 14.236 1.00 0.00 O ATOM 137 O5' U A 5 2.923 8.842 13.403 1.00 0.00 O ATOM 138 C5' U A 5 2.237 10.029 13.064 1.00 0.00 C ATOM 139 C4' U A 5 0.775 9.682 12.771 1.00 0.00 C ATOM 140 O4' U A 5 0.658 8.762 11.689 1.00 0.00 O ATOM 141 C3' U A 5 0.129 9.008 13.968 1.00 0.00 C ATOM 142 O3' U A 5 -0.352 9.944 14.923 1.00 0.00 O ATOM 143 C2' U A 5 -0.982 8.241 13.330 1.00 0.00 C ATOM 144 O2' U A 5 -2.097 9.086 13.131 1.00 0.00 O ATOM 145 C1' U A 5 -0.410 7.851 11.983 1.00 0.00 C ATOM 146 N1 U A 5 0.092 6.458 11.984 1.00 0.00 N ATOM 147 C2 U A 5 -0.823 5.449 11.723 1.00 0.00 C ATOM 148 O2 U A 5 -2.013 5.685 11.530 1.00 0.00 O ATOM 149 N3 U A 5 -0.321 4.156 11.688 1.00 0.00 N ATOM 150 C4 U A 5 1.012 3.802 11.851 1.00 0.00 C ATOM 151 O4 U A 5 1.357 2.624 11.810 1.00 0.00 O ATOM 152 C5 U A 5 1.900 4.931 12.056 1.00 0.00 C ATOM 153 C6 U A 5 1.423 6.186 12.117 1.00 0.00 C ATOM 0 H5' U A 5 2.697 10.496 12.193 1.00 0.00 H new ATOM 0 H5'' U A 5 2.299 10.748 13.881 1.00 0.00 H new ATOM 0 H4' U A 5 0.286 10.626 12.530 1.00 0.00 H new ATOM 0 H3' U A 5 0.820 8.389 14.540 1.00 0.00 H new ATOM 0 H2' U A 5 -1.313 7.392 13.929 1.00 0.00 H new ATOM 0 HO2' U A 5 -1.921 9.961 13.536 1.00 0.00 H new ATOM 0 H1' U A 5 -1.191 7.904 11.225 1.00 0.00 H new ATOM 0 H3 U A 5 -0.988 3.401 11.529 1.00 0.00 H new ATOM 0 H5 U A 5 2.961 4.760 12.161 1.00 0.00 H new ATOM 0 H6 U A 5 2.112 7.002 12.276 1.00 0.00 H new ATOM 164 P U A 6 -0.908 9.457 16.367 1.00 0.00 P ATOM 165 OP1 U A 6 -1.080 10.656 17.216 1.00 0.00 O ATOM 166 OP2 U A 6 -0.041 8.352 16.832 1.00 0.00 O ATOM 167 O5' U A 6 -2.380 8.843 16.067 1.00 0.00 O ATOM 168 C5' U A 6 -3.520 9.682 15.939 1.00 0.00 C ATOM 169 C4' U A 6 -4.794 8.821 15.826 1.00 0.00 C ATOM 170 O4' U A 6 -4.806 8.053 14.628 1.00 0.00 O ATOM 171 C3' U A 6 -4.912 7.815 16.959 1.00 0.00 C ATOM 172 O3' U A 6 -5.413 8.379 18.155 1.00 0.00 O ATOM 173 C2' U A 6 -5.901 6.860 16.354 1.00 0.00 C ATOM 174 O2' U A 6 -7.195 7.424 16.395 1.00 0.00 O ATOM 175 C1' U A 6 -5.450 6.803 14.913 1.00 0.00 C ATOM 176 N1 U A 6 -4.494 5.697 14.707 1.00 0.00 N ATOM 177 C2 U A 6 -4.996 4.424 14.485 1.00 0.00 C ATOM 178 O2 U A 6 -6.198 4.173 14.535 1.00 0.00 O ATOM 179 N3 U A 6 -4.059 3.444 14.198 1.00 0.00 N ATOM 180 C4 U A 6 -2.688 3.631 14.102 1.00 0.00 C ATOM 181 O4 U A 6 -1.944 2.691 13.838 1.00 0.00 O ATOM 182 C5 U A 6 -2.265 4.992 14.337 1.00 0.00 C ATOM 183 C6 U A 6 -3.164 5.952 14.631 1.00 0.00 C ATOM 0 H5' U A 6 -3.419 10.316 15.058 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.594 10.345 16.801 1.00 0.00 H new ATOM 0 H4' U A 6 -5.617 9.536 15.852 1.00 0.00 H new ATOM 0 H3' U A 6 -3.960 7.382 17.267 1.00 0.00 H new ATOM 0 H2' U A 6 -5.940 5.895 16.859 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.202 8.181 17.017 1.00 0.00 H new ATOM 0 H1' U A 6 -6.302 6.632 14.255 1.00 0.00 H new ATOM 0 H3 U A 6 -4.410 2.499 14.043 1.00 0.00 H new ATOM 0 H5 U A 6 -1.216 5.243 14.276 1.00 0.00 H new ATOM 0 H6 U A 6 -2.814 6.958 14.812 1.00 0.00 H new ATOM 194 P C A 7 -5.355 7.551 19.544 1.00 0.00 P ATOM 195 OP1 C A 7 -6.050 8.346 20.581 1.00 0.00 O ATOM 196 OP2 C A 7 -3.953 7.133 19.760 1.00 0.00 O ATOM 197 O5' C A 7 -6.232 6.220 19.259 1.00 0.00 O ATOM 198 C5' C A 7 -7.647 6.249 19.284 1.00 0.00 C ATOM 199 C4' C A 7 -8.195 4.829 19.075 1.00 0.00 C ATOM 200 O4' C A 7 -7.817 4.283 17.805 1.00 0.00 O ATOM 201 C3' C A 7 -7.649 3.858 20.101 1.00 0.00 C ATOM 202 O3' C A 7 -8.298 3.971 21.355 1.00 0.00 O ATOM 203 C2' C A 7 -7.969 2.554 19.419 1.00 0.00 C ATOM 204 O2' C A 7 -9.349 2.282 19.538 1.00 0.00 O ATOM 205 C1' C A 7 -7.669 2.856 17.963 1.00 0.00 C ATOM 206 N1 C A 7 -6.291 2.430 17.601 1.00 0.00 N ATOM 207 C2 C A 7 -6.098 1.096 17.251 1.00 0.00 C ATOM 208 O2 C A 7 -7.034 0.300 17.298 1.00 0.00 O ATOM 209 N3 C A 7 -4.853 0.705 16.857 1.00 0.00 N ATOM 210 C4 C A 7 -3.841 1.583 16.807 1.00 0.00 C ATOM 211 N4 C A 7 -2.638 1.158 16.405 1.00 0.00 N ATOM 212 C5 C A 7 -4.028 2.959 17.163 1.00 0.00 C ATOM 213 C6 C A 7 -5.265 3.328 17.549 1.00 0.00 C ATOM 0 H5' C A 7 -8.021 6.913 18.504 1.00 0.00 H new ATOM 0 H5'' C A 7 -7.996 6.648 20.236 1.00 0.00 H new ATOM 0 H4' C A 7 -9.277 4.937 19.155 1.00 0.00 H new ATOM 0 H3' C A 7 -6.598 4.006 20.351 1.00 0.00 H new ATOM 0 H2' C A 7 -7.418 1.707 19.829 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.757 2.923 20.157 1.00 0.00 H new ATOM 0 H1' C A 7 -8.347 2.311 17.306 1.00 0.00 H new ATOM 0 H41 C A 7 -1.855 1.811 16.360 1.00 0.00 H new ATOM 0 H42 C A 7 -2.503 0.181 16.143 1.00 0.00 H new ATOM 0 H5 C A 7 -3.214 3.668 17.124 1.00 0.00 H new ATOM 0 H6 C A 7 -5.448 4.356 17.823 1.00 0.00 H new ATOM 225 P C A 8 -7.708 3.224 22.659 1.00 0.00 P ATOM 226 OP1 C A 8 -8.639 3.456 23.786 1.00 0.00 O ATOM 227 OP2 C A 8 -6.284 3.602 22.795 1.00 0.00 O ATOM 228 O5' C A 8 -7.771 1.662 22.271 1.00 0.00 O ATOM 229 C5' C A 8 -8.988 0.945 22.309 1.00 0.00 C ATOM 230 C4' C A 8 -8.731 -0.494 21.852 1.00 0.00 C ATOM 231 O4' C A 8 -8.210 -0.537 20.527 1.00 0.00 O ATOM 232 C3' C A 8 -7.684 -1.173 22.706 1.00 0.00 C ATOM 233 O3' C A 8 -8.208 -1.634 23.932 1.00 0.00 O ATOM 234 C2' C A 8 -7.286 -2.318 21.812 1.00 0.00 C ATOM 235 O2' C A 8 -8.212 -3.374 21.952 1.00 0.00 O ATOM 236 C1' C A 8 -7.401 -1.720 20.410 1.00 0.00 C ATOM 237 N1 C A 8 -6.038 -1.377 19.933 1.00 0.00 N ATOM 238 C2 C A 8 -5.285 -2.383 19.338 1.00 0.00 C ATOM 239 O2 C A 8 -5.771 -3.497 19.154 1.00 0.00 O ATOM 240 N3 C A 8 -4.001 -2.099 18.974 1.00 0.00 N ATOM 241 C4 C A 8 -3.477 -0.884 19.192 1.00 0.00 C ATOM 242 N4 C A 8 -2.217 -0.646 18.817 1.00 0.00 N ATOM 243 C5 C A 8 -4.238 0.153 19.821 1.00 0.00 C ATOM 244 C6 C A 8 -5.506 -0.146 20.170 1.00 0.00 C ATOM 0 H5' C A 8 -9.726 1.420 21.662 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.398 0.952 23.319 1.00 0.00 H new ATOM 0 H4' C A 8 -9.697 -0.994 21.925 1.00 0.00 H new ATOM 0 H3' C A 8 -6.864 -0.519 23.003 1.00 0.00 H new ATOM 0 H2' C A 8 -6.297 -2.719 22.035 1.00 0.00 H new ATOM 0 HO2' C A 8 -8.530 -3.410 22.878 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.497 -2.067 24.449 1.00 0.00 H new ATOM 0 H1' C A 8 -7.852 -2.414 19.701 1.00 0.00 H new ATOM 0 H41 C A 8 -1.803 0.273 18.975 1.00 0.00 H new ATOM 0 H42 C A 8 -1.669 -1.383 18.372 1.00 0.00 H new ATOM 0 H5 C A 8 -3.816 1.130 20.007 1.00 0.00 H new ATOM 0 H6 C A 8 -6.113 0.608 20.648 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.691 -8.698 15.202 1.00 0.00 O ATOM 259 C5' G B 9 3.150 -9.983 15.416 1.00 0.00 C ATOM 260 C4' G B 9 1.699 -9.868 15.888 1.00 0.00 C ATOM 261 O4' G B 9 1.602 -9.148 17.117 1.00 0.00 O ATOM 262 C3' G B 9 0.823 -9.099 14.920 1.00 0.00 C ATOM 263 O3' G B 9 0.457 -9.853 13.779 1.00 0.00 O ATOM 264 C2' G B 9 -0.356 -8.833 15.817 1.00 0.00 C ATOM 265 O2' G B 9 -1.085 -10.026 15.999 1.00 0.00 O ATOM 266 C1' G B 9 0.324 -8.486 17.132 1.00 0.00 C ATOM 267 N9 G B 9 0.507 -7.024 17.239 1.00 0.00 N ATOM 268 C8 G B 9 1.631 -6.272 17.012 1.00 0.00 C ATOM 269 N7 G B 9 1.463 -4.995 17.213 1.00 0.00 N ATOM 270 C5 G B 9 0.130 -4.889 17.600 1.00 0.00 C ATOM 271 C6 G B 9 -0.632 -3.738 17.956 1.00 0.00 C ATOM 272 O6 G B 9 -0.267 -2.566 17.998 1.00 0.00 O ATOM 273 N1 G B 9 -1.942 -4.073 18.284 1.00 0.00 N ATOM 274 C2 G B 9 -2.458 -5.351 18.270 1.00 0.00 C ATOM 275 N2 G B 9 -3.747 -5.483 18.603 1.00 0.00 N ATOM 276 N3 G B 9 -1.745 -6.433 17.941 1.00 0.00 N ATOM 277 C4 G B 9 -0.463 -6.128 17.618 1.00 0.00 C ATOM 0 H5' G B 9 3.742 -10.516 16.160 1.00 0.00 H new ATOM 0 H5'' G B 9 3.197 -10.564 14.495 1.00 0.00 H new ATOM 0 H4' G B 9 1.366 -10.901 15.983 1.00 0.00 H new ATOM 0 H3' G B 9 1.295 -8.219 14.483 1.00 0.00 H new ATOM 0 H2' G B 9 -1.038 -8.073 15.436 1.00 0.00 H new ATOM 0 HO2' G B 9 -0.860 -10.659 15.286 1.00 0.00 H new ATOM 0 HO5' G B 9 4.620 -8.780 14.902 1.00 0.00 H new ATOM 0 H1' G B 9 -0.275 -8.806 17.984 1.00 0.00 H new ATOM 0 H8 G B 9 2.571 -6.699 16.695 1.00 0.00 H new ATOM 0 H1 G B 9 -2.568 -3.315 18.556 1.00 0.00 H new ATOM 0 H21 G B 9 -4.180 -6.406 18.609 1.00 0.00 H new ATOM 0 H22 G B 9 -4.297 -4.660 18.851 1.00 0.00 H new ATOM 290 P G B 10 -0.247 -9.138 12.509 1.00 0.00 P ATOM 291 OP1 G B 10 -0.447 -10.162 11.460 1.00 0.00 O ATOM 292 OP2 G B 10 0.521 -7.912 12.199 1.00 0.00 O ATOM 293 O5' G B 10 -1.703 -8.690 13.055 1.00 0.00 O ATOM 294 C5' G B 10 -2.760 -9.624 13.161 1.00 0.00 C ATOM 295 C4' G B 10 -4.045 -8.918 13.608 1.00 0.00 C ATOM 296 O4' G B 10 -3.916 -8.288 14.884 1.00 0.00 O ATOM 297 C3' G B 10 -4.467 -7.817 12.661 1.00 0.00 C ATOM 298 O3' G B 10 -5.065 -8.308 11.477 1.00 0.00 O ATOM 299 C2' G B 10 -5.456 -7.103 13.537 1.00 0.00 C ATOM 300 O2' G B 10 -6.630 -7.876 13.673 1.00 0.00 O ATOM 301 C1' G B 10 -4.724 -7.095 14.863 1.00 0.00 C ATOM 302 N9 G B 10 -3.846 -5.919 14.971 1.00 0.00 N ATOM 303 C8 G B 10 -2.494 -5.854 14.794 1.00 0.00 C ATOM 304 N7 G B 10 -1.985 -4.672 15.006 1.00 0.00 N ATOM 305 C5 G B 10 -3.086 -3.893 15.358 1.00 0.00 C ATOM 306 C6 G B 10 -3.158 -2.515 15.722 1.00 0.00 C ATOM 307 O6 G B 10 -2.244 -1.696 15.794 1.00 0.00 O ATOM 308 N1 G B 10 -4.460 -2.132 16.022 1.00 0.00 N ATOM 309 C2 G B 10 -5.559 -2.964 15.984 1.00 0.00 C ATOM 310 N2 G B 10 -6.737 -2.419 16.303 1.00 0.00 N ATOM 311 N3 G B 10 -5.495 -4.258 15.646 1.00 0.00 N ATOM 312 C4 G B 10 -4.231 -4.653 15.346 1.00 0.00 C ATOM 0 H5' G B 10 -2.497 -10.403 13.876 1.00 0.00 H new ATOM 0 H5'' G B 10 -2.920 -10.114 12.201 1.00 0.00 H new ATOM 0 H4' G B 10 -4.781 -9.721 13.636 1.00 0.00 H new ATOM 0 H3' G B 10 -3.649 -7.205 12.281 1.00 0.00 H new ATOM 0 H2' G B 10 -5.755 -6.124 13.163 1.00 0.00 H new ATOM 0 HO2' G B 10 -7.268 -7.403 14.247 1.00 0.00 H new ATOM 0 H1' G B 10 -5.432 -7.059 15.691 1.00 0.00 H new ATOM 0 H8 G B 10 -1.898 -6.707 14.504 1.00 0.00 H new ATOM 0 H1 G B 10 -4.614 -1.160 16.291 1.00 0.00 H new ATOM 0 H21 G B 10 -7.583 -2.989 16.291 1.00 0.00 H new ATOM 0 H22 G B 10 -6.790 -1.433 16.558 1.00 0.00 H new ATOM 324 P A B 11 -5.309 -7.333 10.212 1.00 0.00 P ATOM 325 OP1 A B 11 -6.030 -8.101 9.172 1.00 0.00 O ATOM 326 OP2 A B 11 -4.021 -6.685 9.883 1.00 0.00 O ATOM 327 O5' A B 11 -6.306 -6.199 10.780 1.00 0.00 O ATOM 328 C5' A B 11 -7.671 -6.476 11.008 1.00 0.00 C ATOM 329 C4' A B 11 -8.373 -5.213 11.517 1.00 0.00 C ATOM 330 O4' A B 11 -7.826 -4.743 12.743 1.00 0.00 O ATOM 331 C3' A B 11 -8.264 -4.063 10.540 1.00 0.00 C ATOM 332 O3' A B 11 -9.182 -4.193 9.472 1.00 0.00 O ATOM 333 C2' A B 11 -8.614 -2.906 11.445 1.00 0.00 C ATOM 334 O2' A B 11 -10.005 -2.899 11.686 1.00 0.00 O ATOM 335 C1' A B 11 -7.921 -3.310 12.750 1.00 0.00 C ATOM 336 N9 A B 11 -6.562 -2.764 12.796 1.00 0.00 N ATOM 337 C8 A B 11 -5.386 -3.418 12.575 1.00 0.00 C ATOM 338 N7 A B 11 -4.327 -2.670 12.714 1.00 0.00 N ATOM 339 C5 A B 11 -4.848 -1.428 13.069 1.00 0.00 C ATOM 340 C6 A B 11 -4.248 -0.196 13.381 1.00 0.00 C ATOM 341 N6 A B 11 -2.926 -0.001 13.364 1.00 0.00 N ATOM 342 N1 A B 11 -5.059 0.824 13.722 1.00 0.00 N ATOM 343 C2 A B 11 -6.374 0.626 13.744 1.00 0.00 C ATOM 344 N3 A B 11 -7.056 -0.476 13.467 1.00 0.00 N ATOM 345 C4 A B 11 -6.213 -1.482 13.131 1.00 0.00 C ATOM 0 H5' A B 11 -7.773 -7.280 11.737 1.00 0.00 H new ATOM 0 H5'' A B 11 -8.142 -6.820 10.087 1.00 0.00 H new ATOM 0 H4' A B 11 -9.412 -5.515 11.649 1.00 0.00 H new ATOM 0 H3' A B 11 -7.298 -3.976 10.043 1.00 0.00 H new ATOM 0 H2' A B 11 -8.328 -1.934 11.043 1.00 0.00 H new ATOM 0 HO2' A B 11 -10.445 -3.530 11.079 1.00 0.00 H new ATOM 0 H1' A B 11 -8.482 -2.935 13.606 1.00 0.00 H new ATOM 0 H8 A B 11 -5.336 -4.463 12.308 1.00 0.00 H new ATOM 0 H61 A B 11 -2.542 0.914 13.599 1.00 0.00 H new ATOM 0 H62 A B 11 -2.301 -0.768 13.116 1.00 0.00 H new ATOM 0 H2 A B 11 -6.969 1.482 14.027 1.00 0.00 H new ATOM 357 P G B 12 -9.019 -3.317 8.131 1.00 0.00 P ATOM 358 OP1 G B 12 -10.200 -3.561 7.274 1.00 0.00 O ATOM 359 OP2 G B 12 -7.661 -3.557 7.594 1.00 0.00 O ATOM 360 O5' G B 12 -9.083 -1.798 8.655 1.00 0.00 O ATOM 361 C5' G B 12 -10.302 -1.212 9.063 1.00 0.00 C ATOM 362 C4' G B 12 -10.049 0.226 9.450 1.00 0.00 C ATOM 363 O4' G B 12 -9.188 0.304 10.573 1.00 0.00 O ATOM 364 C3' G B 12 -9.341 0.977 8.371 1.00 0.00 C ATOM 365 O3' G B 12 -10.202 1.306 7.295 1.00 0.00 O ATOM 366 C2' G B 12 -8.947 2.185 9.173 1.00 0.00 C ATOM 367 O2' G B 12 -10.085 2.983 9.425 1.00 0.00 O ATOM 368 C1' G B 12 -8.509 1.550 10.483 1.00 0.00 C ATOM 369 N9 G B 12 -7.048 1.346 10.510 1.00 0.00 N ATOM 370 C8 G B 12 -6.332 0.190 10.333 1.00 0.00 C ATOM 371 N7 G B 12 -5.041 0.342 10.464 1.00 0.00 N ATOM 372 C5 G B 12 -4.890 1.699 10.745 1.00 0.00 C ATOM 373 C6 G B 12 -3.708 2.467 10.989 1.00 0.00 C ATOM 374 O6 G B 12 -2.535 2.094 11.018 1.00 0.00 O ATOM 375 N1 G B 12 -4.010 3.802 11.210 1.00 0.00 N ATOM 376 C2 G B 12 -5.275 4.342 11.217 1.00 0.00 C ATOM 377 N2 G B 12 -5.363 5.655 11.456 1.00 0.00 N ATOM 378 N3 G B 12 -6.383 3.629 11.001 1.00 0.00 N ATOM 379 C4 G B 12 -6.116 2.319 10.769 1.00 0.00 C ATOM 0 H5' G B 12 -10.720 -1.761 9.906 1.00 0.00 H new ATOM 0 H5'' G B 12 -11.033 -1.262 8.256 1.00 0.00 H new ATOM 0 H4' G B 12 -11.033 0.650 9.651 1.00 0.00 H new ATOM 0 H3' G B 12 -8.526 0.447 7.877 1.00 0.00 H new ATOM 0 H2' G B 12 -8.200 2.814 8.688 1.00 0.00 H new ATOM 0 HO2' G B 12 -10.760 2.818 8.734 1.00 0.00 H new ATOM 0 H1' G B 12 -8.752 2.196 11.327 1.00 0.00 H new ATOM 0 H8 G B 12 -6.793 -0.760 10.106 1.00 0.00 H new ATOM 0 H1 G B 12 -3.230 4.436 11.382 1.00 0.00 H new ATOM 0 H21 G B 12 -6.276 6.110 11.473 1.00 0.00 H new ATOM 0 H22 G B 12 -4.517 6.201 11.621 1.00 0.00 H new ATOM 391 P U B 13 -9.611 1.787 5.875 1.00 0.00 P ATOM 392 OP1 U B 13 -10.737 2.266 5.044 1.00 0.00 O ATOM 393 OP2 U B 13 -8.725 0.717 5.366 1.00 0.00 O ATOM 394 O5' U B 13 -8.692 3.051 6.253 1.00 0.00 O ATOM 395 C5' U B 13 -9.255 4.295 6.609 1.00 0.00 C ATOM 396 C4' U B 13 -8.119 5.268 6.940 1.00 0.00 C ATOM 397 O4' U B 13 -7.327 4.804 8.030 1.00 0.00 O ATOM 398 C3' U B 13 -7.171 5.412 5.763 1.00 0.00 C ATOM 399 O3' U B 13 -7.631 6.361 4.807 1.00 0.00 O ATOM 400 C2' U B 13 -5.914 5.857 6.437 1.00 0.00 C ATOM 401 O2' U B 13 -5.961 7.248 6.673 1.00 0.00 O ATOM 402 C1' U B 13 -5.957 5.134 7.767 1.00 0.00 C ATOM 403 N1 U B 13 -5.129 3.905 7.747 1.00 0.00 N ATOM 404 C2 U B 13 -3.777 4.042 8.025 1.00 0.00 C ATOM 405 O2 U B 13 -3.267 5.137 8.247 1.00 0.00 O ATOM 406 N3 U B 13 -3.030 2.872 8.041 1.00 0.00 N ATOM 407 C4 U B 13 -3.531 1.591 7.844 1.00 0.00 C ATOM 408 O4 U B 13 -2.784 0.616 7.872 1.00 0.00 O ATOM 409 C5 U B 13 -4.964 1.547 7.624 1.00 0.00 C ATOM 410 C6 U B 13 -5.694 2.674 7.580 1.00 0.00 C ATOM 0 H5' U B 13 -9.916 4.179 7.468 1.00 0.00 H new ATOM 0 H5'' U B 13 -9.860 4.684 5.791 1.00 0.00 H new ATOM 0 H4' U B 13 -8.599 6.215 7.188 1.00 0.00 H new ATOM 0 H3' U B 13 -7.059 4.498 5.180 1.00 0.00 H new ATOM 0 H2' U B 13 -5.020 5.649 5.849 1.00 0.00 H new ATOM 0 HO2' U B 13 -6.581 7.667 6.040 1.00 0.00 H new ATOM 0 H1' U B 13 -5.550 5.776 8.548 1.00 0.00 H new ATOM 0 H3 U B 13 -2.028 2.960 8.212 1.00 0.00 H new ATOM 0 H5 U B 13 -5.452 0.593 7.493 1.00 0.00 H new ATOM 0 H6 U B 13 -6.758 2.604 7.408 1.00 0.00 H new ATOM 421 P U B 14 -6.902 6.524 3.367 1.00 0.00 P ATOM 422 OP1 U B 14 -7.773 7.354 2.507 1.00 0.00 O ATOM 423 OP2 U B 14 -6.498 5.175 2.913 1.00 0.00 O ATOM 424 O5' U B 14 -5.551 7.371 3.671 1.00 0.00 O ATOM 425 C5' U B 14 -5.565 8.791 3.733 1.00 0.00 C ATOM 426 C4' U B 14 -4.124 9.321 3.859 1.00 0.00 C ATOM 427 O4' U B 14 -3.509 8.891 5.068 1.00 0.00 O ATOM 428 C3' U B 14 -3.227 8.819 2.740 1.00 0.00 C ATOM 429 O3' U B 14 -3.374 9.557 1.543 1.00 0.00 O ATOM 430 C2' U B 14 -1.878 9.053 3.358 1.00 0.00 C ATOM 431 O2' U B 14 -1.555 10.427 3.307 1.00 0.00 O ATOM 432 C1' U B 14 -2.116 8.667 4.800 1.00 0.00 C ATOM 433 N1 U B 14 -1.787 7.244 5.024 1.00 0.00 N ATOM 434 C2 U B 14 -0.458 6.897 5.218 1.00 0.00 C ATOM 435 O2 U B 14 0.454 7.718 5.142 1.00 0.00 O ATOM 436 N3 U B 14 -0.215 5.564 5.507 1.00 0.00 N ATOM 437 C4 U B 14 -1.173 4.569 5.629 1.00 0.00 C ATOM 438 O4 U B 14 -0.849 3.414 5.890 1.00 0.00 O ATOM 439 C5 U B 14 -2.526 5.030 5.425 1.00 0.00 C ATOM 440 C6 U B 14 -2.777 6.323 5.132 1.00 0.00 C ATOM 0 H5' U B 14 -6.160 9.121 4.585 1.00 0.00 H new ATOM 0 H5'' U B 14 -6.036 9.199 2.838 1.00 0.00 H new ATOM 0 H4' U B 14 -4.221 10.406 3.824 1.00 0.00 H new ATOM 0 H3' U B 14 -3.434 7.794 2.434 1.00 0.00 H new ATOM 0 H2' U B 14 -1.074 8.507 2.865 1.00 0.00 H new ATOM 0 HO2' U B 14 -2.173 10.886 2.701 1.00 0.00 H new ATOM 0 H1' U B 14 -1.483 9.259 5.461 1.00 0.00 H new ATOM 0 H3 U B 14 0.758 5.289 5.642 1.00 0.00 H new ATOM 0 H5 U B 14 -3.346 4.332 5.508 1.00 0.00 H new ATOM 0 H6 U B 14 -3.800 6.635 4.978 1.00 0.00 H new ATOM 451 P C B 15 -2.753 9.007 0.155 1.00 0.00 P ATOM 452 OP1 C B 15 -2.957 10.044 -0.882 1.00 0.00 O ATOM 453 OP2 C B 15 -3.278 7.642 -0.063 1.00 0.00 O ATOM 454 O5' C B 15 -1.164 8.887 0.439 1.00 0.00 O ATOM 455 C5' C B 15 -0.320 10.024 0.411 1.00 0.00 C ATOM 456 C4' C B 15 1.140 9.585 0.600 1.00 0.00 C ATOM 457 O4' C B 15 1.359 8.960 1.870 1.00 0.00 O ATOM 458 C3' C B 15 1.551 8.552 -0.428 1.00 0.00 C ATOM 459 O3' C B 15 1.846 9.128 -1.688 1.00 0.00 O ATOM 460 C2' C B 15 2.783 7.998 0.238 1.00 0.00 C ATOM 461 O2' C B 15 3.850 8.911 0.100 1.00 0.00 O ATOM 462 C1' C B 15 2.381 7.956 1.700 1.00 0.00 C ATOM 463 N1 C B 15 1.862 6.615 2.072 1.00 0.00 N ATOM 464 C2 C B 15 2.790 5.629 2.394 1.00 0.00 C ATOM 465 O2 C B 15 3.995 5.863 2.321 1.00 0.00 O ATOM 466 N3 C B 15 2.327 4.411 2.792 1.00 0.00 N ATOM 467 C4 C B 15 1.010 4.168 2.871 1.00 0.00 C ATOM 468 N4 C B 15 0.600 2.961 3.272 1.00 0.00 N ATOM 469 C5 C B 15 0.045 5.177 2.545 1.00 0.00 C ATOM 470 C6 C B 15 0.522 6.376 2.156 1.00 0.00 C ATOM 0 H5' C B 15 -0.606 10.721 1.198 1.00 0.00 H new ATOM 0 H5'' C B 15 -0.433 10.550 -0.537 1.00 0.00 H new ATOM 0 H4' C B 15 1.720 10.503 0.507 1.00 0.00 H new ATOM 0 H3' C B 15 0.781 7.817 -0.664 1.00 0.00 H new ATOM 0 H2' C B 15 3.100 7.040 -0.173 1.00 0.00 H new ATOM 0 HO2' C B 15 3.591 9.626 -0.518 1.00 0.00 H new ATOM 0 H1' C B 15 3.239 8.150 2.344 1.00 0.00 H new ATOM 0 H41 C B 15 -0.397 2.757 3.338 1.00 0.00 H new ATOM 0 H42 C B 15 1.284 2.244 3.512 1.00 0.00 H new ATOM 0 H5 C B 15 -1.016 4.985 2.608 1.00 0.00 H new ATOM 0 H6 C B 15 -0.172 7.165 1.905 1.00 0.00 H new ATOM 482 P C B 16 2.043 8.199 -2.994 1.00 0.00 P ATOM 483 OP1 C B 16 2.422 9.070 -4.129 1.00 0.00 O ATOM 484 OP2 C B 16 0.861 7.317 -3.108 1.00 0.00 O ATOM 485 O5' C B 16 3.313 7.280 -2.624 1.00 0.00 O ATOM 486 C5' C B 16 4.629 7.790 -2.682 1.00 0.00 C ATOM 487 C4' C B 16 5.604 6.695 -2.244 1.00 0.00 C ATOM 488 O4' C B 16 5.343 6.261 -0.911 1.00 0.00 O ATOM 489 C3' C B 16 5.464 5.450 -3.089 1.00 0.00 C ATOM 490 O3' C B 16 6.108 5.570 -4.340 1.00 0.00 O ATOM 491 C2' C B 16 6.145 4.435 -2.211 1.00 0.00 C ATOM 492 O2' C B 16 7.543 4.523 -2.382 1.00 0.00 O ATOM 493 C1' C B 16 5.773 4.893 -0.801 1.00 0.00 C ATOM 494 N1 C B 16 4.670 4.033 -0.306 1.00 0.00 N ATOM 495 C2 C B 16 5.007 2.814 0.274 1.00 0.00 C ATOM 496 O2 C B 16 6.186 2.505 0.429 1.00 0.00 O ATOM 497 N3 C B 16 3.998 1.980 0.654 1.00 0.00 N ATOM 498 C4 C B 16 2.715 2.322 0.466 1.00 0.00 C ATOM 499 N4 C B 16 1.756 1.477 0.856 1.00 0.00 N ATOM 500 C5 C B 16 2.357 3.565 -0.148 1.00 0.00 C ATOM 501 C6 C B 16 3.370 4.379 -0.513 1.00 0.00 C ATOM 0 H5' C B 16 4.725 8.661 -2.034 1.00 0.00 H new ATOM 0 H5'' C B 16 4.862 8.119 -3.695 1.00 0.00 H new ATOM 0 H4' C B 16 6.593 7.142 -2.341 1.00 0.00 H new ATOM 0 H3' C B 16 4.434 5.209 -3.353 1.00 0.00 H new ATOM 0 H2' C B 16 5.853 3.407 -2.427 1.00 0.00 H new ATOM 0 HO2' C B 16 7.741 4.915 -3.258 1.00 0.00 H new ATOM 0 HO3' C B 16 5.991 4.741 -4.849 1.00 0.00 H new ATOM 0 H1' C B 16 6.609 4.818 -0.105 1.00 0.00 H new ATOM 0 H41 C B 16 0.775 1.721 0.721 1.00 0.00 H new ATOM 0 H42 C B 16 2.005 0.588 1.289 1.00 0.00 H new ATOM 0 H5 C B 16 1.325 3.838 -0.311 1.00 0.00 H new ATOM 0 H6 C B 16 3.144 5.326 -0.980 1.00 0.00 H new TER 514 C B 16