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= -0.452 USER MOD Single : A 1 G O5' : rot 180:sc= -0.0112 USER MOD Single : A 2 G O2' : rot 180:sc= -0.477 USER MOD Single : A 3 A O2' : rot -13:sc= -0.918 USER MOD Single : A 4 G O2' : rot -15:sc= -0.601 USER MOD Single : A 5 U O2' : rot -7:sc= 0.14 USER MOD Single : A 6 U O2' : rot -15:sc= -0.43 USER MOD Single : A 7 C O2' : rot -9:sc= -0.453 USER MOD Single : A 8 C O2' : rot -27:sc= 0.198 USER MOD Single : A 8 C O3' : rot 180:sc= 0.196 USER MOD Single : B 9 G O2' : rot 180:sc= -0.481 USER MOD Single : B 9 G O5' : rot 180:sc=-0.00487 USER MOD Single : B 10 G O2' : rot 180:sc= -0.508 USER MOD Single : B 11 A O2' : rot -11:sc= -0.942 USER MOD Single : B 12 G O2' : rot -25:sc= -0.583 USER MOD Single : B 13 U O2' : rot -6:sc= 0.132 USER MOD Single : B 14 U O2' : rot -16:sc= 0.0292 USER MOD Single : B 15 C O2' : rot -8:sc= -0.477 USER MOD Single : B 16 C O2' : rot -25:sc= 0.17 USER MOD Single : B 16 C O3' : rot 180:sc= 0.193 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 4.602 -7.993 4.451 1.00 0.00 O ATOM 2 C5' G A 1 5.949 -8.381 4.282 1.00 0.00 C ATOM 3 C4' G A 1 6.799 -7.183 3.844 1.00 0.00 C ATOM 4 O4' G A 1 6.378 -6.677 2.577 1.00 0.00 O ATOM 5 C3' G A 1 6.697 -6.006 4.794 1.00 0.00 C ATOM 6 O3' G A 1 7.469 -6.175 5.965 1.00 0.00 O ATOM 7 C2' G A 1 7.239 -4.911 3.912 1.00 0.00 C ATOM 8 O2' G A 1 8.642 -5.027 3.798 1.00 0.00 O ATOM 9 C1' G A 1 6.611 -5.258 2.570 1.00 0.00 C ATOM 10 N9 G A 1 5.331 -4.536 2.417 1.00 0.00 N ATOM 11 C8 G A 1 4.051 -4.993 2.601 1.00 0.00 C ATOM 12 N7 G A 1 3.131 -4.096 2.376 1.00 0.00 N ATOM 13 C5 G A 1 3.852 -2.961 2.018 1.00 0.00 C ATOM 14 C6 G A 1 3.392 -1.660 1.657 1.00 0.00 C ATOM 15 O6 G A 1 2.234 -1.254 1.585 1.00 0.00 O ATOM 16 N1 G A 1 4.449 -0.806 1.364 1.00 0.00 N ATOM 17 C2 G A 1 5.783 -1.152 1.414 1.00 0.00 C ATOM 18 N2 G A 1 6.665 -0.195 1.110 1.00 0.00 N ATOM 19 N3 G A 1 6.217 -2.371 1.750 1.00 0.00 N ATOM 20 C4 G A 1 5.200 -3.222 2.039 1.00 0.00 C ATOM 0 H5' G A 1 6.015 -9.174 3.537 1.00 0.00 H new ATOM 0 H5'' G A 1 6.337 -8.788 5.216 1.00 0.00 H new ATOM 0 H4' G A 1 7.817 -7.571 3.816 1.00 0.00 H new ATOM 0 H3' G A 1 5.696 -5.832 5.188 1.00 0.00 H new ATOM 0 H2' G A 1 7.025 -3.907 4.277 1.00 0.00 H new ATOM 0 HO2' G A 1 8.984 -4.312 3.222 1.00 0.00 H new ATOM 0 HO5' G A 1 4.071 -8.768 4.729 1.00 0.00 H new ATOM 0 H1' G A 1 7.261 -4.973 1.743 1.00 0.00 H new ATOM 0 H8 G A 1 3.825 -6.004 2.905 1.00 0.00 H new ATOM 0 H1 G A 1 4.220 0.150 1.091 1.00 0.00 H new ATOM 0 H21 G A 1 7.665 -0.397 1.131 1.00 0.00 H new ATOM 0 H22 G A 1 6.339 0.738 0.857 1.00 0.00 H new ATOM 33 P G A 2 7.306 -5.157 7.210 1.00 0.00 P ATOM 34 OP1 G A 2 8.213 -5.605 8.290 1.00 0.00 O ATOM 35 OP2 G A 2 5.860 -5.006 7.483 1.00 0.00 O ATOM 36 O5' G A 2 7.857 -3.749 6.643 1.00 0.00 O ATOM 37 C5' G A 2 9.243 -3.523 6.482 1.00 0.00 C ATOM 38 C4' G A 2 9.491 -2.085 6.012 1.00 0.00 C ATOM 39 O4' G A 2 8.898 -1.806 4.743 1.00 0.00 O ATOM 40 C3' G A 2 8.914 -1.056 6.959 1.00 0.00 C ATOM 41 O3' G A 2 9.691 -0.880 8.127 1.00 0.00 O ATOM 42 C2' G A 2 8.955 0.153 6.067 1.00 0.00 C ATOM 43 O2' G A 2 10.289 0.587 5.901 1.00 0.00 O ATOM 44 C1' G A 2 8.466 -0.431 4.758 1.00 0.00 C ATOM 45 N9 G A 2 6.997 -0.392 4.676 1.00 0.00 N ATOM 46 C8 G A 2 6.112 -1.411 4.879 1.00 0.00 C ATOM 47 N7 G A 2 4.866 -1.085 4.671 1.00 0.00 N ATOM 48 C5 G A 2 4.931 0.255 4.296 1.00 0.00 C ATOM 49 C6 G A 2 3.888 1.155 3.923 1.00 0.00 C ATOM 50 O6 G A 2 2.680 0.939 3.858 1.00 0.00 O ATOM 51 N1 G A 2 4.387 2.413 3.604 1.00 0.00 N ATOM 52 C2 G A 2 5.720 2.765 3.628 1.00 0.00 C ATOM 53 N2 G A 2 6.016 4.024 3.290 1.00 0.00 N ATOM 54 N3 G A 2 6.702 1.922 3.970 1.00 0.00 N ATOM 55 C4 G A 2 6.235 0.688 4.293 1.00 0.00 C ATOM 0 H5' G A 2 9.652 -4.227 5.757 1.00 0.00 H new ATOM 0 H5'' G A 2 9.760 -3.700 7.425 1.00 0.00 H new ATOM 0 H4' G A 2 10.578 -2.014 5.962 1.00 0.00 H new ATOM 0 H3' G A 2 7.934 -1.310 7.361 1.00 0.00 H new ATOM 0 H2' G A 2 8.383 1.002 6.441 1.00 0.00 H new ATOM 0 HO2' G A 2 10.307 1.374 5.317 1.00 0.00 H new ATOM 0 H1' G A 2 8.861 0.140 3.918 1.00 0.00 H new ATOM 0 H8 G A 2 6.417 -2.401 5.185 1.00 0.00 H new ATOM 0 H1 G A 2 3.715 3.131 3.331 1.00 0.00 H new ATOM 0 H21 G A 2 6.987 4.338 3.291 1.00 0.00 H new ATOM 0 H22 G A 2 5.271 4.671 3.031 1.00 0.00 H new ATOM 67 P A A 3 9.098 -0.078 9.398 1.00 0.00 P ATOM 68 OP1 A A 3 10.167 0.028 10.415 1.00 0.00 O ATOM 69 OP2 A A 3 7.802 -0.695 9.758 1.00 0.00 O ATOM 70 O5' A A 3 8.802 1.400 8.824 1.00 0.00 O ATOM 71 C5' A A 3 9.853 2.306 8.570 1.00 0.00 C ATOM 72 C4' A A 3 9.280 3.634 8.064 1.00 0.00 C ATOM 73 O4' A A 3 8.562 3.488 6.844 1.00 0.00 O ATOM 74 C3' A A 3 8.313 4.257 9.049 1.00 0.00 C ATOM 75 O3' A A 3 8.987 4.917 10.102 1.00 0.00 O ATOM 76 C2' A A 3 7.591 5.232 8.149 1.00 0.00 C ATOM 77 O2' A A 3 8.419 6.347 7.893 1.00 0.00 O ATOM 78 C1' A A 3 7.477 4.430 6.849 1.00 0.00 C ATOM 79 N9 A A 3 6.220 3.678 6.823 1.00 0.00 N ATOM 80 C8 A A 3 6.029 2.350 7.062 1.00 0.00 C ATOM 81 N7 A A 3 4.792 1.959 6.939 1.00 0.00 N ATOM 82 C5 A A 3 4.117 3.121 6.577 1.00 0.00 C ATOM 83 C6 A A 3 2.770 3.385 6.274 1.00 0.00 C ATOM 84 N6 A A 3 1.815 2.450 6.311 1.00 0.00 N ATOM 85 N1 A A 3 2.445 4.644 5.924 1.00 0.00 N ATOM 86 C2 A A 3 3.397 5.571 5.883 1.00 0.00 C ATOM 87 N3 A A 3 4.691 5.450 6.148 1.00 0.00 N ATOM 88 C4 A A 3 4.985 4.174 6.494 1.00 0.00 C ATOM 0 H5' A A 3 10.535 1.888 7.830 1.00 0.00 H new ATOM 0 H5'' A A 3 10.431 2.471 9.479 1.00 0.00 H new ATOM 0 H4' A A 3 10.155 4.269 7.924 1.00 0.00 H new ATOM 0 H3' A A 3 7.665 3.544 9.559 1.00 0.00 H new ATOM 0 H2' A A 3 6.649 5.593 8.562 1.00 0.00 H new ATOM 0 HO2' A A 3 9.180 6.338 8.511 1.00 0.00 H new ATOM 0 H1' A A 3 7.507 5.100 5.990 1.00 0.00 H new ATOM 0 H8 A A 3 6.833 1.680 7.330 1.00 0.00 H new ATOM 0 H61 A A 3 0.852 2.695 6.082 1.00 0.00 H new ATOM 0 H62 A A 3 2.050 1.491 6.569 1.00 0.00 H new ATOM 0 H2 A A 3 3.072 6.559 5.594 1.00 0.00 H new ATOM 100 P G A 4 8.211 5.319 11.455 1.00 0.00 P ATOM 101 OP1 G A 4 9.126 6.132 12.287 1.00 0.00 O ATOM 102 OP2 G A 4 7.610 4.088 12.015 1.00 0.00 O ATOM 103 O5' G A 4 7.017 6.268 10.947 1.00 0.00 O ATOM 104 C5' G A 4 7.260 7.595 10.526 1.00 0.00 C ATOM 105 C4' G A 4 5.946 8.246 10.162 1.00 0.00 C ATOM 106 O4' G A 4 5.348 7.600 9.052 1.00 0.00 O ATOM 107 C3' G A 4 4.941 8.130 11.260 1.00 0.00 C ATOM 108 O3' G A 4 5.205 9.026 12.325 1.00 0.00 O ATOM 109 C2' G A 4 3.713 8.517 10.484 1.00 0.00 C ATOM 110 O2' G A 4 3.709 9.910 10.233 1.00 0.00 O ATOM 111 C1' G A 4 3.943 7.791 9.169 1.00 0.00 C ATOM 112 N9 G A 4 3.242 6.492 9.152 1.00 0.00 N ATOM 113 C8 G A 4 3.753 5.230 9.311 1.00 0.00 C ATOM 114 N7 G A 4 2.863 4.280 9.197 1.00 0.00 N ATOM 115 C5 G A 4 1.674 4.963 8.947 1.00 0.00 C ATOM 116 C6 G A 4 0.350 4.466 8.732 1.00 0.00 C ATOM 117 O6 G A 4 -0.043 3.300 8.704 1.00 0.00 O ATOM 118 N1 G A 4 -0.553 5.500 8.542 1.00 0.00 N ATOM 119 C2 G A 4 -0.240 6.839 8.533 1.00 0.00 C ATOM 120 N2 G A 4 -1.252 7.688 8.324 1.00 0.00 N ATOM 121 N3 G A 4 0.995 7.310 8.719 1.00 0.00 N ATOM 122 C4 G A 4 1.899 6.318 8.924 1.00 0.00 C ATOM 0 H5' G A 4 7.933 7.600 9.668 1.00 0.00 H new ATOM 0 H5'' G A 4 7.751 8.158 11.320 1.00 0.00 H new ATOM 0 H4' G A 4 6.190 9.288 9.954 1.00 0.00 H new ATOM 0 H3' G A 4 4.898 7.162 11.760 1.00 0.00 H new ATOM 0 H2' G A 4 2.780 8.276 10.993 1.00 0.00 H new ATOM 0 HO2' G A 4 4.362 10.350 10.817 1.00 0.00 H new ATOM 0 H1' G A 4 3.552 8.372 8.334 1.00 0.00 H new ATOM 0 H8 G A 4 4.797 5.038 9.512 1.00 0.00 H new ATOM 0 H1 G A 4 -1.530 5.247 8.397 1.00 0.00 H new ATOM 0 H21 G A 4 -1.079 8.693 8.307 1.00 0.00 H new ATOM 0 H22 G A 4 -2.197 7.330 8.182 1.00 0.00 H new ATOM 134 P U A 5 4.503 8.834 13.764 1.00 0.00 P ATOM 135 OP1 U A 5 4.798 10.030 14.584 1.00 0.00 O ATOM 136 OP2 U A 5 4.862 7.491 14.269 1.00 0.00 O ATOM 137 O5' U A 5 2.932 8.832 13.424 1.00 0.00 O ATOM 138 C5' U A 5 2.249 10.018 13.081 1.00 0.00 C ATOM 139 C4' U A 5 0.788 9.673 12.778 1.00 0.00 C ATOM 140 O4' U A 5 0.675 8.758 11.693 1.00 0.00 O ATOM 141 C3' U A 5 0.132 8.997 13.968 1.00 0.00 C ATOM 142 O3' U A 5 -0.351 9.932 14.924 1.00 0.00 O ATOM 143 C2' U A 5 -0.980 8.239 13.319 1.00 0.00 C ATOM 144 O2' U A 5 -2.087 9.091 13.112 1.00 0.00 O ATOM 145 C1' U A 5 -0.398 7.850 11.975 1.00 0.00 C ATOM 146 N1 U A 5 0.099 6.455 11.979 1.00 0.00 N ATOM 147 C2 U A 5 -0.817 5.450 11.711 1.00 0.00 C ATOM 148 O2 U A 5 -2.005 5.690 11.508 1.00 0.00 O ATOM 149 N3 U A 5 -0.320 4.154 11.680 1.00 0.00 N ATOM 150 C4 U A 5 1.011 3.795 11.853 1.00 0.00 C ATOM 151 O4 U A 5 1.351 2.616 11.814 1.00 0.00 O ATOM 152 C5 U A 5 1.901 4.921 12.064 1.00 0.00 C ATOM 153 C6 U A 5 1.428 6.178 12.122 1.00 0.00 C ATOM 0 H5' U A 5 2.715 10.485 12.213 1.00 0.00 H new ATOM 0 H5'' U A 5 2.306 10.737 13.898 1.00 0.00 H new ATOM 0 H4' U A 5 0.303 10.619 12.537 1.00 0.00 H new ATOM 0 H3' U A 5 0.816 8.372 14.541 1.00 0.00 H new ATOM 0 H2' U A 5 -1.322 7.392 13.913 1.00 0.00 H new ATOM 0 HO2' U A 5 -1.916 9.958 13.535 1.00 0.00 H new ATOM 0 H1' U A 5 -1.172 7.907 11.209 1.00 0.00 H new ATOM 0 H3 U A 5 -0.989 3.401 11.516 1.00 0.00 H new ATOM 0 H5 U A 5 2.961 4.747 12.176 1.00 0.00 H new ATOM 0 H6 U A 5 2.119 6.992 12.286 1.00 0.00 H new ATOM 164 P U A 6 -0.910 9.444 16.365 1.00 0.00 P ATOM 165 OP1 U A 6 -1.072 10.641 17.220 1.00 0.00 O ATOM 166 OP2 U A 6 -0.054 8.328 16.825 1.00 0.00 O ATOM 167 O5' U A 6 -2.388 8.845 16.064 1.00 0.00 O ATOM 168 C5' U A 6 -3.518 9.696 15.936 1.00 0.00 C ATOM 169 C4' U A 6 -4.803 8.852 15.819 1.00 0.00 C ATOM 170 O4' U A 6 -4.825 8.091 14.617 1.00 0.00 O ATOM 171 C3' U A 6 -4.937 7.842 16.947 1.00 0.00 C ATOM 172 O3' U A 6 -5.441 8.406 18.142 1.00 0.00 O ATOM 173 C2' U A 6 -5.931 6.895 16.336 1.00 0.00 C ATOM 174 O2' U A 6 -7.226 7.460 16.377 1.00 0.00 O ATOM 175 C1' U A 6 -5.476 6.842 14.896 1.00 0.00 C ATOM 176 N1 U A 6 -4.525 5.731 14.688 1.00 0.00 N ATOM 177 C2 U A 6 -5.033 4.460 14.471 1.00 0.00 C ATOM 178 O2 U A 6 -6.236 4.214 14.522 1.00 0.00 O ATOM 179 N3 U A 6 -4.101 3.474 14.187 1.00 0.00 N ATOM 180 C4 U A 6 -2.730 3.654 14.090 1.00 0.00 C ATOM 181 O4 U A 6 -1.990 2.709 13.829 1.00 0.00 O ATOM 182 C5 U A 6 -2.299 5.013 14.319 1.00 0.00 C ATOM 183 C6 U A 6 -3.194 5.980 14.609 1.00 0.00 C ATOM 0 H5' U A 6 -3.408 10.330 15.056 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.585 10.358 16.800 1.00 0.00 H new ATOM 0 H4' U A 6 -5.616 9.578 15.849 1.00 0.00 H new ATOM 0 H3' U A 6 -3.990 7.401 17.257 1.00 0.00 H new ATOM 0 H2' U A 6 -5.976 5.929 16.838 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.234 8.215 17.002 1.00 0.00 H new ATOM 0 H1' U A 6 -6.327 6.679 14.235 1.00 0.00 H new ATOM 0 H3 U A 6 -4.456 2.530 14.036 1.00 0.00 H new ATOM 0 H5 U A 6 -1.249 5.258 14.257 1.00 0.00 H new ATOM 0 H6 U A 6 -2.839 6.985 14.784 1.00 0.00 H new ATOM 194 P C A 7 -5.385 7.580 19.531 1.00 0.00 P ATOM 195 OP1 C A 7 -6.084 8.373 20.566 1.00 0.00 O ATOM 196 OP2 C A 7 -3.982 7.165 19.751 1.00 0.00 O ATOM 197 O5' C A 7 -6.257 6.245 19.246 1.00 0.00 O ATOM 198 C5' C A 7 -7.672 6.271 19.267 1.00 0.00 C ATOM 199 C4' C A 7 -8.220 4.850 19.067 1.00 0.00 C ATOM 200 O4' C A 7 -7.849 4.295 17.799 1.00 0.00 O ATOM 201 C3' C A 7 -7.673 3.884 20.099 1.00 0.00 C ATOM 202 O3' C A 7 -8.329 4.001 21.348 1.00 0.00 O ATOM 203 C2' C A 7 -7.982 2.572 19.423 1.00 0.00 C ATOM 204 O2' C A 7 -9.359 2.283 19.547 1.00 0.00 O ATOM 205 C1' C A 7 -7.687 2.870 17.964 1.00 0.00 C ATOM 206 N1 C A 7 -6.306 2.455 17.602 1.00 0.00 N ATOM 207 C2 C A 7 -6.101 1.121 17.259 1.00 0.00 C ATOM 208 O2 C A 7 -7.028 0.316 17.311 1.00 0.00 O ATOM 209 N3 C A 7 -4.852 0.740 16.867 1.00 0.00 N ATOM 210 C4 C A 7 -3.848 1.627 16.811 1.00 0.00 C ATOM 211 N4 C A 7 -2.641 1.211 16.413 1.00 0.00 N ATOM 212 C5 C A 7 -4.049 3.004 17.157 1.00 0.00 C ATOM 213 C6 C A 7 -5.290 3.363 17.541 1.00 0.00 C ATOM 0 H5' C A 7 -8.045 6.929 18.482 1.00 0.00 H new ATOM 0 H5'' C A 7 -8.024 6.676 20.216 1.00 0.00 H new ATOM 0 H4' C A 7 -9.301 4.960 19.149 1.00 0.00 H new ATOM 0 H3' C A 7 -6.624 4.037 20.351 1.00 0.00 H new ATOM 0 H2' C A 7 -7.422 1.733 19.837 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.774 2.924 20.161 1.00 0.00 H new ATOM 0 H1' C A 7 -8.361 2.316 17.311 1.00 0.00 H new ATOM 0 H41 C A 7 -1.865 1.871 16.364 1.00 0.00 H new ATOM 0 H42 C A 7 -2.497 0.234 16.159 1.00 0.00 H new ATOM 0 H5 C A 7 -3.243 3.721 17.112 1.00 0.00 H new ATOM 0 H6 C A 7 -5.484 4.392 17.806 1.00 0.00 H new ATOM 225 P C A 8 -7.734 3.275 22.663 1.00 0.00 P ATOM 226 OP1 C A 8 -8.671 3.508 23.784 1.00 0.00 O ATOM 227 OP2 C A 8 -6.315 3.672 22.798 1.00 0.00 O ATOM 228 O5' C A 8 -7.777 1.710 22.291 1.00 0.00 O ATOM 229 C5' C A 8 -8.986 0.980 22.333 1.00 0.00 C ATOM 230 C4' C A 8 -8.713 -0.460 21.893 1.00 0.00 C ATOM 231 O4' C A 8 -8.199 -0.514 20.566 1.00 0.00 O ATOM 232 C3' C A 8 -7.648 -1.114 22.744 1.00 0.00 C ATOM 233 O3' C A 8 -8.146 -1.552 23.991 1.00 0.00 O ATOM 234 C2' C A 8 -7.258 -2.273 21.865 1.00 0.00 C ATOM 235 O2' C A 8 -8.185 -3.324 22.031 1.00 0.00 O ATOM 236 C1' C A 8 -7.388 -1.696 20.456 1.00 0.00 C ATOM 237 N1 C A 8 -6.031 -1.358 19.961 1.00 0.00 N ATOM 238 C2 C A 8 -5.283 -2.372 19.373 1.00 0.00 C ATOM 239 O2 C A 8 -5.770 -3.488 19.210 1.00 0.00 O ATOM 240 N3 C A 8 -4.002 -2.093 18.995 1.00 0.00 N ATOM 241 C4 C A 8 -3.477 -0.875 19.190 1.00 0.00 C ATOM 242 N4 C A 8 -2.219 -0.643 18.802 1.00 0.00 N ATOM 243 C5 C A 8 -4.233 0.171 19.810 1.00 0.00 C ATOM 244 C6 C A 8 -5.498 -0.123 20.174 1.00 0.00 C ATOM 0 H5' C A 8 -9.727 1.440 21.679 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.399 0.994 23.341 1.00 0.00 H new ATOM 0 H4' C A 8 -9.673 -0.969 21.981 1.00 0.00 H new ATOM 0 H3' C A 8 -6.828 -0.449 23.015 1.00 0.00 H new ATOM 0 H2' C A 8 -6.267 -2.671 22.084 1.00 0.00 H new ATOM 0 HO2' C A 8 -8.586 -3.269 22.924 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.423 -1.969 24.504 1.00 0.00 H new ATOM 0 H1' C A 8 -7.844 -2.400 19.760 1.00 0.00 H new ATOM 0 H41 C A 8 -1.804 0.278 18.943 1.00 0.00 H new ATOM 0 H42 C A 8 -1.675 -1.387 18.365 1.00 0.00 H new ATOM 0 H5 C A 8 -3.810 1.150 19.978 1.00 0.00 H new ATOM 0 H6 C A 8 -6.102 0.638 20.645 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.693 -8.749 15.322 1.00 0.00 O ATOM 259 C5' G B 9 3.106 -10.025 15.446 1.00 0.00 C ATOM 260 C4' G B 9 1.637 -9.888 15.855 1.00 0.00 C ATOM 261 O4' G B 9 1.502 -9.224 17.111 1.00 0.00 O ATOM 262 C3' G B 9 0.832 -9.047 14.885 1.00 0.00 C ATOM 263 O3' G B 9 0.503 -9.735 13.694 1.00 0.00 O ATOM 264 C2' G B 9 -0.381 -8.779 15.736 1.00 0.00 C ATOM 265 O2' G B 9 -1.178 -9.941 15.815 1.00 0.00 O ATOM 266 C1' G B 9 0.243 -8.528 17.100 1.00 0.00 C ATOM 267 N9 G B 9 0.453 -7.078 17.291 1.00 0.00 N ATOM 268 C8 G B 9 1.602 -6.342 17.152 1.00 0.00 C ATOM 269 N7 G B 9 1.448 -5.070 17.394 1.00 0.00 N ATOM 270 C5 G B 9 0.099 -4.952 17.716 1.00 0.00 C ATOM 271 C6 G B 9 -0.660 -3.799 18.073 1.00 0.00 C ATOM 272 O6 G B 9 -0.278 -2.636 18.175 1.00 0.00 O ATOM 273 N1 G B 9 -1.991 -4.119 18.322 1.00 0.00 N ATOM 274 C2 G B 9 -2.529 -5.385 18.236 1.00 0.00 C ATOM 275 N2 G B 9 -3.834 -5.504 18.501 1.00 0.00 N ATOM 276 N3 G B 9 -1.820 -6.468 17.901 1.00 0.00 N ATOM 277 C4 G B 9 -0.517 -6.178 17.656 1.00 0.00 C ATOM 0 H5' G B 9 3.646 -10.612 16.189 1.00 0.00 H new ATOM 0 H5'' G B 9 3.180 -10.562 14.500 1.00 0.00 H new ATOM 0 H4' G B 9 1.269 -10.914 15.885 1.00 0.00 H new ATOM 0 H3' G B 9 1.351 -8.163 14.513 1.00 0.00 H new ATOM 0 H2' G B 9 -1.010 -7.971 15.362 1.00 0.00 H new ATOM 0 HO2' G B 9 -1.965 -9.761 16.371 1.00 0.00 H new ATOM 0 HO5' G B 9 4.633 -8.845 15.062 1.00 0.00 H new ATOM 0 H1' G B 9 -0.401 -8.881 17.906 1.00 0.00 H new ATOM 0 H8 G B 9 2.549 -6.777 16.868 1.00 0.00 H new ATOM 0 H1 G B 9 -2.616 -3.359 18.589 1.00 0.00 H new ATOM 0 H21 G B 9 -4.283 -6.419 18.452 1.00 0.00 H new ATOM 0 H22 G B 9 -4.381 -4.680 18.752 1.00 0.00 H new ATOM 290 P G B 10 -0.170 -8.951 12.450 1.00 0.00 P ATOM 291 OP1 G B 10 -0.336 -9.912 11.338 1.00 0.00 O ATOM 292 OP2 G B 10 0.596 -7.704 12.233 1.00 0.00 O ATOM 293 O5' G B 10 -1.639 -8.549 12.989 1.00 0.00 O ATOM 294 C5' G B 10 -2.656 -9.521 13.115 1.00 0.00 C ATOM 295 C4' G B 10 -3.963 -8.868 13.583 1.00 0.00 C ATOM 296 O4' G B 10 -3.843 -8.244 14.865 1.00 0.00 O ATOM 297 C3' G B 10 -4.440 -7.777 12.649 1.00 0.00 C ATOM 298 O3' G B 10 -5.051 -8.280 11.478 1.00 0.00 O ATOM 299 C2' G B 10 -5.430 -7.085 13.546 1.00 0.00 C ATOM 300 O2' G B 10 -6.592 -7.875 13.700 1.00 0.00 O ATOM 301 C1' G B 10 -4.675 -7.065 14.857 1.00 0.00 C ATOM 302 N9 G B 10 -3.817 -5.871 14.955 1.00 0.00 N ATOM 303 C8 G B 10 -2.470 -5.782 14.757 1.00 0.00 C ATOM 304 N7 G B 10 -1.976 -4.594 14.977 1.00 0.00 N ATOM 305 C5 G B 10 -3.083 -3.838 15.353 1.00 0.00 C ATOM 306 C6 G B 10 -3.170 -2.466 15.735 1.00 0.00 C ATOM 307 O6 G B 10 -2.266 -1.636 15.809 1.00 0.00 O ATOM 308 N1 G B 10 -4.475 -2.103 16.049 1.00 0.00 N ATOM 309 C2 G B 10 -5.562 -2.950 16.015 1.00 0.00 C ATOM 310 N2 G B 10 -6.745 -2.424 16.351 1.00 0.00 N ATOM 311 N3 G B 10 -5.484 -4.240 15.665 1.00 0.00 N ATOM 312 C4 G B 10 -4.217 -4.615 15.346 1.00 0.00 C ATOM 0 H5' G B 10 -2.349 -10.287 13.827 1.00 0.00 H new ATOM 0 H5'' G B 10 -2.813 -10.019 12.158 1.00 0.00 H new ATOM 0 H4' G B 10 -4.668 -9.699 13.613 1.00 0.00 H new ATOM 0 H3' G B 10 -3.645 -7.144 12.254 1.00 0.00 H new ATOM 0 H2' G B 10 -5.754 -6.111 13.179 1.00 0.00 H new ATOM 0 HO2' G B 10 -7.226 -7.413 14.287 1.00 0.00 H new ATOM 0 H1' G B 10 -5.371 -7.044 15.695 1.00 0.00 H new ATOM 0 H8 G B 10 -1.865 -6.621 14.446 1.00 0.00 H new ATOM 0 H1 G B 10 -4.641 -1.135 16.326 1.00 0.00 H new ATOM 0 H21 G B 10 -7.583 -3.006 16.343 1.00 0.00 H new ATOM 0 H22 G B 10 -6.809 -1.441 16.615 1.00 0.00 H new ATOM 324 P A B 11 -5.328 -7.314 10.213 1.00 0.00 P ATOM 325 OP1 A B 11 -6.063 -8.093 9.192 1.00 0.00 O ATOM 326 OP2 A B 11 -4.051 -6.659 9.855 1.00 0.00 O ATOM 327 O5' A B 11 -6.321 -6.183 10.793 1.00 0.00 O ATOM 328 C5' A B 11 -7.680 -6.467 11.045 1.00 0.00 C ATOM 329 C4' A B 11 -8.386 -5.209 11.561 1.00 0.00 C ATOM 330 O4' A B 11 -7.830 -4.734 12.781 1.00 0.00 O ATOM 331 C3' A B 11 -8.298 -4.057 10.582 1.00 0.00 C ATOM 332 O3' A B 11 -9.238 -4.188 9.533 1.00 0.00 O ATOM 333 C2' A B 11 -8.632 -2.896 11.490 1.00 0.00 C ATOM 334 O2' A B 11 -10.021 -2.879 11.750 1.00 0.00 O ATOM 335 C1' A B 11 -7.924 -3.300 12.787 1.00 0.00 C ATOM 336 N9 A B 11 -6.564 -2.755 12.816 1.00 0.00 N ATOM 337 C8 A B 11 -5.391 -3.409 12.582 1.00 0.00 C ATOM 338 N7 A B 11 -4.330 -2.661 12.711 1.00 0.00 N ATOM 339 C5 A B 11 -4.847 -1.420 13.071 1.00 0.00 C ATOM 340 C6 A B 11 -4.243 -0.188 13.377 1.00 0.00 C ATOM 341 N6 A B 11 -2.920 0.007 13.347 1.00 0.00 N ATOM 342 N1 A B 11 -5.049 0.833 13.724 1.00 0.00 N ATOM 343 C2 A B 11 -6.364 0.637 13.758 1.00 0.00 C ATOM 344 N3 A B 11 -7.049 -0.466 13.490 1.00 0.00 N ATOM 345 C4 A B 11 -6.211 -1.472 13.147 1.00 0.00 C ATOM 0 H5' A B 11 -7.763 -7.269 11.779 1.00 0.00 H new ATOM 0 H5'' A B 11 -8.163 -6.818 10.133 1.00 0.00 H new ATOM 0 H4' A B 11 -9.421 -5.520 11.704 1.00 0.00 H new ATOM 0 H3' A B 11 -7.340 -3.971 10.069 1.00 0.00 H new ATOM 0 H2' A B 11 -8.347 -1.926 11.081 1.00 0.00 H new ATOM 0 HO2' A B 11 -10.474 -3.510 11.152 1.00 0.00 H new ATOM 0 H1' A B 11 -8.475 -2.924 13.649 1.00 0.00 H new ATOM 0 H8 A B 11 -5.344 -4.454 12.314 1.00 0.00 H new ATOM 0 H61 A B 11 -2.534 0.922 13.578 1.00 0.00 H new ATOM 0 H62 A B 11 -2.297 -0.760 13.093 1.00 0.00 H new ATOM 0 H2 A B 11 -6.955 1.495 14.043 1.00 0.00 H new ATOM 357 P G B 12 -9.094 -3.321 8.183 1.00 0.00 P ATOM 358 OP1 G B 12 -10.297 -3.557 7.354 1.00 0.00 O ATOM 359 OP2 G B 12 -7.752 -3.580 7.618 1.00 0.00 O ATOM 360 O5' G B 12 -9.130 -1.798 8.698 1.00 0.00 O ATOM 361 C5' G B 12 -10.333 -1.193 9.126 1.00 0.00 C ATOM 362 C4' G B 12 -10.057 0.246 9.496 1.00 0.00 C ATOM 363 O4' G B 12 -9.181 0.326 10.605 1.00 0.00 O ATOM 364 C3' G B 12 -9.355 0.979 8.401 1.00 0.00 C ATOM 365 O3' G B 12 -10.226 1.304 7.331 1.00 0.00 O ATOM 366 C2' G B 12 -8.942 2.191 9.186 1.00 0.00 C ATOM 367 O2' G B 12 -10.070 3.002 9.442 1.00 0.00 O ATOM 368 C1' G B 12 -8.495 1.567 10.497 1.00 0.00 C ATOM 369 N9 G B 12 -7.036 1.352 10.514 1.00 0.00 N ATOM 370 C8 G B 12 -6.330 0.191 10.340 1.00 0.00 C ATOM 371 N7 G B 12 -5.037 0.334 10.463 1.00 0.00 N ATOM 372 C5 G B 12 -4.874 1.691 10.735 1.00 0.00 C ATOM 373 C6 G B 12 -3.686 2.452 10.970 1.00 0.00 C ATOM 374 O6 G B 12 -2.516 2.071 10.995 1.00 0.00 O ATOM 375 N1 G B 12 -3.977 3.790 11.185 1.00 0.00 N ATOM 376 C2 G B 12 -5.237 4.340 11.195 1.00 0.00 C ATOM 377 N2 G B 12 -5.315 5.654 11.429 1.00 0.00 N ATOM 378 N3 G B 12 -6.352 3.634 10.989 1.00 0.00 N ATOM 379 C4 G B 12 -6.096 2.321 10.762 1.00 0.00 C ATOM 0 H5' G B 12 -10.740 -1.730 9.982 1.00 0.00 H new ATOM 0 H5'' G B 12 -11.081 -1.241 8.334 1.00 0.00 H new ATOM 0 H4' G B 12 -11.034 0.682 9.706 1.00 0.00 H new ATOM 0 H3' G B 12 -8.551 0.437 7.903 1.00 0.00 H new ATOM 0 H2' G B 12 -8.195 2.808 8.686 1.00 0.00 H new ATOM 0 HO2' G B 12 -10.754 2.836 8.760 1.00 0.00 H new ATOM 0 H1' G B 12 -8.725 2.224 11.336 1.00 0.00 H new ATOM 0 H8 G B 12 -6.800 -0.757 10.121 1.00 0.00 H new ATOM 0 H1 G B 12 -3.191 4.419 11.349 1.00 0.00 H new ATOM 0 H21 G B 12 -6.224 6.116 11.448 1.00 0.00 H new ATOM 0 H22 G B 12 -4.465 6.195 11.589 1.00 0.00 H new ATOM 391 P U B 13 -9.646 1.769 5.901 1.00 0.00 P ATOM 392 OP1 U B 13 -10.779 2.244 5.075 1.00 0.00 O ATOM 393 OP2 U B 13 -8.771 0.690 5.393 1.00 0.00 O ATOM 394 O5' U B 13 -8.719 3.032 6.257 1.00 0.00 O ATOM 395 C5' U B 13 -9.274 4.282 6.609 1.00 0.00 C ATOM 396 C4' U B 13 -8.131 5.253 6.919 1.00 0.00 C ATOM 397 O4' U B 13 -7.326 4.792 8.001 1.00 0.00 O ATOM 398 C3' U B 13 -7.199 5.388 5.729 1.00 0.00 C ATOM 399 O3' U B 13 -7.664 6.339 4.780 1.00 0.00 O ATOM 400 C2' U B 13 -5.927 5.823 6.379 1.00 0.00 C ATOM 401 O2' U B 13 -5.950 7.220 6.593 1.00 0.00 O ATOM 402 C1' U B 13 -5.959 5.117 7.719 1.00 0.00 C ATOM 403 N1 U B 13 -5.133 3.888 7.711 1.00 0.00 N ATOM 404 C2 U B 13 -3.779 4.025 7.982 1.00 0.00 C ATOM 405 O2 U B 13 -3.266 5.122 8.188 1.00 0.00 O ATOM 406 N3 U B 13 -3.035 2.854 8.012 1.00 0.00 N ATOM 407 C4 U B 13 -3.538 1.572 7.832 1.00 0.00 C ATOM 408 O4 U B 13 -2.793 0.596 7.870 1.00 0.00 O ATOM 409 C5 U B 13 -4.972 1.528 7.617 1.00 0.00 C ATOM 410 C6 U B 13 -5.700 2.655 7.561 1.00 0.00 C ATOM 0 H5' U B 13 -9.926 4.176 7.476 1.00 0.00 H new ATOM 0 H5'' U B 13 -9.887 4.667 5.794 1.00 0.00 H new ATOM 0 H4' U B 13 -8.604 6.203 7.168 1.00 0.00 H new ATOM 0 H3' U B 13 -7.105 4.471 5.148 1.00 0.00 H new ATOM 0 H2' U B 13 -5.044 5.594 5.783 1.00 0.00 H new ATOM 0 HO2' U B 13 -6.757 7.600 6.187 1.00 0.00 H new ATOM 0 H1' U B 13 -5.544 5.771 8.486 1.00 0.00 H new ATOM 0 H3 U B 13 -2.033 2.942 8.181 1.00 0.00 H new ATOM 0 H5 U B 13 -5.462 0.573 7.500 1.00 0.00 H new ATOM 0 H6 U B 13 -6.764 2.584 7.392 1.00 0.00 H new ATOM 421 P U B 14 -6.934 6.514 3.343 1.00 0.00 P ATOM 422 OP1 U B 14 -7.797 7.367 2.495 1.00 0.00 O ATOM 423 OP2 U B 14 -6.546 5.167 2.869 1.00 0.00 O ATOM 424 O5' U B 14 -5.574 7.341 3.659 1.00 0.00 O ATOM 425 C5' U B 14 -5.585 8.754 3.810 1.00 0.00 C ATOM 426 C4' U B 14 -4.142 9.278 3.945 1.00 0.00 C ATOM 427 O4' U B 14 -3.523 8.818 5.141 1.00 0.00 O ATOM 428 C3' U B 14 -3.245 8.805 2.813 1.00 0.00 C ATOM 429 O3' U B 14 -3.395 9.564 1.628 1.00 0.00 O ATOM 430 C2' U B 14 -1.901 9.046 3.435 1.00 0.00 C ATOM 431 O2' U B 14 -1.626 10.431 3.434 1.00 0.00 O ATOM 432 C1' U B 14 -2.129 8.610 4.864 1.00 0.00 C ATOM 433 N1 U B 14 -1.801 7.181 5.043 1.00 0.00 N ATOM 434 C2 U B 14 -0.480 6.831 5.274 1.00 0.00 C ATOM 435 O2 U B 14 0.434 7.653 5.244 1.00 0.00 O ATOM 436 N3 U B 14 -0.246 5.493 5.550 1.00 0.00 N ATOM 437 C4 U B 14 -1.208 4.497 5.626 1.00 0.00 C ATOM 438 O4 U B 14 -0.894 3.339 5.883 1.00 0.00 O ATOM 439 C5 U B 14 -2.553 4.961 5.381 1.00 0.00 C ATOM 440 C6 U B 14 -2.793 6.258 5.098 1.00 0.00 C ATOM 0 H5' U B 14 -6.165 9.030 4.690 1.00 0.00 H new ATOM 0 H5'' U B 14 -6.070 9.217 2.951 1.00 0.00 H new ATOM 0 H4' U B 14 -4.241 10.363 3.936 1.00 0.00 H new ATOM 0 H3' U B 14 -3.447 7.785 2.487 1.00 0.00 H new ATOM 0 H2' U B 14 -1.083 8.536 2.926 1.00 0.00 H new ATOM 0 HO2' U B 14 -2.234 10.885 2.814 1.00 0.00 H new ATOM 0 H1' U B 14 -1.491 9.181 5.539 1.00 0.00 H new ATOM 0 H3 U B 14 0.722 5.216 5.712 1.00 0.00 H new ATOM 0 H5 U B 14 -3.376 4.263 5.425 1.00 0.00 H new ATOM 0 H6 U B 14 -3.809 6.572 4.909 1.00 0.00 H new ATOM 451 P C B 15 -2.781 9.035 0.226 1.00 0.00 P ATOM 452 OP1 C B 15 -2.987 10.090 -0.790 1.00 0.00 O ATOM 453 OP2 C B 15 -3.314 7.676 -0.012 1.00 0.00 O ATOM 454 O5' C B 15 -1.189 8.903 0.499 1.00 0.00 O ATOM 455 C5' C B 15 -0.328 10.026 0.425 1.00 0.00 C ATOM 456 C4' C B 15 1.129 9.571 0.587 1.00 0.00 C ATOM 457 O4' C B 15 1.369 8.957 1.859 1.00 0.00 O ATOM 458 C3' C B 15 1.505 8.522 -0.437 1.00 0.00 C ATOM 459 O3' C B 15 1.774 9.081 -1.711 1.00 0.00 O ATOM 460 C2' C B 15 2.747 7.965 0.207 1.00 0.00 C ATOM 461 O2' C B 15 3.819 8.867 0.033 1.00 0.00 O ATOM 462 C1' C B 15 2.379 7.943 1.678 1.00 0.00 C ATOM 463 N1 C B 15 1.859 6.609 2.073 1.00 0.00 N ATOM 464 C2 C B 15 2.788 5.617 2.372 1.00 0.00 C ATOM 465 O2 C B 15 3.992 5.842 2.271 1.00 0.00 O ATOM 466 N3 C B 15 2.326 4.401 2.779 1.00 0.00 N ATOM 467 C4 C B 15 1.010 4.167 2.889 1.00 0.00 C ATOM 468 N4 C B 15 0.602 2.960 3.295 1.00 0.00 N ATOM 469 C5 C B 15 0.044 5.185 2.590 1.00 0.00 C ATOM 470 C6 C B 15 0.519 6.381 2.192 1.00 0.00 C ATOM 0 H5' C B 15 -0.584 10.745 1.204 1.00 0.00 H new ATOM 0 H5'' C B 15 -0.457 10.533 -0.531 1.00 0.00 H new ATOM 0 H4' C B 15 1.717 10.481 0.470 1.00 0.00 H new ATOM 0 H3' C B 15 0.724 7.791 -0.646 1.00 0.00 H new ATOM 0 H2' C B 15 3.046 6.999 -0.200 1.00 0.00 H new ATOM 0 HO2' C B 15 3.546 9.586 -0.575 1.00 0.00 H new ATOM 0 H1' C B 15 3.251 8.138 2.303 1.00 0.00 H new ATOM 0 H41 C B 15 -0.395 2.762 3.385 1.00 0.00 H new ATOM 0 H42 C B 15 1.287 2.237 3.515 1.00 0.00 H new ATOM 0 H5 C B 15 -1.016 5.001 2.680 1.00 0.00 H new ATOM 0 H6 C B 15 -0.175 7.176 1.962 1.00 0.00 H new ATOM 482 P C B 16 1.954 8.133 -3.007 1.00 0.00 P ATOM 483 OP1 C B 16 2.285 8.992 -4.165 1.00 0.00 O ATOM 484 OP2 C B 16 0.785 7.229 -3.075 1.00 0.00 O ATOM 485 O5' C B 16 3.249 7.244 -2.655 1.00 0.00 O ATOM 486 C5' C B 16 4.554 7.778 -2.753 1.00 0.00 C ATOM 487 C4' C B 16 5.561 6.714 -2.310 1.00 0.00 C ATOM 488 O4' C B 16 5.326 6.297 -0.966 1.00 0.00 O ATOM 489 C3' C B 16 5.440 5.452 -3.133 1.00 0.00 C ATOM 490 O3' C B 16 6.068 5.567 -4.393 1.00 0.00 O ATOM 491 C2' C B 16 6.156 4.468 -2.246 1.00 0.00 C ATOM 492 O2' C B 16 7.550 4.593 -2.426 1.00 0.00 O ATOM 493 C1' C B 16 5.781 4.938 -0.841 1.00 0.00 C ATOM 494 N1 C B 16 4.695 4.065 -0.330 1.00 0.00 N ATOM 495 C2 C B 16 5.055 2.867 0.279 1.00 0.00 C ATOM 496 O2 C B 16 6.240 2.586 0.443 1.00 0.00 O ATOM 497 N3 C B 16 4.062 2.022 0.677 1.00 0.00 N ATOM 498 C4 C B 16 2.773 2.334 0.481 1.00 0.00 C ATOM 499 N4 C B 16 1.830 1.480 0.891 1.00 0.00 N ATOM 500 C5 C B 16 2.392 3.554 -0.163 1.00 0.00 C ATOM 501 C6 C B 16 3.389 4.380 -0.546 1.00 0.00 C ATOM 0 H5' C B 16 4.645 8.666 -2.128 1.00 0.00 H new ATOM 0 H5'' C B 16 4.759 8.087 -3.778 1.00 0.00 H new ATOM 0 H4' C B 16 6.539 7.182 -2.427 1.00 0.00 H new ATOM 0 H3' C B 16 4.413 5.182 -3.381 1.00 0.00 H new ATOM 0 H2' C B 16 5.892 3.430 -2.447 1.00 0.00 H new ATOM 0 HO2' C B 16 7.733 4.962 -3.315 1.00 0.00 H new ATOM 0 HO3' C B 16 5.965 4.727 -4.888 1.00 0.00 H new ATOM 0 H1' C B 16 6.621 4.887 -0.148 1.00 0.00 H new ATOM 0 H41 C B 16 0.845 1.702 0.750 1.00 0.00 H new ATOM 0 H42 C B 16 2.096 0.606 1.345 1.00 0.00 H new ATOM 0 H5 C B 16 1.355 3.802 -0.335 1.00 0.00 H new ATOM 0 H6 C B 16 3.144 5.312 -1.035 1.00 0.00 H new TER 514 C B 16