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= -0.691 USER MOD Single : A 1 G O5' : rot 180:sc=-0.000866 USER MOD Single : A 2 G O2' : rot -77:sc= 0.254 USER MOD Single : A 3 A O2' : rot -15:sc= -0.704 USER MOD Single : A 4 G O2' : rot -20:sc= -0.466 USER MOD Single : A 5 U O2' : rot -5:sc= 0.128 USER MOD Single : A 6 U O2' : rot -11:sc= -0.557 USER MOD Single : A 7 C O2' : rot -8:sc= -0.42 USER MOD Single : A 8 C O2' : rot -33:sc= 0.184 USER MOD Single : A 8 C O3' : rot 180:sc= 0.17 USER MOD Single : B 9 G O2' : rot -2:sc= -0.636 USER MOD Single : B 9 G O5' : rot 180:sc=-0.00365 USER MOD Single : B 10 G O2' : rot -77:sc= 0.283 USER MOD Single : B 11 A O2' : rot -15:sc= -0.771 USER MOD Single : B 12 G O2' : rot -26:sc= -0.468 USER MOD Single : B 13 U O2' : rot -3:sc= 0.104 USER MOD Single : B 14 U O2' : rot -12:sc= -0.539 USER MOD Single : B 15 C O2' : rot -7:sc= -0.397 USER MOD Single : B 16 C O2' : rot -37:sc= 0.188 USER MOD Single : B 16 C O3' : rot 180:sc= 0.172 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 5.166 -7.981 2.541 1.00 0.00 O ATOM 2 C5' G A 1 6.506 -8.218 2.164 1.00 0.00 C ATOM 3 C4' G A 1 7.220 -6.892 1.881 1.00 0.00 C ATOM 4 O4' G A 1 6.610 -6.192 0.799 1.00 0.00 O ATOM 5 C3' G A 1 7.165 -5.928 3.048 1.00 0.00 C ATOM 6 O3' G A 1 8.073 -6.259 4.079 1.00 0.00 O ATOM 7 C2' G A 1 7.554 -4.655 2.345 1.00 0.00 C ATOM 8 O2' G A 1 8.939 -4.662 2.078 1.00 0.00 O ATOM 9 C1' G A 1 6.814 -4.787 1.023 1.00 0.00 C ATOM 10 N9 G A 1 5.518 -4.088 1.096 1.00 0.00 N ATOM 11 C8 G A 1 4.263 -4.601 1.300 1.00 0.00 C ATOM 12 N7 G A 1 3.316 -3.703 1.285 1.00 0.00 N ATOM 13 C5 G A 1 3.994 -2.508 1.056 1.00 0.00 C ATOM 14 C6 G A 1 3.494 -1.178 0.932 1.00 0.00 C ATOM 15 O6 G A 1 2.330 -0.791 1.001 1.00 0.00 O ATOM 16 N1 G A 1 4.519 -0.266 0.702 1.00 0.00 N ATOM 17 C2 G A 1 5.856 -0.586 0.607 1.00 0.00 C ATOM 18 N2 G A 1 6.705 0.424 0.397 1.00 0.00 N ATOM 19 N3 G A 1 6.327 -1.831 0.717 1.00 0.00 N ATOM 20 C4 G A 1 5.342 -2.737 0.941 1.00 0.00 C ATOM 0 H5' G A 1 6.535 -8.851 1.277 1.00 0.00 H new ATOM 0 H5'' G A 1 7.025 -8.756 2.957 1.00 0.00 H new ATOM 0 H4' G A 1 8.248 -7.182 1.664 1.00 0.00 H new ATOM 0 H3' G A 1 6.207 -5.902 3.567 1.00 0.00 H new ATOM 0 H2' G A 1 7.326 -3.754 2.914 1.00 0.00 H new ATOM 0 HO2' G A 1 9.188 -3.833 1.619 1.00 0.00 H new ATOM 0 HO5' G A 1 4.720 -8.835 2.717 1.00 0.00 H new ATOM 0 H1' G A 1 7.385 -4.342 0.208 1.00 0.00 H new ATOM 0 H8 G A 1 4.075 -5.653 1.459 1.00 0.00 H new ATOM 0 H1 G A 1 4.261 0.715 0.595 1.00 0.00 H new ATOM 0 H21 G A 1 7.705 0.241 0.319 1.00 0.00 H new ATOM 0 H22 G A 1 6.353 1.378 0.315 1.00 0.00 H new ATOM 33 P G A 2 8.018 -5.493 5.498 1.00 0.00 P ATOM 34 OP1 G A 2 9.062 -6.071 6.372 1.00 0.00 O ATOM 35 OP2 G A 2 6.609 -5.481 5.950 1.00 0.00 O ATOM 36 O5' G A 2 8.442 -3.974 5.144 1.00 0.00 O ATOM 37 C5' G A 2 9.788 -3.637 4.875 1.00 0.00 C ATOM 38 C4' G A 2 9.923 -2.119 4.712 1.00 0.00 C ATOM 39 O4' G A 2 9.172 -1.605 3.615 1.00 0.00 O ATOM 40 C3' G A 2 9.433 -1.376 5.931 1.00 0.00 C ATOM 41 O3' G A 2 10.385 -1.399 6.976 1.00 0.00 O ATOM 42 C2' G A 2 9.239 0.003 5.373 1.00 0.00 C ATOM 43 O2' G A 2 10.492 0.645 5.242 1.00 0.00 O ATOM 44 C1' G A 2 8.694 -0.297 3.985 1.00 0.00 C ATOM 45 N9 G A 2 7.225 -0.319 3.968 1.00 0.00 N ATOM 46 C8 G A 2 6.398 -1.405 4.004 1.00 0.00 C ATOM 47 N7 G A 2 5.132 -1.113 3.880 1.00 0.00 N ATOM 48 C5 G A 2 5.122 0.273 3.733 1.00 0.00 C ATOM 49 C6 G A 2 4.029 1.168 3.520 1.00 0.00 C ATOM 50 O6 G A 2 2.829 0.908 3.454 1.00 0.00 O ATOM 51 N1 G A 2 4.464 2.481 3.372 1.00 0.00 N ATOM 52 C2 G A 2 5.779 2.890 3.424 1.00 0.00 C ATOM 53 N2 G A 2 6.009 4.197 3.264 1.00 0.00 N ATOM 54 N3 G A 2 6.805 2.055 3.627 1.00 0.00 N ATOM 55 C4 G A 2 6.404 0.766 3.771 1.00 0.00 C ATOM 0 H5' G A 2 10.124 -4.140 3.968 1.00 0.00 H new ATOM 0 H5'' G A 2 10.428 -3.983 5.687 1.00 0.00 H new ATOM 0 H4' G A 2 10.989 -1.963 4.548 1.00 0.00 H new ATOM 0 H3' G A 2 8.537 -1.799 6.385 1.00 0.00 H new ATOM 0 H2' G A 2 8.604 0.643 5.985 1.00 0.00 H new ATOM 0 HO2' G A 2 10.797 0.949 6.122 1.00 0.00 H new ATOM 0 H1' G A 2 9.026 0.479 3.296 1.00 0.00 H new ATOM 0 H8 G A 2 6.759 -2.416 4.124 1.00 0.00 H new ATOM 0 H1 G A 2 3.755 3.196 3.213 1.00 0.00 H new ATOM 0 H21 G A 2 6.964 4.554 3.294 1.00 0.00 H new ATOM 0 H22 G A 2 5.229 4.837 3.112 1.00 0.00 H new ATOM 67 P A A 3 10.044 -0.758 8.405 1.00 0.00 P ATOM 68 OP1 A A 3 11.204 -0.967 9.300 1.00 0.00 O ATOM 69 OP2 A A 3 8.703 -1.231 8.812 1.00 0.00 O ATOM 70 O5' A A 3 9.947 0.811 8.064 1.00 0.00 O ATOM 71 C5' A A 3 9.091 1.643 8.804 1.00 0.00 C ATOM 72 C4' A A 3 9.132 3.075 8.266 1.00 0.00 C ATOM 73 O4' A A 3 8.694 3.159 6.906 1.00 0.00 O ATOM 74 C3' A A 3 8.191 3.924 9.092 1.00 0.00 C ATOM 75 O3' A A 3 8.868 4.515 10.184 1.00 0.00 O ATOM 76 C2' A A 3 7.710 4.955 8.105 1.00 0.00 C ATOM 77 O2' A A 3 8.693 5.956 7.944 1.00 0.00 O ATOM 78 C1' A A 3 7.651 4.139 6.813 1.00 0.00 C ATOM 79 N9 A A 3 6.370 3.429 6.687 1.00 0.00 N ATOM 80 C8 A A 3 6.147 2.081 6.731 1.00 0.00 C ATOM 81 N7 A A 3 4.901 1.742 6.552 1.00 0.00 N ATOM 82 C5 A A 3 4.257 2.958 6.344 1.00 0.00 C ATOM 83 C6 A A 3 2.921 3.289 6.058 1.00 0.00 C ATOM 84 N6 A A 3 1.946 2.379 5.967 1.00 0.00 N ATOM 85 N1 A A 3 2.629 4.587 5.846 1.00 0.00 N ATOM 86 C2 A A 3 3.604 5.489 5.925 1.00 0.00 C ATOM 87 N3 A A 3 4.891 5.306 6.198 1.00 0.00 N ATOM 88 C4 A A 3 5.150 3.992 6.401 1.00 0.00 C ATOM 0 H5' A A 3 9.385 1.635 9.854 1.00 0.00 H new ATOM 0 H5'' A A 3 8.072 1.260 8.756 1.00 0.00 H new ATOM 0 H4' A A 3 10.165 3.417 8.323 1.00 0.00 H new ATOM 0 H3' A A 3 7.374 3.358 9.541 1.00 0.00 H new ATOM 0 H2' A A 3 6.778 5.441 8.395 1.00 0.00 H new ATOM 0 HO2' A A 3 9.351 5.888 8.667 1.00 0.00 H new ATOM 0 H1' A A 3 7.761 4.799 5.953 1.00 0.00 H new ATOM 0 H8 A A 3 6.934 1.360 6.899 1.00 0.00 H new ATOM 0 H61 A A 3 0.992 2.673 5.757 1.00 0.00 H new ATOM 0 H62 A A 3 2.156 1.391 6.108 1.00 0.00 H new ATOM 0 H2 A A 3 3.308 6.511 5.742 1.00 0.00 H new ATOM 100 P G A 4 8.068 5.005 11.486 1.00 0.00 P ATOM 101 OP1 G A 4 8.999 5.779 12.337 1.00 0.00 O ATOM 102 OP2 G A 4 7.359 3.835 12.048 1.00 0.00 O ATOM 103 O5' G A 4 6.969 6.013 10.896 1.00 0.00 O ATOM 104 C5' G A 4 7.309 7.320 10.474 1.00 0.00 C ATOM 105 C4' G A 4 6.041 8.018 10.046 1.00 0.00 C ATOM 106 O4' G A 4 5.467 7.370 8.925 1.00 0.00 O ATOM 107 C3' G A 4 4.996 7.943 11.108 1.00 0.00 C ATOM 108 O3' G A 4 5.247 8.846 12.172 1.00 0.00 O ATOM 109 C2' G A 4 3.813 8.353 10.283 1.00 0.00 C ATOM 110 O2' G A 4 3.881 9.736 10.001 1.00 0.00 O ATOM 111 C1' G A 4 4.064 7.584 8.998 1.00 0.00 C ATOM 112 N9 G A 4 3.339 6.297 9.005 1.00 0.00 N ATOM 113 C8 G A 4 3.827 5.025 9.167 1.00 0.00 C ATOM 114 N7 G A 4 2.917 4.093 9.070 1.00 0.00 N ATOM 115 C5 G A 4 1.739 4.797 8.833 1.00 0.00 C ATOM 116 C6 G A 4 0.403 4.326 8.641 1.00 0.00 C ATOM 117 O6 G A 4 -0.013 3.168 8.625 1.00 0.00 O ATOM 118 N1 G A 4 -0.481 5.378 8.459 1.00 0.00 N ATOM 119 C2 G A 4 -0.143 6.710 8.443 1.00 0.00 C ATOM 120 N2 G A 4 -1.141 7.580 8.251 1.00 0.00 N ATOM 121 N3 G A 4 1.104 7.157 8.606 1.00 0.00 N ATOM 122 C4 G A 4 1.991 6.149 8.800 1.00 0.00 C ATOM 0 H5' G A 4 8.019 7.281 9.648 1.00 0.00 H new ATOM 0 H5'' G A 4 7.791 7.868 11.283 1.00 0.00 H new ATOM 0 H4' G A 4 6.323 9.048 9.829 1.00 0.00 H new ATOM 0 H3' G A 4 4.908 6.984 11.619 1.00 0.00 H new ATOM 0 H2' G A 4 2.851 8.162 10.759 1.00 0.00 H new ATOM 0 HO2' G A 4 4.479 10.172 10.644 1.00 0.00 H new ATOM 0 H1' G A 4 3.706 8.142 8.133 1.00 0.00 H new ATOM 0 H8 G A 4 4.869 4.814 9.357 1.00 0.00 H new ATOM 0 H1 G A 4 -1.465 5.144 8.326 1.00 0.00 H new ATOM 0 H21 G A 4 -0.948 8.581 8.230 1.00 0.00 H new ATOM 0 H22 G A 4 -2.095 7.242 8.126 1.00 0.00 H new ATOM 134 P U A 5 4.505 8.688 13.595 1.00 0.00 P ATOM 135 OP1 U A 5 4.791 9.894 14.402 1.00 0.00 O ATOM 136 OP2 U A 5 4.836 7.350 14.132 1.00 0.00 O ATOM 137 O5' U A 5 2.942 8.695 13.218 1.00 0.00 O ATOM 138 C5' U A 5 2.279 9.877 12.826 1.00 0.00 C ATOM 139 C4' U A 5 0.819 9.537 12.508 1.00 0.00 C ATOM 140 O4' U A 5 0.722 8.591 11.445 1.00 0.00 O ATOM 141 C3' U A 5 0.133 8.902 13.706 1.00 0.00 C ATOM 142 O3' U A 5 -0.387 9.873 14.605 1.00 0.00 O ATOM 143 C2' U A 5 -0.952 8.105 13.061 1.00 0.00 C ATOM 144 O2' U A 5 -2.063 8.934 12.789 1.00 0.00 O ATOM 145 C1' U A 5 -0.332 7.669 11.750 1.00 0.00 C ATOM 146 N1 U A 5 0.198 6.288 11.827 1.00 0.00 N ATOM 147 C2 U A 5 -0.697 5.252 11.616 1.00 0.00 C ATOM 148 O2 U A 5 -1.890 5.456 11.413 1.00 0.00 O ATOM 149 N3 U A 5 -0.172 3.969 11.639 1.00 0.00 N ATOM 150 C4 U A 5 1.169 3.647 11.808 1.00 0.00 C ATOM 151 O4 U A 5 1.536 2.475 11.816 1.00 0.00 O ATOM 152 C5 U A 5 2.036 4.802 11.955 1.00 0.00 C ATOM 153 C6 U A 5 1.534 6.048 11.964 1.00 0.00 C ATOM 0 H5' U A 5 2.765 10.311 11.952 1.00 0.00 H new ATOM 0 H5'' U A 5 2.330 10.621 13.621 1.00 0.00 H new ATOM 0 H4' U A 5 0.344 10.479 12.233 1.00 0.00 H new ATOM 0 H3' U A 5 0.806 8.307 14.323 1.00 0.00 H new ATOM 0 H2' U A 5 -1.299 7.279 13.682 1.00 0.00 H new ATOM 0 HO2' U A 5 -1.899 9.830 13.151 1.00 0.00 H new ATOM 0 H1' U A 5 -1.091 7.670 10.968 1.00 0.00 H new ATOM 0 H3 U A 5 -0.826 3.195 11.522 1.00 0.00 H new ATOM 0 H5 U A 5 3.101 4.657 12.059 1.00 0.00 H new ATOM 0 H6 U A 5 2.207 6.884 12.083 1.00 0.00 H new ATOM 164 P U A 6 -0.989 9.443 16.048 1.00 0.00 P ATOM 165 OP1 U A 6 -1.192 10.675 16.842 1.00 0.00 O ATOM 166 OP2 U A 6 -0.136 8.360 16.586 1.00 0.00 O ATOM 167 O5' U A 6 -2.450 8.812 15.727 1.00 0.00 O ATOM 168 C5' U A 6 -3.585 9.641 15.512 1.00 0.00 C ATOM 169 C4' U A 6 -4.856 8.775 15.418 1.00 0.00 C ATOM 170 O4' U A 6 -4.830 7.922 14.280 1.00 0.00 O ATOM 171 C3' U A 6 -5.016 7.856 16.618 1.00 0.00 C ATOM 172 O3' U A 6 -5.567 8.509 17.746 1.00 0.00 O ATOM 173 C2' U A 6 -5.978 6.853 16.049 1.00 0.00 C ATOM 174 O2' U A 6 -7.273 7.409 15.993 1.00 0.00 O ATOM 175 C1' U A 6 -5.472 6.689 14.636 1.00 0.00 C ATOM 176 N1 U A 6 -4.500 5.580 14.548 1.00 0.00 N ATOM 177 C2 U A 6 -4.983 4.283 14.456 1.00 0.00 C ATOM 178 O2 U A 6 -6.181 4.021 14.532 1.00 0.00 O ATOM 179 N3 U A 6 -4.031 3.292 14.265 1.00 0.00 N ATOM 180 C4 U A 6 -2.663 3.491 14.143 1.00 0.00 C ATOM 181 O4 U A 6 -1.904 2.541 13.974 1.00 0.00 O ATOM 182 C5 U A 6 -2.261 4.876 14.233 1.00 0.00 C ATOM 183 C6 U A 6 -3.175 5.847 14.435 1.00 0.00 C ATOM 0 H5' U A 6 -3.458 10.216 14.595 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.682 10.358 16.327 1.00 0.00 H new ATOM 0 H4' U A 6 -5.677 9.490 15.362 1.00 0.00 H new ATOM 0 H3' U A 6 -4.077 7.452 16.995 1.00 0.00 H new ATOM 0 H2' U A 6 -6.034 5.930 16.626 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.288 8.254 16.489 1.00 0.00 H new ATOM 0 H1' U A 6 -6.297 6.456 13.963 1.00 0.00 H new ATOM 0 H3 U A 6 -4.367 2.330 14.209 1.00 0.00 H new ATOM 0 H5 U A 6 -1.217 5.136 14.137 1.00 0.00 H new ATOM 0 H6 U A 6 -2.841 6.871 14.509 1.00 0.00 H new ATOM 194 P C A 7 -5.595 7.778 19.190 1.00 0.00 P ATOM 195 OP1 C A 7 -6.317 8.657 20.136 1.00 0.00 O ATOM 196 OP2 C A 7 -4.215 7.343 19.501 1.00 0.00 O ATOM 197 O5' C A 7 -6.491 6.451 18.953 1.00 0.00 O ATOM 198 C5' C A 7 -7.904 6.515 18.896 1.00 0.00 C ATOM 199 C4' C A 7 -8.476 5.101 18.719 1.00 0.00 C ATOM 200 O4' C A 7 -8.014 4.473 17.515 1.00 0.00 O ATOM 201 C3' C A 7 -8.044 4.177 19.837 1.00 0.00 C ATOM 202 O3' C A 7 -8.788 4.380 21.025 1.00 0.00 O ATOM 203 C2' C A 7 -8.349 2.845 19.203 1.00 0.00 C ATOM 204 O2' C A 7 -9.742 2.619 19.222 1.00 0.00 O ATOM 205 C1' C A 7 -7.921 3.054 17.763 1.00 0.00 C ATOM 206 N1 C A 7 -6.532 2.571 17.539 1.00 0.00 N ATOM 207 C2 C A 7 -6.356 1.218 17.259 1.00 0.00 C ATOM 208 O2 C A 7 -7.318 0.452 17.261 1.00 0.00 O ATOM 209 N3 C A 7 -5.097 0.773 16.982 1.00 0.00 N ATOM 210 C4 C A 7 -4.055 1.617 16.979 1.00 0.00 C ATOM 211 N4 C A 7 -2.839 1.140 16.690 1.00 0.00 N ATOM 212 C5 C A 7 -4.224 3.012 17.264 1.00 0.00 C ATOM 213 C6 C A 7 -5.476 3.434 17.534 1.00 0.00 C ATOM 0 H5' C A 7 -8.216 7.151 18.068 1.00 0.00 H new ATOM 0 H5'' C A 7 -8.295 6.965 19.809 1.00 0.00 H new ATOM 0 H4' C A 7 -9.557 5.242 18.703 1.00 0.00 H new ATOM 0 H3' C A 7 -7.013 4.310 20.164 1.00 0.00 H new ATOM 0 H2' C A 7 -7.861 2.008 19.703 1.00 0.00 H new ATOM 0 HO2' C A 7 -10.179 3.315 19.756 1.00 0.00 H new ATOM 0 H1' C A 7 -8.558 2.489 17.083 1.00 0.00 H new ATOM 0 H41 C A 7 -2.034 1.766 16.683 1.00 0.00 H new ATOM 0 H42 C A 7 -2.717 0.150 16.477 1.00 0.00 H new ATOM 0 H5 C A 7 -3.387 3.694 17.263 1.00 0.00 H new ATOM 0 H6 C A 7 -5.646 4.478 17.751 1.00 0.00 H new ATOM 225 P C A 8 -8.337 3.683 22.411 1.00 0.00 P ATOM 226 OP1 C A 8 -9.340 4.019 23.446 1.00 0.00 O ATOM 227 OP2 C A 8 -6.912 4.005 22.639 1.00 0.00 O ATOM 228 O5' C A 8 -8.446 2.106 22.101 1.00 0.00 O ATOM 229 C5' C A 8 -9.695 1.446 22.082 1.00 0.00 C ATOM 230 C4' C A 8 -9.475 -0.023 21.713 1.00 0.00 C ATOM 231 O4' C A 8 -8.871 -0.157 20.427 1.00 0.00 O ATOM 232 C3' C A 8 -8.517 -0.703 22.666 1.00 0.00 C ATOM 233 O3' C A 8 -9.134 -1.073 23.880 1.00 0.00 O ATOM 234 C2' C A 8 -8.123 -1.909 21.855 1.00 0.00 C ATOM 235 O2' C A 8 -9.125 -2.899 21.960 1.00 0.00 O ATOM 236 C1' C A 8 -8.093 -1.367 20.427 1.00 0.00 C ATOM 237 N1 C A 8 -6.683 -1.080 20.061 1.00 0.00 N ATOM 238 C2 C A 8 -5.923 -2.120 19.537 1.00 0.00 C ATOM 239 O2 C A 8 -6.434 -3.218 19.328 1.00 0.00 O ATOM 240 N3 C A 8 -4.606 -1.886 19.271 1.00 0.00 N ATOM 241 C4 C A 8 -4.056 -0.687 19.515 1.00 0.00 C ATOM 242 N4 C A 8 -2.762 -0.497 19.238 1.00 0.00 N ATOM 243 C5 C A 8 -4.826 0.385 20.070 1.00 0.00 C ATOM 244 C6 C A 8 -6.127 0.135 20.323 1.00 0.00 C ATOM 0 H5' C A 8 -10.361 1.920 21.361 1.00 0.00 H new ATOM 0 H5'' C A 8 -10.176 1.522 23.057 1.00 0.00 H new ATOM 0 H4' C A 8 -10.466 -0.475 21.746 1.00 0.00 H new ATOM 0 H3' C A 8 -7.686 -0.073 22.983 1.00 0.00 H new ATOM 0 H2' C A 8 -7.182 -2.359 22.173 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.532 -2.859 22.850 1.00 0.00 H new ATOM 0 HO3' C A 8 -8.477 -1.509 24.461 1.00 0.00 H new ATOM 0 H1' C A 8 -8.500 -2.078 19.707 1.00 0.00 H new ATOM 0 H41 C A 8 -2.330 0.409 19.418 1.00 0.00 H new ATOM 0 H42 C A 8 -2.207 -1.258 18.847 1.00 0.00 H new ATOM 0 H5 C A 8 -4.385 1.349 20.276 1.00 0.00 H new ATOM 0 H6 C A 8 -6.742 0.917 20.743 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.301 -9.037 17.140 1.00 0.00 O ATOM 259 C5' G B 9 2.671 -10.247 17.498 1.00 0.00 C ATOM 260 C4' G B 9 1.187 -10.000 17.778 1.00 0.00 C ATOM 261 O4' G B 9 1.006 -9.078 18.851 1.00 0.00 O ATOM 262 C3' G B 9 0.464 -9.373 16.602 1.00 0.00 C ATOM 263 O3' G B 9 0.159 -10.306 15.586 1.00 0.00 O ATOM 264 C2' G B 9 -0.779 -8.873 17.292 1.00 0.00 C ATOM 265 O2' G B 9 -1.656 -9.951 17.545 1.00 0.00 O ATOM 266 C1' G B 9 -0.232 -8.382 18.624 1.00 0.00 C ATOM 267 N9 G B 9 -0.002 -6.926 18.570 1.00 0.00 N ATOM 268 C8 G B 9 1.168 -6.234 18.386 1.00 0.00 C ATOM 269 N7 G B 9 1.026 -4.938 18.411 1.00 0.00 N ATOM 270 C5 G B 9 -0.338 -4.756 18.625 1.00 0.00 C ATOM 271 C6 G B 9 -1.095 -3.554 18.750 1.00 0.00 C ATOM 272 O6 G B 9 -0.697 -2.393 18.696 1.00 0.00 O ATOM 273 N1 G B 9 -2.445 -3.819 18.961 1.00 0.00 N ATOM 274 C2 G B 9 -3.000 -5.078 19.039 1.00 0.00 C ATOM 275 N2 G B 9 -4.321 -5.143 19.231 1.00 0.00 N ATOM 276 N3 G B 9 -2.293 -6.205 18.928 1.00 0.00 N ATOM 277 C4 G B 9 -0.973 -5.969 18.722 1.00 0.00 C ATOM 0 H5' G B 9 3.151 -10.669 18.381 1.00 0.00 H new ATOM 0 H5'' G B 9 2.782 -10.976 16.695 1.00 0.00 H new ATOM 0 H4' G B 9 0.785 -10.987 18.005 1.00 0.00 H new ATOM 0 H3' G B 9 1.041 -8.613 16.075 1.00 0.00 H new ATOM 0 H2' G B 9 -1.324 -8.126 16.715 1.00 0.00 H new ATOM 0 HO2' G B 9 -1.271 -10.777 17.185 1.00 0.00 H new ATOM 0 HO5' G B 9 4.251 -9.202 16.964 1.00 0.00 H new ATOM 0 H1' G B 9 -0.937 -8.575 19.433 1.00 0.00 H new ATOM 0 H8 G B 9 2.121 -6.719 18.234 1.00 0.00 H new ATOM 0 H1 G B 9 -3.071 -3.021 19.066 1.00 0.00 H new ATOM 0 H21 G B 9 -4.783 -6.050 19.296 1.00 0.00 H new ATOM 0 H22 G B 9 -4.867 -4.285 19.312 1.00 0.00 H new ATOM 290 P G B 10 -0.410 -9.808 14.158 1.00 0.00 P ATOM 291 OP1 G B 10 -0.597 -10.998 13.299 1.00 0.00 O ATOM 292 OP2 G B 10 0.449 -8.696 13.692 1.00 0.00 O ATOM 293 O5' G B 10 -1.869 -9.202 14.500 1.00 0.00 O ATOM 294 C5' G B 10 -2.968 -10.052 14.762 1.00 0.00 C ATOM 295 C4' G B 10 -4.249 -9.221 14.908 1.00 0.00 C ATOM 296 O4' G B 10 -4.207 -8.313 16.004 1.00 0.00 O ATOM 297 C3' G B 10 -4.517 -8.377 13.685 1.00 0.00 C ATOM 298 O3' G B 10 -5.066 -9.142 12.631 1.00 0.00 O ATOM 299 C2' G B 10 -5.496 -7.379 14.230 1.00 0.00 C ATOM 300 O2' G B 10 -6.773 -7.975 14.341 1.00 0.00 O ATOM 301 C1' G B 10 -4.945 -7.135 15.628 1.00 0.00 C ATOM 302 N9 G B 10 -4.031 -5.985 15.662 1.00 0.00 N ATOM 303 C8 G B 10 -2.667 -5.993 15.636 1.00 0.00 C ATOM 304 N7 G B 10 -2.125 -4.813 15.774 1.00 0.00 N ATOM 305 C5 G B 10 -3.219 -3.960 15.918 1.00 0.00 C ATOM 306 C6 G B 10 -3.263 -2.549 16.142 1.00 0.00 C ATOM 307 O6 G B 10 -2.326 -1.758 16.221 1.00 0.00 O ATOM 308 N1 G B 10 -4.570 -2.094 16.286 1.00 0.00 N ATOM 309 C2 G B 10 -5.695 -2.887 16.218 1.00 0.00 C ATOM 310 N2 G B 10 -6.873 -2.273 16.375 1.00 0.00 N ATOM 311 N3 G B 10 -5.659 -4.207 16.004 1.00 0.00 N ATOM 312 C4 G B 10 -4.391 -4.675 15.866 1.00 0.00 C ATOM 0 H5' G B 10 -2.788 -10.622 15.673 1.00 0.00 H new ATOM 0 H5'' G B 10 -3.082 -10.773 13.952 1.00 0.00 H new ATOM 0 H4' G B 10 -5.030 -9.965 15.062 1.00 0.00 H new ATOM 0 H3' G B 10 -3.627 -7.928 13.244 1.00 0.00 H new ATOM 0 H2' G B 10 -5.603 -6.484 13.618 1.00 0.00 H new ATOM 0 HO2' G B 10 -7.187 -8.028 13.454 1.00 0.00 H new ATOM 0 H1' G B 10 -5.772 -6.926 16.307 1.00 0.00 H new ATOM 0 H8 G B 10 -2.087 -6.895 15.512 1.00 0.00 H new ATOM 0 H1 G B 10 -4.706 -1.097 16.455 1.00 0.00 H new ATOM 0 H21 G B 10 -7.738 -2.812 16.334 1.00 0.00 H new ATOM 0 H22 G B 10 -6.906 -1.266 16.536 1.00 0.00 H new ATOM 324 P A B 11 -5.350 -8.475 11.201 1.00 0.00 P ATOM 325 OP1 A B 11 -5.875 -9.518 10.293 1.00 0.00 O ATOM 326 OP2 A B 11 -4.154 -7.693 10.814 1.00 0.00 O ATOM 327 O5' A B 11 -6.542 -7.447 11.532 1.00 0.00 O ATOM 328 C5' A B 11 -6.675 -6.258 10.799 1.00 0.00 C ATOM 329 C4' A B 11 -7.842 -5.424 11.331 1.00 0.00 C ATOM 330 O4' A B 11 -7.651 -5.031 12.695 1.00 0.00 O ATOM 331 C3' A B 11 -7.939 -4.155 10.513 1.00 0.00 C ATOM 332 O3' A B 11 -8.800 -4.331 9.404 1.00 0.00 O ATOM 333 C2' A B 11 -8.490 -3.160 11.500 1.00 0.00 C ATOM 334 O2' A B 11 -9.881 -3.350 11.646 1.00 0.00 O ATOM 335 C1' A B 11 -7.814 -3.611 12.797 1.00 0.00 C ATOM 336 N9 A B 11 -6.480 -3.013 12.944 1.00 0.00 N ATOM 337 C8 A B 11 -5.267 -3.642 12.907 1.00 0.00 C ATOM 338 N7 A B 11 -4.251 -2.850 13.105 1.00 0.00 N ATOM 339 C5 A B 11 -4.840 -1.607 13.320 1.00 0.00 C ATOM 340 C6 A B 11 -4.308 -0.343 13.628 1.00 0.00 C ATOM 341 N6 A B 11 -2.995 -0.110 13.735 1.00 0.00 N ATOM 342 N1 A B 11 -5.174 0.665 13.844 1.00 0.00 N ATOM 343 C2 A B 11 -6.480 0.427 13.749 1.00 0.00 C ATOM 344 N3 A B 11 -7.102 -0.709 13.454 1.00 0.00 N ATOM 345 C4 A B 11 -6.203 -1.702 13.249 1.00 0.00 C ATOM 0 H5' A B 11 -6.837 -6.490 9.746 1.00 0.00 H new ATOM 0 H5'' A B 11 -5.752 -5.682 10.860 1.00 0.00 H new ATOM 0 H4' A B 11 -8.740 -6.037 11.262 1.00 0.00 H new ATOM 0 H3' A B 11 -6.989 -3.839 10.083 1.00 0.00 H new ATOM 0 H2' A B 11 -8.320 -2.121 11.218 1.00 0.00 H new ATOM 0 HO2' A B 11 -10.213 -3.911 10.914 1.00 0.00 H new ATOM 0 H1' A B 11 -8.420 -3.309 13.652 1.00 0.00 H new ATOM 0 H8 A B 11 -5.160 -4.702 12.729 1.00 0.00 H new ATOM 0 H61 A B 11 -2.660 0.827 13.961 1.00 0.00 H new ATOM 0 H62 A B 11 -2.329 -0.869 13.591 1.00 0.00 H new ATOM 0 H2 A B 11 -7.123 1.274 13.938 1.00 0.00 H new ATOM 357 P G B 12 -8.695 -3.377 8.118 1.00 0.00 P ATOM 358 OP1 G B 12 -9.849 -3.660 7.236 1.00 0.00 O ATOM 359 OP2 G B 12 -7.319 -3.484 7.585 1.00 0.00 O ATOM 360 O5' G B 12 -8.876 -1.905 8.727 1.00 0.00 O ATOM 361 C5' G B 12 -10.140 -1.421 9.135 1.00 0.00 C ATOM 362 C4' G B 12 -9.973 0.011 9.582 1.00 0.00 C ATOM 363 O4' G B 12 -9.126 0.087 10.715 1.00 0.00 O ATOM 364 C3' G B 12 -9.293 0.829 8.536 1.00 0.00 C ATOM 365 O3' G B 12 -10.167 1.172 7.475 1.00 0.00 O ATOM 366 C2' G B 12 -8.924 2.017 9.374 1.00 0.00 C ATOM 367 O2' G B 12 -10.071 2.801 9.648 1.00 0.00 O ATOM 368 C1' G B 12 -8.471 1.348 10.660 1.00 0.00 C ATOM 369 N9 G B 12 -7.003 1.176 10.673 1.00 0.00 N ATOM 370 C8 G B 12 -6.260 0.034 10.511 1.00 0.00 C ATOM 371 N7 G B 12 -4.972 0.219 10.626 1.00 0.00 N ATOM 372 C5 G B 12 -4.851 1.584 10.875 1.00 0.00 C ATOM 373 C6 G B 12 -3.686 2.385 11.087 1.00 0.00 C ATOM 374 O6 G B 12 -2.505 2.038 11.111 1.00 0.00 O ATOM 375 N1 G B 12 -4.018 3.718 11.279 1.00 0.00 N ATOM 376 C2 G B 12 -5.295 4.228 11.284 1.00 0.00 C ATOM 377 N2 G B 12 -5.413 5.545 11.487 1.00 0.00 N ATOM 378 N3 G B 12 -6.387 3.485 11.100 1.00 0.00 N ATOM 379 C4 G B 12 -6.092 2.176 10.898 1.00 0.00 C ATOM 0 H5' G B 12 -10.536 -2.030 9.948 1.00 0.00 H new ATOM 0 H5'' G B 12 -10.854 -1.482 8.314 1.00 0.00 H new ATOM 0 H4' G B 12 -10.977 0.380 9.792 1.00 0.00 H new ATOM 0 H3' G B 12 -8.464 0.342 8.023 1.00 0.00 H new ATOM 0 H2' G B 12 -8.190 2.674 8.908 1.00 0.00 H new ATOM 0 HO2' G B 12 -10.733 2.672 8.937 1.00 0.00 H new ATOM 0 H1' G B 12 -8.725 1.958 11.527 1.00 0.00 H new ATOM 0 H8 G B 12 -6.700 -0.931 10.307 1.00 0.00 H new ATOM 0 H1 G B 12 -3.252 4.374 11.429 1.00 0.00 H new ATOM 0 H21 G B 12 -6.336 5.978 11.501 1.00 0.00 H new ATOM 0 H22 G B 12 -4.580 6.116 11.628 1.00 0.00 H new ATOM 391 P U B 13 -9.594 1.678 6.056 1.00 0.00 P ATOM 392 OP1 U B 13 -10.731 2.178 5.251 1.00 0.00 O ATOM 393 OP2 U B 13 -8.724 0.613 5.512 1.00 0.00 O ATOM 394 O5' U B 13 -8.662 2.929 6.441 1.00 0.00 O ATOM 395 C5' U B 13 -9.211 4.169 6.833 1.00 0.00 C ATOM 396 C4' U B 13 -8.064 5.129 7.160 1.00 0.00 C ATOM 397 O4' U B 13 -7.257 4.637 8.227 1.00 0.00 O ATOM 398 C3' U B 13 -7.135 5.293 5.970 1.00 0.00 C ATOM 399 O3' U B 13 -7.595 6.280 5.056 1.00 0.00 O ATOM 400 C2' U B 13 -5.855 5.695 6.626 1.00 0.00 C ATOM 401 O2' U B 13 -5.867 7.082 6.894 1.00 0.00 O ATOM 402 C1' U B 13 -5.886 4.939 7.938 1.00 0.00 C ATOM 403 N1 U B 13 -5.090 3.693 7.872 1.00 0.00 N ATOM 404 C2 U B 13 -3.726 3.799 8.093 1.00 0.00 C ATOM 405 O2 U B 13 -3.184 4.882 8.294 1.00 0.00 O ATOM 406 N3 U B 13 -3.006 2.613 8.081 1.00 0.00 N ATOM 407 C4 U B 13 -3.543 1.343 7.912 1.00 0.00 C ATOM 408 O4 U B 13 -2.819 0.351 7.915 1.00 0.00 O ATOM 409 C5 U B 13 -4.985 1.331 7.751 1.00 0.00 C ATOM 410 C6 U B 13 -5.690 2.475 7.732 1.00 0.00 C ATOM 0 H5' U B 13 -9.856 4.040 7.702 1.00 0.00 H new ATOM 0 H5'' U B 13 -9.831 4.578 6.035 1.00 0.00 H new ATOM 0 H4' U B 13 -8.533 6.075 7.432 1.00 0.00 H new ATOM 0 H3' U B 13 -7.053 4.393 5.360 1.00 0.00 H new ATOM 0 H2' U B 13 -4.977 5.484 6.015 1.00 0.00 H new ATOM 0 HO2' U B 13 -6.696 7.475 6.549 1.00 0.00 H new ATOM 0 H1' U B 13 -5.445 5.552 8.724 1.00 0.00 H new ATOM 0 H3 U B 13 -1.996 2.679 8.207 1.00 0.00 H new ATOM 0 H5 U B 13 -5.500 0.388 7.645 1.00 0.00 H new ATOM 0 H6 U B 13 -6.761 2.429 7.602 1.00 0.00 H new ATOM 421 P U B 14 -6.868 6.498 3.622 1.00 0.00 P ATOM 422 OP1 U B 14 -7.730 7.381 2.805 1.00 0.00 O ATOM 423 OP2 U B 14 -6.488 5.166 3.104 1.00 0.00 O ATOM 424 O5' U B 14 -5.503 7.310 3.959 1.00 0.00 O ATOM 425 C5' U B 14 -5.512 8.714 4.175 1.00 0.00 C ATOM 426 C4' U B 14 -4.065 9.236 4.289 1.00 0.00 C ATOM 427 O4' U B 14 -3.403 8.713 5.434 1.00 0.00 O ATOM 428 C3' U B 14 -3.212 8.834 3.098 1.00 0.00 C ATOM 429 O3' U B 14 -3.399 9.672 1.974 1.00 0.00 O ATOM 430 C2' U B 14 -1.840 9.013 3.684 1.00 0.00 C ATOM 431 O2' U B 14 -1.517 10.386 3.749 1.00 0.00 O ATOM 432 C1' U B 14 -2.025 8.500 5.091 1.00 0.00 C ATOM 433 N1 U B 14 -1.710 7.059 5.175 1.00 0.00 N ATOM 434 C2 U B 14 -0.379 6.677 5.271 1.00 0.00 C ATOM 435 O2 U B 14 0.544 7.485 5.201 1.00 0.00 O ATOM 436 N3 U B 14 -0.149 5.322 5.459 1.00 0.00 N ATOM 437 C4 U B 14 -1.122 4.339 5.575 1.00 0.00 C ATOM 438 O4 U B 14 -0.810 3.164 5.744 1.00 0.00 O ATOM 439 C5 U B 14 -2.474 4.839 5.481 1.00 0.00 C ATOM 440 C6 U B 14 -2.711 6.151 5.282 1.00 0.00 C ATOM 0 H5' U B 14 -6.065 8.947 5.085 1.00 0.00 H new ATOM 0 H5'' U B 14 -6.025 9.214 3.353 1.00 0.00 H new ATOM 0 H4' U B 14 -4.164 10.320 4.348 1.00 0.00 H new ATOM 0 H3' U B 14 -3.435 7.840 2.712 1.00 0.00 H new ATOM 0 H2' U B 14 -1.057 8.515 3.113 1.00 0.00 H new ATOM 0 HO2' U B 14 -2.164 10.900 3.222 1.00 0.00 H new ATOM 0 H1' U B 14 -1.356 9.023 5.774 1.00 0.00 H new ATOM 0 H3 U B 14 0.824 5.021 5.517 1.00 0.00 H new ATOM 0 H5 U B 14 -3.304 4.154 5.571 1.00 0.00 H new ATOM 0 H6 U B 14 -3.733 6.490 5.205 1.00 0.00 H new ATOM 451 P C B 15 -2.792 9.264 0.531 1.00 0.00 P ATOM 452 OP1 C B 15 -3.056 10.376 -0.409 1.00 0.00 O ATOM 453 OP2 C B 15 -3.273 7.903 0.208 1.00 0.00 O ATOM 454 O5' C B 15 -1.194 9.181 0.774 1.00 0.00 O ATOM 455 C5' C B 15 -0.397 10.348 0.843 1.00 0.00 C ATOM 456 C4' C B 15 1.079 9.957 1.011 1.00 0.00 C ATOM 457 O4' C B 15 1.313 9.207 2.210 1.00 0.00 O ATOM 458 C3' C B 15 1.556 9.065 -0.116 1.00 0.00 C ATOM 459 O3' C B 15 1.844 9.794 -1.296 1.00 0.00 O ATOM 460 C2' C B 15 2.803 8.495 0.510 1.00 0.00 C ATOM 461 O2' C B 15 3.834 9.460 0.489 1.00 0.00 O ATOM 462 C1' C B 15 2.385 8.274 1.951 1.00 0.00 C ATOM 463 N1 C B 15 1.927 6.876 2.172 1.00 0.00 N ATOM 464 C2 C B 15 2.898 5.912 2.437 1.00 0.00 C ATOM 465 O2 C B 15 4.090 6.211 2.425 1.00 0.00 O ATOM 466 N3 C B 15 2.489 4.640 2.712 1.00 0.00 N ATOM 467 C4 C B 15 1.186 4.325 2.727 1.00 0.00 C ATOM 468 N4 C B 15 0.829 3.068 3.013 1.00 0.00 N ATOM 469 C5 C B 15 0.178 5.309 2.459 1.00 0.00 C ATOM 470 C6 C B 15 0.600 6.561 2.191 1.00 0.00 C ATOM 0 H5' C B 15 -0.716 10.969 1.680 1.00 0.00 H new ATOM 0 H5'' C B 15 -0.525 10.942 -0.062 1.00 0.00 H new ATOM 0 H4' C B 15 1.613 10.907 1.030 1.00 0.00 H new ATOM 0 H3' C B 15 0.827 8.326 -0.449 1.00 0.00 H new ATOM 0 H2' C B 15 3.167 7.602 0.003 1.00 0.00 H new ATOM 0 HO2' C B 15 3.540 10.241 -0.024 1.00 0.00 H new ATOM 0 H1' C B 15 3.225 8.435 2.626 1.00 0.00 H new ATOM 0 H41 C B 15 -0.157 2.809 3.029 1.00 0.00 H new ATOM 0 H42 C B 15 1.543 2.368 3.215 1.00 0.00 H new ATOM 0 H5 C B 15 -0.872 5.058 2.471 1.00 0.00 H new ATOM 0 H6 C B 15 -0.129 7.332 1.987 1.00 0.00 H new ATOM 482 P C B 16 2.106 9.029 -2.694 1.00 0.00 P ATOM 483 OP1 C B 16 2.452 10.042 -3.717 1.00 0.00 O ATOM 484 OP2 C B 16 0.974 8.107 -2.928 1.00 0.00 O ATOM 485 O5' C B 16 3.418 8.141 -2.406 1.00 0.00 O ATOM 486 C5' C B 16 4.707 8.719 -2.390 1.00 0.00 C ATOM 487 C4' C B 16 5.733 7.637 -2.045 1.00 0.00 C ATOM 488 O4' C B 16 5.480 7.066 -0.763 1.00 0.00 O ATOM 489 C3' C B 16 5.667 6.473 -3.008 1.00 0.00 C ATOM 490 O3' C B 16 6.323 6.744 -4.229 1.00 0.00 O ATOM 491 C2' C B 16 6.386 5.412 -2.217 1.00 0.00 C ATOM 492 O2' C B 16 7.781 5.591 -2.343 1.00 0.00 O ATOM 493 C1' C B 16 5.964 5.712 -0.779 1.00 0.00 C ATOM 494 N1 C B 16 4.885 4.767 -0.397 1.00 0.00 N ATOM 495 C2 C B 16 5.257 3.528 0.109 1.00 0.00 C ATOM 496 O2 C B 16 6.443 3.262 0.292 1.00 0.00 O ATOM 497 N3 C B 16 4.275 2.622 0.385 1.00 0.00 N ATOM 498 C4 C B 16 2.985 2.919 0.170 1.00 0.00 C ATOM 499 N4 C B 16 2.052 2.005 0.456 1.00 0.00 N ATOM 500 C5 C B 16 2.592 4.188 -0.365 1.00 0.00 C ATOM 501 C6 C B 16 3.578 5.070 -0.629 1.00 0.00 C ATOM 0 H5' C B 16 4.749 9.525 -1.658 1.00 0.00 H new ATOM 0 H5'' C B 16 4.935 9.158 -3.361 1.00 0.00 H new ATOM 0 H4' C B 16 6.700 8.139 -2.085 1.00 0.00 H new ATOM 0 H3' C B 16 4.655 6.209 -3.314 1.00 0.00 H new ATOM 0 H2' C B 16 6.154 4.397 -2.540 1.00 0.00 H new ATOM 0 HO2' C B 16 7.992 5.884 -3.254 1.00 0.00 H new ATOM 0 HO3' C B 16 6.255 5.963 -4.817 1.00 0.00 H new ATOM 0 H1' C B 16 6.788 5.598 -0.075 1.00 0.00 H new ATOM 0 H41 C B 16 1.067 2.216 0.298 1.00 0.00 H new ATOM 0 H42 C B 16 2.326 1.097 0.832 1.00 0.00 H new ATOM 0 H5 C B 16 1.555 4.428 -0.548 1.00 0.00 H new ATOM 0 H6 C B 16 3.325 6.039 -1.034 1.00 0.00 H new TER 514 C B 16