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= -0.195 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot 180:sc= -0.374 USER MOD Single : A 3 A O2' : rot -31:sc= 0.147 USER MOD Single : A 4 U O2' : rot 180:sc= -0.264 USER MOD Single : A 5 G O2' : rot -8:sc= 0.11 USER MOD Single : A 6 U O2' : rot -15:sc= -0.415 USER MOD Single : A 7 C O2' : rot 180:sc= -0.291 USER MOD Single : A 8 C O2' : rot -22:sc= 0.107 USER MOD Single : A 8 C O3' : rot 180:sc= 0.152 USER MOD Single : B 9 G O2' : rot 180:sc= -0.187 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 G O2' : rot 180:sc= -0.369 USER MOD Single : B 11 A O2' : rot -23:sc= 0.15 USER MOD Single : B 12 U O2' : rot 180:sc= -0.234 USER MOD Single : B 13 G O2' : rot -8:sc= 0.121 USER MOD Single : B 14 U O2' : rot -15:sc= -0.427 USER MOD Single : B 15 C O2' : rot 180:sc= -0.272 USER MOD Single : B 16 C O2' : rot -29:sc= 0.142 USER MOD Single : B 16 C O3' : rot 180:sc= 0.173 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 5.310 -8.129 5.672 1.00 0.00 O ATOM 2 C5' G A 1 6.667 -8.511 5.750 1.00 0.00 C ATOM 3 C4' G A 1 7.569 -7.364 5.280 1.00 0.00 C ATOM 4 O4' G A 1 7.324 -7.034 3.914 1.00 0.00 O ATOM 5 C3' G A 1 7.337 -6.077 6.044 1.00 0.00 C ATOM 6 O3' G A 1 7.912 -6.098 7.337 1.00 0.00 O ATOM 7 C2' G A 1 8.029 -5.108 5.117 1.00 0.00 C ATOM 8 O2' G A 1 9.429 -5.249 5.232 1.00 0.00 O ATOM 9 C1' G A 1 7.590 -5.632 3.748 1.00 0.00 C ATOM 10 N9 G A 1 6.354 -4.934 3.333 1.00 0.00 N ATOM 11 C8 G A 1 5.061 -5.393 3.337 1.00 0.00 C ATOM 12 N7 G A 1 4.187 -4.517 2.927 1.00 0.00 N ATOM 13 C5 G A 1 4.952 -3.394 2.629 1.00 0.00 C ATOM 14 C6 G A 1 4.550 -2.115 2.141 1.00 0.00 C ATOM 15 O6 G A 1 3.417 -1.722 1.876 1.00 0.00 O ATOM 16 N1 G A 1 5.638 -1.266 1.972 1.00 0.00 N ATOM 17 C2 G A 1 6.950 -1.598 2.239 1.00 0.00 C ATOM 18 N2 G A 1 7.867 -0.650 2.021 1.00 0.00 N ATOM 19 N3 G A 1 7.330 -2.795 2.700 1.00 0.00 N ATOM 20 C4 G A 1 6.282 -3.641 2.871 1.00 0.00 C ATOM 0 H5' G A 1 6.839 -9.394 5.135 1.00 0.00 H new ATOM 0 H5'' G A 1 6.917 -8.783 6.775 1.00 0.00 H new ATOM 0 H4' G A 1 8.582 -7.733 5.443 1.00 0.00 H new ATOM 0 H3' G A 1 6.292 -5.849 6.255 1.00 0.00 H new ATOM 0 H2' G A 1 7.791 -4.062 5.309 1.00 0.00 H new ATOM 0 HO2' G A 1 9.872 -4.618 4.627 1.00 0.00 H new ATOM 0 HO5' G A 1 4.744 -8.870 5.973 1.00 0.00 H new ATOM 0 H1' G A 1 8.354 -5.464 2.989 1.00 0.00 H new ATOM 0 H8 G A 1 4.792 -6.390 3.652 1.00 0.00 H new ATOM 0 H1 G A 1 5.452 -0.326 1.624 1.00 0.00 H new ATOM 0 H21 G A 1 8.852 -0.842 2.202 1.00 0.00 H new ATOM 0 H22 G A 1 7.581 0.266 1.674 1.00 0.00 H new ATOM 33 P G A 2 7.531 -4.968 8.430 1.00 0.00 P ATOM 34 OP1 G A 2 8.258 -5.276 9.681 1.00 0.00 O ATOM 35 OP2 G A 2 6.057 -4.840 8.452 1.00 0.00 O ATOM 36 O5' G A 2 8.141 -3.609 7.816 1.00 0.00 O ATOM 37 C5' G A 2 9.532 -3.369 7.830 1.00 0.00 C ATOM 38 C4' G A 2 9.829 -2.029 7.153 1.00 0.00 C ATOM 39 O4' G A 2 9.320 -1.996 5.816 1.00 0.00 O ATOM 40 C3' G A 2 9.179 -0.852 7.856 1.00 0.00 C ATOM 41 O3' G A 2 9.874 -0.453 9.023 1.00 0.00 O ATOM 42 C2' G A 2 9.268 0.180 6.756 1.00 0.00 C ATOM 43 O2' G A 2 10.600 0.630 6.610 1.00 0.00 O ATOM 44 C1' G A 2 8.891 -0.652 5.537 1.00 0.00 C ATOM 45 N9 G A 2 7.420 -0.613 5.364 1.00 0.00 N ATOM 46 C8 G A 2 6.486 -1.570 5.675 1.00 0.00 C ATOM 47 N7 G A 2 5.259 -1.220 5.412 1.00 0.00 N ATOM 48 C5 G A 2 5.380 0.065 4.896 1.00 0.00 C ATOM 49 C6 G A 2 4.373 0.964 4.440 1.00 0.00 C ATOM 50 O6 G A 2 3.159 0.785 4.391 1.00 0.00 O ATOM 51 N1 G A 2 4.917 2.170 4.015 1.00 0.00 N ATOM 52 C2 G A 2 6.261 2.476 4.019 1.00 0.00 C ATOM 53 N2 G A 2 6.602 3.690 3.575 1.00 0.00 N ATOM 54 N3 G A 2 7.210 1.632 4.441 1.00 0.00 N ATOM 55 C4 G A 2 6.699 0.449 4.866 1.00 0.00 C ATOM 0 H5' G A 2 10.055 -4.173 7.312 1.00 0.00 H new ATOM 0 H5'' G A 2 9.899 -3.359 8.856 1.00 0.00 H new ATOM 0 H4' G A 2 10.915 -1.944 7.185 1.00 0.00 H new ATOM 0 H3' G A 2 8.175 -1.046 8.233 1.00 0.00 H new ATOM 0 H2' G A 2 8.652 1.063 6.926 1.00 0.00 H new ATOM 0 HO2' G A 2 10.643 1.297 5.893 1.00 0.00 H new ATOM 0 H1' G A 2 9.355 -0.276 4.625 1.00 0.00 H new ATOM 0 H8 G A 2 6.746 -2.528 6.100 1.00 0.00 H new ATOM 0 H1 G A 2 4.273 2.883 3.674 1.00 0.00 H new ATOM 0 H21 G A 2 7.583 3.969 3.556 1.00 0.00 H new ATOM 0 H22 G A 2 5.881 4.337 3.255 1.00 0.00 H new ATOM 67 P A A 3 9.167 0.500 10.129 1.00 0.00 P ATOM 68 OP1 A A 3 10.152 0.762 11.202 1.00 0.00 O ATOM 69 OP2 A A 3 7.856 -0.094 10.469 1.00 0.00 O ATOM 70 O5' A A 3 8.898 1.887 9.349 1.00 0.00 O ATOM 71 C5' A A 3 9.966 2.738 8.997 1.00 0.00 C ATOM 72 C4' A A 3 9.434 3.955 8.234 1.00 0.00 C ATOM 73 O4' A A 3 8.692 3.558 7.078 1.00 0.00 O ATOM 74 C3' A A 3 8.480 4.814 9.040 1.00 0.00 C ATOM 75 O3' A A 3 9.156 5.682 9.928 1.00 0.00 O ATOM 76 C2' A A 3 7.782 5.580 7.949 1.00 0.00 C ATOM 77 O2' A A 3 8.622 6.613 7.473 1.00 0.00 O ATOM 78 C1' A A 3 7.634 4.513 6.871 1.00 0.00 C ATOM 79 N9 A A 3 6.315 3.847 7.000 1.00 0.00 N ATOM 80 C8 A A 3 6.023 2.570 7.410 1.00 0.00 C ATOM 81 N7 A A 3 4.755 2.272 7.355 1.00 0.00 N ATOM 82 C5 A A 3 4.159 3.439 6.892 1.00 0.00 C ATOM 83 C6 A A 3 2.822 3.783 6.623 1.00 0.00 C ATOM 84 N6 A A 3 1.800 2.932 6.774 1.00 0.00 N ATOM 85 N1 A A 3 2.573 5.038 6.206 1.00 0.00 N ATOM 86 C2 A A 3 3.590 5.883 6.056 1.00 0.00 C ATOM 87 N3 A A 3 4.884 5.676 6.260 1.00 0.00 N ATOM 88 C4 A A 3 5.101 4.410 6.687 1.00 0.00 C ATOM 0 H5' A A 3 10.685 2.198 8.381 1.00 0.00 H new ATOM 0 H5'' A A 3 10.494 3.062 9.893 1.00 0.00 H new ATOM 0 H4' A A 3 10.332 4.521 7.986 1.00 0.00 H new ATOM 0 H3' A A 3 7.817 4.241 9.688 1.00 0.00 H new ATOM 0 H2' A A 3 6.847 6.046 8.259 1.00 0.00 H new ATOM 0 HO2' A A 3 9.198 6.928 8.201 1.00 0.00 H new ATOM 0 H1' A A 3 7.695 4.951 5.875 1.00 0.00 H new ATOM 0 H8 A A 3 6.777 1.874 7.748 1.00 0.00 H new ATOM 0 H61 A A 3 0.849 3.235 6.564 1.00 0.00 H new ATOM 0 H62 A A 3 1.972 1.981 7.099 1.00 0.00 H new ATOM 0 H2 A A 3 3.325 6.875 5.722 1.00 0.00 H new ATOM 100 P U A 4 8.787 5.705 11.489 1.00 0.00 P ATOM 101 OP1 U A 4 9.762 6.568 12.191 1.00 0.00 O ATOM 102 OP2 U A 4 8.563 4.315 11.942 1.00 0.00 O ATOM 103 O5' U A 4 7.371 6.466 11.442 1.00 0.00 O ATOM 104 C5' U A 4 7.310 7.839 11.105 1.00 0.00 C ATOM 105 C4' U A 4 5.862 8.249 10.841 1.00 0.00 C ATOM 106 O4' U A 4 5.331 7.545 9.721 1.00 0.00 O ATOM 107 C3' U A 4 4.935 7.925 11.993 1.00 0.00 C ATOM 108 O3' U A 4 5.046 8.863 13.048 1.00 0.00 O ATOM 109 C2' U A 4 3.601 8.006 11.289 1.00 0.00 C ATOM 110 O2' U A 4 3.245 9.359 11.103 1.00 0.00 O ATOM 111 C1' U A 4 3.919 7.397 9.921 1.00 0.00 C ATOM 112 N1 U A 4 3.542 5.963 9.899 1.00 0.00 N ATOM 113 C2 U A 4 2.208 5.669 9.671 1.00 0.00 C ATOM 114 O2 U A 4 1.372 6.551 9.490 1.00 0.00 O ATOM 115 N3 U A 4 1.865 4.326 9.655 1.00 0.00 N ATOM 116 C4 U A 4 2.735 3.265 9.856 1.00 0.00 C ATOM 117 O4 U A 4 2.324 2.108 9.834 1.00 0.00 O ATOM 118 C5 U A 4 4.111 3.662 10.075 1.00 0.00 C ATOM 119 C6 U A 4 4.468 4.968 10.086 1.00 0.00 C ATOM 0 H5' U A 4 7.918 8.032 10.221 1.00 0.00 H new ATOM 0 H5'' U A 4 7.725 8.439 11.915 1.00 0.00 H new ATOM 0 H4' U A 4 5.903 9.326 10.678 1.00 0.00 H new ATOM 0 H3' U A 4 5.132 6.973 12.486 1.00 0.00 H new ATOM 0 H2' U A 4 2.791 7.516 11.829 1.00 0.00 H new ATOM 0 HO2' U A 4 2.380 9.410 10.645 1.00 0.00 H new ATOM 0 H1' U A 4 3.359 7.896 9.130 1.00 0.00 H new ATOM 0 H3 U A 4 0.886 4.098 9.480 1.00 0.00 H new ATOM 0 H5 U A 4 4.864 2.904 10.232 1.00 0.00 H new ATOM 0 H6 U A 4 5.503 5.232 10.245 1.00 0.00 H new ATOM 130 P G A 5 4.289 8.621 14.452 1.00 0.00 P ATOM 131 OP1 G A 5 4.689 9.699 15.383 1.00 0.00 O ATOM 132 OP2 G A 5 4.485 7.207 14.838 1.00 0.00 O ATOM 133 O5' G A 5 2.734 8.828 14.084 1.00 0.00 O ATOM 134 C5' G A 5 2.199 10.122 13.883 1.00 0.00 C ATOM 135 C4' G A 5 0.710 10.003 13.547 1.00 0.00 C ATOM 136 O4' G A 5 0.507 9.229 12.370 1.00 0.00 O ATOM 137 C3' G A 5 -0.052 9.267 14.628 1.00 0.00 C ATOM 138 O3' G A 5 -0.333 10.089 15.750 1.00 0.00 O ATOM 139 C2' G A 5 -1.304 8.893 13.874 1.00 0.00 C ATOM 140 O2' G A 5 -2.208 9.977 13.874 1.00 0.00 O ATOM 141 C1' G A 5 -0.807 8.663 12.453 1.00 0.00 C ATOM 142 N9 G A 5 -0.776 7.216 12.178 1.00 0.00 N ATOM 143 C8 G A 5 0.273 6.346 12.268 1.00 0.00 C ATOM 144 N7 G A 5 -0.034 5.109 11.982 1.00 0.00 N ATOM 145 C5 G A 5 -1.393 5.164 11.687 1.00 0.00 C ATOM 146 C6 G A 5 -2.299 4.125 11.310 1.00 0.00 C ATOM 147 O6 G A 5 -2.072 2.929 11.140 1.00 0.00 O ATOM 148 N1 G A 5 -3.583 4.613 11.133 1.00 0.00 N ATOM 149 C2 G A 5 -3.964 5.926 11.281 1.00 0.00 C ATOM 150 N2 G A 5 -5.253 6.202 11.057 1.00 0.00 N ATOM 151 N3 G A 5 -3.123 6.905 11.626 1.00 0.00 N ATOM 152 C4 G A 5 -1.856 6.452 11.813 1.00 0.00 C ATOM 0 H5' G A 5 2.728 10.626 13.074 1.00 0.00 H new ATOM 0 H5'' G A 5 2.335 10.728 14.779 1.00 0.00 H new ATOM 0 H4' G A 5 0.359 11.028 13.432 1.00 0.00 H new ATOM 0 H3' G A 5 0.488 8.426 15.063 1.00 0.00 H new ATOM 0 H2' G A 5 -1.817 8.033 14.305 1.00 0.00 H new ATOM 0 HO2' G A 5 -1.876 10.680 14.470 1.00 0.00 H new ATOM 0 H1' G A 5 -1.461 9.130 11.717 1.00 0.00 H new ATOM 0 H8 G A 5 1.269 6.654 12.551 1.00 0.00 H new ATOM 0 H1 G A 5 -4.306 3.943 10.871 1.00 0.00 H new ATOM 0 H21 G A 5 -5.594 7.159 11.152 1.00 0.00 H new ATOM 0 H22 G A 5 -5.896 5.456 10.792 1.00 0.00 H new ATOM 164 P U A 6 -0.844 9.446 17.145 1.00 0.00 P ATOM 165 OP1 U A 6 -0.985 10.542 18.129 1.00 0.00 O ATOM 166 OP2 U A 6 0.029 8.293 17.456 1.00 0.00 O ATOM 167 O5' U A 6 -2.322 8.875 16.821 1.00 0.00 O ATOM 168 C5' U A 6 -3.455 9.722 16.816 1.00 0.00 C ATOM 169 C4' U A 6 -4.728 8.890 16.581 1.00 0.00 C ATOM 170 O4' U A 6 -4.723 8.264 15.291 1.00 0.00 O ATOM 171 C3' U A 6 -4.872 7.747 17.572 1.00 0.00 C ATOM 172 O3' U A 6 -5.359 8.151 18.837 1.00 0.00 O ATOM 173 C2' U A 6 -5.884 6.906 16.844 1.00 0.00 C ATOM 174 O2' U A 6 -7.156 7.514 16.924 1.00 0.00 O ATOM 175 C1' U A 6 -5.399 6.995 15.410 1.00 0.00 C ATOM 176 N1 U A 6 -4.461 5.887 15.101 1.00 0.00 N ATOM 177 C2 U A 6 -4.994 4.724 14.561 1.00 0.00 C ATOM 178 O2 U A 6 -6.202 4.571 14.393 1.00 0.00 O ATOM 179 N3 U A 6 -4.085 3.738 14.219 1.00 0.00 N ATOM 180 C4 U A 6 -2.710 3.810 14.365 1.00 0.00 C ATOM 181 O4 U A 6 -1.997 2.863 14.044 1.00 0.00 O ATOM 182 C5 U A 6 -2.242 5.063 14.915 1.00 0.00 C ATOM 183 C6 U A 6 -3.112 6.036 15.265 1.00 0.00 C ATOM 0 H5' U A 6 -3.353 10.476 16.035 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.527 10.253 17.765 1.00 0.00 H new ATOM 0 H4' U A 6 -5.542 9.607 16.686 1.00 0.00 H new ATOM 0 H3' U A 6 -3.930 7.258 17.819 1.00 0.00 H new ATOM 0 H2' U A 6 -5.973 5.893 17.235 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.148 8.197 17.627 1.00 0.00 H new ATOM 0 H1' U A 6 -6.232 6.916 14.711 1.00 0.00 H new ATOM 0 H3 U A 6 -4.463 2.878 13.822 1.00 0.00 H new ATOM 0 H5 U A 6 -1.182 5.223 15.048 1.00 0.00 H new ATOM 0 H6 U A 6 -2.732 6.955 15.685 1.00 0.00 H new ATOM 194 P C A 7 -5.302 7.138 20.099 1.00 0.00 P ATOM 195 OP1 C A 7 -5.997 7.782 21.236 1.00 0.00 O ATOM 196 OP2 C A 7 -3.900 6.692 20.256 1.00 0.00 O ATOM 197 O5' C A 7 -6.180 5.860 19.630 1.00 0.00 O ATOM 198 C5' C A 7 -7.593 5.904 19.630 1.00 0.00 C ATOM 199 C4' C A 7 -8.161 4.548 19.182 1.00 0.00 C ATOM 200 O4' C A 7 -7.740 4.194 17.860 1.00 0.00 O ATOM 201 C3' C A 7 -7.684 3.408 20.054 1.00 0.00 C ATOM 202 O3' C A 7 -8.346 3.367 21.305 1.00 0.00 O ATOM 203 C2' C A 7 -8.054 2.236 19.176 1.00 0.00 C ATOM 204 O2' C A 7 -9.446 2.013 19.243 1.00 0.00 O ATOM 205 C1' C A 7 -7.712 2.752 17.777 1.00 0.00 C ATOM 206 N1 C A 7 -6.368 2.260 17.369 1.00 0.00 N ATOM 207 C2 C A 7 -6.267 0.925 16.985 1.00 0.00 C ATOM 208 O2 C A 7 -7.265 0.207 16.974 1.00 0.00 O ATOM 209 N3 C A 7 -5.044 0.445 16.626 1.00 0.00 N ATOM 210 C4 C A 7 -3.962 1.235 16.648 1.00 0.00 C ATOM 211 N4 C A 7 -2.781 0.726 16.284 1.00 0.00 N ATOM 212 C5 C A 7 -4.049 2.609 17.039 1.00 0.00 C ATOM 213 C6 C A 7 -5.268 3.075 17.382 1.00 0.00 C ATOM 0 H5' C A 7 -7.941 6.692 18.962 1.00 0.00 H new ATOM 0 H5'' C A 7 -7.957 6.149 20.628 1.00 0.00 H new ATOM 0 H4' C A 7 -9.241 4.679 19.243 1.00 0.00 H new ATOM 0 H3' C A 7 -6.632 3.460 20.335 1.00 0.00 H new ATOM 0 H2' C A 7 -7.552 1.309 19.453 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.683 1.253 18.672 1.00 0.00 H new ATOM 0 H1' C A 7 -8.420 2.398 17.028 1.00 0.00 H new ATOM 0 H41 C A 7 -1.947 1.314 16.295 1.00 0.00 H new ATOM 0 H42 C A 7 -2.714 -0.250 15.995 1.00 0.00 H new ATOM 0 H5 C A 7 -3.177 3.245 17.059 1.00 0.00 H new ATOM 0 H6 C A 7 -5.378 4.110 17.672 1.00 0.00 H new ATOM 225 P C A 8 -7.794 2.434 22.501 1.00 0.00 P ATOM 226 OP1 C A 8 -8.697 2.591 23.663 1.00 0.00 O ATOM 227 OP2 C A 8 -6.348 2.703 22.656 1.00 0.00 O ATOM 228 O5' C A 8 -7.961 0.934 21.938 1.00 0.00 O ATOM 229 C5' C A 8 -9.221 0.297 21.918 1.00 0.00 C ATOM 230 C4' C A 8 -9.053 -1.133 21.397 1.00 0.00 C ATOM 231 O4' C A 8 -8.561 -1.152 20.064 1.00 0.00 O ATOM 232 C3' C A 8 -8.020 -1.905 22.185 1.00 0.00 C ATOM 233 O3' C A 8 -8.493 -2.330 23.445 1.00 0.00 O ATOM 234 C2' C A 8 -7.753 -3.053 21.260 1.00 0.00 C ATOM 235 O2' C A 8 -8.791 -4.006 21.355 1.00 0.00 O ATOM 236 C1' C A 8 -7.810 -2.368 19.899 1.00 0.00 C ATOM 237 N1 C A 8 -6.426 -2.075 19.463 1.00 0.00 N ATOM 238 C2 C A 8 -5.723 -3.094 18.828 1.00 0.00 C ATOM 239 O2 C A 8 -6.274 -4.163 18.571 1.00 0.00 O ATOM 240 N3 C A 8 -4.417 -2.875 18.508 1.00 0.00 N ATOM 241 C4 C A 8 -3.822 -1.713 18.812 1.00 0.00 C ATOM 242 N4 C A 8 -2.540 -1.536 18.478 1.00 0.00 N ATOM 243 C5 C A 8 -4.530 -0.668 19.489 1.00 0.00 C ATOM 244 C6 C A 8 -5.823 -0.895 19.788 1.00 0.00 C ATOM 0 H5' C A 8 -9.912 0.850 21.281 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.651 0.284 22.919 1.00 0.00 H new ATOM 0 H4' C A 8 -10.046 -1.575 21.479 1.00 0.00 H new ATOM 0 H3' C A 8 -7.137 -1.320 22.443 1.00 0.00 H new ATOM 0 H2' C A 8 -6.822 -3.582 21.464 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.247 -3.908 22.217 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.786 -2.825 23.910 1.00 0.00 H new ATOM 0 H1' C A 8 -8.286 -2.996 19.146 1.00 0.00 H new ATOM 0 H41 C A 8 -2.071 -0.658 18.702 1.00 0.00 H new ATOM 0 H42 C A 8 -2.030 -2.279 18.000 1.00 0.00 H new ATOM 0 H5 C A 8 -4.047 0.263 19.749 1.00 0.00 H new ATOM 0 H6 C A 8 -6.393 -0.130 20.294 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 2.479 -9.408 13.868 1.00 0.00 O ATOM 259 C5' G B 9 1.895 -10.690 13.769 1.00 0.00 C ATOM 260 C4' G B 9 0.436 -10.647 14.237 1.00 0.00 C ATOM 261 O4' G B 9 0.338 -10.272 15.610 1.00 0.00 O ATOM 262 C3' G B 9 -0.397 -9.628 13.484 1.00 0.00 C ATOM 263 O3' G B 9 -0.769 -10.077 12.194 1.00 0.00 O ATOM 264 C2' G B 9 -1.578 -9.514 14.419 1.00 0.00 C ATOM 265 O2' G B 9 -2.405 -10.653 14.300 1.00 0.00 O ATOM 266 C1' G B 9 -0.888 -9.541 15.783 1.00 0.00 C ATOM 267 N9 G B 9 -0.585 -8.156 16.205 1.00 0.00 N ATOM 268 C8 G B 9 0.618 -7.497 16.205 1.00 0.00 C ATOM 269 N7 G B 9 0.547 -6.264 16.624 1.00 0.00 N ATOM 270 C5 G B 9 -0.800 -6.089 16.925 1.00 0.00 C ATOM 271 C6 G B 9 -1.485 -4.941 17.422 1.00 0.00 C ATOM 272 O6 G B 9 -1.022 -3.836 17.694 1.00 0.00 O ATOM 273 N1 G B 9 -2.842 -5.188 17.592 1.00 0.00 N ATOM 274 C2 G B 9 -3.469 -6.385 17.317 1.00 0.00 C ATOM 275 N2 G B 9 -4.787 -6.439 17.536 1.00 0.00 N ATOM 276 N3 G B 9 -2.830 -7.463 16.848 1.00 0.00 N ATOM 277 C4 G B 9 -1.501 -7.244 16.676 1.00 0.00 C ATOM 0 H5' G B 9 2.457 -11.401 14.374 1.00 0.00 H new ATOM 0 H5'' G B 9 1.943 -11.041 12.738 1.00 0.00 H new ATOM 0 H4' G B 9 0.065 -11.656 14.058 1.00 0.00 H new ATOM 0 H3' G B 9 0.113 -8.688 13.274 1.00 0.00 H new ATOM 0 H2' G B 9 -2.206 -8.642 14.236 1.00 0.00 H new ATOM 0 HO2' G B 9 -3.167 -10.570 14.911 1.00 0.00 H new ATOM 0 HO5' G B 9 3.411 -9.449 13.568 1.00 0.00 H new ATOM 0 H1' G B 9 -1.519 -10.005 16.541 1.00 0.00 H new ATOM 0 H8 G B 9 1.541 -7.958 15.887 1.00 0.00 H new ATOM 0 H1 G B 9 -3.418 -4.425 17.947 1.00 0.00 H new ATOM 0 H21 G B 9 -5.300 -7.300 17.349 1.00 0.00 H new ATOM 0 H22 G B 9 -5.279 -5.619 17.890 1.00 0.00 H new ATOM 290 P G B 10 -1.353 -9.043 11.097 1.00 0.00 P ATOM 291 OP1 G B 10 -1.627 -9.799 9.855 1.00 0.00 O ATOM 292 OP2 G B 10 -0.453 -7.869 11.057 1.00 0.00 O ATOM 293 O5' G B 10 -2.763 -8.571 11.717 1.00 0.00 O ATOM 294 C5' G B 10 -3.883 -9.430 11.710 1.00 0.00 C ATOM 295 C4' G B 10 -5.067 -8.735 12.386 1.00 0.00 C ATOM 296 O4' G B 10 -4.745 -8.343 13.723 1.00 0.00 O ATOM 297 C3' G B 10 -5.478 -7.454 11.687 1.00 0.00 C ATOM 298 O3' G B 10 -6.226 -7.683 10.506 1.00 0.00 O ATOM 299 C2' G B 10 -6.312 -6.835 12.783 1.00 0.00 C ATOM 300 O2' G B 10 -7.537 -7.527 12.910 1.00 0.00 O ATOM 301 C1' G B 10 -5.453 -7.125 14.008 1.00 0.00 C ATOM 302 N9 G B 10 -4.493 -6.014 14.198 1.00 0.00 N ATOM 303 C8 G B 10 -3.154 -5.968 13.903 1.00 0.00 C ATOM 304 N7 G B 10 -2.589 -4.826 14.178 1.00 0.00 N ATOM 305 C5 G B 10 -3.626 -4.052 14.686 1.00 0.00 C ATOM 306 C6 G B 10 -3.618 -2.705 15.150 1.00 0.00 C ATOM 307 O6 G B 10 -2.669 -1.927 15.211 1.00 0.00 O ATOM 308 N1 G B 10 -4.880 -2.298 15.565 1.00 0.00 N ATOM 309 C2 G B 10 -6.011 -3.087 15.546 1.00 0.00 C ATOM 310 N2 G B 10 -7.143 -2.525 15.983 1.00 0.00 N ATOM 311 N3 G B 10 -6.022 -4.354 15.115 1.00 0.00 N ATOM 312 C4 G B 10 -4.798 -4.769 14.699 1.00 0.00 C ATOM 0 H5' G B 10 -3.646 -10.357 12.232 1.00 0.00 H new ATOM 0 H5'' G B 10 -4.142 -9.698 10.686 1.00 0.00 H new ATOM 0 H4' G B 10 -5.871 -9.470 12.350 1.00 0.00 H new ATOM 0 H3' G B 10 -4.650 -6.844 11.326 1.00 0.00 H new ATOM 0 H2' G B 10 -6.552 -5.784 12.621 1.00 0.00 H new ATOM 0 HO2' G B 10 -8.070 -7.120 13.624 1.00 0.00 H new ATOM 0 H1' G B 10 -6.052 -7.222 14.914 1.00 0.00 H new ATOM 0 H8 G B 10 -2.616 -6.804 13.480 1.00 0.00 H new ATOM 0 H1 G B 10 -4.977 -1.343 15.910 1.00 0.00 H new ATOM 0 H21 G B 10 -8.010 -3.063 15.991 1.00 0.00 H new ATOM 0 H22 G B 10 -7.140 -1.558 16.308 1.00 0.00 H new ATOM 324 P A B 11 -6.449 -6.501 9.418 1.00 0.00 P ATOM 325 OP1 A B 11 -7.281 -7.041 8.320 1.00 0.00 O ATOM 326 OP2 A B 11 -5.127 -5.911 9.112 1.00 0.00 O ATOM 327 O5' A B 11 -7.317 -5.392 10.205 1.00 0.00 O ATOM 328 C5' A B 11 -8.668 -5.632 10.535 1.00 0.00 C ATOM 329 C4' A B 11 -9.234 -4.441 11.313 1.00 0.00 C ATOM 330 O4' A B 11 -8.458 -4.169 12.483 1.00 0.00 O ATOM 331 C3' A B 11 -9.237 -3.142 10.531 1.00 0.00 C ATOM 332 O3' A B 11 -10.324 -3.057 9.632 1.00 0.00 O ATOM 333 C2' A B 11 -9.358 -2.132 11.637 1.00 0.00 C ATOM 334 O2' A B 11 -10.690 -2.088 12.107 1.00 0.00 O ATOM 335 C1' A B 11 -8.465 -2.746 12.709 1.00 0.00 C ATOM 336 N9 A B 11 -7.090 -2.204 12.587 1.00 0.00 N ATOM 337 C8 A B 11 -5.945 -2.827 12.157 1.00 0.00 C ATOM 338 N7 A B 11 -4.877 -2.081 12.223 1.00 0.00 N ATOM 339 C5 A B 11 -5.349 -0.870 12.715 1.00 0.00 C ATOM 340 C6 A B 11 -4.713 0.350 13.007 1.00 0.00 C ATOM 341 N6 A B 11 -3.398 0.548 12.853 1.00 0.00 N ATOM 342 N1 A B 11 -5.480 1.362 13.451 1.00 0.00 N ATOM 343 C2 A B 11 -6.787 1.164 13.604 1.00 0.00 C ATOM 344 N3 A B 11 -7.496 0.066 13.379 1.00 0.00 N ATOM 345 C4 A B 11 -6.699 -0.930 12.926 1.00 0.00 C ATOM 0 H5' A B 11 -8.750 -6.540 11.133 1.00 0.00 H new ATOM 0 H5'' A B 11 -9.250 -5.794 9.628 1.00 0.00 H new ATOM 0 H4' A B 11 -10.256 -4.743 11.544 1.00 0.00 H new ATOM 0 H3' A B 11 -8.361 -3.013 9.895 1.00 0.00 H new ATOM 0 H2' A B 11 -9.089 -1.117 11.345 1.00 0.00 H new ATOM 0 HO2' A B 11 -11.294 -2.420 11.410 1.00 0.00 H new ATOM 0 H1' A B 11 -8.832 -2.513 13.709 1.00 0.00 H new ATOM 0 H8 A B 11 -5.930 -3.845 11.796 1.00 0.00 H new ATOM 0 H61 A B 11 -2.989 1.454 13.080 1.00 0.00 H new ATOM 0 H62 A B 11 -2.805 -0.207 12.508 1.00 0.00 H new ATOM 0 H2 A B 11 -7.348 2.015 13.961 1.00 0.00 H new ATOM 357 P U B 12 -10.081 -2.729 8.081 1.00 0.00 P ATOM 358 OP1 U B 12 -11.365 -2.877 7.360 1.00 0.00 O ATOM 359 OP2 U B 12 -8.882 -3.465 7.625 1.00 0.00 O ATOM 360 O5' U B 12 -9.723 -1.163 8.169 1.00 0.00 O ATOM 361 C5' U B 12 -10.718 -0.224 8.523 1.00 0.00 C ATOM 362 C4' U B 12 -10.078 1.133 8.821 1.00 0.00 C ATOM 363 O4' U B 12 -9.205 1.049 9.945 1.00 0.00 O ATOM 364 C3' U B 12 -9.223 1.648 7.683 1.00 0.00 C ATOM 365 O3' U B 12 -10.001 2.210 6.643 1.00 0.00 O ATOM 366 C2' U B 12 -8.402 2.686 8.414 1.00 0.00 C ATOM 367 O2' U B 12 -9.179 3.845 8.630 1.00 0.00 O ATOM 368 C1' U B 12 -8.155 2.009 9.765 1.00 0.00 C ATOM 369 N1 U B 12 -6.833 1.335 9.764 1.00 0.00 N ATOM 370 C2 U B 12 -5.723 2.128 10.008 1.00 0.00 C ATOM 371 O2 U B 12 -5.823 3.334 10.222 1.00 0.00 O ATOM 372 N3 U B 12 -4.493 1.488 9.999 1.00 0.00 N ATOM 373 C4 U B 12 -4.283 0.139 9.761 1.00 0.00 C ATOM 374 O4 U B 12 -3.146 -0.326 9.765 1.00 0.00 O ATOM 375 C5 U B 12 -5.497 -0.617 9.530 1.00 0.00 C ATOM 376 C6 U B 12 -6.709 -0.014 9.541 1.00 0.00 C ATOM 0 H5' U B 12 -11.267 -0.576 9.397 1.00 0.00 H new ATOM 0 H5'' U B 12 -11.440 -0.124 7.712 1.00 0.00 H new ATOM 0 H4' U B 12 -10.919 1.804 8.996 1.00 0.00 H new ATOM 0 H3' U B 12 -8.637 0.886 7.170 1.00 0.00 H new ATOM 0 H2' U B 12 -7.500 2.984 7.880 1.00 0.00 H new ATOM 0 HO2' U B 12 -8.643 4.514 9.105 1.00 0.00 H new ATOM 0 H1' U B 12 -8.152 2.738 10.575 1.00 0.00 H new ATOM 0 H3 U B 12 -3.670 2.061 10.184 1.00 0.00 H new ATOM 0 H5 U B 12 -5.434 -1.679 9.346 1.00 0.00 H new ATOM 0 H6 U B 12 -7.596 -0.606 9.371 1.00 0.00 H new ATOM 387 P G B 13 -9.323 2.644 5.245 1.00 0.00 P ATOM 388 OP1 G B 13 -10.399 3.081 4.327 1.00 0.00 O ATOM 389 OP2 G B 13 -8.399 1.565 4.832 1.00 0.00 O ATOM 390 O5' G B 13 -8.443 3.935 5.634 1.00 0.00 O ATOM 391 C5' G B 13 -9.052 5.191 5.860 1.00 0.00 C ATOM 392 C4' G B 13 -7.974 6.220 6.204 1.00 0.00 C ATOM 393 O4' G B 13 -7.255 5.844 7.373 1.00 0.00 O ATOM 394 C3' G B 13 -6.921 6.317 5.120 1.00 0.00 C ATOM 395 O3' G B 13 -7.352 7.094 4.014 1.00 0.00 O ATOM 396 C2' G B 13 -5.803 6.989 5.879 1.00 0.00 C ATOM 397 O2' G B 13 -6.009 8.387 5.899 1.00 0.00 O ATOM 398 C1' G B 13 -5.958 6.444 7.293 1.00 0.00 C ATOM 399 N9 G B 13 -4.901 5.448 7.546 1.00 0.00 N ATOM 400 C8 G B 13 -4.958 4.088 7.436 1.00 0.00 C ATOM 401 N7 G B 13 -3.833 3.484 7.705 1.00 0.00 N ATOM 402 C5 G B 13 -2.961 4.525 8.009 1.00 0.00 C ATOM 403 C6 G B 13 -1.580 4.497 8.374 1.00 0.00 C ATOM 404 O6 G B 13 -0.842 3.524 8.525 1.00 0.00 O ATOM 405 N1 G B 13 -1.080 5.774 8.566 1.00 0.00 N ATOM 406 C2 G B 13 -1.801 6.939 8.441 1.00 0.00 C ATOM 407 N2 G B 13 -1.141 8.078 8.674 1.00 0.00 N ATOM 408 N3 G B 13 -3.094 6.974 8.108 1.00 0.00 N ATOM 409 C4 G B 13 -3.608 5.733 7.906 1.00 0.00 C ATOM 0 H5' G B 13 -9.774 5.117 6.674 1.00 0.00 H new ATOM 0 H5'' G B 13 -9.602 5.506 4.973 1.00 0.00 H new ATOM 0 H4' G B 13 -8.509 7.161 6.333 1.00 0.00 H new ATOM 0 H3' G B 13 -6.655 5.361 4.668 1.00 0.00 H new ATOM 0 H2' G B 13 -4.821 6.804 5.443 1.00 0.00 H new ATOM 0 HO2' G B 13 -6.758 8.616 5.310 1.00 0.00 H new ATOM 0 H1' G B 13 -5.865 7.231 8.041 1.00 0.00 H new ATOM 0 H8 G B 13 -5.855 3.559 7.151 1.00 0.00 H new ATOM 0 H1 G B 13 -0.096 5.858 8.821 1.00 0.00 H new ATOM 0 H21 G B 13 -1.625 8.973 8.596 1.00 0.00 H new ATOM 0 H22 G B 13 -0.154 8.052 8.930 1.00 0.00 H new ATOM 421 P U B 14 -6.548 7.061 2.608 1.00 0.00 P ATOM 422 OP1 U B 14 -7.278 7.914 1.645 1.00 0.00 O ATOM 423 OP2 U B 14 -6.282 5.644 2.275 1.00 0.00 O ATOM 424 O5' U B 14 -5.130 7.770 2.926 1.00 0.00 O ATOM 425 C5' U B 14 -5.000 9.178 2.950 1.00 0.00 C ATOM 426 C4' U B 14 -3.528 9.566 3.173 1.00 0.00 C ATOM 427 O4' U B 14 -3.050 9.134 4.454 1.00 0.00 O ATOM 428 C3' U B 14 -2.591 8.921 2.164 1.00 0.00 C ATOM 429 O3' U B 14 -2.571 9.575 0.911 1.00 0.00 O ATOM 430 C2' U B 14 -1.278 9.087 2.882 1.00 0.00 C ATOM 431 O2' U B 14 -0.855 10.433 2.811 1.00 0.00 O ATOM 432 C1' U B 14 -1.659 8.777 4.317 1.00 0.00 C ATOM 433 N1 U B 14 -1.470 7.335 4.613 1.00 0.00 N ATOM 434 C2 U B 14 -0.248 6.940 5.141 1.00 0.00 C ATOM 435 O2 U B 14 0.679 7.728 5.314 1.00 0.00 O ATOM 436 N3 U B 14 -0.128 5.600 5.467 1.00 0.00 N ATOM 437 C4 U B 14 -1.107 4.633 5.314 1.00 0.00 C ATOM 438 O4 U B 14 -0.883 3.465 5.619 1.00 0.00 O ATOM 439 C5 U B 14 -2.352 5.136 4.779 1.00 0.00 C ATOM 440 C6 U B 14 -2.488 6.438 4.445 1.00 0.00 C ATOM 0 H5' U B 14 -5.619 9.595 3.744 1.00 0.00 H new ATOM 0 H5'' U B 14 -5.358 9.601 2.011 1.00 0.00 H new ATOM 0 H4' U B 14 -3.520 10.652 3.079 1.00 0.00 H new ATOM 0 H3' U B 14 -2.868 7.899 1.904 1.00 0.00 H new ATOM 0 H2' U B 14 -0.479 8.468 2.475 1.00 0.00 H new ATOM 0 HO2' U B 14 -1.368 10.901 2.120 1.00 0.00 H new ATOM 0 H1' U B 14 -1.032 9.333 5.014 1.00 0.00 H new ATOM 0 H3 U B 14 0.765 5.297 5.856 1.00 0.00 H new ATOM 0 H5 U B 14 -3.185 4.462 4.644 1.00 0.00 H new ATOM 0 H6 U B 14 -3.427 6.780 4.034 1.00 0.00 H new ATOM 451 P C B 15 -1.877 8.871 -0.371 1.00 0.00 P ATOM 452 OP1 C B 15 -1.895 9.837 -1.491 1.00 0.00 O ATOM 453 OP2 C B 15 -2.498 7.539 -0.544 1.00 0.00 O ATOM 454 O5' C B 15 -0.336 8.646 0.076 1.00 0.00 O ATOM 455 C5' C B 15 0.589 9.715 0.076 1.00 0.00 C ATOM 456 C4' C B 15 1.979 9.210 0.491 1.00 0.00 C ATOM 457 O4' C B 15 1.984 8.648 1.809 1.00 0.00 O ATOM 458 C3' C B 15 2.477 8.094 -0.402 1.00 0.00 C ATOM 459 O3' C B 15 2.926 8.565 -1.659 1.00 0.00 O ATOM 460 C2' C B 15 3.609 7.566 0.448 1.00 0.00 C ATOM 461 O2' C B 15 4.715 8.439 0.361 1.00 0.00 O ATOM 462 C1' C B 15 3.031 7.654 1.861 1.00 0.00 C ATOM 463 N1 C B 15 2.496 6.328 2.275 1.00 0.00 N ATOM 464 C2 C B 15 3.422 5.353 2.637 1.00 0.00 C ATOM 465 O2 C B 15 4.625 5.604 2.623 1.00 0.00 O ATOM 466 N3 C B 15 2.958 4.125 3.002 1.00 0.00 N ATOM 467 C4 C B 15 1.645 3.859 3.007 1.00 0.00 C ATOM 468 N4 C B 15 1.232 2.643 3.375 1.00 0.00 N ATOM 469 C5 C B 15 0.682 4.851 2.638 1.00 0.00 C ATOM 470 C6 C B 15 1.153 6.067 2.289 1.00 0.00 C ATOM 0 H5' C B 15 0.257 10.494 0.762 1.00 0.00 H new ATOM 0 H5'' C B 15 0.638 10.164 -0.916 1.00 0.00 H new ATOM 0 H4' C B 15 2.612 10.095 0.425 1.00 0.00 H new ATOM 0 H3' C B 15 1.722 7.356 -0.673 1.00 0.00 H new ATOM 0 H2' C B 15 3.943 6.570 0.157 1.00 0.00 H new ATOM 0 HO2' C B 15 5.447 8.095 0.914 1.00 0.00 H new ATOM 0 H1' C B 15 3.789 7.933 2.593 1.00 0.00 H new ATOM 0 H41 C B 15 0.236 2.424 3.384 1.00 0.00 H new ATOM 0 H42 C B 15 1.913 1.934 3.647 1.00 0.00 H new ATOM 0 H5 C B 15 -0.376 4.636 2.639 1.00 0.00 H new ATOM 0 H6 C B 15 0.458 6.847 2.016 1.00 0.00 H new ATOM 482 P C B 16 3.216 7.536 -2.869 1.00 0.00 P ATOM 483 OP1 C B 16 3.680 8.317 -4.037 1.00 0.00 O ATOM 484 OP2 C B 16 2.039 6.649 -3.002 1.00 0.00 O ATOM 485 O5' C B 16 4.450 6.646 -2.340 1.00 0.00 O ATOM 486 C5' C B 16 5.770 7.148 -2.349 1.00 0.00 C ATOM 487 C4' C B 16 6.724 6.062 -1.844 1.00 0.00 C ATOM 488 O4' C B 16 6.424 5.679 -0.509 1.00 0.00 O ATOM 489 C3' C B 16 6.596 4.781 -2.637 1.00 0.00 C ATOM 490 O3' C B 16 7.232 4.847 -3.893 1.00 0.00 O ATOM 491 C2' C B 16 7.271 3.808 -1.723 1.00 0.00 C ATOM 492 O2' C B 16 8.673 3.934 -1.843 1.00 0.00 O ATOM 493 C1' C B 16 6.826 4.308 -0.354 1.00 0.00 C ATOM 494 N1 C B 16 5.689 3.476 0.101 1.00 0.00 N ATOM 495 C2 C B 16 5.985 2.272 0.732 1.00 0.00 C ATOM 496 O2 C B 16 7.152 1.964 0.967 1.00 0.00 O ATOM 497 N3 C B 16 4.953 1.450 1.071 1.00 0.00 N ATOM 498 C4 C B 16 3.687 1.787 0.791 1.00 0.00 C ATOM 499 N4 C B 16 2.703 0.954 1.143 1.00 0.00 N ATOM 500 C5 C B 16 3.374 3.012 0.118 1.00 0.00 C ATOM 501 C6 C B 16 4.403 3.819 -0.200 1.00 0.00 C ATOM 0 H5' C B 16 5.840 8.033 -1.717 1.00 0.00 H new ATOM 0 H5'' C B 16 6.049 7.454 -3.357 1.00 0.00 H new ATOM 0 H4' C B 16 7.717 6.502 -1.936 1.00 0.00 H new ATOM 0 H3' C B 16 5.567 4.527 -2.892 1.00 0.00 H new ATOM 0 H2' C B 16 7.027 2.764 -1.921 1.00 0.00 H new ATOM 0 HO2' C B 16 8.898 4.235 -2.748 1.00 0.00 H new ATOM 0 HO3' C B 16 7.120 3.994 -4.362 1.00 0.00 H new ATOM 0 H1' C B 16 7.625 4.240 0.385 1.00 0.00 H new ATOM 0 H41 C B 16 1.733 1.195 0.938 1.00 0.00 H new ATOM 0 H42 C B 16 2.922 0.078 1.617 1.00 0.00 H new ATOM 0 H5 C B 16 2.355 3.277 -0.124 1.00 0.00 H new ATOM 0 H6 C B 16 4.207 4.755 -0.702 1.00 0.00 H new TER 514 C B 16