USER MOD reduce.3.24.130724 H: found=0, std=0, add=164, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 164 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 -23:sc= 0.312 USER MOD Single : A 1 G O5' : rot 50:sc= -0.0783 USER MOD Single : A 2 G O2' : rot 1:sc= -5.05! USER MOD Single : A 3 C O2' : rot 9:sc= -1.07 USER MOD Single : A 4 U O2' : rot 6:sc= -7.21! USER MOD Single : A 5 C O2' : rot -2:sc= -7.63! USER MOD Single : A 6 U O2' : rot 105:sc= 0.685 USER MOD Single : A 7 C O2' : rot 147:sc= 0.579 USER MOD Single : A 8 A O2' : rot 21:sc= 0.172 USER MOD Single : A 9 G O2' : rot -8:sc= 0.586 USER MOD Single : A 10 U O2' : rot 180:sc= -0.0235 USER MOD Single : A 11 G O2' : rot -28:sc= 0.237 USER MOD Single : A 12 A O2' : rot -25:sc= 0.309 USER MOD Single : A 13 G O2' : rot -29:sc= 0.279 USER MOD Single : A 14 C O2' : rot -169:sc= -6.47! USER MOD Single : A 15 C O2' : rot -16:sc= 0.17 USER MOD Single : A 15 C O3' : rot 180:sc= 0.171 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -9.383 3.564 6.205 1.00 0.00 O ATOM 2 C5' G A 1 -10.723 3.323 6.644 1.00 0.00 C ATOM 3 C4' G A 1 -11.741 4.029 5.754 1.00 0.00 C ATOM 4 O4' G A 1 -11.853 5.419 6.093 1.00 0.00 O ATOM 5 C3' G A 1 -11.309 3.989 4.295 1.00 0.00 C ATOM 6 O3' G A 1 -11.974 2.893 3.663 1.00 0.00 O ATOM 7 C2' G A 1 -11.879 5.286 3.739 1.00 0.00 C ATOM 8 O2' G A 1 -13.256 5.139 3.373 1.00 0.00 O ATOM 9 C1' G A 1 -11.717 6.225 4.913 1.00 0.00 C ATOM 10 N9 G A 1 -10.407 6.907 4.872 1.00 0.00 N ATOM 11 C8 G A 1 -9.448 7.007 5.827 1.00 0.00 C ATOM 12 N7 G A 1 -8.383 7.675 5.538 1.00 0.00 N ATOM 13 C5 G A 1 -8.647 8.080 4.227 1.00 0.00 C ATOM 14 C6 G A 1 -7.855 8.856 3.338 1.00 0.00 C ATOM 15 O6 G A 1 -6.746 9.346 3.535 1.00 0.00 O ATOM 16 N1 G A 1 -8.489 9.035 2.115 1.00 0.00 N ATOM 17 C2 G A 1 -9.731 8.532 1.782 1.00 0.00 C ATOM 18 N2 G A 1 -10.171 8.812 0.556 1.00 0.00 N ATOM 19 N3 G A 1 -10.483 7.801 2.613 1.00 0.00 N ATOM 20 C4 G A 1 -9.885 7.614 3.811 1.00 0.00 C ATOM 0 H5' G A 1 -10.837 3.667 7.672 1.00 0.00 H new ATOM 0 H5'' G A 1 -10.920 2.251 6.643 1.00 0.00 H new ATOM 0 H4' G A 1 -12.687 3.509 5.904 1.00 0.00 H new ATOM 0 H3' G A 1 -10.234 3.882 4.151 1.00 0.00 H new ATOM 0 H2' G A 1 -11.386 5.629 2.829 1.00 0.00 H new ATOM 0 HO2' G A 1 -13.450 4.194 3.201 1.00 0.00 H new ATOM 0 HO5' G A 1 -9.251 4.526 6.069 1.00 0.00 H new ATOM 0 H1' G A 1 -12.468 7.015 4.893 1.00 0.00 H new ATOM 0 H8 G A 1 -9.572 6.544 6.795 1.00 0.00 H new ATOM 0 H1 G A 1 -7.998 9.581 1.407 1.00 0.00 H new ATOM 0 H21 G A 1 -11.082 8.469 0.250 1.00 0.00 H new ATOM 0 H22 G A 1 -9.597 9.370 -0.077 1.00 0.00 H new ATOM 33 P G A 2 -11.123 1.737 2.936 1.00 0.00 P ATOM 34 OP1 G A 2 -11.895 0.477 3.010 1.00 0.00 O ATOM 35 OP2 G A 2 -9.738 1.787 3.454 1.00 0.00 O ATOM 36 O5' G A 2 -11.106 2.229 1.404 1.00 0.00 O ATOM 37 C5' G A 2 -12.319 2.299 0.651 1.00 0.00 C ATOM 38 C4' G A 2 -12.144 3.138 -0.610 1.00 0.00 C ATOM 39 O4' G A 2 -11.824 4.498 -0.290 1.00 0.00 O ATOM 40 C3' G A 2 -10.990 2.613 -1.452 1.00 0.00 C ATOM 41 O3' G A 2 -11.530 1.788 -2.488 1.00 0.00 O ATOM 42 C2' G A 2 -10.417 3.864 -2.092 1.00 0.00 C ATOM 43 O2' G A 2 -11.073 4.164 -3.330 1.00 0.00 O ATOM 44 C1' G A 2 -10.687 4.938 -1.048 1.00 0.00 C ATOM 45 N9 G A 2 -9.513 5.155 -0.174 1.00 0.00 N ATOM 46 C8 G A 2 -9.332 4.852 1.140 1.00 0.00 C ATOM 47 N7 G A 2 -8.195 5.153 1.671 1.00 0.00 N ATOM 48 C5 G A 2 -7.519 5.733 0.594 1.00 0.00 C ATOM 49 C6 G A 2 -6.208 6.277 0.529 1.00 0.00 C ATOM 50 O6 G A 2 -5.369 6.351 1.424 1.00 0.00 O ATOM 51 N1 G A 2 -5.918 6.760 -0.741 1.00 0.00 N ATOM 52 C2 G A 2 -6.778 6.726 -1.820 1.00 0.00 C ATOM 53 N2 G A 2 -6.316 7.241 -2.959 1.00 0.00 N ATOM 54 N3 G A 2 -8.013 6.217 -1.768 1.00 0.00 N ATOM 55 C4 G A 2 -8.319 5.740 -0.540 1.00 0.00 C ATOM 0 H5' G A 2 -13.108 2.728 1.269 1.00 0.00 H new ATOM 0 H5'' G A 2 -12.639 1.293 0.379 1.00 0.00 H new ATOM 0 H4' G A 2 -13.088 3.080 -1.151 1.00 0.00 H new ATOM 0 H3' G A 2 -10.259 2.042 -0.880 1.00 0.00 H new ATOM 0 H2' G A 2 -9.361 3.769 -2.346 1.00 0.00 H new ATOM 0 HO2' G A 2 -11.773 3.500 -3.498 1.00 0.00 H new ATOM 0 H1' G A 2 -10.885 5.897 -1.527 1.00 0.00 H new ATOM 0 H8 G A 2 -10.111 4.377 1.717 1.00 0.00 H new ATOM 0 H1 G A 2 -4.997 7.172 -0.888 1.00 0.00 H new ATOM 0 H21 G A 2 -6.904 7.245 -3.792 1.00 0.00 H new ATOM 0 H22 G A 2 -5.374 7.631 -2.997 1.00 0.00 H new ATOM 67 P C A 3 -10.602 0.706 -3.235 1.00 0.00 P ATOM 68 OP1 C A 3 -11.427 0.006 -4.245 1.00 0.00 O ATOM 69 OP2 C A 3 -9.876 -0.071 -2.206 1.00 0.00 O ATOM 70 O5' C A 3 -9.538 1.633 -4.010 1.00 0.00 O ATOM 71 C5' C A 3 -9.959 2.479 -5.082 1.00 0.00 C ATOM 72 C4' C A 3 -8.777 3.191 -5.733 1.00 0.00 C ATOM 73 O4' C A 3 -8.128 4.072 -4.819 1.00 0.00 O ATOM 74 C3' C A 3 -7.709 2.203 -6.153 1.00 0.00 C ATOM 75 O3' C A 3 -7.980 1.775 -7.489 1.00 0.00 O ATOM 76 C2' C A 3 -6.444 3.047 -6.167 1.00 0.00 C ATOM 77 O2' C A 3 -6.235 3.655 -7.447 1.00 0.00 O ATOM 78 C1' C A 3 -6.716 4.098 -5.087 1.00 0.00 C ATOM 79 N1 C A 3 -5.941 3.806 -3.868 1.00 0.00 N ATOM 80 C2 C A 3 -4.611 4.192 -3.848 1.00 0.00 C ATOM 81 O2 C A 3 -4.124 4.773 -4.815 1.00 0.00 O ATOM 82 N3 C A 3 -3.875 3.911 -2.737 1.00 0.00 N ATOM 83 C4 C A 3 -4.423 3.278 -1.691 1.00 0.00 C ATOM 84 N4 C A 3 -3.673 3.015 -0.620 1.00 0.00 N ATOM 85 C5 C A 3 -5.798 2.880 -1.712 1.00 0.00 C ATOM 86 C6 C A 3 -6.514 3.164 -2.814 1.00 0.00 C ATOM 0 H5' C A 3 -10.668 3.217 -4.707 1.00 0.00 H new ATOM 0 H5'' C A 3 -10.484 1.885 -5.830 1.00 0.00 H new ATOM 0 H4' C A 3 -9.192 3.731 -6.584 1.00 0.00 H new ATOM 0 H3' C A 3 -7.648 1.326 -5.509 1.00 0.00 H new ATOM 0 H2' C A 3 -5.541 2.466 -5.980 1.00 0.00 H new ATOM 0 HO2' C A 3 -7.023 3.510 -8.011 1.00 0.00 H new ATOM 0 H1' C A 3 -6.410 5.088 -5.425 1.00 0.00 H new ATOM 0 H41 C A 3 -4.080 2.534 0.182 1.00 0.00 H new ATOM 0 H42 C A 3 -2.692 3.295 -0.603 1.00 0.00 H new ATOM 0 H5 C A 3 -6.245 2.369 -0.872 1.00 0.00 H new ATOM 0 H6 C A 3 -7.555 2.880 -2.863 1.00 0.00 H new ATOM 98 P U A 4 -7.339 0.407 -8.048 1.00 0.00 P ATOM 99 OP1 U A 4 -7.766 0.237 -9.454 1.00 0.00 O ATOM 100 OP2 U A 4 -7.602 -0.664 -7.062 1.00 0.00 O ATOM 101 O5' U A 4 -5.760 0.728 -8.034 1.00 0.00 O ATOM 102 C5' U A 4 -5.176 1.520 -9.071 1.00 0.00 C ATOM 103 C4' U A 4 -3.740 1.919 -8.743 1.00 0.00 C ATOM 104 O4' U A 4 -3.600 2.304 -7.382 1.00 0.00 O ATOM 105 C3' U A 4 -2.786 0.751 -8.913 1.00 0.00 C ATOM 106 O3' U A 4 -2.302 0.755 -10.259 1.00 0.00 O ATOM 107 C2' U A 4 -1.627 1.102 -7.988 1.00 0.00 C ATOM 108 O2' U A 4 -0.565 1.744 -8.703 1.00 0.00 O ATOM 109 C1' U A 4 -2.254 2.051 -6.959 1.00 0.00 C ATOM 110 N1 U A 4 -2.223 1.453 -5.613 1.00 0.00 N ATOM 111 C2 U A 4 -1.101 1.686 -4.845 1.00 0.00 C ATOM 112 O2 U A 4 -0.165 2.373 -5.247 1.00 0.00 O ATOM 113 N3 U A 4 -1.089 1.101 -3.594 1.00 0.00 N ATOM 114 C4 U A 4 -2.092 0.311 -3.053 1.00 0.00 C ATOM 115 O4 U A 4 -1.980 -0.164 -1.925 1.00 0.00 O ATOM 116 C5 U A 4 -3.227 0.123 -3.926 1.00 0.00 C ATOM 117 C6 U A 4 -3.260 0.688 -5.156 1.00 0.00 C ATOM 0 H5' U A 4 -5.776 2.417 -9.224 1.00 0.00 H new ATOM 0 H5'' U A 4 -5.193 0.962 -10.007 1.00 0.00 H new ATOM 0 H4' U A 4 -3.509 2.739 -9.423 1.00 0.00 H new ATOM 0 H3' U A 4 -3.240 -0.217 -8.699 1.00 0.00 H new ATOM 0 H2' U A 4 -1.177 0.221 -7.530 1.00 0.00 H new ATOM 0 HO2' U A 4 -0.847 1.911 -9.627 1.00 0.00 H new ATOM 0 H1' U A 4 -1.694 2.984 -6.901 1.00 0.00 H new ATOM 0 H3 U A 4 -0.266 1.265 -3.014 1.00 0.00 H new ATOM 0 H5 U A 4 -4.061 -0.477 -3.593 1.00 0.00 H new ATOM 0 H6 U A 4 -4.122 0.531 -5.788 1.00 0.00 H new ATOM 128 P C A 5 -1.450 -0.490 -10.820 1.00 0.00 P ATOM 129 OP1 C A 5 -0.828 -0.087 -12.101 1.00 0.00 O ATOM 130 OP2 C A 5 -2.302 -1.699 -10.760 1.00 0.00 O ATOM 131 O5' C A 5 -0.285 -0.641 -9.720 1.00 0.00 O ATOM 132 C5' C A 5 0.912 0.133 -9.823 1.00 0.00 C ATOM 133 C4' C A 5 2.041 -0.467 -8.990 1.00 0.00 C ATOM 134 O4' C A 5 1.897 -0.160 -7.607 1.00 0.00 O ATOM 135 C3' C A 5 2.021 -1.981 -9.045 1.00 0.00 C ATOM 136 O3' C A 5 2.779 -2.412 -10.178 1.00 0.00 O ATOM 137 C2' C A 5 2.776 -2.372 -7.783 1.00 0.00 C ATOM 138 O2' C A 5 4.179 -2.498 -8.034 1.00 0.00 O ATOM 139 C1' C A 5 2.490 -1.211 -6.826 1.00 0.00 C ATOM 140 N1 C A 5 1.595 -1.643 -5.736 1.00 0.00 N ATOM 141 C2 C A 5 2.167 -1.845 -4.491 1.00 0.00 C ATOM 142 O2 C A 5 3.369 -1.645 -4.327 1.00 0.00 O ATOM 143 N3 C A 5 1.368 -2.267 -3.474 1.00 0.00 N ATOM 144 C4 C A 5 0.061 -2.481 -3.670 1.00 0.00 C ATOM 145 N4 C A 5 -0.692 -2.894 -2.650 1.00 0.00 N ATOM 146 C5 C A 5 -0.536 -2.272 -4.955 1.00 0.00 C ATOM 147 C6 C A 5 0.265 -1.854 -5.955 1.00 0.00 C ATOM 0 H5' C A 5 0.716 1.153 -9.491 1.00 0.00 H new ATOM 0 H5'' C A 5 1.220 0.191 -10.867 1.00 0.00 H new ATOM 0 H4' C A 5 2.957 -0.048 -9.407 1.00 0.00 H new ATOM 0 H3' C A 5 1.020 -2.406 -9.115 1.00 0.00 H new ATOM 0 H2' C A 5 2.466 -3.339 -7.387 1.00 0.00 H new ATOM 0 HO2' C A 5 4.357 -2.337 -8.984 1.00 0.00 H new ATOM 0 H1' C A 5 3.407 -0.859 -6.353 1.00 0.00 H new ATOM 0 H41 C A 5 -1.689 -3.060 -2.787 1.00 0.00 H new ATOM 0 H42 C A 5 -0.271 -3.043 -1.733 1.00 0.00 H new ATOM 0 H5 C A 5 -1.590 -2.443 -5.117 1.00 0.00 H new ATOM 0 H6 C A 5 -0.149 -1.685 -6.938 1.00 0.00 H new ATOM 159 P U A 6 2.600 -3.905 -10.758 1.00 0.00 P ATOM 160 OP1 U A 6 3.615 -4.117 -11.814 1.00 0.00 O ATOM 161 OP2 U A 6 1.166 -4.117 -11.059 1.00 0.00 O ATOM 162 O5' U A 6 2.990 -4.823 -9.494 1.00 0.00 O ATOM 163 C5' U A 6 4.302 -4.753 -8.933 1.00 0.00 C ATOM 164 C4' U A 6 4.360 -5.381 -7.544 1.00 0.00 C ATOM 165 O4' U A 6 3.196 -5.087 -6.781 1.00 0.00 O ATOM 166 C3' U A 6 4.391 -6.892 -7.629 1.00 0.00 C ATOM 167 O3' U A 6 5.755 -7.310 -7.723 1.00 0.00 O ATOM 168 C2' U A 6 3.843 -7.331 -6.277 1.00 0.00 C ATOM 169 O2' U A 6 4.901 -7.570 -5.342 1.00 0.00 O ATOM 170 C1' U A 6 2.968 -6.148 -5.841 1.00 0.00 C ATOM 171 N1 U A 6 1.544 -6.535 -5.810 1.00 0.00 N ATOM 172 C2 U A 6 1.116 -7.307 -4.746 1.00 0.00 C ATOM 173 O2 U A 6 1.875 -7.655 -3.845 1.00 0.00 O ATOM 174 N3 U A 6 -0.220 -7.666 -4.753 1.00 0.00 N ATOM 175 C4 U A 6 -1.152 -7.324 -5.718 1.00 0.00 C ATOM 176 O4 U A 6 -2.318 -7.701 -5.625 1.00 0.00 O ATOM 177 C5 U A 6 -0.618 -6.516 -6.791 1.00 0.00 C ATOM 178 C6 U A 6 0.688 -6.153 -6.806 1.00 0.00 C ATOM 0 H5' U A 6 4.617 -3.711 -8.874 1.00 0.00 H new ATOM 0 H5'' U A 6 5.006 -5.262 -9.591 1.00 0.00 H new ATOM 0 H4' U A 6 5.259 -4.973 -7.081 1.00 0.00 H new ATOM 0 H3' U A 6 3.837 -7.295 -8.477 1.00 0.00 H new ATOM 0 H2' U A 6 3.288 -8.268 -6.329 1.00 0.00 H new ATOM 0 HO2' U A 6 4.942 -6.832 -4.699 1.00 0.00 H new ATOM 0 H1' U A 6 3.227 -5.825 -4.833 1.00 0.00 H new ATOM 0 H3 U A 6 -0.549 -8.236 -3.974 1.00 0.00 H new ATOM 0 H5 U A 6 -1.269 -6.197 -7.592 1.00 0.00 H new ATOM 0 H6 U A 6 1.060 -5.550 -7.621 1.00 0.00 H new ATOM 189 P C A 7 6.278 -8.099 -9.024 1.00 0.00 P ATOM 190 OP1 C A 7 6.697 -7.101 -10.035 1.00 0.00 O ATOM 191 OP2 C A 7 5.275 -9.128 -9.376 1.00 0.00 O ATOM 192 O5' C A 7 7.595 -8.845 -8.477 1.00 0.00 O ATOM 193 C5' C A 7 8.809 -8.117 -8.273 1.00 0.00 C ATOM 194 C4' C A 7 9.449 -8.460 -6.931 1.00 0.00 C ATOM 195 O4' C A 7 10.257 -7.380 -6.457 1.00 0.00 O ATOM 196 C3' C A 7 8.380 -8.712 -5.864 1.00 0.00 C ATOM 197 O3' C A 7 8.646 -9.981 -5.259 1.00 0.00 O ATOM 198 C2' C A 7 8.606 -7.628 -4.812 1.00 0.00 C ATOM 199 O2' C A 7 8.433 -8.142 -3.487 1.00 0.00 O ATOM 200 C1' C A 7 10.044 -7.206 -5.059 1.00 0.00 C ATOM 201 N1 C A 7 10.266 -5.803 -4.657 1.00 0.00 N ATOM 202 C2 C A 7 10.414 -5.539 -3.304 1.00 0.00 C ATOM 203 O2 C A 7 10.350 -6.455 -2.487 1.00 0.00 O ATOM 204 N3 C A 7 10.628 -4.250 -2.918 1.00 0.00 N ATOM 205 C4 C A 7 10.694 -3.263 -3.822 1.00 0.00 C ATOM 206 N4 C A 7 10.906 -2.011 -3.413 1.00 0.00 N ATOM 207 C5 C A 7 10.541 -3.533 -5.219 1.00 0.00 C ATOM 208 C6 C A 7 10.330 -4.809 -5.590 1.00 0.00 C ATOM 0 H5' C A 7 8.604 -7.047 -8.317 1.00 0.00 H new ATOM 0 H5'' C A 7 9.508 -8.341 -9.078 1.00 0.00 H new ATOM 0 H4' C A 7 10.053 -9.352 -7.094 1.00 0.00 H new ATOM 0 H3' C A 7 7.369 -8.700 -6.270 1.00 0.00 H new ATOM 0 H2' C A 7 7.898 -6.803 -4.889 1.00 0.00 H new ATOM 0 HO2' C A 7 9.043 -7.680 -2.875 1.00 0.00 H new ATOM 0 H1' C A 7 10.742 -7.800 -4.469 1.00 0.00 H new ATOM 0 H41 C A 7 10.958 -1.254 -4.094 1.00 0.00 H new ATOM 0 H42 C A 7 11.016 -1.811 -2.419 1.00 0.00 H new ATOM 0 H5 C A 7 10.593 -2.740 -5.950 1.00 0.00 H new ATOM 0 H6 C A 7 10.210 -5.049 -6.636 1.00 0.00 H new ATOM 220 P A A 8 7.980 -11.324 -5.847 1.00 0.00 P ATOM 221 OP1 A A 8 8.858 -12.464 -5.503 1.00 0.00 O ATOM 222 OP2 A A 8 7.612 -11.078 -7.259 1.00 0.00 O ATOM 223 O5' A A 8 6.624 -11.453 -4.987 1.00 0.00 O ATOM 224 C5' A A 8 6.459 -10.706 -3.778 1.00 0.00 C ATOM 225 C4' A A 8 5.029 -10.794 -3.250 1.00 0.00 C ATOM 226 O4' A A 8 4.087 -10.305 -4.216 1.00 0.00 O ATOM 227 C3' A A 8 4.635 -12.242 -2.975 1.00 0.00 C ATOM 228 O3' A A 8 3.666 -12.253 -1.924 1.00 0.00 O ATOM 229 C2' A A 8 3.942 -12.660 -4.259 1.00 0.00 C ATOM 230 O2' A A 8 3.009 -13.725 -4.035 1.00 0.00 O ATOM 231 C1' A A 8 3.240 -11.374 -4.666 1.00 0.00 C ATOM 232 N9 A A 8 3.038 -11.319 -6.126 1.00 0.00 N ATOM 233 C8 A A 8 3.947 -11.224 -7.128 1.00 0.00 C ATOM 234 N7 A A 8 3.499 -11.208 -8.340 1.00 0.00 N ATOM 235 C5 A A 8 2.119 -11.304 -8.131 1.00 0.00 C ATOM 236 C6 A A 8 1.027 -11.341 -9.006 1.00 0.00 C ATOM 237 N6 A A 8 1.153 -11.285 -10.333 1.00 0.00 N ATOM 238 N1 A A 8 -0.200 -11.439 -8.462 1.00 0.00 N ATOM 239 C2 A A 8 -0.348 -11.497 -7.137 1.00 0.00 C ATOM 240 N3 A A 8 0.613 -11.470 -6.219 1.00 0.00 N ATOM 241 C4 A A 8 1.832 -11.372 -6.787 1.00 0.00 C ATOM 0 H5' A A 8 6.717 -9.662 -3.957 1.00 0.00 H new ATOM 0 H5'' A A 8 7.150 -11.080 -3.022 1.00 0.00 H new ATOM 0 H4' A A 8 5.005 -10.196 -2.339 1.00 0.00 H new ATOM 0 H3' A A 8 5.474 -12.880 -2.696 1.00 0.00 H new ATOM 0 H2' A A 8 4.620 -13.051 -5.018 1.00 0.00 H new ATOM 0 HO2' A A 8 2.763 -13.751 -3.087 1.00 0.00 H new ATOM 0 H1' A A 8 2.247 -11.304 -4.222 1.00 0.00 H new ATOM 0 H8 A A 8 5.005 -11.164 -6.921 1.00 0.00 H new ATOM 0 H61 A A 8 0.324 -11.316 -10.926 1.00 0.00 H new ATOM 0 H62 A A 8 2.079 -11.211 -10.755 1.00 0.00 H new ATOM 0 H2 A A 8 -1.361 -11.574 -6.770 1.00 0.00 H new ATOM 253 P G A 9 4.106 -12.538 -0.401 1.00 0.00 P ATOM 254 OP1 G A 9 5.256 -13.471 -0.417 1.00 0.00 O ATOM 255 OP2 G A 9 2.893 -12.874 0.376 1.00 0.00 O ATOM 256 O5' G A 9 4.632 -11.097 0.086 1.00 0.00 O ATOM 257 C5' G A 9 3.981 -10.411 1.159 1.00 0.00 C ATOM 258 C4' G A 9 4.964 -10.083 2.287 1.00 0.00 C ATOM 259 O4' G A 9 6.294 -10.003 1.766 1.00 0.00 O ATOM 260 C3' G A 9 4.655 -8.732 2.946 1.00 0.00 C ATOM 261 O3' G A 9 4.248 -8.989 4.294 1.00 0.00 O ATOM 262 C2' G A 9 6.005 -8.008 3.023 1.00 0.00 C ATOM 263 O2' G A 9 6.585 -8.136 4.326 1.00 0.00 O ATOM 264 C1' G A 9 6.858 -8.706 1.979 1.00 0.00 C ATOM 265 N9 G A 9 6.912 -7.918 0.730 1.00 0.00 N ATOM 266 C8 G A 9 7.921 -7.158 0.244 1.00 0.00 C ATOM 267 N7 G A 9 7.730 -6.550 -0.877 1.00 0.00 N ATOM 268 C5 G A 9 6.428 -6.942 -1.195 1.00 0.00 C ATOM 269 C6 G A 9 5.627 -6.607 -2.320 1.00 0.00 C ATOM 270 O6 G A 9 5.915 -5.887 -3.273 1.00 0.00 O ATOM 271 N1 G A 9 4.379 -7.213 -2.256 1.00 0.00 N ATOM 272 C2 G A 9 3.949 -8.039 -1.238 1.00 0.00 C ATOM 273 N2 G A 9 2.713 -8.527 -1.356 1.00 0.00 N ATOM 274 N3 G A 9 4.696 -8.359 -0.176 1.00 0.00 N ATOM 275 C4 G A 9 5.917 -7.782 -0.216 1.00 0.00 C ATOM 0 H5' G A 9 3.170 -11.026 1.548 1.00 0.00 H new ATOM 0 H5'' G A 9 3.532 -9.491 0.786 1.00 0.00 H new ATOM 0 H4' G A 9 4.869 -10.878 3.026 1.00 0.00 H new ATOM 0 H3' G A 9 3.892 -8.169 2.408 1.00 0.00 H new ATOM 0 H2' G A 9 5.914 -6.937 2.843 1.00 0.00 H new ATOM 0 HO2' G A 9 5.937 -8.550 4.933 1.00 0.00 H new ATOM 0 H1' G A 9 7.888 -8.803 2.322 1.00 0.00 H new ATOM 0 H8 G A 9 8.855 -7.064 0.777 1.00 0.00 H new ATOM 0 H1 G A 9 3.729 -7.033 -3.022 1.00 0.00 H new ATOM 0 H21 G A 9 2.337 -9.144 -0.636 1.00 0.00 H new ATOM 0 H22 G A 9 2.144 -8.283 -2.166 1.00 0.00 H new ATOM 287 P U A 10 2.707 -8.813 4.728 1.00 0.00 P ATOM 288 OP1 U A 10 2.233 -10.100 5.285 1.00 0.00 O ATOM 289 OP2 U A 10 1.978 -8.183 3.604 1.00 0.00 O ATOM 290 O5' U A 10 2.796 -7.747 5.931 1.00 0.00 O ATOM 291 C5' U A 10 1.605 -7.195 6.501 1.00 0.00 C ATOM 292 C4' U A 10 1.691 -5.677 6.617 1.00 0.00 C ATOM 293 O4' U A 10 0.387 -5.084 6.637 1.00 0.00 O ATOM 294 C3' U A 10 2.364 -5.264 7.919 1.00 0.00 C ATOM 295 O3' U A 10 3.013 -4.008 7.706 1.00 0.00 O ATOM 296 C2' U A 10 1.195 -5.040 8.865 1.00 0.00 C ATOM 297 O2' U A 10 1.518 -4.081 9.878 1.00 0.00 O ATOM 298 C1' U A 10 0.115 -4.517 7.927 1.00 0.00 C ATOM 299 N1 U A 10 -1.226 -4.908 8.395 1.00 0.00 N ATOM 300 C2 U A 10 -1.991 -3.941 9.019 1.00 0.00 C ATOM 301 O2 U A 10 -1.582 -2.796 9.193 1.00 0.00 O ATOM 302 N3 U A 10 -3.248 -4.339 9.436 1.00 0.00 N ATOM 303 C4 U A 10 -3.796 -5.602 9.286 1.00 0.00 C ATOM 304 O4 U A 10 -4.929 -5.845 9.697 1.00 0.00 O ATOM 305 C5 U A 10 -2.925 -6.546 8.625 1.00 0.00 C ATOM 306 C6 U A 10 -1.691 -6.180 8.208 1.00 0.00 C ATOM 0 H5' U A 10 1.439 -7.627 7.488 1.00 0.00 H new ATOM 0 H5'' U A 10 0.747 -7.466 5.886 1.00 0.00 H new ATOM 0 H4' U A 10 2.263 -5.339 5.753 1.00 0.00 H new ATOM 0 H3' U A 10 3.091 -5.989 8.286 1.00 0.00 H new ATOM 0 H2' U A 10 0.900 -5.935 9.413 1.00 0.00 H new ATOM 0 HO2' U A 10 0.746 -3.957 10.469 1.00 0.00 H new ATOM 0 H1' U A 10 0.128 -3.428 7.889 1.00 0.00 H new ATOM 0 H3 U A 10 -3.826 -3.636 9.897 1.00 0.00 H new ATOM 0 H5 U A 10 -3.264 -7.558 8.461 1.00 0.00 H new ATOM 0 H6 U A 10 -1.061 -6.907 7.718 1.00 0.00 H new ATOM 317 P G A 11 4.336 -3.622 8.538 1.00 0.00 P ATOM 318 OP1 G A 11 4.841 -4.846 9.200 1.00 0.00 O ATOM 319 OP2 G A 11 4.043 -2.415 9.343 1.00 0.00 O ATOM 320 O5' G A 11 5.374 -3.212 7.377 1.00 0.00 O ATOM 321 C5' G A 11 4.906 -2.701 6.125 1.00 0.00 C ATOM 322 C4' G A 11 6.027 -2.643 5.093 1.00 0.00 C ATOM 323 O4' G A 11 6.074 -3.843 4.304 1.00 0.00 O ATOM 324 C3' G A 11 5.810 -1.507 4.102 1.00 0.00 C ATOM 325 O3' G A 11 6.540 -0.362 4.550 1.00 0.00 O ATOM 326 C2' G A 11 6.467 -2.042 2.846 1.00 0.00 C ATOM 327 O2' G A 11 7.890 -1.883 2.885 1.00 0.00 O ATOM 328 C1' G A 11 6.064 -3.503 2.909 1.00 0.00 C ATOM 329 N9 G A 11 4.723 -3.698 2.326 1.00 0.00 N ATOM 330 C8 G A 11 3.594 -4.183 2.898 1.00 0.00 C ATOM 331 N7 G A 11 2.523 -4.213 2.178 1.00 0.00 N ATOM 332 C5 G A 11 2.979 -3.684 0.967 1.00 0.00 C ATOM 333 C6 G A 11 2.276 -3.450 -0.245 1.00 0.00 C ATOM 334 O6 G A 11 1.092 -3.666 -0.493 1.00 0.00 O ATOM 335 N1 G A 11 3.104 -2.907 -1.218 1.00 0.00 N ATOM 336 C2 G A 11 4.445 -2.621 -1.052 1.00 0.00 C ATOM 337 N2 G A 11 5.072 -2.103 -2.108 1.00 0.00 N ATOM 338 N3 G A 11 5.114 -2.837 0.085 1.00 0.00 N ATOM 339 C4 G A 11 4.327 -3.367 1.049 1.00 0.00 C ATOM 0 H5' G A 11 4.491 -1.704 6.270 1.00 0.00 H new ATOM 0 H5'' G A 11 4.099 -3.331 5.752 1.00 0.00 H new ATOM 0 H4' G A 11 6.946 -2.505 5.662 1.00 0.00 H new ATOM 0 H3' G A 11 4.766 -1.221 3.972 1.00 0.00 H new ATOM 0 H2' G A 11 6.167 -1.533 1.930 1.00 0.00 H new ATOM 0 HO2' G A 11 8.118 -1.111 3.443 1.00 0.00 H new ATOM 0 H1' G A 11 6.743 -4.137 2.339 1.00 0.00 H new ATOM 0 H8 G A 11 3.591 -4.532 3.920 1.00 0.00 H new ATOM 0 H1 G A 11 2.689 -2.703 -2.127 1.00 0.00 H new ATOM 0 H21 G A 11 6.063 -1.870 -2.049 1.00 0.00 H new ATOM 0 H22 G A 11 4.560 -1.940 -2.975 1.00 0.00 H new ATOM 351 P A A 12 5.757 0.971 5.002 1.00 0.00 P ATOM 352 OP1 A A 12 6.560 1.648 6.044 1.00 0.00 O ATOM 353 OP2 A A 12 4.348 0.609 5.275 1.00 0.00 O ATOM 354 O5' A A 12 5.796 1.874 3.669 1.00 0.00 O ATOM 355 C5' A A 12 6.936 2.689 3.382 1.00 0.00 C ATOM 356 C4' A A 12 7.142 2.863 1.880 1.00 0.00 C ATOM 357 O4' A A 12 6.874 1.647 1.176 1.00 0.00 O ATOM 358 C3' A A 12 6.177 3.883 1.299 1.00 0.00 C ATOM 359 O3' A A 12 6.795 5.173 1.341 1.00 0.00 O ATOM 360 C2' A A 12 6.079 3.446 -0.155 1.00 0.00 C ATOM 361 O2' A A 12 7.161 3.970 -0.933 1.00 0.00 O ATOM 362 C1' A A 12 6.161 1.931 -0.041 1.00 0.00 C ATOM 363 N9 A A 12 4.811 1.338 -0.022 1.00 0.00 N ATOM 364 C8 A A 12 4.245 0.495 0.875 1.00 0.00 C ATOM 365 N7 A A 12 3.042 0.091 0.637 1.00 0.00 N ATOM 366 C5 A A 12 2.760 0.742 -0.568 1.00 0.00 C ATOM 367 C6 A A 12 1.634 0.755 -1.396 1.00 0.00 C ATOM 368 N6 A A 12 0.528 0.060 -1.132 1.00 0.00 N ATOM 369 N1 A A 12 1.693 1.507 -2.510 1.00 0.00 N ATOM 370 C2 A A 12 2.794 2.206 -2.795 1.00 0.00 C ATOM 371 N3 A A 12 3.914 2.264 -2.083 1.00 0.00 N ATOM 372 C4 A A 12 3.831 1.503 -0.974 1.00 0.00 C ATOM 0 H5' A A 12 7.826 2.238 3.821 1.00 0.00 H new ATOM 0 H5'' A A 12 6.811 3.667 3.848 1.00 0.00 H new ATOM 0 H4' A A 12 8.178 3.180 1.761 1.00 0.00 H new ATOM 0 H3' A A 12 5.220 3.937 1.818 1.00 0.00 H new ATOM 0 H2' A A 12 5.178 3.799 -0.657 1.00 0.00 H new ATOM 0 HO2' A A 12 7.498 4.789 -0.514 1.00 0.00 H new ATOM 0 H1' A A 12 6.679 1.498 -0.897 1.00 0.00 H new ATOM 0 H8 A A 12 4.780 0.173 1.756 1.00 0.00 H new ATOM 0 H61 A A 12 -0.267 0.104 -1.770 1.00 0.00 H new ATOM 0 H62 A A 12 0.476 -0.516 -0.292 1.00 0.00 H new ATOM 0 H2 A A 12 2.772 2.788 -3.704 1.00 0.00 H new ATOM 384 P G A 13 5.933 6.480 1.722 1.00 0.00 P ATOM 385 OP1 G A 13 6.873 7.561 2.095 1.00 0.00 O ATOM 386 OP2 G A 13 4.864 6.074 2.662 1.00 0.00 O ATOM 387 O5' G A 13 5.246 6.876 0.319 1.00 0.00 O ATOM 388 C5' G A 13 5.879 7.807 -0.562 1.00 0.00 C ATOM 389 C4' G A 13 5.138 7.921 -1.892 1.00 0.00 C ATOM 390 O4' G A 13 4.782 6.632 -2.405 1.00 0.00 O ATOM 391 C3' G A 13 3.826 8.675 -1.729 1.00 0.00 C ATOM 392 O3' G A 13 4.053 10.055 -2.027 1.00 0.00 O ATOM 393 C2' G A 13 2.958 8.084 -2.823 1.00 0.00 C ATOM 394 O2' G A 13 3.194 8.715 -4.087 1.00 0.00 O ATOM 395 C1' G A 13 3.409 6.632 -2.832 1.00 0.00 C ATOM 396 N9 G A 13 2.573 5.826 -1.925 1.00 0.00 N ATOM 397 C8 G A 13 2.868 5.310 -0.708 1.00 0.00 C ATOM 398 N7 G A 13 1.946 4.642 -0.101 1.00 0.00 N ATOM 399 C5 G A 13 0.893 4.712 -1.018 1.00 0.00 C ATOM 400 C6 G A 13 -0.417 4.170 -0.942 1.00 0.00 C ATOM 401 O6 G A 13 -0.917 3.509 -0.035 1.00 0.00 O ATOM 402 N1 G A 13 -1.160 4.472 -2.076 1.00 0.00 N ATOM 403 C2 G A 13 -0.703 5.204 -3.154 1.00 0.00 C ATOM 404 N2 G A 13 -1.568 5.388 -4.150 1.00 0.00 N ATOM 405 N3 G A 13 0.528 5.718 -3.234 1.00 0.00 N ATOM 406 C4 G A 13 1.270 5.437 -2.139 1.00 0.00 C ATOM 0 H5' G A 13 6.907 7.494 -0.744 1.00 0.00 H new ATOM 0 H5'' G A 13 5.924 8.786 -0.085 1.00 0.00 H new ATOM 0 H4' G A 13 5.818 8.442 -2.566 1.00 0.00 H new ATOM 0 H3' G A 13 3.394 8.598 -0.731 1.00 0.00 H new ATOM 0 H2' G A 13 1.889 8.213 -2.650 1.00 0.00 H new ATOM 0 HO2' G A 13 3.474 9.643 -3.942 1.00 0.00 H new ATOM 0 H1' G A 13 3.311 6.191 -3.824 1.00 0.00 H new ATOM 0 H8 G A 13 3.841 5.453 -0.261 1.00 0.00 H new ATOM 0 H1 G A 13 -2.119 4.126 -2.116 1.00 0.00 H new ATOM 0 H21 G A 13 -1.291 5.920 -4.975 1.00 0.00 H new ATOM 0 H22 G A 13 -2.508 4.997 -4.088 1.00 0.00 H new ATOM 418 P C A 14 3.280 11.204 -1.204 1.00 0.00 P ATOM 419 OP1 C A 14 3.951 12.496 -1.470 1.00 0.00 O ATOM 420 OP2 C A 14 3.104 10.737 0.189 1.00 0.00 O ATOM 421 O5' C A 14 1.834 11.231 -1.912 1.00 0.00 O ATOM 422 C5' C A 14 1.667 11.844 -3.194 1.00 0.00 C ATOM 423 C4' C A 14 0.401 11.356 -3.892 1.00 0.00 C ATOM 424 O4' C A 14 0.203 9.955 -3.697 1.00 0.00 O ATOM 425 C3' C A 14 -0.834 12.022 -3.316 1.00 0.00 C ATOM 426 O3' C A 14 -1.102 13.205 -4.074 1.00 0.00 O ATOM 427 C2' C A 14 -1.933 11.012 -3.598 1.00 0.00 C ATOM 428 O2' C A 14 -2.514 11.221 -4.891 1.00 0.00 O ATOM 429 C1' C A 14 -1.196 9.674 -3.525 1.00 0.00 C ATOM 430 N1 C A 14 -1.444 9.008 -2.232 1.00 0.00 N ATOM 431 C2 C A 14 -2.687 8.423 -2.044 1.00 0.00 C ATOM 432 O2 C A 14 -3.527 8.464 -2.939 1.00 0.00 O ATOM 433 N3 C A 14 -2.941 7.814 -0.854 1.00 0.00 N ATOM 434 C4 C A 14 -2.014 7.779 0.113 1.00 0.00 C ATOM 435 N4 C A 14 -2.297 7.177 1.268 1.00 0.00 N ATOM 436 C5 C A 14 -0.730 8.380 -0.076 1.00 0.00 C ATOM 437 C6 C A 14 -0.488 8.981 -1.258 1.00 0.00 C ATOM 0 H5' C A 14 2.534 11.625 -3.818 1.00 0.00 H new ATOM 0 H5'' C A 14 1.624 12.927 -3.077 1.00 0.00 H new ATOM 0 H4' C A 14 0.534 11.596 -4.947 1.00 0.00 H new ATOM 0 H3' C A 14 -0.741 12.288 -2.263 1.00 0.00 H new ATOM 0 H2' C A 14 -2.768 11.079 -2.900 1.00 0.00 H new ATOM 0 HO2' C A 14 -3.325 10.678 -4.977 1.00 0.00 H new ATOM 0 H1' C A 14 -1.550 8.996 -4.301 1.00 0.00 H new ATOM 0 H41 C A 14 -1.599 7.145 2.011 1.00 0.00 H new ATOM 0 H42 C A 14 -3.212 6.749 1.409 1.00 0.00 H new ATOM 0 H5 C A 14 0.019 8.353 0.701 1.00 0.00 H new ATOM 0 H6 C A 14 0.471 9.445 -1.436 1.00 0.00 H new ATOM 449 P C A 15 -1.995 14.390 -3.450 1.00 0.00 P ATOM 450 OP1 C A 15 -1.939 15.547 -4.371 1.00 0.00 O ATOM 451 OP2 C A 15 -1.615 14.559 -2.030 1.00 0.00 O ATOM 452 O5' C A 15 -3.481 13.774 -3.505 1.00 0.00 O ATOM 453 C5' C A 15 -4.037 13.330 -4.745 1.00 0.00 C ATOM 454 C4' C A 15 -5.523 13.013 -4.610 1.00 0.00 C ATOM 455 O4' C A 15 -5.725 11.735 -4.000 1.00 0.00 O ATOM 456 C3' C A 15 -6.215 14.027 -3.710 1.00 0.00 C ATOM 457 O3' C A 15 -6.712 15.141 -4.460 1.00 0.00 O ATOM 458 C2' C A 15 -7.345 13.213 -3.109 1.00 0.00 C ATOM 459 O2' C A 15 -8.492 13.194 -3.967 1.00 0.00 O ATOM 460 C1' C A 15 -6.724 11.828 -2.976 1.00 0.00 C ATOM 461 N1 C A 15 -6.131 11.640 -1.639 1.00 0.00 N ATOM 462 C2 C A 15 -6.877 10.939 -0.706 1.00 0.00 C ATOM 463 O2 C A 15 -7.986 10.504 -1.005 1.00 0.00 O ATOM 464 N3 C A 15 -6.349 10.752 0.534 1.00 0.00 N ATOM 465 C4 C A 15 -5.139 11.234 0.846 1.00 0.00 C ATOM 466 N4 C A 15 -4.652 11.033 2.069 1.00 0.00 N ATOM 467 C5 C A 15 -4.365 11.959 -0.115 1.00 0.00 C ATOM 468 C6 C A 15 -4.897 12.138 -1.340 1.00 0.00 C ATOM 0 H5' C A 15 -3.504 12.443 -5.087 1.00 0.00 H new ATOM 0 H5'' C A 15 -3.896 14.099 -5.504 1.00 0.00 H new ATOM 0 H4' C A 15 -5.934 13.034 -5.619 1.00 0.00 H new ATOM 0 H3' C A 15 -5.554 14.468 -2.964 1.00 0.00 H new ATOM 0 H2' C A 15 -7.711 13.614 -2.164 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.413 13.907 -4.634 1.00 0.00 H new ATOM 0 HO3' C A 15 -7.152 15.773 -3.854 1.00 0.00 H new ATOM 0 H1' C A 15 -7.477 11.048 -3.090 1.00 0.00 H new ATOM 0 H41 C A 15 -3.732 11.396 2.317 1.00 0.00 H new ATOM 0 H42 C A 15 -5.199 10.516 2.757 1.00 0.00 H new ATOM 0 H5 C A 15 -3.389 12.349 0.133 1.00 0.00 H new ATOM 0 H6 C A 15 -4.342 12.680 -2.091 1.00 0.00 H new TER 481 C A 15