USER MOD reduce.3.24.130724 H: found=0, std=0, add=186, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 186 hydrogens (21 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 PSU O2' : rot -139:sc= 0.0956 USER MOD Single : A 2 C O2' : rot -24:sc= 0.0568 USER MOD Single : A 3 G O2' : rot -29:sc= 0.0472 USER MOD Single : A 4 G O2' : rot -16:sc= 0.058 USER MOD Single : A 5 G O2' : rot -16:sc= -0.17 USER MOD Single : A 6 C O2' : rot -17:sc= -0.115 USER MOD Single : A 7 C O2' : rot -29:sc= 0.322 USER MOD Single : A 8 RSQ O2' : rot -127:sc= 0.23 USER MOD Single : A 9 A O2' : rot -20:sc= 0.116 USER MOD Single : A 10 U O2' : rot 180:sc= -3.72! USER MOD Single : A 11 A O2' : rot -19:sc= 0.07 USER MOD Single : A 12 C O2' : rot -18:sc= 0.0653 USER MOD Single : A 13 C O2' : rot 180:sc= -0.141 USER MOD Single : A 14 C O2' : rot -22:sc= 0.067 USER MOD Single : A 15 C O2' : rot -18:sc= 0.0867 USER MOD Single : A 16 G O2' : rot -111:sc= 0.349 USER MOD Single : A 17 A O2' : rot -19:sc= 0.0785 USER MOD Single : A 17 A O3' : rot 180:sc= 0.077 USER MOD ----------------------------------------------------------------- HETATM 1 N1 PSU A 1 -8.227 3.312 8.276 1.00 0.00 N HETATM 2 C2 PSU A 1 -7.982 4.668 8.274 1.00 0.00 C HETATM 3 N3 PSU A 1 -9.028 5.445 7.848 1.00 0.00 N HETATM 4 C4 PSU A 1 -10.266 5.014 7.434 1.00 0.00 C HETATM 5 C5 PSU A 1 -10.445 3.594 7.465 1.00 0.00 C HETATM 6 C6 PSU A 1 -9.443 2.806 7.876 1.00 0.00 C HETATM 7 O2 PSU A 1 -6.922 5.147 8.633 1.00 0.00 O HETATM 8 O4 PSU A 1 -11.103 5.843 7.079 1.00 0.00 O HETATM 9 C1' PSU A 1 -11.737 3.051 7.039 1.00 0.00 C HETATM 10 C2' PSU A 1 -11.995 3.170 5.536 1.00 0.00 C HETATM 11 O2' PSU A 1 -13.389 3.297 5.327 1.00 0.00 O HETATM 12 C3' PSU A 1 -11.482 1.824 5.038 1.00 0.00 C HETATM 13 C4' PSU A 1 -11.882 0.877 6.161 1.00 0.00 C HETATM 14 O3' PSU A 1 -12.076 1.437 3.800 1.00 0.00 O HETATM 15 O4' PSU A 1 -11.775 1.675 7.372 1.00 0.00 O HETATM 16 C5' PSU A 1 -11.019 -0.355 6.309 1.00 0.00 C HETATM 17 O5' PSU A 1 -9.639 0.001 6.443 1.00 0.00 O HETATM 0 HO2' PSU A 1 -13.653 2.763 4.549 1.00 0.00 H new HETATM 0 H5'' PSU A 1 -11.338 -0.925 7.182 1.00 0.00 H new HETATM 0 HN3 PSU A 1 -8.871 6.453 7.837 1.00 0.00 H new HETATM 0 HN1 PSU A 1 -7.494 2.671 8.580 1.00 0.00 H new HETATM 0 H6 PSU A 1 -9.596 1.727 7.894 1.00 0.00 H new HETATM 0 H5' PSU A 1 -11.149 -1.002 5.441 1.00 0.00 H new HETATM 0 H4' PSU A 1 -12.877 0.487 5.949 1.00 0.00 H new HETATM 0 H3' PSU A 1 -10.412 1.835 4.831 1.00 0.00 H new HETATM 0 H2' PSU A 1 -11.527 4.020 5.040 1.00 0.00 H new HETATM 0 H1' PSU A 1 -12.503 3.635 7.549 1.00 0.00 H new ATOM 28 P C A 2 -11.165 1.299 2.481 1.00 0.00 P ATOM 29 OP1 C A 2 -12.011 0.683 1.428 1.00 0.00 O ATOM 30 OP2 C A 2 -9.880 0.656 2.859 1.00 0.00 O ATOM 31 O5' C A 2 -10.866 2.807 2.061 1.00 0.00 O ATOM 32 C5' C A 2 -11.924 3.695 1.705 1.00 0.00 C ATOM 33 C4' C A 2 -11.373 4.886 0.958 1.00 0.00 C ATOM 34 O4' C A 2 -10.897 5.868 1.922 1.00 0.00 O ATOM 35 C3' C A 2 -10.170 4.594 0.069 1.00 0.00 C ATOM 36 O3' C A 2 -10.573 4.182 -1.236 1.00 0.00 O ATOM 37 C2' C A 2 -9.435 5.927 0.073 1.00 0.00 C ATOM 38 O2' C A 2 -10.077 6.874 -0.761 1.00 0.00 O ATOM 39 C1' C A 2 -9.621 6.344 1.529 1.00 0.00 C ATOM 40 N1 C A 2 -8.612 5.783 2.446 1.00 0.00 N ATOM 41 C2 C A 2 -7.299 6.256 2.378 1.00 0.00 C ATOM 42 O2 C A 2 -7.020 7.145 1.559 1.00 0.00 O ATOM 43 N3 C A 2 -6.365 5.735 3.205 1.00 0.00 N ATOM 44 C4 C A 2 -6.702 4.783 4.077 1.00 0.00 C ATOM 45 N4 C A 2 -5.746 4.295 4.869 1.00 0.00 N ATOM 46 C5 C A 2 -8.034 4.287 4.174 1.00 0.00 C ATOM 47 C6 C A 2 -8.948 4.811 3.348 1.00 0.00 C ATOM 0 H5' C A 2 -12.447 4.028 2.602 1.00 0.00 H new ATOM 0 H5'' C A 2 -12.654 3.174 1.086 1.00 0.00 H new ATOM 0 H4' C A 2 -12.197 5.222 0.329 1.00 0.00 H new ATOM 0 H3' C A 2 -9.547 3.770 0.417 1.00 0.00 H new ATOM 0 H2' C A 2 -8.406 5.862 -0.280 1.00 0.00 H new ATOM 0 HO2' C A 2 -10.606 6.406 -1.440 1.00 0.00 H new ATOM 0 H1' C A 2 -9.518 7.427 1.589 1.00 0.00 H new ATOM 0 H41 C A 2 -5.968 3.566 5.547 1.00 0.00 H new ATOM 0 H42 C A 2 -4.793 4.650 4.796 1.00 0.00 H new ATOM 0 H5 C A 2 -8.296 3.518 4.886 1.00 0.00 H new ATOM 0 H6 C A 2 -9.968 4.460 3.395 1.00 0.00 H new ATOM 59 P G A 3 -9.759 3.021 -2.000 1.00 0.00 P ATOM 60 OP1 G A 3 -10.652 2.449 -3.040 1.00 0.00 O ATOM 61 OP2 G A 3 -9.148 2.122 -0.987 1.00 0.00 O ATOM 62 O5' G A 3 -8.582 3.801 -2.737 1.00 0.00 O ATOM 63 C5' G A 3 -8.862 4.850 -3.661 1.00 0.00 C ATOM 64 C4' G A 3 -7.663 5.759 -3.798 1.00 0.00 C ATOM 65 O4' G A 3 -7.357 6.343 -2.501 1.00 0.00 O ATOM 66 C3' G A 3 -6.365 5.082 -4.217 1.00 0.00 C ATOM 67 O3' G A 3 -6.282 4.922 -5.631 1.00 0.00 O ATOM 68 C2' G A 3 -5.317 6.042 -3.671 1.00 0.00 C ATOM 69 O2' G A 3 -5.211 7.202 -4.477 1.00 0.00 O ATOM 70 C1' G A 3 -5.951 6.428 -2.336 1.00 0.00 C ATOM 71 N9 G A 3 -5.561 5.554 -1.232 1.00 0.00 N ATOM 72 C8 G A 3 -6.246 4.463 -0.756 1.00 0.00 C ATOM 73 N7 G A 3 -5.647 3.871 0.239 1.00 0.00 N ATOM 74 C5 G A 3 -4.492 4.616 0.433 1.00 0.00 C ATOM 75 C6 G A 3 -3.443 4.454 1.372 1.00 0.00 C ATOM 76 O6 G A 3 -3.320 3.591 2.249 1.00 0.00 O ATOM 77 N1 G A 3 -2.466 5.431 1.220 1.00 0.00 N ATOM 78 C2 G A 3 -2.492 6.433 0.286 1.00 0.00 C ATOM 79 N2 G A 3 -1.452 7.273 0.298 1.00 0.00 N ATOM 80 N3 G A 3 -3.464 6.598 -0.595 1.00 0.00 N ATOM 81 C4 G A 3 -4.424 5.659 -0.466 1.00 0.00 C ATOM 0 H5' G A 3 -9.725 5.423 -3.321 1.00 0.00 H new ATOM 0 H5'' G A 3 -9.121 4.429 -4.632 1.00 0.00 H new ATOM 0 H4' G A 3 -7.958 6.466 -4.573 1.00 0.00 H new ATOM 0 H3' G A 3 -6.253 4.066 -3.839 1.00 0.00 H new ATOM 0 H2' G A 3 -4.316 5.613 -3.619 1.00 0.00 H new ATOM 0 HO2' G A 3 -5.447 6.980 -5.402 1.00 0.00 H new ATOM 0 H1' G A 3 -5.610 7.431 -2.078 1.00 0.00 H new ATOM 0 H8 G A 3 -7.188 4.129 -1.165 1.00 0.00 H new ATOM 0 H1 G A 3 -1.667 5.399 1.853 1.00 0.00 H new ATOM 0 H21 G A 3 -1.409 8.041 -0.371 1.00 0.00 H new ATOM 0 H22 G A 3 -0.701 7.145 0.977 1.00 0.00 H new ATOM 93 P G A 4 -5.449 3.691 -6.251 1.00 0.00 P ATOM 94 OP1 G A 4 -5.648 3.703 -7.724 1.00 0.00 O ATOM 95 OP2 G A 4 -5.791 2.471 -5.476 1.00 0.00 O ATOM 96 O5' G A 4 -3.928 4.061 -5.947 1.00 0.00 O ATOM 97 C5' G A 4 -3.276 5.121 -6.645 1.00 0.00 C ATOM 98 C4' G A 4 -2.095 5.630 -5.847 1.00 0.00 C ATOM 99 O4' G A 4 -2.484 5.735 -4.449 1.00 0.00 O ATOM 100 C3' G A 4 -0.863 4.734 -5.830 1.00 0.00 C ATOM 101 O3' G A 4 -0.024 4.969 -6.959 1.00 0.00 O ATOM 102 C2' G A 4 -0.191 5.130 -4.521 1.00 0.00 C ATOM 103 O2' G A 4 0.497 6.360 -4.652 1.00 0.00 O ATOM 104 C1' G A 4 -1.406 5.342 -3.620 1.00 0.00 C ATOM 105 N9 G A 4 -1.802 4.146 -2.881 1.00 0.00 N ATOM 106 C8 G A 4 -2.897 3.350 -3.112 1.00 0.00 C ATOM 107 N7 G A 4 -2.991 2.348 -2.281 1.00 0.00 N ATOM 108 C5 G A 4 -1.887 2.490 -1.451 1.00 0.00 C ATOM 109 C6 G A 4 -1.452 1.700 -0.355 1.00 0.00 C ATOM 110 O6 G A 4 -1.972 0.685 0.121 1.00 0.00 O ATOM 111 N1 G A 4 -0.281 2.201 0.201 1.00 0.00 N ATOM 112 C2 G A 4 0.386 3.317 -0.235 1.00 0.00 C ATOM 113 N2 G A 4 1.499 3.635 0.433 1.00 0.00 N ATOM 114 N3 G A 4 -0.009 4.064 -1.250 1.00 0.00 N ATOM 115 C4 G A 4 -1.143 3.595 -1.809 1.00 0.00 C ATOM 0 H5' G A 4 -3.980 5.934 -6.824 1.00 0.00 H new ATOM 0 H5'' G A 4 -2.940 4.770 -7.621 1.00 0.00 H new ATOM 0 H4' G A 4 -1.832 6.568 -6.336 1.00 0.00 H new ATOM 0 H3' G A 4 -1.095 3.671 -5.889 1.00 0.00 H new ATOM 0 H2' G A 4 0.540 4.402 -4.169 1.00 0.00 H new ATOM 0 HO2' G A 4 0.619 6.567 -5.602 1.00 0.00 H new ATOM 0 H1' G A 4 -1.143 6.096 -2.878 1.00 0.00 H new ATOM 0 H8 G A 4 -3.609 3.535 -3.902 1.00 0.00 H new ATOM 0 H1 G A 4 0.114 1.699 0.996 1.00 0.00 H new ATOM 0 H21 G A 4 2.042 4.454 0.159 1.00 0.00 H new ATOM 0 H22 G A 4 1.806 3.059 1.217 1.00 0.00 H new ATOM 127 P G A 5 1.119 3.903 -7.346 1.00 0.00 P ATOM 128 OP1 G A 5 1.854 4.461 -8.510 1.00 0.00 O ATOM 129 OP2 G A 5 0.496 2.559 -7.451 1.00 0.00 O ATOM 130 O5' G A 5 2.101 3.904 -6.091 1.00 0.00 O ATOM 131 C5' G A 5 3.107 4.906 -5.950 1.00 0.00 C ATOM 132 C4' G A 5 3.907 4.678 -4.686 1.00 0.00 C ATOM 133 O4' G A 5 3.011 4.404 -3.573 1.00 0.00 O ATOM 134 C3' G A 5 4.834 3.473 -4.689 1.00 0.00 C ATOM 135 O3' G A 5 6.047 3.727 -5.393 1.00 0.00 O ATOM 136 C2' G A 5 5.053 3.254 -3.198 1.00 0.00 C ATOM 137 O2' G A 5 5.935 4.222 -2.659 1.00 0.00 O ATOM 138 C1' G A 5 3.647 3.519 -2.662 1.00 0.00 C ATOM 139 N9 G A 5 2.831 2.314 -2.542 1.00 0.00 N ATOM 140 C8 G A 5 1.775 1.946 -3.344 1.00 0.00 C ATOM 141 N7 G A 5 1.221 0.820 -2.983 1.00 0.00 N ATOM 142 C5 G A 5 1.961 0.412 -1.879 1.00 0.00 C ATOM 143 C6 G A 5 1.834 -0.743 -1.063 1.00 0.00 C ATOM 144 O6 G A 5 1.018 -1.666 -1.156 1.00 0.00 O ATOM 145 N1 G A 5 2.789 -0.764 -0.052 1.00 0.00 N ATOM 146 C2 G A 5 3.753 0.194 0.141 1.00 0.00 C ATOM 147 N2 G A 5 4.591 -0.011 1.163 1.00 0.00 N ATOM 148 N3 G A 5 3.886 1.274 -0.613 1.00 0.00 N ATOM 149 C4 G A 5 2.962 1.320 -1.596 1.00 0.00 C ATOM 0 H5' G A 5 2.645 5.893 -5.922 1.00 0.00 H new ATOM 0 H5'' G A 5 3.770 4.889 -6.815 1.00 0.00 H new ATOM 0 H4' G A 5 4.496 5.592 -4.606 1.00 0.00 H new ATOM 0 H3' G A 5 4.428 2.601 -5.202 1.00 0.00 H new ATOM 0 H2' G A 5 5.482 2.281 -2.957 1.00 0.00 H new ATOM 0 HO2' G A 5 6.421 4.663 -3.387 1.00 0.00 H new ATOM 0 H1' G A 5 3.742 3.933 -1.658 1.00 0.00 H new ATOM 0 H8 G A 5 1.438 2.530 -4.188 1.00 0.00 H new ATOM 0 H1 G A 5 2.772 -1.552 0.596 1.00 0.00 H new ATOM 0 H21 G A 5 5.330 0.664 1.360 1.00 0.00 H new ATOM 0 H22 G A 5 4.491 -0.842 1.746 1.00 0.00 H new ATOM 161 P C A 6 6.845 2.506 -6.074 1.00 0.00 P ATOM 162 OP1 C A 6 8.186 3.019 -6.454 1.00 0.00 O ATOM 163 OP2 C A 6 5.975 1.892 -7.109 1.00 0.00 O ATOM 164 O5' C A 6 7.027 1.457 -4.889 1.00 0.00 O ATOM 165 C5' C A 6 7.928 1.713 -3.813 1.00 0.00 C ATOM 166 C4' C A 6 8.027 0.500 -2.919 1.00 0.00 C ATOM 167 O4' C A 6 6.769 0.300 -2.220 1.00 0.00 O ATOM 168 C3' C A 6 8.240 -0.817 -3.641 1.00 0.00 C ATOM 169 O3' C A 6 9.600 -1.004 -4.017 1.00 0.00 O ATOM 170 C2' C A 6 7.760 -1.827 -2.606 1.00 0.00 C ATOM 171 O2' C A 6 8.716 -2.019 -1.579 1.00 0.00 O ATOM 172 C1' C A 6 6.557 -1.090 -2.018 1.00 0.00 C ATOM 173 N1 C A 6 5.278 -1.470 -2.642 1.00 0.00 N ATOM 174 C2 C A 6 4.772 -2.755 -2.416 1.00 0.00 C ATOM 175 O2 C A 6 5.398 -3.526 -1.674 1.00 0.00 O ATOM 176 N3 C A 6 3.614 -3.121 -3.010 1.00 0.00 N ATOM 177 C4 C A 6 2.963 -2.255 -3.789 1.00 0.00 C ATOM 178 N4 C A 6 1.834 -2.662 -4.366 1.00 0.00 N ATOM 179 C5 C A 6 3.444 -0.934 -4.013 1.00 0.00 C ATOM 180 C6 C A 6 4.594 -0.591 -3.430 1.00 0.00 C ATOM 0 H5' C A 6 7.584 2.572 -3.237 1.00 0.00 H new ATOM 0 H5'' C A 6 8.913 1.966 -4.206 1.00 0.00 H new ATOM 0 H4' C A 6 8.884 0.720 -2.283 1.00 0.00 H new ATOM 0 H3' C A 6 7.708 -0.896 -4.589 1.00 0.00 H new ATOM 0 H2' C A 6 7.562 -2.813 -3.027 1.00 0.00 H new ATOM 0 HO2' C A 6 9.586 -1.676 -1.873 1.00 0.00 H new ATOM 0 H1' C A 6 6.482 -1.354 -0.963 1.00 0.00 H new ATOM 0 H41 C A 6 1.311 -2.026 -4.968 1.00 0.00 H new ATOM 0 H42 C A 6 1.493 -3.610 -4.206 1.00 0.00 H new ATOM 0 H5 C A 6 2.899 -0.236 -4.631 1.00 0.00 H new ATOM 0 H6 C A 6 4.991 0.401 -3.585 1.00 0.00 H new ATOM 192 P C A 7 9.946 -1.760 -5.393 1.00 0.00 P ATOM 193 OP1 C A 7 11.420 -1.935 -5.442 1.00 0.00 O ATOM 194 OP2 C A 7 9.254 -1.058 -6.506 1.00 0.00 O ATOM 195 O5' C A 7 9.278 -3.196 -5.219 1.00 0.00 O ATOM 196 C5' C A 7 9.644 -4.047 -4.135 1.00 0.00 C ATOM 197 C4' C A 7 8.574 -5.088 -3.899 1.00 0.00 C ATOM 198 O4' C A 7 7.270 -4.444 -3.866 1.00 0.00 O ATOM 199 C3' C A 7 8.460 -6.153 -4.980 1.00 0.00 C ATOM 200 O3' C A 7 9.381 -7.209 -4.714 1.00 0.00 O ATOM 201 C2' C A 7 6.997 -6.573 -4.881 1.00 0.00 C ATOM 202 O2' C A 7 6.790 -7.453 -3.791 1.00 0.00 O ATOM 203 C1' C A 7 6.317 -5.245 -4.544 1.00 0.00 C ATOM 204 N1 C A 7 5.816 -4.474 -5.699 1.00 0.00 N ATOM 205 C2 C A 7 4.992 -5.102 -6.644 1.00 0.00 C ATOM 206 O2 C A 7 4.702 -6.298 -6.494 1.00 0.00 O ATOM 207 N3 C A 7 4.532 -4.385 -7.695 1.00 0.00 N ATOM 208 C4 C A 7 4.860 -3.097 -7.820 1.00 0.00 C ATOM 209 N4 C A 7 4.375 -2.430 -8.870 1.00 0.00 N ATOM 210 C5 C A 7 5.697 -2.435 -6.874 1.00 0.00 C ATOM 211 C6 C A 7 6.147 -3.155 -5.842 1.00 0.00 C ATOM 0 H5' C A 7 9.789 -3.454 -3.232 1.00 0.00 H new ATOM 0 H5'' C A 7 10.594 -4.535 -4.352 1.00 0.00 H new ATOM 0 H4' C A 7 8.866 -5.566 -2.964 1.00 0.00 H new ATOM 0 H3' C A 7 8.710 -5.822 -5.988 1.00 0.00 H new ATOM 0 H2' C A 7 6.640 -7.079 -5.778 1.00 0.00 H new ATOM 0 HO2' C A 7 7.611 -7.961 -3.620 1.00 0.00 H new ATOM 0 H1' C A 7 5.437 -5.493 -3.950 1.00 0.00 H new ATOM 0 H41 C A 7 4.604 -1.444 -8.998 1.00 0.00 H new ATOM 0 H42 C A 7 3.775 -2.906 -9.544 1.00 0.00 H new ATOM 0 H5 C A 7 5.957 -1.393 -6.987 1.00 0.00 H new ATOM 0 H6 C A 7 6.784 -2.686 -5.107 1.00 0.00 H new HETATM 223 P RSQ A 8 9.393 -8.527 -5.637 1.00 0.00 P HETATM 224 N1 RSQ A 8 8.318 -12.399 -7.854 1.00 0.00 N HETATM 225 C2 RSQ A 8 7.601 -13.571 -8.101 1.00 0.00 C HETATM 226 O2 RSQ A 8 7.387 -13.909 -9.274 1.00 0.00 O HETATM 227 N3 RSQ A 8 7.159 -14.305 -7.057 1.00 0.00 N HETATM 228 C4 RSQ A 8 7.414 -13.911 -5.811 1.00 0.00 C HETATM 229 N4 RSQ A 8 6.956 -14.667 -4.822 1.00 0.00 N HETATM 230 C5 RSQ A 8 8.151 -12.725 -5.525 1.00 0.00 C HETATM 231 C6 RSQ A 8 8.580 -12.009 -6.572 1.00 0.00 C HETATM 232 C1' RSQ A 8 8.793 -11.597 -8.993 1.00 0.00 C HETATM 233 C10 RSQ A 8 8.462 -12.254 -4.184 1.00 0.00 C HETATM 234 C2' RSQ A 8 7.723 -10.672 -9.581 1.00 0.00 C HETATM 235 O2' RSQ A 8 7.738 -10.818 -10.988 1.00 0.00 O HETATM 236 C3' RSQ A 8 8.212 -9.282 -9.166 1.00 0.00 C HETATM 237 O3' RSQ A 8 7.885 -8.303 -10.147 1.00 0.00 O HETATM 238 O30 RSQ A 8 8.146 -12.789 -3.161 1.00 0.00 O HETATM 239 C4' RSQ A 8 9.719 -9.453 -9.034 1.00 0.00 C HETATM 240 O4' RSQ A 8 9.880 -10.807 -8.553 1.00 0.00 O HETATM 241 C5' RSQ A 8 10.412 -8.510 -8.073 1.00 0.00 C HETATM 242 O5' RSQ A 8 9.476 -7.975 -7.132 1.00 0.00 O HETATM 243 OP1 RSQ A 8 10.653 -9.247 -5.318 1.00 0.00 O HETATM 244 OP2 RSQ A 8 8.094 -9.224 -5.472 1.00 0.00 O HETATM 0 HO2' RSQ A 8 7.833 -9.937 -11.407 1.00 0.00 H new HETATM 0 HN4A RSQ A 8 7.130 -14.400 -3.853 1.00 0.00 H new HETATM 0 H5'A RSQ A 8 11.206 -9.038 -7.545 1.00 0.00 H new HETATM 0 HN4 RSQ A 8 6.430 -15.516 -5.030 1.00 0.00 H new HETATM 0 H6 RSQ A 8 9.150 -11.096 -6.397 1.00 0.00 H new HETATM 0 H5' RSQ A 8 10.883 -7.698 -8.627 1.00 0.00 H new HETATM 0 H4' RSQ A 8 10.179 -9.233 -9.997 1.00 0.00 H new HETATM 0 H3' RSQ A 8 7.747 -8.931 -8.245 1.00 0.00 H new HETATM 0 H2' RSQ A 8 6.705 -10.871 -9.245 1.00 0.00 H new HETATM 0 H10 RSQ A 8 9.035 -11.330 -4.104 1.00 0.00 H new HETATM 0 H1' RSQ A 8 9.077 -12.293 -9.783 1.00 0.00 H new ATOM 256 P A A 9 6.513 -7.474 -10.020 1.00 0.00 P ATOM 257 OP1 A A 9 6.152 -7.012 -11.386 1.00 0.00 O ATOM 258 OP2 A A 9 6.683 -6.479 -8.932 1.00 0.00 O ATOM 259 O5' A A 9 5.449 -8.562 -9.543 1.00 0.00 O ATOM 260 C5' A A 9 4.729 -9.367 -10.479 1.00 0.00 C ATOM 261 C4' A A 9 3.343 -9.654 -9.952 1.00 0.00 C ATOM 262 O4' A A 9 3.422 -10.733 -8.976 1.00 0.00 O ATOM 263 C3' A A 9 2.697 -8.489 -9.214 1.00 0.00 C ATOM 264 O3' A A 9 1.950 -7.664 -10.105 1.00 0.00 O ATOM 265 C2' A A 9 1.802 -9.186 -8.191 1.00 0.00 C ATOM 266 O2' A A 9 0.588 -9.618 -8.778 1.00 0.00 O ATOM 267 C1' A A 9 2.642 -10.412 -7.838 1.00 0.00 C ATOM 268 N9 A A 9 3.543 -10.169 -6.714 1.00 0.00 N ATOM 269 C8 A A 9 4.610 -9.317 -6.725 1.00 0.00 C ATOM 270 N7 A A 9 5.259 -9.265 -5.590 1.00 0.00 N ATOM 271 C5 A A 9 4.567 -10.143 -4.770 1.00 0.00 C ATOM 272 C6 A A 9 4.755 -10.534 -3.433 1.00 0.00 C ATOM 273 N6 A A 9 5.740 -10.077 -2.660 1.00 0.00 N ATOM 274 N1 A A 9 3.886 -11.423 -2.912 1.00 0.00 N ATOM 275 C2 A A 9 2.900 -11.885 -3.688 1.00 0.00 C ATOM 276 N3 A A 9 2.623 -11.600 -4.961 1.00 0.00 N ATOM 277 C4 A A 9 3.506 -10.711 -5.450 1.00 0.00 C ATOM 0 H5' A A 9 5.262 -10.302 -10.653 1.00 0.00 H new ATOM 0 H5'' A A 9 4.664 -8.854 -11.438 1.00 0.00 H new ATOM 0 H4' A A 9 2.744 -9.888 -10.832 1.00 0.00 H new ATOM 0 H3' A A 9 3.417 -7.814 -8.752 1.00 0.00 H new ATOM 0 H2' A A 9 1.528 -8.546 -7.352 1.00 0.00 H new ATOM 0 HO2' A A 9 0.429 -9.118 -9.606 1.00 0.00 H new ATOM 0 H1' A A 9 1.970 -11.220 -7.549 1.00 0.00 H new ATOM 0 H8 A A 9 4.893 -8.738 -7.592 1.00 0.00 H new ATOM 0 H61 A A 9 5.823 -10.400 -1.696 1.00 0.00 H new ATOM 0 H62 A A 9 6.410 -9.405 -3.033 1.00 0.00 H new ATOM 0 H2 A A 9 2.232 -12.590 -3.216 1.00 0.00 H new ATOM 289 P U A 10 1.442 -6.215 -9.623 1.00 0.00 P ATOM 290 OP1 U A 10 0.215 -5.886 -10.392 1.00 0.00 O ATOM 291 OP2 U A 10 2.609 -5.299 -9.682 1.00 0.00 O ATOM 292 O5' U A 10 1.029 -6.429 -8.098 1.00 0.00 O ATOM 293 C5' U A 10 1.141 -5.371 -7.145 1.00 0.00 C ATOM 294 C4' U A 10 -0.216 -5.036 -6.567 1.00 0.00 C ATOM 295 O4' U A 10 -1.237 -5.294 -7.574 1.00 0.00 O ATOM 296 C3' U A 10 -0.629 -5.852 -5.339 1.00 0.00 C ATOM 297 O3' U A 10 -1.175 -5.001 -4.332 1.00 0.00 O ATOM 298 C2' U A 10 -1.661 -6.834 -5.892 1.00 0.00 C ATOM 299 O2' U A 10 -2.647 -7.167 -4.934 1.00 0.00 O ATOM 300 C1' U A 10 -2.308 -5.985 -6.977 1.00 0.00 C ATOM 301 N1 U A 10 -3.020 -6.744 -8.016 1.00 0.00 N ATOM 302 C2 U A 10 -4.388 -6.561 -8.122 1.00 0.00 C ATOM 303 O2 U A 10 -5.016 -5.814 -7.392 1.00 0.00 O ATOM 304 N3 U A 10 -4.995 -7.287 -9.114 1.00 0.00 N ATOM 305 C4 U A 10 -4.391 -8.158 -9.992 1.00 0.00 C ATOM 306 O4 U A 10 -5.075 -8.733 -10.838 1.00 0.00 O ATOM 307 C5 U A 10 -2.980 -8.298 -9.816 1.00 0.00 C ATOM 308 C6 U A 10 -2.353 -7.608 -8.854 1.00 0.00 C ATOM 0 H5' U A 10 1.569 -4.488 -7.621 1.00 0.00 H new ATOM 0 H5'' U A 10 1.822 -5.664 -6.346 1.00 0.00 H new ATOM 0 H4' U A 10 -0.134 -3.992 -6.263 1.00 0.00 H new ATOM 0 H3' U A 10 0.202 -6.365 -4.856 1.00 0.00 H new ATOM 0 H2' U A 10 -1.223 -7.780 -6.212 1.00 0.00 H new ATOM 0 HO2' U A 10 -3.287 -7.795 -5.328 1.00 0.00 H new ATOM 0 H1' U A 10 -3.070 -5.352 -6.523 1.00 0.00 H new ATOM 0 H3 U A 10 -6.003 -7.169 -9.212 1.00 0.00 H new ATOM 0 H5 U A 10 -2.419 -8.960 -10.459 1.00 0.00 H new ATOM 0 H6 U A 10 -1.287 -7.734 -8.732 1.00 0.00 H new ATOM 319 P A A 11 -0.488 -4.930 -2.878 1.00 0.00 P ATOM 320 OP1 A A 11 -1.068 -3.767 -2.161 1.00 0.00 O ATOM 321 OP2 A A 11 0.984 -5.020 -3.055 1.00 0.00 O ATOM 322 O5' A A 11 -0.988 -6.255 -2.148 1.00 0.00 O ATOM 323 C5' A A 11 -2.365 -6.626 -2.163 1.00 0.00 C ATOM 324 C4' A A 11 -2.528 -8.052 -1.688 1.00 0.00 C ATOM 325 O4' A A 11 -1.622 -8.915 -2.443 1.00 0.00 O ATOM 326 C3' A A 11 -2.175 -8.280 -0.222 1.00 0.00 C ATOM 327 O3' A A 11 -3.306 -8.134 0.630 1.00 0.00 O ATOM 328 C2' A A 11 -1.635 -9.702 -0.227 1.00 0.00 C ATOM 329 O2' A A 11 -2.682 -10.652 -0.308 1.00 0.00 O ATOM 330 C1' A A 11 -0.869 -9.705 -1.544 1.00 0.00 C ATOM 331 N9 A A 11 0.487 -9.155 -1.475 1.00 0.00 N ATOM 332 C8 A A 11 1.055 -8.233 -2.320 1.00 0.00 C ATOM 333 N7 A A 11 2.300 -7.945 -2.030 1.00 0.00 N ATOM 334 C5 A A 11 2.572 -8.729 -0.917 1.00 0.00 C ATOM 335 C6 A A 11 3.724 -8.879 -0.126 1.00 0.00 C ATOM 336 N6 A A 11 4.866 -8.224 -0.347 1.00 0.00 N ATOM 337 N1 A A 11 3.663 -9.735 0.916 1.00 0.00 N ATOM 338 C2 A A 11 2.517 -10.389 1.142 1.00 0.00 C ATOM 339 N3 A A 11 1.373 -10.343 0.461 1.00 0.00 N ATOM 340 C4 A A 11 1.465 -9.481 -0.566 1.00 0.00 C ATOM 0 H5' A A 11 -2.766 -6.523 -3.171 1.00 0.00 H new ATOM 0 H5'' A A 11 -2.937 -5.954 -1.523 1.00 0.00 H new ATOM 0 H4' A A 11 -3.585 -8.276 -1.832 1.00 0.00 H new ATOM 0 H3' A A 11 -1.461 -7.554 0.167 1.00 0.00 H new ATOM 0 H2' A A 11 -1.061 -9.956 0.664 1.00 0.00 H new ATOM 0 HO2' A A 11 -3.527 -10.231 -0.044 1.00 0.00 H new ATOM 0 H1' A A 11 -0.747 -10.744 -1.850 1.00 0.00 H new ATOM 0 H8 A A 11 0.524 -7.786 -3.148 1.00 0.00 H new ATOM 0 H61 A A 11 5.668 -8.377 0.264 1.00 0.00 H new ATOM 0 H62 A A 11 4.936 -7.571 -1.127 1.00 0.00 H new ATOM 0 H2 A A 11 2.520 -11.047 1.998 1.00 0.00 H new ATOM 352 P C A 12 -3.192 -7.240 1.962 1.00 0.00 P ATOM 353 OP1 C A 12 -4.311 -7.636 2.854 1.00 0.00 O ATOM 354 OP2 C A 12 -3.049 -5.818 1.553 1.00 0.00 O ATOM 355 O5' C A 12 -1.819 -7.702 2.630 1.00 0.00 O ATOM 356 C5' C A 12 -1.752 -8.866 3.455 1.00 0.00 C ATOM 357 C4' C A 12 -0.514 -8.824 4.323 1.00 0.00 C ATOM 358 O4' C A 12 0.661 -8.992 3.485 1.00 0.00 O ATOM 359 C3' C A 12 -0.272 -7.516 5.062 1.00 0.00 C ATOM 360 O3' C A 12 -0.991 -7.479 6.294 1.00 0.00 O ATOM 361 C2' C A 12 1.240 -7.524 5.269 1.00 0.00 C ATOM 362 O2' C A 12 1.612 -8.340 6.364 1.00 0.00 O ATOM 363 C1' C A 12 1.722 -8.194 3.981 1.00 0.00 C ATOM 364 N1 C A 12 2.116 -7.238 2.932 1.00 0.00 N ATOM 365 C2 C A 12 3.362 -6.609 3.027 1.00 0.00 C ATOM 366 O2 C A 12 4.090 -6.860 3.999 1.00 0.00 O ATOM 367 N3 C A 12 3.741 -5.743 2.058 1.00 0.00 N ATOM 368 C4 C A 12 2.927 -5.494 1.031 1.00 0.00 C ATOM 369 N4 C A 12 3.344 -4.642 0.095 1.00 0.00 N ATOM 370 C5 C A 12 1.648 -6.109 0.916 1.00 0.00 C ATOM 371 C6 C A 12 1.285 -6.965 1.880 1.00 0.00 C ATOM 0 H5' C A 12 -1.738 -9.761 2.833 1.00 0.00 H new ATOM 0 H5'' C A 12 -2.642 -8.928 4.082 1.00 0.00 H new ATOM 0 H4' C A 12 -0.679 -9.614 5.056 1.00 0.00 H new ATOM 0 H3' C A 12 -0.617 -6.634 4.522 1.00 0.00 H new ATOM 0 H2' C A 12 1.646 -6.532 5.469 1.00 0.00 H new ATOM 0 HO2' C A 12 0.831 -8.497 6.935 1.00 0.00 H new ATOM 0 H1' C A 12 2.609 -8.778 4.226 1.00 0.00 H new ATOM 0 H41 C A 12 2.746 -4.429 -0.704 1.00 0.00 H new ATOM 0 H42 C A 12 4.261 -4.203 0.177 1.00 0.00 H new ATOM 0 H5 C A 12 0.995 -5.893 0.083 1.00 0.00 H new ATOM 0 H6 C A 12 0.320 -7.448 1.826 1.00 0.00 H new ATOM 383 P C A 13 -1.502 -6.071 6.882 1.00 0.00 P ATOM 384 OP1 C A 13 -1.880 -6.297 8.301 1.00 0.00 O ATOM 385 OP2 C A 13 -2.500 -5.503 5.940 1.00 0.00 O ATOM 386 O5' C A 13 -0.205 -5.145 6.856 1.00 0.00 O ATOM 387 C5' C A 13 0.846 -5.325 7.803 1.00 0.00 C ATOM 388 C4' C A 13 2.043 -4.487 7.421 1.00 0.00 C ATOM 389 O4' C A 13 2.466 -4.840 6.074 1.00 0.00 O ATOM 390 C3' C A 13 1.794 -2.987 7.353 1.00 0.00 C ATOM 391 O3' C A 13 1.896 -2.384 8.642 1.00 0.00 O ATOM 392 C2' C A 13 2.880 -2.526 6.390 1.00 0.00 C ATOM 393 O2' C A 13 4.147 -2.475 7.018 1.00 0.00 O ATOM 394 C1' C A 13 2.888 -3.675 5.384 1.00 0.00 C ATOM 395 N1 C A 13 1.991 -3.464 4.235 1.00 0.00 N ATOM 396 C2 C A 13 2.421 -2.652 3.176 1.00 0.00 C ATOM 397 O2 C A 13 3.543 -2.127 3.234 1.00 0.00 O ATOM 398 N3 C A 13 1.601 -2.461 2.117 1.00 0.00 N ATOM 399 C4 C A 13 0.399 -3.042 2.092 1.00 0.00 C ATOM 400 N4 C A 13 -0.375 -2.831 1.029 1.00 0.00 N ATOM 401 C5 C A 13 -0.064 -3.867 3.158 1.00 0.00 C ATOM 402 C6 C A 13 0.757 -4.049 4.198 1.00 0.00 C ATOM 0 H5' C A 13 1.129 -6.377 7.847 1.00 0.00 H new ATOM 0 H5'' C A 13 0.500 -5.046 8.798 1.00 0.00 H new ATOM 0 H4' C A 13 2.771 -4.693 8.206 1.00 0.00 H new ATOM 0 H3' C A 13 0.793 -2.712 7.020 1.00 0.00 H new ATOM 0 H2' C A 13 2.697 -1.532 5.983 1.00 0.00 H new ATOM 0 HO2' C A 13 4.821 -2.177 6.372 1.00 0.00 H new ATOM 0 H1' C A 13 3.897 -3.757 4.980 1.00 0.00 H new ATOM 0 H41 C A 13 -1.299 -3.260 0.978 1.00 0.00 H new ATOM 0 H42 C A 13 -0.044 -2.241 0.266 1.00 0.00 H new ATOM 0 H5 C A 13 -1.040 -4.328 3.127 1.00 0.00 H new ATOM 0 H6 C A 13 0.439 -4.669 5.023 1.00 0.00 H new ATOM 414 P C A 14 1.098 -1.021 8.957 1.00 0.00 P ATOM 415 OP1 C A 14 1.254 -0.752 10.409 1.00 0.00 O ATOM 416 OP2 C A 14 -0.264 -1.113 8.371 1.00 0.00 O ATOM 417 O5' C A 14 1.910 0.093 8.158 1.00 0.00 O ATOM 418 C5' C A 14 3.298 0.305 8.405 1.00 0.00 C ATOM 419 C4' C A 14 3.943 0.977 7.215 1.00 0.00 C ATOM 420 O4' C A 14 3.629 0.224 6.013 1.00 0.00 O ATOM 421 C3' C A 14 3.459 2.386 6.916 1.00 0.00 C ATOM 422 O3' C A 14 4.156 3.338 7.718 1.00 0.00 O ATOM 423 C2' C A 14 3.758 2.521 5.427 1.00 0.00 C ATOM 424 O2' C A 14 5.133 2.767 5.197 1.00 0.00 O ATOM 425 C1' C A 14 3.426 1.114 4.929 1.00 0.00 C ATOM 426 N1 C A 14 2.040 0.956 4.452 1.00 0.00 N ATOM 427 C2 C A 14 1.736 1.315 3.137 1.00 0.00 C ATOM 428 O2 C A 14 2.632 1.778 2.419 1.00 0.00 O ATOM 429 N3 C A 14 0.474 1.152 2.682 1.00 0.00 N ATOM 430 C4 C A 14 -0.468 0.661 3.488 1.00 0.00 C ATOM 431 N4 C A 14 -1.697 0.511 2.990 1.00 0.00 N ATOM 432 C5 C A 14 -0.191 0.301 4.838 1.00 0.00 C ATOM 433 C6 C A 14 1.065 0.462 5.274 1.00 0.00 C ATOM 0 H5' C A 14 3.789 -0.648 8.604 1.00 0.00 H new ATOM 0 H5'' C A 14 3.427 0.922 9.294 1.00 0.00 H new ATOM 0 H4' C A 14 5.001 1.016 7.475 1.00 0.00 H new ATOM 0 H3' C A 14 2.408 2.566 7.144 1.00 0.00 H new ATOM 0 H2' C A 14 3.213 3.336 4.950 1.00 0.00 H new ATOM 0 HO2' C A 14 5.539 3.137 6.008 1.00 0.00 H new ATOM 0 H1' C A 14 4.071 0.908 4.075 1.00 0.00 H new ATOM 0 H41 C A 14 -2.443 0.138 3.577 1.00 0.00 H new ATOM 0 H42 C A 14 -1.890 0.769 2.022 1.00 0.00 H new ATOM 0 H5 C A 14 -0.964 -0.087 5.485 1.00 0.00 H new ATOM 0 H6 C A 14 1.312 0.197 6.292 1.00 0.00 H new ATOM 445 P C A 15 3.348 4.515 8.463 1.00 0.00 P ATOM 446 OP1 C A 15 4.175 4.936 9.622 1.00 0.00 O ATOM 447 OP2 C A 15 1.939 4.098 8.683 1.00 0.00 O ATOM 448 O5' C A 15 3.355 5.700 7.400 1.00 0.00 O ATOM 449 C5' C A 15 4.575 6.153 6.820 1.00 0.00 C ATOM 450 C4' C A 15 4.299 6.849 5.510 1.00 0.00 C ATOM 451 O4' C A 15 3.860 5.863 4.537 1.00 0.00 O ATOM 452 C3' C A 15 3.188 7.887 5.547 1.00 0.00 C ATOM 453 O3' C A 15 3.702 9.156 5.943 1.00 0.00 O ATOM 454 C2' C A 15 2.678 7.877 4.111 1.00 0.00 C ATOM 455 O2' C A 15 3.535 8.618 3.262 1.00 0.00 O ATOM 456 C1' C A 15 2.800 6.393 3.761 1.00 0.00 C ATOM 457 N1 C A 15 1.586 5.601 4.036 1.00 0.00 N ATOM 458 C2 C A 15 0.591 5.528 3.058 1.00 0.00 C ATOM 459 O2 C A 15 0.746 6.148 1.996 1.00 0.00 O ATOM 460 N3 C A 15 -0.515 4.787 3.295 1.00 0.00 N ATOM 461 C4 C A 15 -0.649 4.140 4.454 1.00 0.00 C ATOM 462 N4 C A 15 -1.754 3.415 4.640 1.00 0.00 N ATOM 463 C5 C A 15 0.343 4.205 5.473 1.00 0.00 C ATOM 464 C6 C A 15 1.434 4.939 5.224 1.00 0.00 C ATOM 0 H5' C A 15 5.245 5.309 6.658 1.00 0.00 H new ATOM 0 H5'' C A 15 5.081 6.835 7.504 1.00 0.00 H new ATOM 0 H4' C A 15 5.234 7.352 5.265 1.00 0.00 H new ATOM 0 H3' C A 15 2.397 7.677 6.267 1.00 0.00 H new ATOM 0 H2' C A 15 1.682 8.307 4.000 1.00 0.00 H new ATOM 0 HO2' C A 15 4.097 9.212 3.802 1.00 0.00 H new ATOM 0 H1' C A 15 2.972 6.327 2.687 1.00 0.00 H new ATOM 0 H41 C A 15 -1.890 2.907 5.514 1.00 0.00 H new ATOM 0 H42 C A 15 -2.463 3.369 3.908 1.00 0.00 H new ATOM 0 H5 C A 15 0.220 3.683 6.410 1.00 0.00 H new ATOM 0 H6 C A 15 2.208 5.010 5.974 1.00 0.00 H new ATOM 476 P G A 16 3.258 9.803 7.348 1.00 0.00 P ATOM 477 OP1 G A 16 4.347 10.727 7.758 1.00 0.00 O ATOM 478 OP2 G A 16 2.829 8.723 8.274 1.00 0.00 O ATOM 479 O5' G A 16 1.983 10.678 6.966 1.00 0.00 O ATOM 480 C5' G A 16 2.133 11.976 6.394 1.00 0.00 C ATOM 481 C4' G A 16 0.888 12.355 5.628 1.00 0.00 C ATOM 482 O4' G A 16 0.649 11.366 4.593 1.00 0.00 O ATOM 483 C3' G A 16 -0.405 12.368 6.427 1.00 0.00 C ATOM 484 O3' G A 16 -0.546 13.588 7.154 1.00 0.00 O ATOM 485 C2' G A 16 -1.457 12.190 5.338 1.00 0.00 C ATOM 486 O2' G A 16 -1.705 13.401 4.649 1.00 0.00 O ATOM 487 C1' G A 16 -0.744 11.231 4.382 1.00 0.00 C ATOM 488 N9 G A 16 -1.114 9.834 4.586 1.00 0.00 N ATOM 489 C8 G A 16 -0.449 8.895 5.338 1.00 0.00 C ATOM 490 N7 G A 16 -1.041 7.732 5.348 1.00 0.00 N ATOM 491 C5 G A 16 -2.161 7.912 4.546 1.00 0.00 C ATOM 492 C6 G A 16 -3.189 7.003 4.180 1.00 0.00 C ATOM 493 O6 G A 16 -3.326 5.819 4.507 1.00 0.00 O ATOM 494 N1 G A 16 -4.128 7.601 3.348 1.00 0.00 N ATOM 495 C2 G A 16 -4.088 8.902 2.921 1.00 0.00 C ATOM 496 N2 G A 16 -5.086 9.288 2.117 1.00 0.00 N ATOM 497 N3 G A 16 -3.142 9.761 3.256 1.00 0.00 N ATOM 498 C4 G A 16 -2.216 9.202 4.064 1.00 0.00 C ATOM 0 H5' G A 16 2.997 11.991 5.729 1.00 0.00 H new ATOM 0 H5'' G A 16 2.323 12.708 7.179 1.00 0.00 H new ATOM 0 H4' G A 16 1.097 13.366 5.278 1.00 0.00 H new ATOM 0 H3' G A 16 -0.470 11.599 7.197 1.00 0.00 H new ATOM 0 H2' G A 16 -2.417 11.851 5.727 1.00 0.00 H new ATOM 0 HO2' G A 16 -2.606 13.721 4.864 1.00 0.00 H new ATOM 0 H1' G A 16 -1.039 11.493 3.366 1.00 0.00 H new ATOM 0 H8 G A 16 0.470 9.099 5.867 1.00 0.00 H new ATOM 0 H1 G A 16 -4.908 7.026 3.030 1.00 0.00 H new ATOM 0 H21 G A 16 -5.115 10.244 1.764 1.00 0.00 H new ATOM 0 H22 G A 16 -5.817 8.626 1.858 1.00 0.00 H new ATOM 510 P A A 17 -1.746 13.760 8.212 1.00 0.00 P ATOM 511 OP1 A A 17 -1.308 14.765 9.216 1.00 0.00 O ATOM 512 OP2 A A 17 -2.185 12.416 8.666 1.00 0.00 O ATOM 513 O5' A A 17 -2.927 14.402 7.354 1.00 0.00 O ATOM 514 C5' A A 17 -2.829 15.732 6.846 1.00 0.00 C ATOM 515 C4' A A 17 -4.064 16.077 6.044 1.00 0.00 C ATOM 516 O4' A A 17 -4.151 15.170 4.911 1.00 0.00 O ATOM 517 C3' A A 17 -5.386 15.918 6.785 1.00 0.00 C ATOM 518 O3' A A 17 -5.752 17.106 7.494 1.00 0.00 O ATOM 519 C2' A A 17 -6.363 15.585 5.662 1.00 0.00 C ATOM 520 O2' A A 17 -6.752 16.747 4.952 1.00 0.00 O ATOM 521 C1' A A 17 -5.486 14.729 4.749 1.00 0.00 C ATOM 522 N9 A A 17 -5.538 13.299 5.052 1.00 0.00 N ATOM 523 C8 A A 17 -4.707 12.588 5.880 1.00 0.00 C ATOM 524 N7 A A 17 -4.998 11.312 5.954 1.00 0.00 N ATOM 525 C5 A A 17 -6.096 11.173 5.117 1.00 0.00 C ATOM 526 C6 A A 17 -6.879 10.061 4.760 1.00 0.00 C ATOM 527 N6 A A 17 -6.667 8.826 5.219 1.00 0.00 N ATOM 528 N1 A A 17 -7.903 10.263 3.902 1.00 0.00 N ATOM 529 C2 A A 17 -8.116 11.501 3.439 1.00 0.00 C ATOM 530 N3 A A 17 -7.450 12.624 3.699 1.00 0.00 N ATOM 531 C4 A A 17 -6.440 12.389 4.555 1.00 0.00 C ATOM 0 H5' A A 17 -1.942 15.825 6.220 1.00 0.00 H new ATOM 0 H5'' A A 17 -2.713 16.436 7.670 1.00 0.00 H new ATOM 0 H4' A A 17 -3.942 17.128 5.783 1.00 0.00 H new ATOM 0 H3' A A 17 -5.355 15.153 7.561 1.00 0.00 H new ATOM 0 H2' A A 17 -7.282 15.117 6.016 1.00 0.00 H new ATOM 0 HO2' A A 17 -6.567 17.540 5.497 1.00 0.00 H new ATOM 0 HO3' A A 17 -6.606 16.963 7.954 1.00 0.00 H new ATOM 0 H1' A A 17 -5.856 14.846 3.730 1.00 0.00 H new ATOM 0 H8 A A 17 -3.888 13.038 6.421 1.00 0.00 H new ATOM 0 H61 A A 17 -7.272 8.060 4.921 1.00 0.00 H new ATOM 0 H62 A A 17 -5.900 8.648 5.868 1.00 0.00 H new ATOM 0 H2 A A 17 -8.947 11.603 2.757 1.00 0.00 H new TER 544 A A 17