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 -127:sc= 0.0892 USER MOD Single : A 2 C O2' : rot -19:sc= 0.107 USER MOD Single : A 3 G O2' : rot -125:sc= 0.507 USER MOD Single : A 4 G O2' : rot -21:sc= 0.0862 USER MOD Single : A 5 G O2' : rot -17:sc= 0.0588 USER MOD Single : A 6 C O2' : rot -19:sc= 0.081 USER MOD Single : A 7 C O2' : rot -130:sc= 0.982 USER MOD Single : A 8 RSQ O2' : rot -134:sc= 0.102 USER MOD Single : A 9 A O2' : rot -27:sc= 0.0891 USER MOD Single : A 10 U O2' : rot 180:sc= -1.28 USER MOD Single : A 11 A O2' : rot -24:sc= 0.0625 USER MOD Single : A 12 C O2' : rot -23:sc= -0.296 USER MOD Single : A 13 C O2' : rot -14:sc= 0.0594 USER MOD Single : A 14 C O2' : rot -18:sc= 0.0648 USER MOD Single : A 15 C O2' : rot -29:sc= 0.0457 USER MOD Single : A 16 G O2' : rot -20:sc= 0.0581 USER MOD Single : A 17 A O2' : rot -24:sc= 0.0678 USER MOD Single : A 17 A O3' : rot 180:sc= 0.0672 USER MOD ----------------------------------------------------------------- HETATM 1 N1 PSU A 1 -7.572 2.360 7.924 1.00 0.00 N HETATM 2 C2 PSU A 1 -7.196 3.678 7.790 1.00 0.00 C HETATM 3 N3 PSU A 1 -8.085 4.467 7.109 1.00 0.00 N HETATM 4 C4 PSU A 1 -9.284 4.082 6.560 1.00 0.00 C HETATM 5 C5 PSU A 1 -9.607 2.699 6.743 1.00 0.00 C HETATM 6 C6 PSU A 1 -8.760 1.901 7.405 1.00 0.00 C HETATM 7 O2 PSU A 1 -6.167 4.121 8.261 1.00 0.00 O HETATM 8 O4 PSU A 1 -9.972 4.916 5.974 1.00 0.00 O HETATM 9 C1' PSU A 1 -10.871 2.207 6.190 1.00 0.00 C HETATM 10 C2' PSU A 1 -10.851 2.011 4.673 1.00 0.00 C HETATM 11 O2' PSU A 1 -12.155 2.243 4.174 1.00 0.00 O HETATM 12 C3' PSU A 1 -10.471 0.539 4.565 1.00 0.00 C HETATM 13 C4' PSU A 1 -11.195 -0.078 5.754 1.00 0.00 C HETATM 14 O3' PSU A 1 -10.899 -0.052 3.340 1.00 0.00 O HETATM 15 O4' PSU A 1 -11.157 0.951 6.780 1.00 0.00 O HETATM 16 C5' PSU A 1 -10.578 -1.342 6.305 1.00 0.00 C HETATM 17 O5' PSU A 1 -9.174 -1.169 6.522 1.00 0.00 O HETATM 0 HO2' PSU A 1 -12.438 1.479 3.630 1.00 0.00 H new HETATM 0 H5'' PSU A 1 -11.065 -1.611 7.242 1.00 0.00 H new HETATM 0 HN3 PSU A 1 -7.829 5.448 6.997 1.00 0.00 H new HETATM 0 HN1 PSU A 1 -6.958 1.712 8.417 1.00 0.00 H new HETATM 0 H6 PSU A 1 -9.021 0.851 7.537 1.00 0.00 H new HETATM 0 H5' PSU A 1 -10.745 -2.166 5.611 1.00 0.00 H new HETATM 0 H4' PSU A 1 -12.193 -0.381 5.436 1.00 0.00 H new HETATM 0 H3' PSU A 1 -9.392 0.385 4.573 1.00 0.00 H new HETATM 0 H2' PSU A 1 -10.182 2.669 4.118 1.00 0.00 H new HETATM 0 H1' PSU A 1 -11.623 2.964 6.411 1.00 0.00 H new ATOM 28 P C A 2 -9.846 -0.284 2.144 1.00 0.00 P ATOM 29 OP1 C A 2 -10.490 -1.211 1.179 1.00 0.00 O ATOM 30 OP2 C A 2 -8.519 -0.628 2.717 1.00 0.00 O ATOM 31 O5' C A 2 -9.731 1.146 1.449 1.00 0.00 O ATOM 32 C5' C A 2 -10.878 1.787 0.895 1.00 0.00 C ATOM 33 C4' C A 2 -10.619 3.266 0.730 1.00 0.00 C ATOM 34 O4' C A 2 -10.388 3.851 2.040 1.00 0.00 O ATOM 35 C3' C A 2 -9.379 3.622 -0.080 1.00 0.00 C ATOM 36 O3' C A 2 -9.674 3.676 -1.475 1.00 0.00 O ATOM 37 C2' C A 2 -8.987 4.982 0.488 1.00 0.00 C ATOM 38 O2' C A 2 -9.791 6.015 -0.052 1.00 0.00 O ATOM 39 C1' C A 2 -9.347 4.808 1.963 1.00 0.00 C ATOM 40 N1 C A 2 -8.232 4.344 2.807 1.00 0.00 N ATOM 41 C2 C A 2 -7.484 5.287 3.514 1.00 0.00 C ATOM 42 O2 C A 2 -7.755 6.491 3.387 1.00 0.00 O ATOM 43 N3 C A 2 -6.480 4.867 4.315 1.00 0.00 N ATOM 44 C4 C A 2 -6.205 3.567 4.415 1.00 0.00 C ATOM 45 N4 C A 2 -5.209 3.202 5.225 1.00 0.00 N ATOM 46 C5 C A 2 -6.939 2.583 3.693 1.00 0.00 C ATOM 47 C6 C A 2 -7.935 3.013 2.908 1.00 0.00 C ATOM 0 H5' C A 2 -11.740 1.631 1.544 1.00 0.00 H new ATOM 0 H5'' C A 2 -11.121 1.343 -0.070 1.00 0.00 H new ATOM 0 H4' C A 2 -11.497 3.642 0.205 1.00 0.00 H new ATOM 0 H3' C A 2 -8.575 2.890 -0.003 1.00 0.00 H new ATOM 0 H2' C A 2 -7.951 5.252 0.282 1.00 0.00 H new ATOM 0 HO2' C A 2 -10.208 5.705 -0.883 1.00 0.00 H new ATOM 0 H1' C A 2 -9.635 5.789 2.341 1.00 0.00 H new ATOM 0 H41 C A 2 -4.970 2.216 5.327 1.00 0.00 H new ATOM 0 H42 C A 2 -4.687 3.909 5.742 1.00 0.00 H new ATOM 0 H5 C A 2 -6.702 1.533 3.775 1.00 0.00 H new ATOM 0 H6 C A 2 -8.514 2.296 2.345 1.00 0.00 H new ATOM 59 P G A 3 -8.979 2.635 -2.487 1.00 0.00 P ATOM 60 OP1 G A 3 -9.844 2.533 -3.691 1.00 0.00 O ATOM 61 OP2 G A 3 -8.633 1.405 -1.730 1.00 0.00 O ATOM 62 O5' G A 3 -7.624 3.363 -2.904 1.00 0.00 O ATOM 63 C5' G A 3 -7.585 4.260 -4.013 1.00 0.00 C ATOM 64 C4' G A 3 -6.415 5.210 -3.879 1.00 0.00 C ATOM 65 O4' G A 3 -6.412 5.778 -2.543 1.00 0.00 O ATOM 66 C3' G A 3 -5.035 4.585 -4.016 1.00 0.00 C ATOM 67 O3' G A 3 -4.665 4.433 -5.385 1.00 0.00 O ATOM 68 C2' G A 3 -4.155 5.583 -3.271 1.00 0.00 C ATOM 69 O2' G A 3 -3.880 6.726 -4.060 1.00 0.00 O ATOM 70 C1' G A 3 -5.076 5.998 -2.123 1.00 0.00 C ATOM 71 N9 G A 3 -4.846 5.245 -0.894 1.00 0.00 N ATOM 72 C8 G A 3 -5.593 4.201 -0.406 1.00 0.00 C ATOM 73 N7 G A 3 -5.135 3.720 0.717 1.00 0.00 N ATOM 74 C5 G A 3 -4.015 4.495 0.989 1.00 0.00 C ATOM 75 C6 G A 3 -3.100 4.445 2.074 1.00 0.00 C ATOM 76 O6 G A 3 -3.094 3.679 3.044 1.00 0.00 O ATOM 77 N1 G A 3 -2.112 5.415 1.956 1.00 0.00 N ATOM 78 C2 G A 3 -2.014 6.318 0.929 1.00 0.00 C ATOM 79 N2 G A 3 -0.990 7.174 0.996 1.00 0.00 N ATOM 80 N3 G A 3 -2.856 6.376 -0.089 1.00 0.00 N ATOM 81 C4 G A 3 -3.825 5.442 0.005 1.00 0.00 C ATOM 0 H5' G A 3 -8.516 4.824 -4.066 1.00 0.00 H new ATOM 0 H5'' G A 3 -7.500 3.697 -4.942 1.00 0.00 H new ATOM 0 H4' G A 3 -6.564 5.920 -4.692 1.00 0.00 H new ATOM 0 H3' G A 3 -4.960 3.575 -3.614 1.00 0.00 H new ATOM 0 H2' G A 3 -3.190 5.167 -2.982 1.00 0.00 H new ATOM 0 HO2' G A 3 -2.911 6.856 -4.120 1.00 0.00 H new ATOM 0 H1' G A 3 -4.873 7.045 -1.895 1.00 0.00 H new ATOM 0 H8 G A 3 -6.472 3.817 -0.902 1.00 0.00 H new ATOM 0 H1 G A 3 -1.405 5.459 2.690 1.00 0.00 H new ATOM 0 H21 G A 3 -0.860 7.872 0.263 1.00 0.00 H new ATOM 0 H22 G A 3 -0.339 7.130 1.780 1.00 0.00 H new ATOM 93 P G A 4 -3.430 3.480 -5.781 1.00 0.00 P ATOM 94 OP1 G A 4 -3.367 3.394 -7.263 1.00 0.00 O ATOM 95 OP2 G A 4 -3.540 2.234 -4.980 1.00 0.00 O ATOM 96 O5' G A 4 -2.146 4.277 -5.274 1.00 0.00 O ATOM 97 C5' G A 4 -1.647 5.405 -5.993 1.00 0.00 C ATOM 98 C4' G A 4 -0.585 6.115 -5.182 1.00 0.00 C ATOM 99 O4' G A 4 -1.038 6.214 -3.802 1.00 0.00 O ATOM 100 C3' G A 4 0.765 5.409 -5.105 1.00 0.00 C ATOM 101 O3' G A 4 1.614 5.787 -6.188 1.00 0.00 O ATOM 102 C2' G A 4 1.307 5.871 -3.757 1.00 0.00 C ATOM 103 O2' G A 4 1.833 7.183 -3.832 1.00 0.00 O ATOM 104 C1' G A 4 0.029 5.907 -2.923 1.00 0.00 C ATOM 105 N9 G A 4 -0.273 4.645 -2.254 1.00 0.00 N ATOM 106 C8 G A 4 -1.137 3.667 -2.679 1.00 0.00 C ATOM 107 N7 G A 4 -1.210 2.652 -1.864 1.00 0.00 N ATOM 108 C5 G A 4 -0.334 2.976 -0.837 1.00 0.00 C ATOM 109 C6 G A 4 0.012 2.261 0.335 1.00 0.00 C ATOM 110 O6 G A 4 -0.404 1.163 0.720 1.00 0.00 O ATOM 111 N1 G A 4 0.943 2.952 1.099 1.00 0.00 N ATOM 112 C2 G A 4 1.471 4.176 0.783 1.00 0.00 C ATOM 113 N2 G A 4 2.354 4.679 1.652 1.00 0.00 N ATOM 114 N3 G A 4 1.156 4.858 -0.304 1.00 0.00 N ATOM 115 C4 G A 4 0.254 4.203 -1.065 1.00 0.00 C ATOM 0 H5' G A 4 -2.463 6.092 -6.218 1.00 0.00 H new ATOM 0 H5'' G A 4 -1.231 5.082 -6.947 1.00 0.00 H new ATOM 0 H4' G A 4 -0.444 7.068 -5.692 1.00 0.00 H new ATOM 0 H3' G A 4 0.696 4.324 -5.184 1.00 0.00 H new ATOM 0 H2' G A 4 2.109 5.239 -3.375 1.00 0.00 H new ATOM 0 HO2' G A 4 2.049 7.396 -4.764 1.00 0.00 H new ATOM 0 H1' G A 4 0.165 6.651 -2.138 1.00 0.00 H new ATOM 0 H8 G A 4 -1.701 3.732 -3.598 1.00 0.00 H new ATOM 0 H1 G A 4 1.259 2.514 1.964 1.00 0.00 H new ATOM 0 H21 G A 4 2.784 5.587 1.475 1.00 0.00 H new ATOM 0 H22 G A 4 2.598 4.155 2.492 1.00 0.00 H new ATOM 127 P G A 5 2.351 4.657 -7.067 1.00 0.00 P ATOM 128 OP1 G A 5 2.817 5.319 -8.313 1.00 0.00 O ATOM 129 OP2 G A 5 1.474 3.462 -7.158 1.00 0.00 O ATOM 130 O5' G A 5 3.635 4.270 -6.205 1.00 0.00 O ATOM 131 C5' G A 5 4.851 5.009 -6.324 1.00 0.00 C ATOM 132 C4' G A 5 5.698 4.830 -5.084 1.00 0.00 C ATOM 133 O4' G A 5 4.844 4.916 -3.909 1.00 0.00 O ATOM 134 C3' G A 5 6.396 3.483 -4.941 1.00 0.00 C ATOM 135 O3' G A 5 7.630 3.442 -5.653 1.00 0.00 O ATOM 136 C2' G A 5 6.590 3.385 -3.434 1.00 0.00 C ATOM 137 O2' G A 5 7.650 4.213 -2.989 1.00 0.00 O ATOM 138 C1' G A 5 5.272 3.976 -2.938 1.00 0.00 C ATOM 139 N9 G A 5 4.217 2.982 -2.757 1.00 0.00 N ATOM 140 C8 G A 5 3.106 2.794 -3.546 1.00 0.00 C ATOM 141 N7 G A 5 2.335 1.827 -3.129 1.00 0.00 N ATOM 142 C5 G A 5 2.977 1.342 -1.995 1.00 0.00 C ATOM 143 C6 G A 5 2.620 0.286 -1.115 1.00 0.00 C ATOM 144 O6 G A 5 1.636 -0.459 -1.165 1.00 0.00 O ATOM 145 N1 G A 5 3.553 0.133 -0.094 1.00 0.00 N ATOM 146 C2 G A 5 4.688 0.890 0.057 1.00 0.00 C ATOM 147 N2 G A 5 5.465 0.584 1.103 1.00 0.00 N ATOM 148 N3 G A 5 5.036 1.873 -0.757 1.00 0.00 N ATOM 149 C4 G A 5 4.141 2.044 -1.753 1.00 0.00 C ATOM 0 H5' G A 5 4.629 6.066 -6.472 1.00 0.00 H new ATOM 0 H5'' G A 5 5.404 4.674 -7.202 1.00 0.00 H new ATOM 0 H4' G A 5 6.456 5.608 -5.174 1.00 0.00 H new ATOM 0 H3' G A 5 5.832 2.649 -5.359 1.00 0.00 H new ATOM 0 H2' G A 5 6.826 2.377 -3.093 1.00 0.00 H new ATOM 0 HO2' G A 5 8.211 4.465 -3.752 1.00 0.00 H new ATOM 0 H1' G A 5 5.450 4.423 -1.960 1.00 0.00 H new ATOM 0 H8 G A 5 2.893 3.387 -4.423 1.00 0.00 H new ATOM 0 H1 G A 5 3.380 -0.598 0.596 1.00 0.00 H new ATOM 0 H21 G A 5 6.323 1.109 1.272 1.00 0.00 H new ATOM 0 H22 G A 5 5.199 -0.174 1.731 1.00 0.00 H new ATOM 161 P C A 6 8.238 2.027 -6.119 1.00 0.00 P ATOM 162 OP1 C A 6 9.687 2.236 -6.370 1.00 0.00 O ATOM 163 OP2 C A 6 7.379 1.485 -7.203 1.00 0.00 O ATOM 164 O5' C A 6 8.077 1.089 -4.839 1.00 0.00 O ATOM 165 C5' C A 6 9.076 1.054 -3.819 1.00 0.00 C ATOM 166 C4' C A 6 8.874 -0.153 -2.930 1.00 0.00 C ATOM 167 O4' C A 6 7.588 -0.051 -2.262 1.00 0.00 O ATOM 168 C3' C A 6 8.800 -1.493 -3.646 1.00 0.00 C ATOM 169 O3' C A 6 10.088 -2.018 -3.949 1.00 0.00 O ATOM 170 C2' C A 6 8.049 -2.355 -2.640 1.00 0.00 C ATOM 171 O2' C A 6 8.891 -2.777 -1.584 1.00 0.00 O ATOM 172 C1' C A 6 7.042 -1.349 -2.083 1.00 0.00 C ATOM 173 N1 C A 6 5.733 -1.409 -2.753 1.00 0.00 N ATOM 174 C2 C A 6 4.958 -2.562 -2.610 1.00 0.00 C ATOM 175 O2 C A 6 5.390 -3.492 -1.915 1.00 0.00 O ATOM 176 N3 C A 6 3.761 -2.635 -3.233 1.00 0.00 N ATOM 177 C4 C A 6 3.329 -1.609 -3.967 1.00 0.00 C ATOM 178 N4 C A 6 2.146 -1.728 -4.568 1.00 0.00 N ATOM 179 C5 C A 6 4.093 -0.416 -4.117 1.00 0.00 C ATOM 180 C6 C A 6 5.278 -0.361 -3.500 1.00 0.00 C ATOM 0 H5' C A 6 9.029 1.965 -3.223 1.00 0.00 H new ATOM 0 H5'' C A 6 10.067 1.019 -4.272 1.00 0.00 H new ATOM 0 H4' C A 6 9.747 -0.139 -2.277 1.00 0.00 H new ATOM 0 H3' C A 6 8.312 -1.436 -4.619 1.00 0.00 H new ATOM 0 H2' C A 6 7.629 -3.260 -3.080 1.00 0.00 H new ATOM 0 HO2' C A 6 9.828 -2.688 -1.857 1.00 0.00 H new ATOM 0 H1' C A 6 6.871 -1.588 -1.033 1.00 0.00 H new ATOM 0 H41 C A 6 1.784 -0.963 -5.137 1.00 0.00 H new ATOM 0 H42 C A 6 1.602 -2.584 -4.459 1.00 0.00 H new ATOM 0 H5 C A 6 3.729 0.412 -4.707 1.00 0.00 H new ATOM 0 H6 C A 6 5.885 0.527 -3.594 1.00 0.00 H new ATOM 192 P C A 7 10.330 -2.776 -5.347 1.00 0.00 P ATOM 193 OP1 C A 7 11.626 -3.494 -5.241 1.00 0.00 O ATOM 194 OP2 C A 7 10.122 -1.798 -6.446 1.00 0.00 O ATOM 195 O5' C A 7 9.160 -3.857 -5.414 1.00 0.00 O ATOM 196 C5' C A 7 9.152 -4.992 -4.549 1.00 0.00 C ATOM 197 C4' C A 7 7.818 -5.702 -4.626 1.00 0.00 C ATOM 198 O4' C A 7 6.757 -4.745 -4.352 1.00 0.00 O ATOM 199 C3' C A 7 7.476 -6.295 -5.988 1.00 0.00 C ATOM 200 O3' C A 7 7.964 -7.629 -6.121 1.00 0.00 O ATOM 201 C2' C A 7 5.952 -6.244 -6.014 1.00 0.00 C ATOM 202 O2' C A 7 5.388 -7.326 -5.298 1.00 0.00 O ATOM 203 C1' C A 7 5.671 -4.960 -5.236 1.00 0.00 C ATOM 204 N1 C A 7 5.519 -3.762 -6.080 1.00 0.00 N ATOM 205 C2 C A 7 4.324 -3.571 -6.778 1.00 0.00 C ATOM 206 O2 C A 7 3.425 -4.416 -6.668 1.00 0.00 O ATOM 207 N3 C A 7 4.181 -2.472 -7.554 1.00 0.00 N ATOM 208 C4 C A 7 5.176 -1.588 -7.646 1.00 0.00 C ATOM 209 N4 C A 7 4.992 -0.522 -8.427 1.00 0.00 N ATOM 210 C5 C A 7 6.403 -1.758 -6.944 1.00 0.00 C ATOM 211 C6 C A 7 6.530 -2.849 -6.181 1.00 0.00 C ATOM 0 H5' C A 7 9.345 -4.677 -3.523 1.00 0.00 H new ATOM 0 H5'' C A 7 9.953 -5.677 -4.829 1.00 0.00 H new ATOM 0 H4' C A 7 7.897 -6.515 -3.905 1.00 0.00 H new ATOM 0 H3' C A 7 7.934 -5.753 -6.816 1.00 0.00 H new ATOM 0 H2' C A 7 5.544 -6.285 -7.024 1.00 0.00 H new ATOM 0 HO2' C A 7 4.713 -7.769 -5.853 1.00 0.00 H new ATOM 0 H1' C A 7 4.720 -5.099 -4.722 1.00 0.00 H new ATOM 0 H41 C A 7 5.731 0.175 -8.521 1.00 0.00 H new ATOM 0 H42 C A 7 4.112 -0.404 -8.930 1.00 0.00 H new ATOM 0 H5 C A 7 7.200 -1.034 -7.025 1.00 0.00 H new ATOM 0 H6 C A 7 7.448 -3.011 -5.635 1.00 0.00 H new HETATM 223 P RSQ A 8 8.775 -8.064 -7.443 1.00 0.00 P HETATM 224 N1 RSQ A 8 5.393 -12.912 -7.923 1.00 0.00 N HETATM 225 C2 RSQ A 8 4.437 -13.925 -7.825 1.00 0.00 C HETATM 226 O2 RSQ A 8 4.004 -14.442 -8.863 1.00 0.00 O HETATM 227 N3 RSQ A 8 4.010 -14.313 -6.605 1.00 0.00 N HETATM 228 C4 RSQ A 8 4.502 -13.734 -5.512 1.00 0.00 C HETATM 229 N4 RSQ A 8 4.044 -14.150 -4.338 1.00 0.00 N HETATM 230 C5 RSQ A 8 5.485 -12.703 -5.575 1.00 0.00 C HETATM 231 C6 RSQ A 8 5.892 -12.323 -6.795 1.00 0.00 C HETATM 232 C1' RSQ A 8 5.860 -12.503 -9.258 1.00 0.00 C HETATM 233 C10 RSQ A 8 6.070 -12.055 -4.411 1.00 0.00 C HETATM 234 C2' RSQ A 8 5.091 -11.320 -9.852 1.00 0.00 C HETATM 235 O2' RSQ A 8 4.856 -11.589 -11.221 1.00 0.00 O HETATM 236 C3' RSQ A 8 6.077 -10.165 -9.677 1.00 0.00 C HETATM 237 O3' RSQ A 8 5.940 -9.180 -10.699 1.00 0.00 O HETATM 238 O30 RSQ A 8 5.810 -12.297 -3.268 1.00 0.00 O HETATM 239 C4' RSQ A 8 7.435 -10.847 -9.758 1.00 0.00 C HETATM 240 O4' RSQ A 8 7.225 -12.146 -9.155 1.00 0.00 O HETATM 241 C5' RSQ A 8 8.560 -10.151 -9.027 1.00 0.00 C HETATM 242 O5' RSQ A 8 8.047 -9.395 -7.930 1.00 0.00 O HETATM 243 OP1 RSQ A 8 8.573 -7.037 -8.498 1.00 0.00 O HETATM 244 OP2 RSQ A 8 10.155 -8.424 -7.029 1.00 0.00 O HETATM 0 HO2' RSQ A 8 5.065 -10.792 -11.752 1.00 0.00 H new HETATM 0 HN4A RSQ A 8 4.395 -13.732 -3.476 1.00 0.00 H new HETATM 0 H5'A RSQ A 8 9.278 -10.887 -8.666 1.00 0.00 H new HETATM 0 HN4 RSQ A 8 3.341 -14.888 -4.297 1.00 0.00 H new HETATM 0 H6 RSQ A 8 6.634 -11.530 -6.889 1.00 0.00 H new HETATM 0 H5' RSQ A 8 9.095 -9.493 -9.712 1.00 0.00 H new HETATM 0 H4' RSQ A 8 7.755 -10.859 -10.800 1.00 0.00 H new HETATM 0 H3' RSQ A 8 5.917 -9.624 -8.744 1.00 0.00 H new HETATM 0 H2' RSQ A 8 4.124 -11.116 -9.393 1.00 0.00 H new HETATM 0 H10 RSQ A 8 6.812 -11.279 -4.597 1.00 0.00 H new HETATM 0 H1' RSQ A 8 5.696 -13.348 -9.927 1.00 0.00 H new ATOM 256 P A A 9 5.030 -7.877 -10.444 1.00 0.00 P ATOM 257 OP1 A A 9 4.809 -7.230 -11.763 1.00 0.00 O ATOM 258 OP2 A A 9 5.634 -7.094 -9.336 1.00 0.00 O ATOM 259 O5' A A 9 3.642 -8.473 -9.931 1.00 0.00 O ATOM 260 C5' A A 9 2.691 -9.033 -10.838 1.00 0.00 C ATOM 261 C4' A A 9 1.291 -8.823 -10.312 1.00 0.00 C ATOM 262 O4' A A 9 0.973 -9.900 -9.384 1.00 0.00 O ATOM 263 C3' A A 9 1.100 -7.539 -9.517 1.00 0.00 C ATOM 264 O3' A A 9 0.695 -6.456 -10.347 1.00 0.00 O ATOM 265 C2' A A 9 0.022 -7.924 -8.508 1.00 0.00 C ATOM 266 O2' A A 9 -1.263 -7.921 -9.103 1.00 0.00 O ATOM 267 C1' A A 9 0.411 -9.367 -8.197 1.00 0.00 C ATOM 268 N9 A A 9 1.400 -9.481 -7.126 1.00 0.00 N ATOM 269 C8 A A 9 2.687 -9.015 -7.156 1.00 0.00 C ATOM 270 N7 A A 9 3.366 -9.260 -6.065 1.00 0.00 N ATOM 271 C5 A A 9 2.458 -9.918 -5.249 1.00 0.00 C ATOM 272 C6 A A 9 2.564 -10.438 -3.950 1.00 0.00 C ATOM 273 N6 A A 9 3.675 -10.377 -3.217 1.00 0.00 N ATOM 274 N1 A A 9 1.475 -11.031 -3.422 1.00 0.00 N ATOM 275 C2 A A 9 0.359 -11.090 -4.155 1.00 0.00 C ATOM 276 N3 A A 9 0.136 -10.642 -5.390 1.00 0.00 N ATOM 277 C4 A A 9 1.240 -10.059 -5.888 1.00 0.00 C ATOM 0 H5' A A 9 2.884 -10.098 -10.968 1.00 0.00 H new ATOM 0 H5'' A A 9 2.794 -8.568 -11.819 1.00 0.00 H new ATOM 0 H4' A A 9 0.655 -8.785 -11.196 1.00 0.00 H new ATOM 0 H3' A A 9 2.017 -7.184 -9.046 1.00 0.00 H new ATOM 0 H2' A A 9 -0.030 -7.251 -7.652 1.00 0.00 H new ATOM 0 HO2' A A 9 -1.275 -7.290 -9.853 1.00 0.00 H new ATOM 0 H1' A A 9 -0.478 -9.901 -7.861 1.00 0.00 H new ATOM 0 H8 A A 9 3.104 -8.492 -8.004 1.00 0.00 H new ATOM 0 H61 A A 9 3.689 -10.774 -2.278 1.00 0.00 H new ATOM 0 H62 A A 9 4.512 -9.933 -3.595 1.00 0.00 H new ATOM 0 H2 A A 9 -0.483 -11.570 -3.678 1.00 0.00 H new ATOM 289 P U A 10 0.823 -4.948 -9.807 1.00 0.00 P ATOM 290 OP1 U A 10 0.105 -4.059 -10.755 1.00 0.00 O ATOM 291 OP2 U A 10 2.261 -4.707 -9.523 1.00 0.00 O ATOM 292 O5' U A 10 0.014 -4.963 -8.431 1.00 0.00 O ATOM 293 C5' U A 10 0.622 -4.561 -7.199 1.00 0.00 C ATOM 294 C4' U A 10 -0.317 -3.670 -6.414 1.00 0.00 C ATOM 295 O4' U A 10 -1.274 -3.080 -7.338 1.00 0.00 O ATOM 296 C3' U A 10 -1.155 -4.366 -5.341 1.00 0.00 C ATOM 297 O3' U A 10 -1.339 -3.529 -4.202 1.00 0.00 O ATOM 298 C2' U A 10 -2.470 -4.642 -6.059 1.00 0.00 C ATOM 299 O2' U A 10 -3.560 -4.668 -5.159 1.00 0.00 O ATOM 300 C1' U A 10 -2.587 -3.395 -6.928 1.00 0.00 C ATOM 301 N1 U A 10 -3.416 -3.578 -8.127 1.00 0.00 N ATOM 302 C2 U A 10 -4.582 -2.843 -8.222 1.00 0.00 C ATOM 303 O2 U A 10 -4.945 -2.063 -7.359 1.00 0.00 O ATOM 304 N3 U A 10 -5.307 -3.053 -9.366 1.00 0.00 N ATOM 305 C4 U A 10 -4.993 -3.905 -10.401 1.00 0.00 C ATOM 306 O4 U A 10 -5.746 -3.980 -11.371 1.00 0.00 O ATOM 307 C5 U A 10 -3.775 -4.634 -10.224 1.00 0.00 C ATOM 308 C6 U A 10 -3.045 -4.455 -9.118 1.00 0.00 C ATOM 0 H5' U A 10 1.553 -4.031 -7.401 1.00 0.00 H new ATOM 0 H5'' U A 10 0.878 -5.441 -6.608 1.00 0.00 H new ATOM 0 H4' U A 10 0.336 -2.958 -5.910 1.00 0.00 H new ATOM 0 H3' U A 10 -0.689 -5.270 -4.949 1.00 0.00 H new ATOM 0 H2' U A 10 -2.485 -5.598 -6.583 1.00 0.00 H new ATOM 0 HO2' U A 10 -4.388 -4.846 -5.653 1.00 0.00 H new ATOM 0 H1' U A 10 -3.069 -2.612 -6.344 1.00 0.00 H new ATOM 0 H3 U A 10 -6.172 -2.521 -9.461 1.00 0.00 H new ATOM 0 H5 U A 10 -3.445 -5.328 -10.983 1.00 0.00 H new ATOM 0 H6 U A 10 -2.132 -5.019 -8.999 1.00 0.00 H new ATOM 319 P A A 11 -0.977 -4.079 -2.734 1.00 0.00 P ATOM 320 OP1 A A 11 -1.482 -3.101 -1.736 1.00 0.00 O ATOM 321 OP2 A A 11 0.466 -4.432 -2.746 1.00 0.00 O ATOM 322 O5' A A 11 -1.818 -5.428 -2.600 1.00 0.00 O ATOM 323 C5' A A 11 -3.190 -5.420 -2.201 1.00 0.00 C ATOM 324 C4' A A 11 -3.554 -6.736 -1.546 1.00 0.00 C ATOM 325 O4' A A 11 -3.011 -7.832 -2.346 1.00 0.00 O ATOM 326 C3' A A 11 -2.981 -6.940 -0.143 1.00 0.00 C ATOM 327 O3' A A 11 -3.881 -6.522 0.877 1.00 0.00 O ATOM 328 C2' A A 11 -2.727 -8.440 -0.097 1.00 0.00 C ATOM 329 O2' A A 11 -3.924 -9.170 0.099 1.00 0.00 O ATOM 330 C1' A A 11 -2.240 -8.680 -1.519 1.00 0.00 C ATOM 331 N9 A A 11 -0.826 -8.368 -1.730 1.00 0.00 N ATOM 332 C8 A A 11 -0.278 -7.585 -2.715 1.00 0.00 C ATOM 333 N7 A A 11 1.027 -7.487 -2.648 1.00 0.00 N ATOM 334 C5 A A 11 1.363 -8.260 -1.546 1.00 0.00 C ATOM 335 C6 A A 11 2.596 -8.559 -0.940 1.00 0.00 C ATOM 336 N6 A A 11 3.766 -8.088 -1.372 1.00 0.00 N ATOM 337 N1 A A 11 2.584 -9.364 0.144 1.00 0.00 N ATOM 338 C2 A A 11 1.407 -9.823 0.588 1.00 0.00 C ATOM 339 N3 A A 11 0.184 -9.616 0.103 1.00 0.00 N ATOM 340 C4 A A 11 0.232 -8.815 -0.975 1.00 0.00 C ATOM 0 H5' A A 11 -3.827 -5.249 -3.069 1.00 0.00 H new ATOM 0 H5'' A A 11 -3.369 -4.599 -1.507 1.00 0.00 H new ATOM 0 H4' A A 11 -4.642 -6.720 -1.477 1.00 0.00 H new ATOM 0 H3' A A 11 -2.086 -6.345 0.039 1.00 0.00 H new ATOM 0 H2' A A 11 -2.054 -8.743 0.705 1.00 0.00 H new ATOM 0 HO2' A A 11 -4.588 -8.598 0.537 1.00 0.00 H new ATOM 0 H1' A A 11 -2.350 -9.741 -1.743 1.00 0.00 H new ATOM 0 H8 A A 11 -0.868 -7.095 -3.475 1.00 0.00 H new ATOM 0 H61 A A 11 4.628 -8.342 -0.889 1.00 0.00 H new ATOM 0 H62 A A 11 3.799 -7.474 -2.186 1.00 0.00 H new ATOM 0 H2 A A 11 1.457 -10.451 1.465 1.00 0.00 H new ATOM 352 P C A 12 -3.323 -5.712 2.151 1.00 0.00 P ATOM 353 OP1 C A 12 -4.320 -5.865 3.240 1.00 0.00 O ATOM 354 OP2 C A 12 -2.940 -4.350 1.697 1.00 0.00 O ATOM 355 O5' C A 12 -1.992 -6.488 2.569 1.00 0.00 O ATOM 356 C5' C A 12 -2.037 -7.613 3.451 1.00 0.00 C ATOM 357 C4' C A 12 -0.704 -7.796 4.147 1.00 0.00 C ATOM 358 O4' C A 12 0.293 -8.213 3.174 1.00 0.00 O ATOM 359 C3' C A 12 -0.109 -6.551 4.787 1.00 0.00 C ATOM 360 O3' C A 12 -0.645 -6.333 6.090 1.00 0.00 O ATOM 361 C2' C A 12 1.379 -6.879 4.813 1.00 0.00 C ATOM 362 O2' C A 12 1.699 -7.774 5.863 1.00 0.00 O ATOM 363 C1' C A 12 1.542 -7.618 3.485 1.00 0.00 C ATOM 364 N1 C A 12 1.929 -6.739 2.371 1.00 0.00 N ATOM 365 C2 C A 12 3.263 -6.331 2.264 1.00 0.00 C ATOM 366 O2 C A 12 4.081 -6.722 3.110 1.00 0.00 O ATOM 367 N3 C A 12 3.625 -5.523 1.243 1.00 0.00 N ATOM 368 C4 C A 12 2.714 -5.123 0.354 1.00 0.00 C ATOM 369 N4 C A 12 3.113 -4.329 -0.635 1.00 0.00 N ATOM 370 C5 C A 12 1.350 -5.519 0.441 1.00 0.00 C ATOM 371 C6 C A 12 1.004 -6.319 1.456 1.00 0.00 C ATOM 0 H5' C A 12 -2.287 -8.513 2.889 1.00 0.00 H new ATOM 0 H5'' C A 12 -2.824 -7.471 4.192 1.00 0.00 H new ATOM 0 H4' C A 12 -0.922 -8.520 4.932 1.00 0.00 H new ATOM 0 H3' C A 12 -0.329 -5.627 4.252 1.00 0.00 H new ATOM 0 H2' C A 12 2.008 -6.000 4.954 1.00 0.00 H new ATOM 0 HO2' C A 12 1.015 -7.716 6.562 1.00 0.00 H new ATOM 0 H1' C A 12 2.342 -8.349 3.604 1.00 0.00 H new ATOM 0 H41 C A 12 2.442 -4.005 -1.331 1.00 0.00 H new ATOM 0 H42 C A 12 4.090 -4.044 -0.697 1.00 0.00 H new ATOM 0 H5 C A 12 0.622 -5.187 -0.284 1.00 0.00 H new ATOM 0 H6 C A 12 -0.023 -6.638 1.554 1.00 0.00 H new ATOM 383 P C A 13 -0.921 -4.834 6.605 1.00 0.00 P ATOM 384 OP1 C A 13 -1.479 -4.935 7.977 1.00 0.00 O ATOM 385 OP2 C A 13 -1.679 -4.104 5.557 1.00 0.00 O ATOM 386 O5' C A 13 0.531 -4.186 6.710 1.00 0.00 O ATOM 387 C5' C A 13 1.552 -4.791 7.503 1.00 0.00 C ATOM 388 C4' C A 13 2.856 -4.053 7.318 1.00 0.00 C ATOM 389 O4' C A 13 3.338 -4.275 5.963 1.00 0.00 O ATOM 390 C3' C A 13 2.758 -2.541 7.461 1.00 0.00 C ATOM 391 O3' C A 13 2.910 -2.155 8.826 1.00 0.00 O ATOM 392 C2' C A 13 3.886 -2.046 6.562 1.00 0.00 C ATOM 393 O2' C A 13 5.147 -2.161 7.196 1.00 0.00 O ATOM 394 C1' C A 13 3.822 -3.059 5.420 1.00 0.00 C ATOM 395 N1 C A 13 2.935 -2.664 4.310 1.00 0.00 N ATOM 396 C2 C A 13 3.386 -1.715 3.381 1.00 0.00 C ATOM 397 O2 C A 13 4.518 -1.226 3.517 1.00 0.00 O ATOM 398 N3 C A 13 2.575 -1.357 2.358 1.00 0.00 N ATOM 399 C4 C A 13 1.362 -1.904 2.247 1.00 0.00 C ATOM 400 N4 C A 13 0.598 -1.531 1.221 1.00 0.00 N ATOM 401 C5 C A 13 0.877 -2.863 3.182 1.00 0.00 C ATOM 402 C6 C A 13 1.689 -3.212 4.185 1.00 0.00 C ATOM 0 H5' C A 13 1.673 -5.836 7.219 1.00 0.00 H new ATOM 0 H5'' C A 13 1.263 -4.778 8.554 1.00 0.00 H new ATOM 0 H4' C A 13 3.510 -4.439 8.100 1.00 0.00 H new ATOM 0 H3' C A 13 1.795 -2.120 7.172 1.00 0.00 H new ATOM 0 H2' C A 13 3.779 -0.999 6.278 1.00 0.00 H new ATOM 0 HO2' C A 13 5.018 -2.318 8.155 1.00 0.00 H new ATOM 0 H1' C A 13 4.824 -3.140 5.000 1.00 0.00 H new ATOM 0 H41 C A 13 -0.334 -1.930 1.107 1.00 0.00 H new ATOM 0 H42 C A 13 0.945 -0.846 0.549 1.00 0.00 H new ATOM 0 H5 C A 13 -0.109 -3.292 3.084 1.00 0.00 H new ATOM 0 H6 C A 13 1.355 -3.940 4.909 1.00 0.00 H new ATOM 414 P C A 14 1.940 -1.037 9.461 1.00 0.00 P ATOM 415 OP1 C A 14 2.046 -1.158 10.937 1.00 0.00 O ATOM 416 OP2 C A 14 0.605 -1.115 8.814 1.00 0.00 O ATOM 417 O5' C A 14 2.624 0.334 9.030 1.00 0.00 O ATOM 418 C5' C A 14 3.985 0.602 9.355 1.00 0.00 C ATOM 419 C4' C A 14 4.552 1.635 8.413 1.00 0.00 C ATOM 420 O4' C A 14 4.559 1.093 7.064 1.00 0.00 O ATOM 421 C3' C A 14 3.757 2.925 8.299 1.00 0.00 C ATOM 422 O3' C A 14 4.099 3.822 9.352 1.00 0.00 O ATOM 423 C2' C A 14 4.166 3.427 6.919 1.00 0.00 C ATOM 424 O2' C A 14 5.458 4.002 6.945 1.00 0.00 O ATOM 425 C1' C A 14 4.227 2.114 6.140 1.00 0.00 C ATOM 426 N1 C A 14 2.960 1.753 5.480 1.00 0.00 N ATOM 427 C2 C A 14 2.698 2.264 4.208 1.00 0.00 C ATOM 428 O2 C A 14 3.535 3.006 3.674 1.00 0.00 O ATOM 429 N3 C A 14 1.541 1.937 3.591 1.00 0.00 N ATOM 430 C4 C A 14 0.663 1.137 4.197 1.00 0.00 C ATOM 431 N4 C A 14 -0.464 0.840 3.546 1.00 0.00 N ATOM 432 C5 C A 14 0.901 0.605 5.496 1.00 0.00 C ATOM 433 C6 C A 14 2.053 0.934 6.094 1.00 0.00 C ATOM 0 H5' C A 14 4.569 -0.316 9.293 1.00 0.00 H new ATOM 0 H5'' C A 14 4.058 0.958 10.383 1.00 0.00 H new ATOM 0 H4' C A 14 5.533 1.864 8.828 1.00 0.00 H new ATOM 0 H3' C A 14 2.677 2.810 8.395 1.00 0.00 H new ATOM 0 H2' C A 14 3.499 4.189 6.516 1.00 0.00 H new ATOM 0 HO2' C A 14 5.701 4.219 7.869 1.00 0.00 H new ATOM 0 H1' C A 14 4.966 2.232 5.347 1.00 0.00 H new ATOM 0 H41 C A 14 -1.158 0.231 3.979 1.00 0.00 H new ATOM 0 H42 C A 14 -0.631 1.222 2.615 1.00 0.00 H new ATOM 0 H5 C A 14 0.181 -0.038 5.980 1.00 0.00 H new ATOM 0 H6 C A 14 2.270 0.546 7.078 1.00 0.00 H new ATOM 445 P C A 15 2.959 4.718 10.049 1.00 0.00 P ATOM 446 OP1 C A 15 3.508 5.186 11.347 1.00 0.00 O ATOM 447 OP2 C A 15 1.667 3.984 10.023 1.00 0.00 O ATOM 448 O5' C A 15 2.836 5.979 9.084 1.00 0.00 O ATOM 449 C5' C A 15 3.988 6.737 8.726 1.00 0.00 C ATOM 450 C4' C A 15 3.739 7.488 7.441 1.00 0.00 C ATOM 451 O4' C A 15 3.597 6.537 6.349 1.00 0.00 O ATOM 452 C3' C A 15 2.458 8.303 7.396 1.00 0.00 C ATOM 453 O3' C A 15 2.636 9.573 8.021 1.00 0.00 O ATOM 454 C2' C A 15 2.198 8.392 5.899 1.00 0.00 C ATOM 455 O2' C A 15 3.073 9.315 5.277 1.00 0.00 O ATOM 456 C1' C A 15 2.583 6.979 5.461 1.00 0.00 C ATOM 457 N1 C A 15 1.469 6.015 5.507 1.00 0.00 N ATOM 458 C2 C A 15 0.605 5.929 4.411 1.00 0.00 C ATOM 459 O2 C A 15 0.802 6.662 3.432 1.00 0.00 O ATOM 460 N3 C A 15 -0.421 5.049 4.445 1.00 0.00 N ATOM 461 C4 C A 15 -0.601 4.277 5.518 1.00 0.00 C ATOM 462 N4 C A 15 -1.626 3.424 5.506 1.00 0.00 N ATOM 463 C5 C A 15 0.262 4.343 6.649 1.00 0.00 C ATOM 464 C6 C A 15 1.276 5.216 6.601 1.00 0.00 C ATOM 0 H5' C A 15 4.846 6.075 8.608 1.00 0.00 H new ATOM 0 H5'' C A 15 4.233 7.438 9.524 1.00 0.00 H new ATOM 0 H4' C A 15 4.591 8.163 7.363 1.00 0.00 H new ATOM 0 H3' C A 15 1.618 7.869 7.939 1.00 0.00 H new ATOM 0 H2' C A 15 1.187 8.713 5.649 1.00 0.00 H new ATOM 0 HO2' C A 15 3.325 10.011 5.920 1.00 0.00 H new ATOM 0 H1' C A 15 2.906 7.024 4.421 1.00 0.00 H new ATOM 0 H41 C A 15 -1.795 2.818 6.309 1.00 0.00 H new ATOM 0 H42 C A 15 -2.241 3.378 4.694 1.00 0.00 H new ATOM 0 H5 C A 15 0.105 3.713 7.512 1.00 0.00 H new ATOM 0 H6 C A 15 1.953 5.291 7.439 1.00 0.00 H new ATOM 476 P G A 16 1.469 10.187 8.944 1.00 0.00 P ATOM 477 OP1 G A 16 2.100 11.208 9.819 1.00 0.00 O ATOM 478 OP2 G A 16 0.687 9.081 9.556 1.00 0.00 O ATOM 479 O5' G A 16 0.531 10.945 7.905 1.00 0.00 O ATOM 480 C5' G A 16 1.064 11.931 7.024 1.00 0.00 C ATOM 481 C4' G A 16 0.169 12.093 5.819 1.00 0.00 C ATOM 482 O4' G A 16 0.153 10.845 5.074 1.00 0.00 O ATOM 483 C3' G A 16 -1.294 12.380 6.121 1.00 0.00 C ATOM 484 O3' G A 16 -1.506 13.776 6.322 1.00 0.00 O ATOM 485 C2' G A 16 -1.993 11.838 4.880 1.00 0.00 C ATOM 486 O2' G A 16 -1.866 12.722 3.781 1.00 0.00 O ATOM 487 C1' G A 16 -1.156 10.591 4.597 1.00 0.00 C ATOM 488 N9 G A 16 -1.657 9.385 5.249 1.00 0.00 N ATOM 489 C8 G A 16 -1.195 8.814 6.410 1.00 0.00 C ATOM 490 N7 G A 16 -1.841 7.731 6.745 1.00 0.00 N ATOM 491 C5 G A 16 -2.791 7.578 5.744 1.00 0.00 C ATOM 492 C6 G A 16 -3.784 6.584 5.565 1.00 0.00 C ATOM 493 O6 G A 16 -4.031 5.602 6.275 1.00 0.00 O ATOM 494 N1 G A 16 -4.535 6.814 4.419 1.00 0.00 N ATOM 495 C2 G A 16 -4.356 7.861 3.554 1.00 0.00 C ATOM 496 N2 G A 16 -5.188 7.908 2.507 1.00 0.00 N ATOM 497 N3 G A 16 -3.432 8.793 3.704 1.00 0.00 N ATOM 498 C4 G A 16 -2.691 8.592 4.814 1.00 0.00 C ATOM 0 H5' G A 16 2.065 11.641 6.706 1.00 0.00 H new ATOM 0 H5'' G A 16 1.158 12.883 7.546 1.00 0.00 H new ATOM 0 H4' G A 16 0.587 12.948 5.287 1.00 0.00 H new ATOM 0 H3' G A 16 -1.667 11.923 7.038 1.00 0.00 H new ATOM 0 H2' G A 16 -3.062 11.678 5.023 1.00 0.00 H new ATOM 0 HO2' G A 16 -1.644 13.619 4.107 1.00 0.00 H new ATOM 0 H1' G A 16 -1.193 10.404 3.524 1.00 0.00 H new ATOM 0 H8 G A 16 -0.378 9.221 6.988 1.00 0.00 H new ATOM 0 H1 G A 16 -5.279 6.150 4.205 1.00 0.00 H new ATOM 0 H21 G A 16 -5.108 8.662 1.825 1.00 0.00 H new ATOM 0 H22 G A 16 -5.902 7.189 2.391 1.00 0.00 H new ATOM 510 P A A 17 -2.487 14.280 7.493 1.00 0.00 P ATOM 511 OP1 A A 17 -2.240 15.733 7.671 1.00 0.00 O ATOM 512 OP2 A A 17 -2.366 13.368 8.660 1.00 0.00 O ATOM 513 O5' A A 17 -3.942 14.103 6.868 1.00 0.00 O ATOM 514 C5' A A 17 -4.270 14.677 5.604 1.00 0.00 C ATOM 515 C4' A A 17 -5.446 13.953 4.993 1.00 0.00 C ATOM 516 O4' A A 17 -5.058 12.583 4.707 1.00 0.00 O ATOM 517 C3' A A 17 -6.669 13.822 5.889 1.00 0.00 C ATOM 518 O3' A A 17 -7.497 14.991 5.849 1.00 0.00 O ATOM 519 C2' A A 17 -7.357 12.583 5.324 1.00 0.00 C ATOM 520 O2' A A 17 -8.086 12.878 4.146 1.00 0.00 O ATOM 521 C1' A A 17 -6.156 11.719 4.939 1.00 0.00 C ATOM 522 N9 A A 17 -5.776 10.754 5.970 1.00 0.00 N ATOM 523 C8 A A 17 -4.751 10.841 6.881 1.00 0.00 C ATOM 524 N7 A A 17 -4.669 9.807 7.683 1.00 0.00 N ATOM 525 C5 A A 17 -5.708 8.983 7.271 1.00 0.00 C ATOM 526 C6 A A 17 -6.157 7.728 7.719 1.00 0.00 C ATOM 527 N6 A A 17 -5.592 7.052 8.721 1.00 0.00 N ATOM 528 N1 A A 17 -7.222 7.183 7.093 1.00 0.00 N ATOM 529 C2 A A 17 -7.789 7.857 6.085 1.00 0.00 C ATOM 530 N3 A A 17 -7.457 9.039 5.572 1.00 0.00 N ATOM 531 C4 A A 17 -6.397 9.555 6.218 1.00 0.00 C ATOM 0 H5' A A 17 -3.411 14.619 4.936 1.00 0.00 H new ATOM 0 H5'' A A 17 -4.508 15.734 5.727 1.00 0.00 H new ATOM 0 H4' A A 17 -5.711 14.554 4.123 1.00 0.00 H new ATOM 0 H3' A A 17 -6.428 13.726 6.948 1.00 0.00 H new ATOM 0 H2' A A 17 -8.064 12.137 6.023 1.00 0.00 H new ATOM 0 HO2' A A 17 -8.323 13.829 4.138 1.00 0.00 H new ATOM 0 HO3' A A 17 -8.271 14.864 6.436 1.00 0.00 H new ATOM 0 H1' A A 17 -6.434 11.145 4.055 1.00 0.00 H new ATOM 0 H8 A A 17 -4.076 11.683 6.932 1.00 0.00 H new ATOM 0 H61 A A 17 -5.966 6.144 8.999 1.00 0.00 H new ATOM 0 H62 A A 17 -4.786 7.443 9.209 1.00 0.00 H new ATOM 0 H2 A A 17 -8.636 7.373 5.622 1.00 0.00 H new TER 544 A A 17