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 -129:sc= 0.0959 USER MOD Single : A 2 C O2' : rot -21:sc= 0.0979 USER MOD Single : A 3 G O2' : rot -19:sc= 0.061 USER MOD Single : A 4 G O2' : rot -22:sc= 0.0629 USER MOD Single : A 5 G O2' : rot -29:sc= 0.0481 USER MOD Single : A 6 C O2' : rot -21:sc= 0.0583 USER MOD Single : A 7 C O2' : rot -146:sc= 1.32 USER MOD Single : A 8 RSQ O2' : rot -132:sc= 0.106 USER MOD Single : A 9 A O2' : rot -24:sc= 0.109 USER MOD Single : A 10 U O2' : rot 180:sc= -0.699 USER MOD Single : A 11 A O2' : rot -31:sc= 0.0325 USER MOD Single : A 12 C O2' : rot -22:sc= 0.12 USER MOD Single : A 13 C O2' : rot -18:sc= 0.136 USER MOD Single : A 14 C O2' : rot -19:sc= 0.0742 USER MOD Single : A 15 C O2' : rot -22:sc= 0.0512 USER MOD Single : A 16 G O2' : rot -25:sc= 0.0683 USER MOD Single : A 17 A O2' : rot -18:sc= 0.0901 USER MOD Single : A 17 A O3' : rot 180:sc= 0.0814 USER MOD ----------------------------------------------------------------- HETATM 1 N1 PSU A 1 -5.943 0.351 7.538 1.00 0.00 N HETATM 2 C2 PSU A 1 -6.229 1.683 7.753 1.00 0.00 C HETATM 3 N3 PSU A 1 -7.479 2.077 7.356 1.00 0.00 N HETATM 4 C4 PSU A 1 -8.453 1.294 6.782 1.00 0.00 C HETATM 5 C5 PSU A 1 -8.083 -0.077 6.593 1.00 0.00 C HETATM 6 C6 PSU A 1 -6.867 -0.495 6.968 1.00 0.00 C HETATM 7 O2 PSU A 1 -5.444 2.450 8.276 1.00 0.00 O HETATM 8 O4 PSU A 1 -9.533 1.802 6.484 1.00 0.00 O HETATM 9 C1' PSU A 1 -9.063 -0.983 5.989 1.00 0.00 C HETATM 10 C2' PSU A 1 -9.262 -0.774 4.486 1.00 0.00 C HETATM 11 O2' PSU A 1 -10.601 -1.095 4.160 1.00 0.00 O HETATM 12 C3' PSU A 1 -8.293 -1.799 3.906 1.00 0.00 C HETATM 13 C4' PSU A 1 -8.399 -2.953 4.894 1.00 0.00 C HETATM 14 O3' PSU A 1 -8.657 -2.214 2.592 1.00 0.00 O HETATM 15 O4' PSU A 1 -8.617 -2.314 6.181 1.00 0.00 O HETATM 16 C5' PSU A 1 -7.179 -3.842 4.986 1.00 0.00 C HETATM 17 O5' PSU A 1 -6.016 -3.081 5.329 1.00 0.00 O HETATM 0 HO2' PSU A 1 -10.613 -1.721 3.406 1.00 0.00 H new HETATM 0 H5'' PSU A 1 -7.345 -4.617 5.734 1.00 0.00 H new HETATM 0 HN3 PSU A 1 -7.713 3.059 7.502 1.00 0.00 H new HETATM 0 HN1 PSU A 1 -5.029 -0.014 7.807 1.00 0.00 H new HETATM 0 H6 PSU A 1 -6.600 -1.541 6.817 1.00 0.00 H new HETATM 0 H5' PSU A 1 -7.020 -4.347 4.033 1.00 0.00 H new HETATM 0 H4' PSU A 1 -9.196 -3.622 4.568 1.00 0.00 H new HETATM 0 H3' PSU A 1 -7.284 -1.403 3.793 1.00 0.00 H new HETATM 0 H2' PSU A 1 -9.085 0.238 4.123 1.00 0.00 H new HETATM 0 H1' PSU A 1 -10.017 -0.777 6.474 1.00 0.00 H new ATOM 28 P C A 2 -7.941 -1.551 1.313 1.00 0.00 P ATOM 29 OP1 C A 2 -8.487 -2.221 0.105 1.00 0.00 O ATOM 30 OP2 C A 2 -6.473 -1.542 1.543 1.00 0.00 O ATOM 31 O5' C A 2 -8.452 -0.041 1.321 1.00 0.00 O ATOM 32 C5' C A 2 -9.758 0.302 0.858 1.00 0.00 C ATOM 33 C4' C A 2 -9.832 1.781 0.557 1.00 0.00 C ATOM 34 O4' C A 2 -9.807 2.516 1.812 1.00 0.00 O ATOM 35 C3' C A 2 -8.668 2.339 -0.253 1.00 0.00 C ATOM 36 O3' C A 2 -8.923 2.240 -1.653 1.00 0.00 O ATOM 37 C2' C A 2 -8.588 3.785 0.224 1.00 0.00 C ATOM 38 O2' C A 2 -9.580 4.584 -0.393 1.00 0.00 O ATOM 39 C1' C A 2 -8.934 3.627 1.703 1.00 0.00 C ATOM 40 N1 C A 2 -7.770 3.387 2.575 1.00 0.00 N ATOM 41 C2 C A 2 -7.042 4.483 3.051 1.00 0.00 C ATOM 42 O2 C A 2 -7.383 5.626 2.712 1.00 0.00 O ATOM 43 N3 C A 2 -5.986 4.269 3.867 1.00 0.00 N ATOM 44 C4 C A 2 -5.645 3.023 4.204 1.00 0.00 C ATOM 45 N4 C A 2 -4.601 2.859 5.017 1.00 0.00 N ATOM 46 C5 C A 2 -6.359 1.890 3.724 1.00 0.00 C ATOM 47 C6 C A 2 -7.405 2.116 2.920 1.00 0.00 C ATOM 0 H5' C A 2 -10.500 0.039 1.612 1.00 0.00 H new ATOM 0 H5'' C A 2 -9.997 -0.271 -0.038 1.00 0.00 H new ATOM 0 H4' C A 2 -10.745 1.899 -0.027 1.00 0.00 H new ATOM 0 H3' C A 2 -7.732 1.800 -0.109 1.00 0.00 H new ATOM 0 H2' C A 2 -7.631 4.261 0.009 1.00 0.00 H new ATOM 0 HO2' C A 2 -9.887 4.148 -1.215 1.00 0.00 H new ATOM 0 H1' C A 2 -9.379 4.565 2.037 1.00 0.00 H new ATOM 0 H41 C A 2 -4.313 1.921 5.295 1.00 0.00 H new ATOM 0 H42 C A 2 -4.090 3.672 5.361 1.00 0.00 H new ATOM 0 H5 C A 2 -6.068 0.887 3.998 1.00 0.00 H new ATOM 0 H6 C A 2 -7.970 1.279 2.537 1.00 0.00 H new ATOM 59 P G A 3 -7.848 1.531 -2.621 1.00 0.00 P ATOM 60 OP1 G A 3 -8.572 1.069 -3.833 1.00 0.00 O ATOM 61 OP2 G A 3 -7.061 0.555 -1.825 1.00 0.00 O ATOM 62 O5' G A 3 -6.878 2.720 -3.050 1.00 0.00 O ATOM 63 C5' G A 3 -7.360 3.811 -3.832 1.00 0.00 C ATOM 64 C4' G A 3 -6.384 4.964 -3.783 1.00 0.00 C ATOM 65 O4' G A 3 -6.377 5.528 -2.443 1.00 0.00 O ATOM 66 C3' G A 3 -4.928 4.609 -4.044 1.00 0.00 C ATOM 67 O3' G A 3 -4.645 4.542 -5.439 1.00 0.00 O ATOM 68 C2' G A 3 -4.195 5.747 -3.347 1.00 0.00 C ATOM 69 O2' G A 3 -4.245 6.936 -4.113 1.00 0.00 O ATOM 70 C1' G A 3 -5.061 5.929 -2.101 1.00 0.00 C ATOM 71 N9 G A 3 -4.621 5.134 -0.958 1.00 0.00 N ATOM 72 C8 G A 3 -5.075 3.891 -0.590 1.00 0.00 C ATOM 73 N7 G A 3 -4.500 3.431 0.487 1.00 0.00 N ATOM 74 C5 G A 3 -3.608 4.430 0.852 1.00 0.00 C ATOM 75 C6 G A 3 -2.704 4.501 1.941 1.00 0.00 C ATOM 76 O6 G A 3 -2.505 3.670 2.834 1.00 0.00 O ATOM 77 N1 G A 3 -1.986 5.692 1.934 1.00 0.00 N ATOM 78 C2 G A 3 -2.120 6.687 1.001 1.00 0.00 C ATOM 79 N2 G A 3 -1.336 7.758 1.165 1.00 0.00 N ATOM 80 N3 G A 3 -2.961 6.636 -0.019 1.00 0.00 N ATOM 81 C4 G A 3 -3.668 5.487 -0.032 1.00 0.00 C ATOM 0 H5' G A 3 -8.332 4.133 -3.459 1.00 0.00 H new ATOM 0 H5'' G A 3 -7.504 3.492 -4.864 1.00 0.00 H new ATOM 0 H4' G A 3 -6.731 5.632 -4.571 1.00 0.00 H new ATOM 0 H3' G A 3 -4.636 3.625 -3.676 1.00 0.00 H new ATOM 0 H2' G A 3 -3.140 5.541 -3.168 1.00 0.00 H new ATOM 0 HO2' G A 3 -4.470 6.718 -5.041 1.00 0.00 H new ATOM 0 H1' G A 3 -4.994 6.974 -1.799 1.00 0.00 H new ATOM 0 H8 G A 3 -5.832 3.349 -1.137 1.00 0.00 H new ATOM 0 H1 G A 3 -1.307 5.836 2.681 1.00 0.00 H new ATOM 0 H21 G A 3 -1.387 8.534 0.505 1.00 0.00 H new ATOM 0 H22 G A 3 -0.687 7.799 1.951 1.00 0.00 H new ATOM 93 P G A 4 -3.478 3.571 -5.973 1.00 0.00 P ATOM 94 OP1 G A 4 -3.495 3.604 -7.458 1.00 0.00 O ATOM 95 OP2 G A 4 -3.606 2.269 -5.269 1.00 0.00 O ATOM 96 O5' G A 4 -2.135 4.269 -5.475 1.00 0.00 O ATOM 97 C5' G A 4 -1.732 5.537 -5.987 1.00 0.00 C ATOM 98 C4' G A 4 -0.667 6.143 -5.101 1.00 0.00 C ATOM 99 O4' G A 4 -1.170 6.223 -3.739 1.00 0.00 O ATOM 100 C3' G A 4 0.623 5.343 -4.981 1.00 0.00 C ATOM 101 O3' G A 4 1.518 5.621 -6.056 1.00 0.00 O ATOM 102 C2' G A 4 1.163 5.805 -3.633 1.00 0.00 C ATOM 103 O2' G A 4 1.751 7.089 -3.725 1.00 0.00 O ATOM 104 C1' G A 4 -0.130 5.914 -2.827 1.00 0.00 C ATOM 105 N9 G A 4 -0.485 4.687 -2.118 1.00 0.00 N ATOM 106 C8 G A 4 -1.402 3.740 -2.504 1.00 0.00 C ATOM 107 N7 G A 4 -1.516 2.757 -1.655 1.00 0.00 N ATOM 108 C5 G A 4 -0.611 3.068 -0.650 1.00 0.00 C ATOM 109 C6 G A 4 -0.285 2.372 0.541 1.00 0.00 C ATOM 110 O6 G A 4 -0.756 1.312 0.970 1.00 0.00 O ATOM 111 N1 G A 4 0.694 3.037 1.269 1.00 0.00 N ATOM 112 C2 G A 4 1.279 4.222 0.906 1.00 0.00 C ATOM 113 N2 G A 4 2.205 4.703 1.743 1.00 0.00 N ATOM 114 N3 G A 4 0.980 4.886 -0.195 1.00 0.00 N ATOM 115 C4 G A 4 0.036 4.255 -0.923 1.00 0.00 C ATOM 0 H5' G A 4 -2.592 6.205 -6.043 1.00 0.00 H new ATOM 0 H5'' G A 4 -1.350 5.423 -7.001 1.00 0.00 H new ATOM 0 H4' G A 4 -0.444 7.100 -5.573 1.00 0.00 H new ATOM 0 H3' G A 4 0.481 4.264 -5.036 1.00 0.00 H new ATOM 0 H2' G A 4 1.928 5.147 -3.222 1.00 0.00 H new ATOM 0 HO2' G A 4 2.000 7.269 -4.656 1.00 0.00 H new ATOM 0 H1' G A 4 0.014 6.682 -2.067 1.00 0.00 H new ATOM 0 H8 G A 4 -1.972 3.803 -3.419 1.00 0.00 H new ATOM 0 H1 G A 4 1.002 2.609 2.143 1.00 0.00 H new ATOM 0 H21 G A 4 2.678 5.581 1.530 1.00 0.00 H new ATOM 0 H22 G A 4 2.438 4.191 2.594 1.00 0.00 H new ATOM 127 P G A 5 2.262 4.412 -6.814 1.00 0.00 P ATOM 128 OP1 G A 5 2.802 4.964 -8.083 1.00 0.00 O ATOM 129 OP2 G A 5 1.355 3.235 -6.856 1.00 0.00 O ATOM 130 O5' G A 5 3.492 4.059 -5.864 1.00 0.00 O ATOM 131 C5' G A 5 4.702 4.813 -5.918 1.00 0.00 C ATOM 132 C4' G A 5 5.470 4.667 -4.623 1.00 0.00 C ATOM 133 O4' G A 5 4.542 4.764 -3.504 1.00 0.00 O ATOM 134 C3' G A 5 6.171 3.331 -4.412 1.00 0.00 C ATOM 135 O3' G A 5 7.449 3.290 -5.041 1.00 0.00 O ATOM 136 C2' G A 5 6.261 3.260 -2.894 1.00 0.00 C ATOM 137 O2' G A 5 7.262 4.125 -2.389 1.00 0.00 O ATOM 138 C1' G A 5 4.892 3.816 -2.509 1.00 0.00 C ATOM 139 N9 G A 5 3.850 2.795 -2.453 1.00 0.00 N ATOM 140 C8 G A 5 2.788 2.646 -3.313 1.00 0.00 C ATOM 141 N7 G A 5 2.022 1.631 -3.017 1.00 0.00 N ATOM 142 C5 G A 5 2.616 1.072 -1.892 1.00 0.00 C ATOM 143 C6 G A 5 2.243 -0.059 -1.121 1.00 0.00 C ATOM 144 O6 G A 5 1.286 -0.821 -1.286 1.00 0.00 O ATOM 145 N1 G A 5 3.121 -0.272 -0.064 1.00 0.00 N ATOM 146 C2 G A 5 4.221 0.498 0.215 1.00 0.00 C ATOM 147 N2 G A 5 4.941 0.129 1.284 1.00 0.00 N ATOM 148 N3 G A 5 4.586 1.552 -0.498 1.00 0.00 N ATOM 149 C4 G A 5 3.744 1.781 -1.528 1.00 0.00 C ATOM 0 H5' G A 5 4.476 5.864 -6.098 1.00 0.00 H new ATOM 0 H5'' G A 5 5.314 4.471 -6.752 1.00 0.00 H new ATOM 0 H4' G A 5 6.223 5.453 -4.679 1.00 0.00 H new ATOM 0 H3' G A 5 5.647 2.483 -4.853 1.00 0.00 H new ATOM 0 H2' G A 5 6.503 2.267 -2.516 1.00 0.00 H new ATOM 0 HO2' G A 5 7.974 4.225 -3.055 1.00 0.00 H new ATOM 0 H1' G A 5 4.962 4.247 -1.510 1.00 0.00 H new ATOM 0 H8 G A 5 2.605 3.303 -4.150 1.00 0.00 H new ATOM 0 H1 G A 5 2.932 -1.063 0.552 1.00 0.00 H new ATOM 0 H21 G A 5 5.772 0.659 1.547 1.00 0.00 H new ATOM 0 H22 G A 5 4.658 -0.682 1.834 1.00 0.00 H new ATOM 161 P C A 6 8.054 1.881 -5.532 1.00 0.00 P ATOM 162 OP1 C A 6 9.521 2.063 -5.675 1.00 0.00 O ATOM 163 OP2 C A 6 7.257 1.408 -6.693 1.00 0.00 O ATOM 164 O5' C A 6 7.780 0.893 -4.311 1.00 0.00 O ATOM 165 C5' C A 6 8.706 0.777 -3.231 1.00 0.00 C ATOM 166 C4' C A 6 8.452 -0.498 -2.462 1.00 0.00 C ATOM 167 O4' C A 6 7.161 -0.411 -1.794 1.00 0.00 O ATOM 168 C3' C A 6 8.338 -1.758 -3.308 1.00 0.00 C ATOM 169 O3' C A 6 9.607 -2.307 -3.643 1.00 0.00 O ATOM 170 C2' C A 6 7.525 -2.672 -2.404 1.00 0.00 C ATOM 171 O2' C A 6 8.312 -3.187 -1.345 1.00 0.00 O ATOM 172 C1' C A 6 6.517 -1.676 -1.834 1.00 0.00 C ATOM 173 N1 C A 6 5.298 -1.563 -2.651 1.00 0.00 N ATOM 174 C2 C A 6 4.418 -2.647 -2.704 1.00 0.00 C ATOM 175 O2 C A 6 4.666 -3.655 -2.029 1.00 0.00 O ATOM 176 N3 C A 6 3.319 -2.568 -3.487 1.00 0.00 N ATOM 177 C4 C A 6 3.081 -1.460 -4.189 1.00 0.00 C ATOM 178 N4 C A 6 1.996 -1.431 -4.961 1.00 0.00 N ATOM 179 C5 C A 6 3.947 -0.331 -4.133 1.00 0.00 C ATOM 180 C6 C A 6 5.031 -0.425 -3.357 1.00 0.00 C ATOM 0 H5' C A 6 8.611 1.636 -2.567 1.00 0.00 H new ATOM 0 H5'' C A 6 9.726 0.782 -3.615 1.00 0.00 H new ATOM 0 H4' C A 6 9.316 -0.581 -1.802 1.00 0.00 H new ATOM 0 H3' C A 6 7.878 -1.589 -4.282 1.00 0.00 H new ATOM 0 H2' C A 6 7.106 -3.538 -2.917 1.00 0.00 H new ATOM 0 HO2' C A 6 9.261 -3.127 -1.583 1.00 0.00 H new ATOM 0 H1' C A 6 6.205 -2.021 -0.848 1.00 0.00 H new ATOM 0 H41 C A 6 1.784 -0.599 -5.511 1.00 0.00 H new ATOM 0 H42 C A 6 1.377 -2.241 -5.002 1.00 0.00 H new ATOM 0 H5 C A 6 3.736 0.566 -4.696 1.00 0.00 H new ATOM 0 H6 C A 6 5.708 0.414 -3.287 1.00 0.00 H new ATOM 192 P C A 7 9.804 -3.046 -5.058 1.00 0.00 P ATOM 193 OP1 C A 7 11.058 -3.836 -4.971 1.00 0.00 O ATOM 194 OP2 C A 7 9.646 -2.037 -6.137 1.00 0.00 O ATOM 195 O5' C A 7 8.576 -4.060 -5.143 1.00 0.00 O ATOM 196 C5' C A 7 8.535 -5.232 -4.331 1.00 0.00 C ATOM 197 C4' C A 7 7.160 -5.860 -4.386 1.00 0.00 C ATOM 198 O4' C A 7 6.143 -4.829 -4.220 1.00 0.00 O ATOM 199 C3' C A 7 6.800 -6.527 -5.706 1.00 0.00 C ATOM 200 O3' C A 7 7.293 -7.861 -5.790 1.00 0.00 O ATOM 201 C2' C A 7 5.281 -6.478 -5.680 1.00 0.00 C ATOM 202 O2' C A 7 4.757 -7.440 -4.785 1.00 0.00 O ATOM 203 C1' C A 7 5.050 -5.089 -5.089 1.00 0.00 C ATOM 204 N1 C A 7 4.985 -4.009 -6.090 1.00 0.00 N ATOM 205 C2 C A 7 4.101 -4.129 -7.170 1.00 0.00 C ATOM 206 O2 C A 7 3.379 -5.135 -7.249 1.00 0.00 O ATOM 207 N3 C A 7 4.054 -3.145 -8.095 1.00 0.00 N ATOM 208 C4 C A 7 4.839 -2.074 -7.971 1.00 0.00 C ATOM 209 N4 C A 7 4.758 -1.131 -8.910 1.00 0.00 N ATOM 210 C5 C A 7 5.742 -1.922 -6.878 1.00 0.00 C ATOM 211 C6 C A 7 5.781 -2.904 -5.971 1.00 0.00 C ATOM 0 H5' C A 7 8.786 -4.978 -3.301 1.00 0.00 H new ATOM 0 H5'' C A 7 9.283 -5.947 -4.674 1.00 0.00 H new ATOM 0 H4' C A 7 7.188 -6.612 -3.598 1.00 0.00 H new ATOM 0 H3' C A 7 7.239 -6.036 -6.575 1.00 0.00 H new ATOM 0 H2' C A 7 4.819 -6.669 -6.649 1.00 0.00 H new ATOM 0 HO2' C A 7 3.904 -7.778 -5.130 1.00 0.00 H new ATOM 0 H1' C A 7 4.082 -5.096 -4.588 1.00 0.00 H new ATOM 0 H41 C A 7 5.343 -0.298 -8.848 1.00 0.00 H new ATOM 0 H42 C A 7 4.111 -1.243 -9.690 1.00 0.00 H new ATOM 0 H5 C A 7 6.370 -1.048 -6.786 1.00 0.00 H new ATOM 0 H6 C A 7 6.453 -2.823 -5.130 1.00 0.00 H new HETATM 223 P RSQ A 8 7.999 -8.373 -7.144 1.00 0.00 P HETATM 224 N1 RSQ A 8 4.121 -12.640 -7.516 1.00 0.00 N HETATM 225 C2 RSQ A 8 2.877 -13.260 -7.393 1.00 0.00 C HETATM 226 O2 RSQ A 8 2.301 -13.657 -8.415 1.00 0.00 O HETATM 227 N3 RSQ A 8 2.334 -13.411 -6.167 1.00 0.00 N HETATM 228 C4 RSQ A 8 2.987 -12.977 -5.091 1.00 0.00 C HETATM 229 N4 RSQ A 8 2.407 -13.149 -3.911 1.00 0.00 N HETATM 230 C5 RSQ A 8 4.263 -12.348 -5.179 1.00 0.00 C HETATM 231 C6 RSQ A 8 4.784 -12.197 -6.406 1.00 0.00 C HETATM 232 C1' RSQ A 8 4.705 -12.482 -8.858 1.00 0.00 C HETATM 233 C10 RSQ A 8 5.024 -11.873 -4.034 1.00 0.00 C HETATM 234 C2' RSQ A 8 4.194 -11.254 -9.612 1.00 0.00 C HETATM 235 O2' RSQ A 8 4.086 -11.589 -10.983 1.00 0.00 O HETATM 236 C3' RSQ A 8 5.314 -10.247 -9.367 1.00 0.00 C HETATM 237 O3' RSQ A 8 5.392 -9.271 -10.402 1.00 0.00 O HETATM 238 O30 RSQ A 8 4.687 -11.947 -2.888 1.00 0.00 O HETATM 239 C4' RSQ A 8 6.558 -11.126 -9.331 1.00 0.00 C HETATM 240 O4' RSQ A 8 6.109 -12.363 -8.722 1.00 0.00 O HETATM 241 C5' RSQ A 8 7.723 -10.588 -8.531 1.00 0.00 C HETATM 242 O5' RSQ A 8 7.256 -9.742 -7.480 1.00 0.00 O HETATM 243 OP1 RSQ A 8 7.689 -7.418 -8.238 1.00 0.00 O HETATM 244 OP2 RSQ A 8 9.415 -8.685 -6.825 1.00 0.00 O HETATM 0 HO2' RSQ A 8 4.506 -10.889 -11.525 1.00 0.00 H new HETATM 0 HN4A RSQ A 8 2.874 -12.831 -3.062 1.00 0.00 H new HETATM 0 H5'A RSQ A 8 8.298 -11.414 -8.113 1.00 0.00 H new HETATM 0 HN4 RSQ A 8 1.494 -13.600 -3.852 1.00 0.00 H new HETATM 0 H6 RSQ A 8 5.754 -11.712 -6.520 1.00 0.00 H new HETATM 0 H5' RSQ A 8 8.394 -10.031 -9.184 1.00 0.00 H new HETATM 0 H4' RSQ A 8 6.948 -11.213 -10.345 1.00 0.00 H new HETATM 0 H3' RSQ A 8 5.169 -9.665 -8.457 1.00 0.00 H new HETATM 0 H2' RSQ A 8 3.218 -10.880 -9.302 1.00 0.00 H new HETATM 0 H10 RSQ A 8 5.988 -11.408 -4.238 1.00 0.00 H new HETATM 0 H1' RSQ A 8 4.412 -13.358 -9.436 1.00 0.00 H new ATOM 256 P A A 9 4.436 -7.977 -10.356 1.00 0.00 P ATOM 257 OP1 A A 9 4.302 -7.479 -11.749 1.00 0.00 O ATOM 258 OP2 A A 9 4.948 -7.067 -9.301 1.00 0.00 O ATOM 259 O5' A A 9 3.028 -8.551 -9.869 1.00 0.00 O ATOM 260 C5' A A 9 2.022 -8.963 -10.799 1.00 0.00 C ATOM 261 C4' A A 9 0.657 -8.546 -10.303 1.00 0.00 C ATOM 262 O4' A A 9 0.216 -9.491 -9.286 1.00 0.00 O ATOM 263 C3' A A 9 0.623 -7.181 -9.629 1.00 0.00 C ATOM 264 O3' A A 9 0.336 -6.149 -10.566 1.00 0.00 O ATOM 265 C2' A A 9 -0.483 -7.337 -8.586 1.00 0.00 C ATOM 266 O2' A A 9 -1.765 -7.193 -9.167 1.00 0.00 O ATOM 267 C1' A A 9 -0.296 -8.793 -8.165 1.00 0.00 C ATOM 268 N9 A A 9 0.647 -8.940 -7.059 1.00 0.00 N ATOM 269 C8 A A 9 1.981 -8.647 -7.106 1.00 0.00 C ATOM 270 N7 A A 9 2.612 -8.863 -5.982 1.00 0.00 N ATOM 271 C5 A A 9 1.621 -9.320 -5.127 1.00 0.00 C ATOM 272 C6 A A 9 1.648 -9.718 -3.782 1.00 0.00 C ATOM 273 N6 A A 9 2.752 -9.725 -3.036 1.00 0.00 N ATOM 274 N1 A A 9 0.487 -10.116 -3.222 1.00 0.00 N ATOM 275 C2 A A 9 -0.620 -10.112 -3.972 1.00 0.00 C ATOM 276 N3 A A 9 -0.771 -9.765 -5.251 1.00 0.00 N ATOM 277 C4 A A 9 0.402 -9.374 -5.777 1.00 0.00 C ATOM 0 H5' A A 9 2.056 -10.045 -10.928 1.00 0.00 H new ATOM 0 H5'' A A 9 2.214 -8.519 -11.776 1.00 0.00 H new ATOM 0 H4' A A 9 0.025 -8.515 -11.191 1.00 0.00 H new ATOM 0 H3' A A 9 1.577 -6.892 -9.187 1.00 0.00 H new ATOM 0 H2' A A 9 -0.424 -6.601 -7.784 1.00 0.00 H new ATOM 0 HO2' A A 9 -1.695 -6.662 -9.987 1.00 0.00 H new ATOM 0 H1' A A 9 -1.256 -9.184 -7.828 1.00 0.00 H new ATOM 0 H8 A A 9 2.470 -8.271 -7.992 1.00 0.00 H new ATOM 0 H61 A A 9 2.708 -10.026 -2.062 1.00 0.00 H new ATOM 0 H62 A A 9 3.641 -9.430 -3.439 1.00 0.00 H new ATOM 0 H2 A A 9 -1.520 -10.436 -3.471 1.00 0.00 H new ATOM 289 P U A 10 0.734 -4.630 -10.224 1.00 0.00 P ATOM 290 OP1 U A 10 0.187 -3.763 -11.297 1.00 0.00 O ATOM 291 OP2 U A 10 2.191 -4.610 -9.937 1.00 0.00 O ATOM 292 O5' U A 10 -0.064 -4.319 -8.877 1.00 0.00 O ATOM 293 C5' U A 10 0.559 -3.637 -7.786 1.00 0.00 C ATOM 294 C4' U A 10 -0.412 -2.668 -7.146 1.00 0.00 C ATOM 295 O4' U A 10 -1.477 -2.381 -8.096 1.00 0.00 O ATOM 296 C3' U A 10 -1.107 -3.166 -5.875 1.00 0.00 C ATOM 297 O3' U A 10 -1.170 -2.135 -4.892 1.00 0.00 O ATOM 298 C2' U A 10 -2.491 -3.580 -6.369 1.00 0.00 C ATOM 299 O2' U A 10 -3.488 -3.404 -5.380 1.00 0.00 O ATOM 300 C1' U A 10 -2.725 -2.550 -7.465 1.00 0.00 C ATOM 301 N1 U A 10 -3.712 -2.955 -8.475 1.00 0.00 N ATOM 302 C2 U A 10 -4.879 -2.217 -8.560 1.00 0.00 C ATOM 303 O2 U A 10 -5.117 -1.267 -7.834 1.00 0.00 O ATOM 304 N3 U A 10 -5.758 -2.632 -9.527 1.00 0.00 N ATOM 305 C4 U A 10 -5.597 -3.686 -10.397 1.00 0.00 C ATOM 306 O4 U A 10 -6.482 -3.933 -11.214 1.00 0.00 O ATOM 307 C5 U A 10 -4.370 -4.403 -10.243 1.00 0.00 C ATOM 308 C6 U A 10 -3.488 -4.029 -9.308 1.00 0.00 C ATOM 0 H5' U A 10 1.439 -3.100 -8.140 1.00 0.00 H new ATOM 0 H5'' U A 10 0.903 -4.360 -7.046 1.00 0.00 H new ATOM 0 H4' U A 10 0.197 -1.807 -6.871 1.00 0.00 H new ATOM 0 H3' U A 10 -0.582 -3.986 -5.385 1.00 0.00 H new ATOM 0 H2' U A 10 -2.538 -4.628 -6.665 1.00 0.00 H new ATOM 0 HO2' U A 10 -4.357 -3.680 -5.739 1.00 0.00 H new ATOM 0 H1' U A 10 -3.126 -1.643 -7.012 1.00 0.00 H new ATOM 0 H3 U A 10 -6.625 -2.102 -9.611 1.00 0.00 H new ATOM 0 H5 U A 10 -4.154 -5.247 -10.881 1.00 0.00 H new ATOM 0 H6 U A 10 -2.570 -4.588 -9.203 1.00 0.00 H new ATOM 319 P A A 11 -0.946 -2.491 -3.338 1.00 0.00 P ATOM 320 OP1 A A 11 -1.292 -1.293 -2.531 1.00 0.00 O ATOM 321 OP2 A A 11 0.402 -3.099 -3.209 1.00 0.00 O ATOM 322 O5' A A 11 -2.016 -3.634 -3.038 1.00 0.00 O ATOM 323 C5' A A 11 -3.269 -3.334 -2.426 1.00 0.00 C ATOM 324 C4' A A 11 -3.861 -4.583 -1.815 1.00 0.00 C ATOM 325 O4' A A 11 -3.444 -5.746 -2.596 1.00 0.00 O ATOM 326 C3' A A 11 -3.397 -4.890 -0.396 1.00 0.00 C ATOM 327 O3' A A 11 -4.189 -4.239 0.591 1.00 0.00 O ATOM 328 C2' A A 11 -3.524 -6.403 -0.340 1.00 0.00 C ATOM 329 O2' A A 11 -4.876 -6.814 -0.250 1.00 0.00 O ATOM 330 C1' A A 11 -2.990 -6.764 -1.720 1.00 0.00 C ATOM 331 N9 A A 11 -1.528 -6.818 -1.783 1.00 0.00 N ATOM 332 C8 A A 11 -0.692 -6.180 -2.667 1.00 0.00 C ATOM 333 N7 A A 11 0.580 -6.416 -2.455 1.00 0.00 N ATOM 334 C5 A A 11 0.582 -7.271 -1.361 1.00 0.00 C ATOM 335 C6 A A 11 1.623 -7.885 -0.642 1.00 0.00 C ATOM 336 N6 A A 11 2.916 -7.719 -0.923 1.00 0.00 N ATOM 337 N1 A A 11 1.285 -8.681 0.394 1.00 0.00 N ATOM 338 C2 A A 11 -0.012 -8.836 0.686 1.00 0.00 C ATOM 339 N3 A A 11 -1.079 -8.318 0.084 1.00 0.00 N ATOM 340 C4 A A 11 -0.709 -7.533 -0.943 1.00 0.00 C ATOM 0 H5' A A 11 -3.955 -2.922 -3.166 1.00 0.00 H new ATOM 0 H5'' A A 11 -3.134 -2.573 -1.658 1.00 0.00 H new ATOM 0 H4' A A 11 -4.935 -4.396 -1.807 1.00 0.00 H new ATOM 0 H3' A A 11 -2.390 -4.531 -0.182 1.00 0.00 H new ATOM 0 H2' A A 11 -3.019 -6.857 0.513 1.00 0.00 H new ATOM 0 HO2' A A 11 -5.392 -6.138 0.237 1.00 0.00 H new ATOM 0 H1' A A 11 -3.345 -7.760 -1.986 1.00 0.00 H new ATOM 0 H8 A A 11 -1.049 -5.543 -3.463 1.00 0.00 H new ATOM 0 H61 A A 11 3.625 -8.193 -0.363 1.00 0.00 H new ATOM 0 H62 A A 11 3.196 -7.118 -1.698 1.00 0.00 H new ATOM 0 H2 A A 11 -0.222 -9.473 1.532 1.00 0.00 H new ATOM 352 P C A 12 -3.484 -3.630 1.902 1.00 0.00 P ATOM 353 OP1 C A 12 -4.556 -3.331 2.885 1.00 0.00 O ATOM 354 OP2 C A 12 -2.560 -2.548 1.476 1.00 0.00 O ATOM 355 O5' C A 12 -2.607 -4.835 2.474 1.00 0.00 O ATOM 356 C5' C A 12 -3.201 -5.887 3.240 1.00 0.00 C ATOM 357 C4' C A 12 -2.173 -6.522 4.154 1.00 0.00 C ATOM 358 O4' C A 12 -1.165 -7.189 3.346 1.00 0.00 O ATOM 359 C3' C A 12 -1.388 -5.556 5.031 1.00 0.00 C ATOM 360 O3' C A 12 -2.073 -5.281 6.249 1.00 0.00 O ATOM 361 C2' C A 12 -0.080 -6.302 5.270 1.00 0.00 C ATOM 362 O2' C A 12 -0.223 -7.281 6.283 1.00 0.00 O ATOM 363 C1' C A 12 0.115 -7.011 3.930 1.00 0.00 C ATOM 364 N1 C A 12 0.957 -6.260 2.983 1.00 0.00 N ATOM 365 C2 C A 12 2.345 -6.277 3.155 1.00 0.00 C ATOM 366 O2 C A 12 2.826 -6.914 4.103 1.00 0.00 O ATOM 367 N3 C A 12 3.126 -5.599 2.284 1.00 0.00 N ATOM 368 C4 C A 12 2.571 -4.920 1.279 1.00 0.00 C ATOM 369 N4 C A 12 3.383 -4.274 0.443 1.00 0.00 N ATOM 370 C5 C A 12 1.160 -4.873 1.087 1.00 0.00 C ATOM 371 C6 C A 12 0.398 -5.553 1.953 1.00 0.00 C ATOM 0 H5' C A 12 -3.618 -6.641 2.572 1.00 0.00 H new ATOM 0 H5'' C A 12 -4.028 -5.493 3.831 1.00 0.00 H new ATOM 0 H4' C A 12 -2.758 -7.179 4.798 1.00 0.00 H new ATOM 0 H3' C A 12 -1.242 -4.578 4.573 1.00 0.00 H new ATOM 0 H2' C A 12 0.735 -5.649 5.582 1.00 0.00 H new ATOM 0 HO2' C A 12 -0.984 -7.051 6.855 1.00 0.00 H new ATOM 0 H1' C A 12 0.625 -7.954 4.128 1.00 0.00 H new ATOM 0 H41 C A 12 2.995 -3.744 -0.337 1.00 0.00 H new ATOM 0 H42 C A 12 4.393 -4.309 0.583 1.00 0.00 H new ATOM 0 H5 C A 12 0.722 -4.311 0.275 1.00 0.00 H new ATOM 0 H6 C A 12 -0.676 -5.543 1.837 1.00 0.00 H new ATOM 383 P C A 13 -1.971 -3.819 6.913 1.00 0.00 P ATOM 384 OP1 C A 13 -2.469 -3.931 8.307 1.00 0.00 O ATOM 385 OP2 C A 13 -2.598 -2.842 5.987 1.00 0.00 O ATOM 386 O5' C A 13 -0.406 -3.520 6.966 1.00 0.00 O ATOM 387 C5' C A 13 0.446 -4.194 7.893 1.00 0.00 C ATOM 388 C4' C A 13 1.894 -3.848 7.620 1.00 0.00 C ATOM 389 O4' C A 13 2.225 -4.258 6.265 1.00 0.00 O ATOM 390 C3' C A 13 2.222 -2.362 7.688 1.00 0.00 C ATOM 391 O3' C A 13 2.621 -2.000 9.010 1.00 0.00 O ATOM 392 C2' C A 13 3.354 -2.202 6.675 1.00 0.00 C ATOM 393 O2' C A 13 4.602 -2.553 7.240 1.00 0.00 O ATOM 394 C1' C A 13 2.990 -3.253 5.626 1.00 0.00 C ATOM 395 N1 C A 13 2.208 -2.740 4.486 1.00 0.00 N ATOM 396 C2 C A 13 2.880 -2.177 3.391 1.00 0.00 C ATOM 397 O2 C A 13 4.118 -2.087 3.421 1.00 0.00 O ATOM 398 N3 C A 13 2.163 -1.745 2.329 1.00 0.00 N ATOM 399 C4 C A 13 0.832 -1.852 2.335 1.00 0.00 C ATOM 400 N4 C A 13 0.168 -1.436 1.257 1.00 0.00 N ATOM 401 C5 C A 13 0.124 -2.396 3.444 1.00 0.00 C ATOM 402 C6 C A 13 0.844 -2.822 4.487 1.00 0.00 C ATOM 0 H5' C A 13 0.301 -5.271 7.814 1.00 0.00 H new ATOM 0 H5'' C A 13 0.183 -3.911 8.912 1.00 0.00 H new ATOM 0 H4' C A 13 2.460 -4.360 8.399 1.00 0.00 H new ATOM 0 H3' C A 13 1.376 -1.714 7.459 1.00 0.00 H new ATOM 0 H2' C A 13 3.449 -1.181 6.305 1.00 0.00 H new ATOM 0 HO2' C A 13 4.531 -2.550 8.217 1.00 0.00 H new ATOM 0 H1' C A 13 3.930 -3.620 5.215 1.00 0.00 H new ATOM 0 H41 C A 13 -0.849 -1.503 1.227 1.00 0.00 H new ATOM 0 H42 C A 13 0.677 -1.051 0.462 1.00 0.00 H new ATOM 0 H5 C A 13 -0.954 -2.462 3.443 1.00 0.00 H new ATOM 0 H6 C A 13 0.338 -3.238 5.346 1.00 0.00 H new ATOM 414 P C A 14 1.978 -0.706 9.721 1.00 0.00 P ATOM 415 OP1 C A 14 2.381 -0.750 11.149 1.00 0.00 O ATOM 416 OP2 C A 14 0.537 -0.626 9.368 1.00 0.00 O ATOM 417 O5' C A 14 2.731 0.517 9.031 1.00 0.00 O ATOM 418 C5' C A 14 4.140 0.685 9.179 1.00 0.00 C ATOM 419 C4' C A 14 4.687 1.528 8.051 1.00 0.00 C ATOM 420 O4' C A 14 4.492 0.825 6.794 1.00 0.00 O ATOM 421 C3' C A 14 4.007 2.871 7.841 1.00 0.00 C ATOM 422 O3' C A 14 4.548 3.856 8.721 1.00 0.00 O ATOM 423 C2' C A 14 4.302 3.153 6.373 1.00 0.00 C ATOM 424 O2' C A 14 5.632 3.602 6.192 1.00 0.00 O ATOM 425 C1' C A 14 4.171 1.753 5.773 1.00 0.00 C ATOM 426 N1 C A 14 2.821 1.443 5.272 1.00 0.00 N ATOM 427 C2 C A 14 2.499 1.770 3.952 1.00 0.00 C ATOM 428 O2 C A 14 3.357 2.316 3.240 1.00 0.00 O ATOM 429 N3 C A 14 1.263 1.488 3.486 1.00 0.00 N ATOM 430 C4 C A 14 0.364 0.907 4.281 1.00 0.00 C ATOM 431 N4 C A 14 -0.842 0.651 3.773 1.00 0.00 N ATOM 432 C5 C A 14 0.663 0.564 5.631 1.00 0.00 C ATOM 433 C6 C A 14 1.892 0.846 6.079 1.00 0.00 C ATOM 0 H5' C A 14 4.631 -0.288 9.186 1.00 0.00 H new ATOM 0 H5'' C A 14 4.358 1.159 10.136 1.00 0.00 H new ATOM 0 H4' C A 14 5.725 1.702 8.333 1.00 0.00 H new ATOM 0 H3' C A 14 2.939 2.880 8.060 1.00 0.00 H new ATOM 0 H2' C A 14 3.657 3.918 5.940 1.00 0.00 H new ATOM 0 HO2' C A 14 5.988 3.923 7.047 1.00 0.00 H new ATOM 0 H1' C A 14 4.841 1.697 4.915 1.00 0.00 H new ATOM 0 H41 C A 14 -1.555 0.207 4.351 1.00 0.00 H new ATOM 0 H42 C A 14 -1.051 0.899 2.806 1.00 0.00 H new ATOM 0 H5 C A 14 -0.073 0.095 6.267 1.00 0.00 H new ATOM 0 H6 C A 14 2.155 0.598 7.097 1.00 0.00 H new ATOM 445 P C A 15 3.566 4.825 9.552 1.00 0.00 P ATOM 446 OP1 C A 15 4.316 5.266 10.755 1.00 0.00 O ATOM 447 OP2 C A 15 2.239 4.175 9.716 1.00 0.00 O ATOM 448 O5' C A 15 3.387 6.090 8.601 1.00 0.00 O ATOM 449 C5' C A 15 4.519 6.826 8.146 1.00 0.00 C ATOM 450 C4' C A 15 4.141 7.691 6.967 1.00 0.00 C ATOM 451 O4' C A 15 3.930 6.846 5.800 1.00 0.00 O ATOM 452 C3' C A 15 2.843 8.470 7.111 1.00 0.00 C ATOM 453 O3' C A 15 3.054 9.689 7.819 1.00 0.00 O ATOM 454 C2' C A 15 2.442 8.675 5.657 1.00 0.00 C ATOM 455 O2' C A 15 3.241 9.667 5.038 1.00 0.00 O ATOM 456 C1' C A 15 2.806 7.312 5.073 1.00 0.00 C ATOM 457 N1 C A 15 1.734 6.306 5.180 1.00 0.00 N ATOM 458 C2 C A 15 0.725 6.285 4.213 1.00 0.00 C ATOM 459 O2 C A 15 0.754 7.116 3.294 1.00 0.00 O ATOM 460 N3 C A 15 -0.257 5.361 4.304 1.00 0.00 N ATOM 461 C4 C A 15 -0.259 4.486 5.310 1.00 0.00 C ATOM 462 N4 C A 15 -1.248 3.596 5.357 1.00 0.00 N ATOM 463 C5 C A 15 0.753 4.486 6.312 1.00 0.00 C ATOM 464 C6 C A 15 1.722 5.403 6.208 1.00 0.00 C ATOM 0 H5' C A 15 5.317 6.140 7.862 1.00 0.00 H new ATOM 0 H5'' C A 15 4.906 7.448 8.953 1.00 0.00 H new ATOM 0 H4' C A 15 4.967 8.398 6.885 1.00 0.00 H new ATOM 0 H3' C A 15 2.068 7.969 7.692 1.00 0.00 H new ATOM 0 H2' C A 15 1.408 8.992 5.525 1.00 0.00 H new ATOM 0 HO2' C A 15 3.631 10.248 5.724 1.00 0.00 H new ATOM 0 H1' C A 15 2.996 7.443 4.008 1.00 0.00 H new ATOM 0 H41 C A 15 -1.282 2.911 6.112 1.00 0.00 H new ATOM 0 H42 C A 15 -1.971 3.599 4.638 1.00 0.00 H new ATOM 0 H5 C A 15 0.739 3.774 7.124 1.00 0.00 H new ATOM 0 H6 C A 15 2.508 5.431 6.948 1.00 0.00 H new ATOM 476 P G A 16 1.945 10.217 8.859 1.00 0.00 P ATOM 477 OP1 G A 16 2.594 11.259 9.695 1.00 0.00 O ATOM 478 OP2 G A 16 1.293 9.054 9.515 1.00 0.00 O ATOM 479 O5' G A 16 0.870 10.933 7.928 1.00 0.00 O ATOM 480 C5' G A 16 1.266 11.938 6.997 1.00 0.00 C ATOM 481 C4' G A 16 0.240 12.064 5.897 1.00 0.00 C ATOM 482 O4' G A 16 0.215 10.832 5.126 1.00 0.00 O ATOM 483 C3' G A 16 -1.198 12.247 6.354 1.00 0.00 C ATOM 484 O3' G A 16 -1.471 13.614 6.654 1.00 0.00 O ATOM 485 C2' G A 16 -1.984 11.733 5.154 1.00 0.00 C ATOM 486 O2' G A 16 -2.010 12.687 4.109 1.00 0.00 O ATOM 487 C1' G A 16 -1.113 10.554 4.715 1.00 0.00 C ATOM 488 N9 G A 16 -1.516 9.277 5.296 1.00 0.00 N ATOM 489 C8 G A 16 -0.966 8.648 6.388 1.00 0.00 C ATOM 490 N7 G A 16 -1.543 7.514 6.673 1.00 0.00 N ATOM 491 C5 G A 16 -2.534 7.382 5.709 1.00 0.00 C ATOM 492 C6 G A 16 -3.487 6.352 5.503 1.00 0.00 C ATOM 493 O6 G A 16 -3.651 5.313 6.153 1.00 0.00 O ATOM 494 N1 G A 16 -4.303 6.620 4.411 1.00 0.00 N ATOM 495 C2 G A 16 -4.215 7.732 3.615 1.00 0.00 C ATOM 496 N2 G A 16 -5.090 7.800 2.607 1.00 0.00 N ATOM 497 N3 G A 16 -3.334 8.701 3.793 1.00 0.00 N ATOM 498 C4 G A 16 -2.530 8.462 4.851 1.00 0.00 C ATOM 0 H5' G A 16 2.237 11.687 6.571 1.00 0.00 H new ATOM 0 H5'' G A 16 1.380 12.894 7.509 1.00 0.00 H new ATOM 0 H4' G A 16 0.551 12.954 5.349 1.00 0.00 H new ATOM 0 H3' G A 16 -1.449 11.721 7.275 1.00 0.00 H new ATOM 0 H2' G A 16 -3.023 11.498 5.386 1.00 0.00 H new ATOM 0 HO2' G A 16 -1.887 13.585 4.482 1.00 0.00 H new ATOM 0 H1' G A 16 -1.214 10.452 3.634 1.00 0.00 H new ATOM 0 H8 G A 16 -0.139 9.053 6.953 1.00 0.00 H new ATOM 0 H1 G A 16 -5.024 5.935 4.184 1.00 0.00 H new ATOM 0 H21 G A 16 -5.080 8.601 1.976 1.00 0.00 H new ATOM 0 H22 G A 16 -5.768 7.051 2.469 1.00 0.00 H new ATOM 510 P A A 17 -2.358 13.992 7.942 1.00 0.00 P ATOM 511 OP1 A A 17 -2.243 15.460 8.135 1.00 0.00 O ATOM 512 OP2 A A 17 -2.008 13.077 9.058 1.00 0.00 O ATOM 513 O5' A A 17 -3.850 13.673 7.482 1.00 0.00 O ATOM 514 C5' A A 17 -4.400 14.276 6.312 1.00 0.00 C ATOM 515 C4' A A 17 -5.552 13.449 5.791 1.00 0.00 C ATOM 516 O4' A A 17 -5.054 12.145 5.392 1.00 0.00 O ATOM 517 C3' A A 17 -6.649 13.145 6.802 1.00 0.00 C ATOM 518 O3' A A 17 -7.607 14.204 6.897 1.00 0.00 O ATOM 519 C2' A A 17 -7.252 11.855 6.256 1.00 0.00 C ATOM 520 O2' A A 17 -8.138 12.113 5.181 1.00 0.00 O ATOM 521 C1' A A 17 -6.011 11.150 5.706 1.00 0.00 C ATOM 522 N9 A A 17 -5.406 10.208 6.647 1.00 0.00 N ATOM 523 C8 A A 17 -4.322 10.408 7.467 1.00 0.00 C ATOM 524 N7 A A 17 -4.020 9.368 8.206 1.00 0.00 N ATOM 525 C5 A A 17 -4.966 8.418 7.847 1.00 0.00 C ATOM 526 C6 A A 17 -5.190 7.095 8.271 1.00 0.00 C ATOM 527 N6 A A 17 -4.445 6.474 9.187 1.00 0.00 N ATOM 528 N1 A A 17 -6.219 6.422 7.713 1.00 0.00 N ATOM 529 C2 A A 17 -6.967 7.043 6.792 1.00 0.00 C ATOM 530 N3 A A 17 -6.857 8.280 6.312 1.00 0.00 N ATOM 531 C4 A A 17 -5.825 8.921 6.887 1.00 0.00 C ATOM 0 H5' A A 17 -3.631 14.366 5.545 1.00 0.00 H new ATOM 0 H5'' A A 17 -4.742 15.285 6.541 1.00 0.00 H new ATOM 0 H4' A A 17 -5.974 14.052 4.987 1.00 0.00 H new ATOM 0 H3' A A 17 -6.281 13.045 7.823 1.00 0.00 H new ATOM 0 H2' A A 17 -7.822 11.299 7.001 1.00 0.00 H new ATOM 0 HO2' A A 17 -8.401 13.057 5.193 1.00 0.00 H new ATOM 0 HO3' A A 17 -8.293 13.966 7.555 1.00 0.00 H new ATOM 0 H1' A A 17 -6.321 10.571 4.836 1.00 0.00 H new ATOM 0 H8 A A 17 -3.770 11.336 7.500 1.00 0.00 H new ATOM 0 H61 A A 17 -4.659 5.513 9.452 1.00 0.00 H new ATOM 0 H62 A A 17 -3.661 6.961 9.622 1.00 0.00 H new ATOM 0 H2 A A 17 -7.775 6.457 6.380 1.00 0.00 H new TER 544 A A 17