USER MOD reduce.3.24.130724 H: found=0, std=0, add=240, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 239 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 G O2' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -20:sc= 0.0469 USER MOD Single : A 3 C O2' : rot 180:sc= 0 USER MOD Single : A 4 G O2' : rot -17:sc= 0.0408 USER MOD Single : A 5 U O2' : rot -69:sc= 0.436 USER MOD Single : A 6 G O2' : rot -23:sc= 0.0694 USER MOD Single : A 7 U O2' : rot -17:sc= 0.0806 USER MOD Single : A 8 U O2' : rot -26:sc= 0.0899 USER MOD Single : A 9 C O2' : rot -16:sc= 0.124 USER MOD Single : A 10 A O2' : rot 180:sc= 0.564 USER MOD Single : A 11 G O2' : rot 18:sc= 0.0948 USER MOD Single : A 12 A O2' : rot 172:sc= 1.36 USER MOD Single : A 13 A O2' : rot -27:sc= 0.0538 USER MOD Single : A 14 G O2' : rot 180:sc= -0.0487 USER MOD Single : A 15 A O2' : rot -72:sc= 0.373 USER MOD Single : A 16 A O2' : rot -55:sc= 0.591 USER MOD Single : A 17 C O2' : rot -123:sc= 0.0121 USER MOD Single : A 18 G O2' : rot -18:sc= 0.0683 USER MOD Single : A 19 C O2' : rot -26:sc= 0.0775 USER MOD Single : A 20 G O2' : rot -18:sc= 0.0432 USER MOD Single : A 21 C O2' : rot 180:sc= -0.0522 USER MOD Single : A 22 C O2' : rot 180:sc= 0 USER MOD Single : A 22 C O3' : rot 136:sc= 0.0836 USER MOD ----------------------------------------------------------------- ATOM 1 P G A 1 12.575 -7.788 6.174 1.00 0.00 P ATOM 2 OP1 G A 1 11.284 -7.675 6.891 1.00 0.00 O ATOM 3 OP2 G A 1 13.363 -6.573 5.873 1.00 0.00 O ATOM 4 O5' G A 1 12.333 -8.600 4.799 1.00 0.00 O ATOM 5 C5' G A 1 11.714 -9.874 4.792 1.00 0.00 C ATOM 6 C4' G A 1 11.726 -10.475 3.379 1.00 0.00 C ATOM 7 O4' G A 1 11.196 -11.794 3.402 1.00 0.00 O ATOM 8 C3' G A 1 10.860 -9.718 2.368 1.00 0.00 C ATOM 9 O3' G A 1 11.464 -8.527 1.882 1.00 0.00 O ATOM 10 C2' G A 1 10.701 -10.801 1.299 1.00 0.00 C ATOM 11 O2' G A 1 11.858 -10.924 0.490 1.00 0.00 O ATOM 12 C1' G A 1 10.555 -12.063 2.161 1.00 0.00 C ATOM 13 N9 G A 1 9.118 -12.382 2.356 1.00 0.00 N ATOM 14 C8 G A 1 8.297 -12.126 3.428 1.00 0.00 C ATOM 15 N7 G A 1 7.063 -12.516 3.264 1.00 0.00 N ATOM 16 C5 G A 1 7.052 -13.063 1.983 1.00 0.00 C ATOM 17 C6 G A 1 5.983 -13.649 1.223 1.00 0.00 C ATOM 18 O6 G A 1 4.812 -13.798 1.560 1.00 0.00 O ATOM 19 N1 G A 1 6.382 -14.086 -0.045 1.00 0.00 N ATOM 20 C2 G A 1 7.670 -13.949 -0.536 1.00 0.00 C ATOM 21 N2 G A 1 7.892 -14.370 -1.780 1.00 0.00 N ATOM 22 N3 G A 1 8.675 -13.398 0.171 1.00 0.00 N ATOM 23 C4 G A 1 8.307 -12.978 1.419 1.00 0.00 C ATOM 0 H5' G A 1 10.687 -9.787 5.147 1.00 0.00 H new ATOM 0 H5'' G A 1 12.234 -10.540 5.480 1.00 0.00 H new ATOM 0 H4' G A 1 12.771 -10.429 3.074 1.00 0.00 H new ATOM 0 H3' G A 1 9.923 -9.333 2.770 1.00 0.00 H new ATOM 0 H2' G A 1 9.879 -10.601 0.612 1.00 0.00 H new ATOM 0 HO2' G A 1 11.716 -11.626 -0.179 1.00 0.00 H new ATOM 0 H1' G A 1 11.013 -12.928 1.681 1.00 0.00 H new ATOM 0 H8 G A 1 8.644 -11.643 4.330 1.00 0.00 H new ATOM 0 H1 G A 1 5.685 -14.531 -0.642 1.00 0.00 H new ATOM 0 H21 G A 1 8.824 -14.291 -2.187 1.00 0.00 H new ATOM 0 H22 G A 1 7.130 -14.772 -2.326 1.00 0.00 H new ATOM 35 P G A 2 10.624 -7.411 1.065 1.00 0.00 P ATOM 36 OP1 G A 2 11.549 -6.310 0.718 1.00 0.00 O ATOM 37 OP2 G A 2 9.394 -7.117 1.834 1.00 0.00 O ATOM 38 O5' G A 2 10.181 -8.150 -0.303 1.00 0.00 O ATOM 39 C5' G A 2 11.080 -8.359 -1.380 1.00 0.00 C ATOM 40 C4' G A 2 10.417 -9.204 -2.479 1.00 0.00 C ATOM 41 O4' G A 2 9.891 -10.425 -1.969 1.00 0.00 O ATOM 42 C3' G A 2 9.246 -8.507 -3.176 1.00 0.00 C ATOM 43 O3' G A 2 9.672 -7.538 -4.125 1.00 0.00 O ATOM 44 C2' G A 2 8.566 -9.721 -3.813 1.00 0.00 C ATOM 45 O2' G A 2 9.230 -10.151 -4.989 1.00 0.00 O ATOM 46 C1' G A 2 8.736 -10.783 -2.719 1.00 0.00 C ATOM 47 N9 G A 2 7.516 -10.835 -1.871 1.00 0.00 N ATOM 48 C8 G A 2 7.285 -10.313 -0.622 1.00 0.00 C ATOM 49 N7 G A 2 6.091 -10.552 -0.151 1.00 0.00 N ATOM 50 C5 G A 2 5.466 -11.267 -1.169 1.00 0.00 C ATOM 51 C6 G A 2 4.144 -11.825 -1.250 1.00 0.00 C ATOM 52 O6 G A 2 3.264 -11.820 -0.394 1.00 0.00 O ATOM 53 N1 G A 2 3.882 -12.437 -2.479 1.00 0.00 N ATOM 54 C2 G A 2 4.801 -12.525 -3.510 1.00 0.00 C ATOM 55 N2 G A 2 4.393 -13.108 -4.637 1.00 0.00 N ATOM 56 N3 G A 2 6.052 -12.037 -3.426 1.00 0.00 N ATOM 57 C4 G A 2 6.325 -11.418 -2.237 1.00 0.00 C ATOM 0 H5' G A 2 11.978 -8.861 -1.020 1.00 0.00 H new ATOM 0 H5'' G A 2 11.394 -7.399 -1.791 1.00 0.00 H new ATOM 0 H4' G A 2 11.226 -9.374 -3.190 1.00 0.00 H new ATOM 0 H3' G A 2 8.602 -7.918 -2.523 1.00 0.00 H new ATOM 0 H2' G A 2 7.538 -9.518 -4.114 1.00 0.00 H new ATOM 0 HO2' G A 2 9.789 -9.424 -5.334 1.00 0.00 H new ATOM 0 H1' G A 2 8.867 -11.780 -3.140 1.00 0.00 H new ATOM 0 H8 G A 2 8.028 -9.752 -0.075 1.00 0.00 H new ATOM 0 H1 G A 2 2.958 -12.843 -2.625 1.00 0.00 H new ATOM 0 H21 G A 2 5.033 -13.197 -5.426 1.00 0.00 H new ATOM 0 H22 G A 2 3.440 -13.465 -4.710 1.00 0.00 H new ATOM 69 P C A 3 8.682 -6.389 -4.690 1.00 0.00 P ATOM 70 OP1 C A 3 9.426 -5.616 -5.710 1.00 0.00 O ATOM 71 OP2 C A 3 8.097 -5.689 -3.527 1.00 0.00 O ATOM 72 O5' C A 3 7.490 -7.193 -5.429 1.00 0.00 O ATOM 73 C5' C A 3 7.629 -7.755 -6.723 1.00 0.00 C ATOM 74 C4' C A 3 6.366 -8.544 -7.106 1.00 0.00 C ATOM 75 O4' C A 3 6.056 -9.554 -6.154 1.00 0.00 O ATOM 76 C3' C A 3 5.103 -7.685 -7.215 1.00 0.00 C ATOM 77 O3' C A 3 5.054 -6.919 -8.412 1.00 0.00 O ATOM 78 C2' C A 3 4.041 -8.786 -7.148 1.00 0.00 C ATOM 79 O2' C A 3 3.893 -9.460 -8.387 1.00 0.00 O ATOM 80 C1' C A 3 4.645 -9.747 -6.112 1.00 0.00 C ATOM 81 N1 C A 3 4.048 -9.492 -4.761 1.00 0.00 N ATOM 82 C2 C A 3 2.784 -10.042 -4.485 1.00 0.00 C ATOM 83 O2 C A 3 2.189 -10.722 -5.318 1.00 0.00 O ATOM 84 N3 C A 3 2.211 -9.808 -3.266 1.00 0.00 N ATOM 85 C4 C A 3 2.821 -9.037 -2.352 1.00 0.00 C ATOM 86 N4 C A 3 2.217 -8.848 -1.179 1.00 0.00 N ATOM 87 C5 C A 3 4.098 -8.427 -2.617 1.00 0.00 C ATOM 88 C6 C A 3 4.663 -8.679 -3.827 1.00 0.00 C ATOM 0 H5' C A 3 8.498 -8.413 -6.749 1.00 0.00 H new ATOM 0 H5'' C A 3 7.806 -6.964 -7.452 1.00 0.00 H new ATOM 0 H4' C A 3 6.620 -8.962 -8.080 1.00 0.00 H new ATOM 0 H3' C A 3 5.002 -6.910 -6.455 1.00 0.00 H new ATOM 0 H2' C A 3 3.051 -8.401 -6.903 1.00 0.00 H new ATOM 0 HO2' C A 3 3.207 -10.155 -8.301 1.00 0.00 H new ATOM 0 H1' C A 3 4.422 -10.791 -6.334 1.00 0.00 H new ATOM 0 H41 C A 3 2.658 -8.267 -0.466 1.00 0.00 H new ATOM 0 H42 C A 3 1.314 -9.285 -0.994 1.00 0.00 H new ATOM 0 H5 C A 3 4.585 -7.797 -1.887 1.00 0.00 H new ATOM 0 H6 C A 3 5.617 -8.233 -4.065 1.00 0.00 H new ATOM 100 P G A 4 4.038 -5.673 -8.599 1.00 0.00 P ATOM 101 OP1 G A 4 4.238 -5.130 -9.961 1.00 0.00 O ATOM 102 OP2 G A 4 4.195 -4.782 -7.428 1.00 0.00 O ATOM 103 O5' G A 4 2.561 -6.326 -8.525 1.00 0.00 O ATOM 104 C5' G A 4 1.984 -7.031 -9.613 1.00 0.00 C ATOM 105 C4' G A 4 0.660 -7.683 -9.183 1.00 0.00 C ATOM 106 O4' G A 4 0.834 -8.486 -8.023 1.00 0.00 O ATOM 107 C3' G A 4 -0.452 -6.683 -8.847 1.00 0.00 C ATOM 108 O3' G A 4 -1.102 -6.187 -10.011 1.00 0.00 O ATOM 109 C2' G A 4 -1.358 -7.572 -7.992 1.00 0.00 C ATOM 110 O2' G A 4 -2.164 -8.429 -8.783 1.00 0.00 O ATOM 111 C1' G A 4 -0.339 -8.423 -7.225 1.00 0.00 C ATOM 112 N9 G A 4 -0.070 -7.855 -5.877 1.00 0.00 N ATOM 113 C8 G A 4 1.032 -7.189 -5.395 1.00 0.00 C ATOM 114 N7 G A 4 0.988 -6.931 -4.117 1.00 0.00 N ATOM 115 C5 G A 4 -0.247 -7.433 -3.716 1.00 0.00 C ATOM 116 C6 G A 4 -0.874 -7.469 -2.423 1.00 0.00 C ATOM 117 O6 G A 4 -0.411 -7.108 -1.345 1.00 0.00 O ATOM 118 N1 G A 4 -2.168 -7.997 -2.454 1.00 0.00 N ATOM 119 C2 G A 4 -2.782 -8.461 -3.604 1.00 0.00 C ATOM 120 N2 G A 4 -4.019 -8.938 -3.482 1.00 0.00 N ATOM 121 N3 G A 4 -2.186 -8.466 -4.810 1.00 0.00 N ATOM 122 C4 G A 4 -0.923 -7.943 -4.803 1.00 0.00 C ATOM 0 H5' G A 4 2.675 -7.795 -9.968 1.00 0.00 H new ATOM 0 H5'' G A 4 1.808 -6.349 -10.445 1.00 0.00 H new ATOM 0 H4' G A 4 0.363 -8.271 -10.051 1.00 0.00 H new ATOM 0 H3' G A 4 -0.118 -5.770 -8.353 1.00 0.00 H new ATOM 0 H2' G A 4 -2.046 -6.993 -7.376 1.00 0.00 H new ATOM 0 HO2' G A 4 -2.185 -8.099 -9.705 1.00 0.00 H new ATOM 0 H1' G A 4 -0.724 -9.427 -7.050 1.00 0.00 H new ATOM 0 H8 G A 4 1.864 -6.903 -6.022 1.00 0.00 H new ATOM 0 H1 G A 4 -2.690 -8.043 -1.579 1.00 0.00 H new ATOM 0 H21 G A 4 -4.513 -9.291 -4.302 1.00 0.00 H new ATOM 0 H22 G A 4 -4.473 -8.950 -2.569 1.00 0.00 H new ATOM 134 P U A 5 -2.017 -4.854 -9.992 1.00 0.00 P ATOM 135 OP1 U A 5 -2.650 -4.722 -11.323 1.00 0.00 O ATOM 136 OP2 U A 5 -1.184 -3.749 -9.469 1.00 0.00 O ATOM 137 O5' U A 5 -3.175 -5.149 -8.903 1.00 0.00 O ATOM 138 C5' U A 5 -4.325 -5.930 -9.185 1.00 0.00 C ATOM 139 C4' U A 5 -5.195 -6.067 -7.923 1.00 0.00 C ATOM 140 O4' U A 5 -4.479 -6.627 -6.830 1.00 0.00 O ATOM 141 C3' U A 5 -5.750 -4.731 -7.424 1.00 0.00 C ATOM 142 O3' U A 5 -6.861 -4.315 -8.211 1.00 0.00 O ATOM 143 C2' U A 5 -6.088 -5.091 -5.973 1.00 0.00 C ATOM 144 O2' U A 5 -7.353 -5.723 -5.876 1.00 0.00 O ATOM 145 C1' U A 5 -4.977 -6.092 -5.608 1.00 0.00 C ATOM 146 N1 U A 5 -3.895 -5.449 -4.793 1.00 0.00 N ATOM 147 C2 U A 5 -4.052 -5.416 -3.398 1.00 0.00 C ATOM 148 O2 U A 5 -5.056 -5.829 -2.820 1.00 0.00 O ATOM 149 N3 U A 5 -2.995 -4.888 -2.661 1.00 0.00 N ATOM 150 C4 U A 5 -1.827 -4.351 -3.185 1.00 0.00 C ATOM 151 O4 U A 5 -0.958 -3.921 -2.433 1.00 0.00 O ATOM 152 C5 U A 5 -1.761 -4.368 -4.636 1.00 0.00 C ATOM 153 C6 U A 5 -2.768 -4.898 -5.379 1.00 0.00 C ATOM 0 H5' U A 5 -4.026 -6.917 -9.539 1.00 0.00 H new ATOM 0 H5'' U A 5 -4.902 -5.466 -9.985 1.00 0.00 H new ATOM 0 H4' U A 5 -6.008 -6.721 -8.239 1.00 0.00 H new ATOM 0 H3' U A 5 -5.080 -3.874 -7.495 1.00 0.00 H new ATOM 0 H2' U A 5 -6.138 -4.218 -5.323 1.00 0.00 H new ATOM 0 HO2' U A 5 -8.059 -5.073 -6.074 1.00 0.00 H new ATOM 0 H1' U A 5 -5.374 -6.891 -4.981 1.00 0.00 H new ATOM 0 H3 U A 5 -3.087 -4.897 -1.645 1.00 0.00 H new ATOM 0 H5 U A 5 -0.897 -3.952 -5.133 1.00 0.00 H new ATOM 0 H6 U A 5 -2.687 -4.889 -6.456 1.00 0.00 H new ATOM 164 P G A 6 -7.599 -2.897 -7.984 1.00 0.00 P ATOM 165 OP1 G A 6 -8.617 -2.733 -9.044 1.00 0.00 O ATOM 166 OP2 G A 6 -6.557 -1.863 -7.796 1.00 0.00 O ATOM 167 O5' G A 6 -8.369 -3.123 -6.584 1.00 0.00 O ATOM 168 C5' G A 6 -8.681 -2.044 -5.720 1.00 0.00 C ATOM 169 C4' G A 6 -9.240 -2.573 -4.390 1.00 0.00 C ATOM 170 O4' G A 6 -8.360 -3.528 -3.813 1.00 0.00 O ATOM 171 C3' G A 6 -9.411 -1.447 -3.363 1.00 0.00 C ATOM 172 O3' G A 6 -10.679 -0.814 -3.482 1.00 0.00 O ATOM 173 C2' G A 6 -9.218 -2.198 -2.044 1.00 0.00 C ATOM 174 O2' G A 6 -10.409 -2.846 -1.629 1.00 0.00 O ATOM 175 C1' G A 6 -8.174 -3.250 -2.436 1.00 0.00 C ATOM 176 N9 G A 6 -6.783 -2.790 -2.186 1.00 0.00 N ATOM 177 C8 G A 6 -5.810 -2.402 -3.076 1.00 0.00 C ATOM 178 N7 G A 6 -4.633 -2.221 -2.545 1.00 0.00 N ATOM 179 C5 G A 6 -4.834 -2.489 -1.195 1.00 0.00 C ATOM 180 C6 G A 6 -3.914 -2.486 -0.094 1.00 0.00 C ATOM 181 O6 G A 6 -2.703 -2.289 -0.120 1.00 0.00 O ATOM 182 N1 G A 6 -4.530 -2.743 1.133 1.00 0.00 N ATOM 183 C2 G A 6 -5.881 -3.001 1.283 1.00 0.00 C ATOM 184 N2 G A 6 -6.324 -3.213 2.522 1.00 0.00 N ATOM 185 N3 G A 6 -6.740 -3.048 0.248 1.00 0.00 N ATOM 186 C4 G A 6 -6.161 -2.783 -0.961 1.00 0.00 C ATOM 0 H5' G A 6 -9.411 -1.388 -6.194 1.00 0.00 H new ATOM 0 H5'' G A 6 -7.788 -1.447 -5.536 1.00 0.00 H new ATOM 0 H4' G A 6 -10.205 -3.023 -4.623 1.00 0.00 H new ATOM 0 H3' G A 6 -8.715 -0.616 -3.479 1.00 0.00 H new ATOM 0 H2' G A 6 -8.933 -1.546 -1.219 1.00 0.00 H new ATOM 0 HO2' G A 6 -11.182 -2.405 -2.041 1.00 0.00 H new ATOM 0 H1' G A 6 -8.312 -4.142 -1.825 1.00 0.00 H new ATOM 0 H8 G A 6 -6.004 -2.259 -4.129 1.00 0.00 H new ATOM 0 H1 G A 6 -3.948 -2.740 1.970 1.00 0.00 H new ATOM 0 H21 G A 6 -7.312 -3.407 2.684 1.00 0.00 H new ATOM 0 H22 G A 6 -5.675 -3.181 3.308 1.00 0.00 H new ATOM 198 P U A 7 -11.004 0.602 -2.778 1.00 0.00 P ATOM 199 OP1 U A 7 -12.436 0.904 -2.993 1.00 0.00 O ATOM 200 OP2 U A 7 -9.976 1.567 -3.228 1.00 0.00 O ATOM 201 O5' U A 7 -10.785 0.316 -1.202 1.00 0.00 O ATOM 202 C5' U A 7 -10.438 1.357 -0.304 1.00 0.00 C ATOM 203 C4' U A 7 -10.111 0.805 1.095 1.00 0.00 C ATOM 204 O4' U A 7 -9.202 -0.291 1.048 1.00 0.00 O ATOM 205 C3' U A 7 -9.446 1.882 1.960 1.00 0.00 C ATOM 206 O3' U A 7 -10.394 2.697 2.636 1.00 0.00 O ATOM 207 C2' U A 7 -8.609 1.030 2.910 1.00 0.00 C ATOM 208 O2' U A 7 -9.401 0.497 3.957 1.00 0.00 O ATOM 209 C1' U A 7 -8.148 -0.102 1.985 1.00 0.00 C ATOM 210 N1 U A 7 -6.842 0.226 1.326 1.00 0.00 N ATOM 211 C2 U A 7 -5.678 0.155 2.108 1.00 0.00 C ATOM 212 O2 U A 7 -5.686 -0.107 3.309 1.00 0.00 O ATOM 213 N3 U A 7 -4.474 0.388 1.454 1.00 0.00 N ATOM 214 C4 U A 7 -4.323 0.685 0.105 1.00 0.00 C ATOM 215 O4 U A 7 -3.203 0.829 -0.374 1.00 0.00 O ATOM 216 C5 U A 7 -5.572 0.782 -0.629 1.00 0.00 C ATOM 217 C6 U A 7 -6.762 0.555 -0.015 1.00 0.00 C ATOM 0 H5' U A 7 -11.261 2.068 -0.233 1.00 0.00 H new ATOM 0 H5'' U A 7 -9.578 1.903 -0.692 1.00 0.00 H new ATOM 0 H4' U A 7 -11.064 0.481 1.514 1.00 0.00 H new ATOM 0 H3' U A 7 -8.862 2.609 1.395 1.00 0.00 H new ATOM 0 H2' U A 7 -7.805 1.584 3.395 1.00 0.00 H new ATOM 0 HO2' U A 7 -10.242 0.997 4.018 1.00 0.00 H new ATOM 0 H1' U A 7 -7.958 -1.022 2.537 1.00 0.00 H new ATOM 0 H3 U A 7 -3.624 0.336 2.015 1.00 0.00 H new ATOM 0 H5 U A 7 -5.555 1.038 -1.678 1.00 0.00 H new ATOM 0 H6 U A 7 -7.672 0.634 -0.591 1.00 0.00 H new ATOM 228 P U A 8 -10.067 4.219 3.067 1.00 0.00 P ATOM 229 OP1 U A 8 -11.225 4.726 3.836 1.00 0.00 O ATOM 230 OP2 U A 8 -9.621 4.939 1.855 1.00 0.00 O ATOM 231 O5' U A 8 -8.800 4.095 4.064 1.00 0.00 O ATOM 232 C5' U A 8 -8.934 3.754 5.434 1.00 0.00 C ATOM 233 C4' U A 8 -7.562 3.750 6.125 1.00 0.00 C ATOM 234 O4' U A 8 -6.670 2.812 5.542 1.00 0.00 O ATOM 235 C3' U A 8 -6.836 5.095 6.059 1.00 0.00 C ATOM 236 O3' U A 8 -7.374 6.037 6.978 1.00 0.00 O ATOM 237 C2' U A 8 -5.416 4.645 6.409 1.00 0.00 C ATOM 238 O2' U A 8 -5.268 4.467 7.807 1.00 0.00 O ATOM 239 C1' U A 8 -5.334 3.281 5.700 1.00 0.00 C ATOM 240 N1 U A 8 -4.610 3.390 4.394 1.00 0.00 N ATOM 241 C2 U A 8 -3.207 3.388 4.430 1.00 0.00 C ATOM 242 O2 U A 8 -2.558 3.407 5.473 1.00 0.00 O ATOM 243 N3 U A 8 -2.553 3.359 3.204 1.00 0.00 N ATOM 244 C4 U A 8 -3.163 3.401 1.958 1.00 0.00 C ATOM 245 O4 U A 8 -2.480 3.355 0.939 1.00 0.00 O ATOM 246 C5 U A 8 -4.612 3.514 2.003 1.00 0.00 C ATOM 247 C6 U A 8 -5.279 3.501 3.187 1.00 0.00 C ATOM 0 H5' U A 8 -9.397 2.772 5.527 1.00 0.00 H new ATOM 0 H5'' U A 8 -9.595 4.466 5.929 1.00 0.00 H new ATOM 0 H4' U A 8 -7.802 3.497 7.158 1.00 0.00 H new ATOM 0 H3' U A 8 -6.914 5.623 5.109 1.00 0.00 H new ATOM 0 H2' U A 8 -4.648 5.360 6.113 1.00 0.00 H new ATOM 0 HO2' U A 8 -5.914 5.033 8.279 1.00 0.00 H new ATOM 0 H1' U A 8 -4.760 2.568 6.292 1.00 0.00 H new ATOM 0 H3 U A 8 -1.535 3.302 3.221 1.00 0.00 H new ATOM 0 H5 U A 8 -5.167 3.610 1.081 1.00 0.00 H new ATOM 0 H6 U A 8 -6.356 3.579 3.186 1.00 0.00 H new ATOM 258 P C A 9 -7.167 7.630 6.801 1.00 0.00 P ATOM 259 OP1 C A 9 -7.852 8.298 7.929 1.00 0.00 O ATOM 260 OP2 C A 9 -7.534 7.981 5.412 1.00 0.00 O ATOM 261 O5' C A 9 -5.575 7.853 6.963 1.00 0.00 O ATOM 262 C5' C A 9 -4.949 8.020 8.225 1.00 0.00 C ATOM 263 C4' C A 9 -3.447 8.284 8.043 1.00 0.00 C ATOM 264 O4' C A 9 -2.805 7.214 7.369 1.00 0.00 O ATOM 265 C3' C A 9 -3.147 9.527 7.202 1.00 0.00 C ATOM 266 O3' C A 9 -3.320 10.727 7.945 1.00 0.00 O ATOM 267 C2' C A 9 -1.694 9.249 6.806 1.00 0.00 C ATOM 268 O2' C A 9 -0.788 9.718 7.791 1.00 0.00 O ATOM 269 C1' C A 9 -1.642 7.714 6.719 1.00 0.00 C ATOM 270 N1 C A 9 -1.552 7.259 5.297 1.00 0.00 N ATOM 271 C2 C A 9 -0.280 7.161 4.705 1.00 0.00 C ATOM 272 O2 C A 9 0.737 7.476 5.320 1.00 0.00 O ATOM 273 N3 C A 9 -0.181 6.700 3.422 1.00 0.00 N ATOM 274 C4 C A 9 -1.278 6.365 2.727 1.00 0.00 C ATOM 275 N4 C A 9 -1.116 5.874 1.500 1.00 0.00 N ATOM 276 C5 C A 9 -2.599 6.534 3.273 1.00 0.00 C ATOM 277 C6 C A 9 -2.684 6.987 4.551 1.00 0.00 C ATOM 0 H5' C A 9 -5.097 7.128 8.833 1.00 0.00 H new ATOM 0 H5'' C A 9 -5.409 8.851 8.760 1.00 0.00 H new ATOM 0 H4' C A 9 -3.077 8.412 9.060 1.00 0.00 H new ATOM 0 H3' C A 9 -3.808 9.684 6.350 1.00 0.00 H new ATOM 0 H2' C A 9 -1.409 9.750 5.881 1.00 0.00 H new ATOM 0 HO2' C A 9 -1.250 10.339 8.391 1.00 0.00 H new ATOM 0 H1' C A 9 -0.750 7.328 7.212 1.00 0.00 H new ATOM 0 H41 C A 9 -1.930 5.609 0.945 1.00 0.00 H new ATOM 0 H42 C A 9 -0.178 5.762 1.115 1.00 0.00 H new ATOM 0 H5 C A 9 -3.482 6.311 2.693 1.00 0.00 H new ATOM 0 H6 C A 9 -3.657 7.138 4.994 1.00 0.00 H new ATOM 289 P A A 10 -3.334 12.180 7.238 1.00 0.00 P ATOM 290 OP1 A A 10 -3.370 13.207 8.301 1.00 0.00 O ATOM 291 OP2 A A 10 -4.382 12.163 6.194 1.00 0.00 O ATOM 292 O5' A A 10 -1.888 12.257 6.517 1.00 0.00 O ATOM 293 C5' A A 10 -1.684 13.025 5.343 1.00 0.00 C ATOM 294 C4' A A 10 -0.309 12.732 4.720 1.00 0.00 C ATOM 295 O4' A A 10 -0.063 11.338 4.586 1.00 0.00 O ATOM 296 C3' A A 10 -0.200 13.346 3.317 1.00 0.00 C ATOM 297 O3' A A 10 0.369 14.649 3.377 1.00 0.00 O ATOM 298 C2' A A 10 0.665 12.325 2.572 1.00 0.00 C ATOM 299 O2' A A 10 2.046 12.535 2.806 1.00 0.00 O ATOM 300 C1' A A 10 0.233 11.012 3.239 1.00 0.00 C ATOM 301 N9 A A 10 -0.943 10.383 2.578 1.00 0.00 N ATOM 302 C8 A A 10 -2.231 10.225 3.038 1.00 0.00 C ATOM 303 N7 A A 10 -2.998 9.501 2.273 1.00 0.00 N ATOM 304 C5 A A 10 -2.166 9.146 1.218 1.00 0.00 C ATOM 305 C6 A A 10 -2.341 8.345 0.059 1.00 0.00 C ATOM 306 N6 A A 10 -3.492 7.737 -0.242 1.00 0.00 N ATOM 307 N1 A A 10 -1.297 8.170 -0.786 1.00 0.00 N ATOM 308 C2 A A 10 -0.135 8.763 -0.499 1.00 0.00 C ATOM 309 N3 A A 10 0.156 9.532 0.554 1.00 0.00 N ATOM 310 C4 A A 10 -0.913 9.689 1.390 1.00 0.00 C ATOM 0 H5' A A 10 -1.760 14.086 5.581 1.00 0.00 H new ATOM 0 H5'' A A 10 -2.469 12.804 4.620 1.00 0.00 H new ATOM 0 H4' A A 10 0.423 13.171 5.398 1.00 0.00 H new ATOM 0 H3' A A 10 -1.154 13.507 2.816 1.00 0.00 H new ATOM 0 H2' A A 10 0.537 12.365 1.490 1.00 0.00 H new ATOM 0 HO2' A A 10 2.566 11.864 2.316 1.00 0.00 H new ATOM 0 H1' A A 10 1.031 10.274 3.159 1.00 0.00 H new ATOM 0 H8 A A 10 -2.578 10.666 3.960 1.00 0.00 H new ATOM 0 H61 A A 10 -3.564 7.172 -1.088 1.00 0.00 H new ATOM 0 H62 A A 10 -4.298 7.838 0.375 1.00 0.00 H new ATOM 0 H2 A A 10 0.667 8.601 -1.204 1.00 0.00 H new ATOM 322 P G A 11 -0.332 15.938 2.699 1.00 0.00 P ATOM 323 OP1 G A 11 0.505 17.122 2.991 1.00 0.00 O ATOM 324 OP2 G A 11 -1.763 15.941 3.075 1.00 0.00 O ATOM 325 O5' G A 11 -0.215 15.603 1.128 1.00 0.00 O ATOM 326 C5' G A 11 1.047 15.517 0.490 1.00 0.00 C ATOM 327 C4' G A 11 0.926 14.859 -0.887 1.00 0.00 C ATOM 328 O4' G A 11 0.316 13.581 -0.751 1.00 0.00 O ATOM 329 C3' G A 11 0.120 15.675 -1.920 1.00 0.00 C ATOM 330 O3' G A 11 0.780 15.683 -3.185 1.00 0.00 O ATOM 331 C2' G A 11 -1.179 14.868 -1.993 1.00 0.00 C ATOM 332 O2' G A 11 -1.876 15.009 -3.217 1.00 0.00 O ATOM 333 C1' G A 11 -0.647 13.451 -1.771 1.00 0.00 C ATOM 334 N9 G A 11 -1.706 12.469 -1.432 1.00 0.00 N ATOM 335 C8 G A 11 -2.028 11.333 -2.124 1.00 0.00 C ATOM 336 N7 G A 11 -3.105 10.729 -1.712 1.00 0.00 N ATOM 337 C5 G A 11 -3.506 11.486 -0.616 1.00 0.00 C ATOM 338 C6 G A 11 -4.604 11.296 0.289 1.00 0.00 C ATOM 339 O6 G A 11 -5.473 10.429 0.251 1.00 0.00 O ATOM 340 N1 G A 11 -4.630 12.232 1.326 1.00 0.00 N ATOM 341 C2 G A 11 -3.702 13.250 1.468 1.00 0.00 C ATOM 342 N2 G A 11 -3.856 14.057 2.518 1.00 0.00 N ATOM 343 N3 G A 11 -2.680 13.442 0.610 1.00 0.00 N ATOM 344 C4 G A 11 -2.626 12.530 -0.407 1.00 0.00 C ATOM 0 H5' G A 11 1.734 14.942 1.112 1.00 0.00 H new ATOM 0 H5'' G A 11 1.473 16.515 0.383 1.00 0.00 H new ATOM 0 H4' G A 11 1.945 14.789 -1.268 1.00 0.00 H new ATOM 0 H3' G A 11 -0.016 16.724 -1.655 1.00 0.00 H new ATOM 0 H2' G A 11 -1.933 15.189 -1.274 1.00 0.00 H new ATOM 0 HO2' G A 11 -1.269 15.363 -3.900 1.00 0.00 H new ATOM 0 H1' G A 11 -0.218 13.046 -2.688 1.00 0.00 H new ATOM 0 H8 G A 11 -1.434 10.966 -2.948 1.00 0.00 H new ATOM 0 H1 G A 11 -5.376 12.161 2.018 1.00 0.00 H new ATOM 0 H21 G A 11 -3.201 14.824 2.672 1.00 0.00 H new ATOM 0 H22 G A 11 -4.628 13.907 3.167 1.00 0.00 H new ATOM 356 P A A 12 2.015 16.682 -3.492 1.00 0.00 P ATOM 357 OP1 A A 12 2.875 16.744 -2.290 1.00 0.00 O ATOM 358 OP2 A A 12 1.449 17.932 -4.044 1.00 0.00 O ATOM 359 O5' A A 12 2.876 15.968 -4.662 1.00 0.00 O ATOM 360 C5' A A 12 3.083 14.563 -4.739 1.00 0.00 C ATOM 361 C4' A A 12 4.473 14.315 -5.369 1.00 0.00 C ATOM 362 O4' A A 12 5.435 14.394 -4.330 1.00 0.00 O ATOM 363 C3' A A 12 4.731 12.936 -5.998 1.00 0.00 C ATOM 364 O3' A A 12 5.943 13.000 -6.757 1.00 0.00 O ATOM 365 C2' A A 12 4.814 12.137 -4.701 1.00 0.00 C ATOM 366 O2' A A 12 5.409 10.868 -4.793 1.00 0.00 O ATOM 367 C1' A A 12 5.563 13.101 -3.756 1.00 0.00 C ATOM 368 N9 A A 12 5.045 13.108 -2.364 1.00 0.00 N ATOM 369 C8 A A 12 3.949 12.466 -1.842 1.00 0.00 C ATOM 370 N7 A A 12 3.681 12.764 -0.602 1.00 0.00 N ATOM 371 C5 A A 12 4.684 13.666 -0.261 1.00 0.00 C ATOM 372 C6 A A 12 5.002 14.380 0.926 1.00 0.00 C ATOM 373 N6 A A 12 4.290 14.288 2.052 1.00 0.00 N ATOM 374 N1 A A 12 6.090 15.185 0.941 1.00 0.00 N ATOM 375 C2 A A 12 6.827 15.289 -0.169 1.00 0.00 C ATOM 376 N3 A A 12 6.637 14.679 -1.343 1.00 0.00 N ATOM 377 C4 A A 12 5.532 13.870 -1.327 1.00 0.00 C ATOM 0 H5' A A 12 2.304 14.096 -5.341 1.00 0.00 H new ATOM 0 H5'' A A 12 3.030 14.116 -3.746 1.00 0.00 H new ATOM 0 H4' A A 12 4.531 15.057 -6.166 1.00 0.00 H new ATOM 0 H3' A A 12 4.014 12.528 -6.711 1.00 0.00 H new ATOM 0 H2' A A 12 3.822 11.853 -4.349 1.00 0.00 H new ATOM 0 HO2' A A 12 5.533 10.499 -3.894 1.00 0.00 H new ATOM 0 H1' A A 12 6.599 12.775 -3.667 1.00 0.00 H new ATOM 0 H8 A A 12 3.355 11.769 -2.414 1.00 0.00 H new ATOM 0 H61 A A 12 4.565 14.824 2.875 1.00 0.00 H new ATOM 0 H62 A A 12 3.471 13.681 2.089 1.00 0.00 H new ATOM 0 H2 A A 12 7.681 15.947 -0.110 1.00 0.00 H new ATOM 389 P A A 13 6.596 11.747 -7.560 1.00 0.00 P ATOM 390 OP1 A A 13 7.253 12.269 -8.778 1.00 0.00 O ATOM 391 OP2 A A 13 5.591 10.666 -7.666 1.00 0.00 O ATOM 392 O5' A A 13 7.750 11.322 -6.506 1.00 0.00 O ATOM 393 C5' A A 13 8.082 9.981 -6.164 1.00 0.00 C ATOM 394 C4' A A 13 8.843 10.032 -4.826 1.00 0.00 C ATOM 395 O4' A A 13 8.074 10.780 -3.886 1.00 0.00 O ATOM 396 C3' A A 13 9.100 8.677 -4.150 1.00 0.00 C ATOM 397 O3' A A 13 10.227 7.957 -4.638 1.00 0.00 O ATOM 398 C2' A A 13 9.278 9.153 -2.701 1.00 0.00 C ATOM 399 O2' A A 13 10.565 9.711 -2.494 1.00 0.00 O ATOM 400 C1' A A 13 8.213 10.245 -2.584 1.00 0.00 C ATOM 401 N9 A A 13 6.901 9.726 -2.104 1.00 0.00 N ATOM 402 C8 A A 13 6.005 8.889 -2.733 1.00 0.00 C ATOM 403 N7 A A 13 4.901 8.676 -2.074 1.00 0.00 N ATOM 404 C5 A A 13 5.073 9.407 -0.907 1.00 0.00 C ATOM 405 C6 A A 13 4.257 9.630 0.231 1.00 0.00 C ATOM 406 N6 A A 13 3.040 9.107 0.365 1.00 0.00 N ATOM 407 N1 A A 13 4.703 10.434 1.221 1.00 0.00 N ATOM 408 C2 A A 13 5.901 11.004 1.083 1.00 0.00 C ATOM 409 N3 A A 13 6.763 10.885 0.067 1.00 0.00 N ATOM 410 C4 A A 13 6.288 10.055 -0.914 1.00 0.00 C ATOM 0 H5' A A 13 8.697 9.526 -6.940 1.00 0.00 H new ATOM 0 H5'' A A 13 7.182 9.372 -6.073 1.00 0.00 H new ATOM 0 H4' A A 13 9.808 10.468 -5.083 1.00 0.00 H new ATOM 0 H3' A A 13 8.311 7.945 -4.321 1.00 0.00 H new ATOM 0 H2' A A 13 9.181 8.348 -1.973 1.00 0.00 H new ATOM 0 HO2' A A 13 11.199 9.314 -3.127 1.00 0.00 H new ATOM 0 H1' A A 13 8.520 10.989 -1.849 1.00 0.00 H new ATOM 0 H8 A A 13 6.202 8.444 -3.697 1.00 0.00 H new ATOM 0 H61 A A 13 2.492 9.298 1.204 1.00 0.00 H new ATOM 0 H62 A A 13 2.655 8.515 -0.371 1.00 0.00 H new ATOM 0 H2 A A 13 6.215 11.643 1.895 1.00 0.00 H new ATOM 422 P G A 14 10.441 6.385 -4.290 1.00 0.00 P ATOM 423 OP1 G A 14 11.839 6.024 -4.612 1.00 0.00 O ATOM 424 OP2 G A 14 9.326 5.636 -4.912 1.00 0.00 O ATOM 425 O5' G A 14 10.262 6.338 -2.681 1.00 0.00 O ATOM 426 C5' G A 14 9.722 5.222 -1.985 1.00 0.00 C ATOM 427 C4' G A 14 9.246 5.688 -0.598 1.00 0.00 C ATOM 428 O4' G A 14 8.161 6.597 -0.730 1.00 0.00 O ATOM 429 C3' G A 14 8.691 4.571 0.289 1.00 0.00 C ATOM 430 O3' G A 14 9.702 3.778 0.896 1.00 0.00 O ATOM 431 C2' G A 14 7.891 5.408 1.294 1.00 0.00 C ATOM 432 O2' G A 14 8.725 6.013 2.266 1.00 0.00 O ATOM 433 C1' G A 14 7.306 6.505 0.396 1.00 0.00 C ATOM 434 N9 G A 14 5.927 6.161 -0.027 1.00 0.00 N ATOM 435 C8 G A 14 5.474 5.700 -1.240 1.00 0.00 C ATOM 436 N7 G A 14 4.183 5.528 -1.301 1.00 0.00 N ATOM 437 C5 G A 14 3.737 5.894 -0.034 1.00 0.00 C ATOM 438 C6 G A 14 2.410 5.952 0.508 1.00 0.00 C ATOM 439 O6 G A 14 1.356 5.673 -0.054 1.00 0.00 O ATOM 440 N1 G A 14 2.374 6.400 1.834 1.00 0.00 N ATOM 441 C2 G A 14 3.501 6.747 2.559 1.00 0.00 C ATOM 442 N2 G A 14 3.311 7.138 3.818 1.00 0.00 N ATOM 443 N3 G A 14 4.748 6.702 2.053 1.00 0.00 N ATOM 444 C4 G A 14 4.802 6.273 0.755 1.00 0.00 C ATOM 0 H5' G A 14 10.475 4.440 -1.883 1.00 0.00 H new ATOM 0 H5'' G A 14 8.891 4.793 -2.545 1.00 0.00 H new ATOM 0 H4' G A 14 10.139 6.118 -0.144 1.00 0.00 H new ATOM 0 H3' G A 14 8.110 3.816 -0.240 1.00 0.00 H new ATOM 0 H2' G A 14 7.164 4.813 1.847 1.00 0.00 H new ATOM 0 HO2' G A 14 8.177 6.538 2.886 1.00 0.00 H new ATOM 0 H1' G A 14 7.247 7.454 0.928 1.00 0.00 H new ATOM 0 H8 G A 14 6.132 5.497 -2.072 1.00 0.00 H new ATOM 0 H1 G A 14 1.466 6.475 2.292 1.00 0.00 H new ATOM 0 H21 G A 14 4.109 7.404 4.395 1.00 0.00 H new ATOM 0 H22 G A 14 2.368 7.171 4.205 1.00 0.00 H new ATOM 456 P A A 15 9.376 2.354 1.593 1.00 0.00 P ATOM 457 OP1 A A 15 10.637 1.831 2.163 1.00 0.00 O ATOM 458 OP2 A A 15 8.625 1.537 0.615 1.00 0.00 O ATOM 459 O5' A A 15 8.373 2.702 2.813 1.00 0.00 O ATOM 460 C5' A A 15 8.821 3.277 4.031 1.00 0.00 C ATOM 461 C4' A A 15 7.624 3.620 4.933 1.00 0.00 C ATOM 462 O4' A A 15 6.645 4.394 4.253 1.00 0.00 O ATOM 463 C3' A A 15 6.894 2.386 5.466 1.00 0.00 C ATOM 464 O3' A A 15 7.600 1.807 6.559 1.00 0.00 O ATOM 465 C2' A A 15 5.544 3.008 5.845 1.00 0.00 C ATOM 466 O2' A A 15 5.589 3.602 7.131 1.00 0.00 O ATOM 467 C1' A A 15 5.358 4.097 4.779 1.00 0.00 C ATOM 468 N9 A A 15 4.427 3.651 3.707 1.00 0.00 N ATOM 469 C8 A A 15 4.701 3.187 2.441 1.00 0.00 C ATOM 470 N7 A A 15 3.644 2.948 1.713 1.00 0.00 N ATOM 471 C5 A A 15 2.583 3.243 2.564 1.00 0.00 C ATOM 472 C6 A A 15 1.170 3.210 2.422 1.00 0.00 C ATOM 473 N6 A A 15 0.549 2.876 1.287 1.00 0.00 N ATOM 474 N1 A A 15 0.395 3.532 3.482 1.00 0.00 N ATOM 475 C2 A A 15 0.982 3.891 4.627 1.00 0.00 C ATOM 476 N3 A A 15 2.291 3.987 4.880 1.00 0.00 N ATOM 477 C4 A A 15 3.053 3.643 3.796 1.00 0.00 C ATOM 0 H5' A A 15 9.399 4.178 3.825 1.00 0.00 H new ATOM 0 H5'' A A 15 9.485 2.583 4.546 1.00 0.00 H new ATOM 0 H4' A A 15 8.069 4.178 5.757 1.00 0.00 H new ATOM 0 H3' A A 15 6.798 1.549 4.774 1.00 0.00 H new ATOM 0 H2' A A 15 4.740 2.273 5.880 1.00 0.00 H new ATOM 0 HO2' A A 15 5.620 2.900 7.814 1.00 0.00 H new ATOM 0 H1' A A 15 4.912 4.988 5.220 1.00 0.00 H new ATOM 0 H8 A A 15 5.707 3.033 2.080 1.00 0.00 H new ATOM 0 H61 A A 15 -0.470 2.870 1.246 1.00 0.00 H new ATOM 0 H62 A A 15 1.094 2.627 0.462 1.00 0.00 H new ATOM 0 H2 A A 15 0.320 4.132 5.446 1.00 0.00 H new ATOM 489 P A A 16 7.128 0.433 7.266 1.00 0.00 P ATOM 490 OP1 A A 16 8.047 0.154 8.391 1.00 0.00 O ATOM 491 OP2 A A 16 6.924 -0.581 6.209 1.00 0.00 O ATOM 492 O5' A A 16 5.691 0.834 7.877 1.00 0.00 O ATOM 493 C5' A A 16 4.785 -0.131 8.387 1.00 0.00 C ATOM 494 C4' A A 16 3.355 0.399 8.203 1.00 0.00 C ATOM 495 O4' A A 16 3.105 0.613 6.831 1.00 0.00 O ATOM 496 C3' A A 16 2.280 -0.606 8.631 1.00 0.00 C ATOM 497 O3' A A 16 1.976 -0.439 10.010 1.00 0.00 O ATOM 498 C2' A A 16 1.112 -0.296 7.668 1.00 0.00 C ATOM 499 O2' A A 16 -0.007 0.290 8.309 1.00 0.00 O ATOM 500 C1' A A 16 1.709 0.687 6.646 1.00 0.00 C ATOM 501 N9 A A 16 1.364 0.388 5.231 1.00 0.00 N ATOM 502 C8 A A 16 2.208 0.178 4.164 1.00 0.00 C ATOM 503 N7 A A 16 1.607 0.010 3.020 1.00 0.00 N ATOM 504 C5 A A 16 0.259 0.117 3.343 1.00 0.00 C ATOM 505 C6 A A 16 -0.935 0.055 2.579 1.00 0.00 C ATOM 506 N6 A A 16 -0.949 -0.143 1.259 1.00 0.00 N ATOM 507 N1 A A 16 -2.124 0.185 3.209 1.00 0.00 N ATOM 508 C2 A A 16 -2.140 0.378 4.529 1.00 0.00 C ATOM 509 N3 A A 16 -1.093 0.475 5.354 1.00 0.00 N ATOM 510 C4 A A 16 0.097 0.336 4.694 1.00 0.00 C ATOM 0 H5' A A 16 4.986 -0.320 9.441 1.00 0.00 H new ATOM 0 H5'' A A 16 4.908 -1.080 7.864 1.00 0.00 H new ATOM 0 H4' A A 16 3.299 1.301 8.812 1.00 0.00 H new ATOM 0 H3' A A 16 2.569 -1.655 8.559 1.00 0.00 H new ATOM 0 H2' A A 16 0.730 -1.215 7.224 1.00 0.00 H new ATOM 0 HO2' A A 16 -0.295 -0.282 9.051 1.00 0.00 H new ATOM 0 H1' A A 16 1.297 1.681 6.820 1.00 0.00 H new ATOM 0 H8 A A 16 3.283 0.154 4.267 1.00 0.00 H new ATOM 0 H61 A A 16 -1.837 -0.179 0.758 1.00 0.00 H new ATOM 0 H62 A A 16 -0.072 -0.258 0.751 1.00 0.00 H new ATOM 0 H2 A A 16 -3.115 0.466 4.985 1.00 0.00 H new ATOM 522 P C A 17 1.302 -1.602 10.906 1.00 0.00 P ATOM 523 OP1 C A 17 0.991 -1.019 12.229 1.00 0.00 O ATOM 524 OP2 C A 17 2.164 -2.802 10.819 1.00 0.00 O ATOM 525 O5' C A 17 -0.100 -1.905 10.158 1.00 0.00 O ATOM 526 C5' C A 17 -0.327 -3.107 9.440 1.00 0.00 C ATOM 527 C4' C A 17 -1.715 -3.071 8.787 1.00 0.00 C ATOM 528 O4' C A 17 -1.762 -2.141 7.713 1.00 0.00 O ATOM 529 C3' C A 17 -2.103 -4.409 8.157 1.00 0.00 C ATOM 530 O3' C A 17 -2.485 -5.384 9.118 1.00 0.00 O ATOM 531 C2' C A 17 -3.238 -3.946 7.243 1.00 0.00 C ATOM 532 O2' C A 17 -4.439 -3.720 7.962 1.00 0.00 O ATOM 533 C1' C A 17 -2.680 -2.608 6.730 1.00 0.00 C ATOM 534 N1 C A 17 -2.045 -2.797 5.387 1.00 0.00 N ATOM 535 C2 C A 17 -2.888 -2.820 4.263 1.00 0.00 C ATOM 536 O2 C A 17 -4.101 -2.660 4.372 1.00 0.00 O ATOM 537 N3 C A 17 -2.338 -3.026 3.031 1.00 0.00 N ATOM 538 C4 C A 17 -1.023 -3.235 2.881 1.00 0.00 C ATOM 539 N4 C A 17 -0.560 -3.431 1.646 1.00 0.00 N ATOM 540 C5 C A 17 -0.133 -3.238 4.013 1.00 0.00 C ATOM 541 C6 C A 17 -0.687 -3.019 5.235 1.00 0.00 C ATOM 0 H5' C A 17 -0.254 -3.962 10.112 1.00 0.00 H new ATOM 0 H5'' C A 17 0.440 -3.235 8.677 1.00 0.00 H new ATOM 0 H4' C A 17 -2.391 -2.804 9.599 1.00 0.00 H new ATOM 0 H3' C A 17 -1.300 -4.931 7.637 1.00 0.00 H new ATOM 0 H2' C A 17 -3.496 -4.672 6.472 1.00 0.00 H new ATOM 0 HO2' C A 17 -5.155 -4.271 7.584 1.00 0.00 H new ATOM 0 H1' C A 17 -3.465 -1.865 6.589 1.00 0.00 H new ATOM 0 H41 C A 17 0.436 -3.593 1.494 1.00 0.00 H new ATOM 0 H42 C A 17 -1.201 -3.419 0.853 1.00 0.00 H new ATOM 0 H5 C A 17 0.927 -3.407 3.896 1.00 0.00 H new ATOM 0 H6 C A 17 -0.052 -3.018 6.109 1.00 0.00 H new ATOM 553 P G A 18 -2.604 -6.954 8.747 1.00 0.00 P ATOM 554 OP1 G A 18 -2.941 -7.687 9.986 1.00 0.00 O ATOM 555 OP2 G A 18 -1.395 -7.331 7.981 1.00 0.00 O ATOM 556 O5' G A 18 -3.868 -7.036 7.746 1.00 0.00 O ATOM 557 C5' G A 18 -5.208 -6.964 8.207 1.00 0.00 C ATOM 558 C4' G A 18 -6.179 -6.988 7.017 1.00 0.00 C ATOM 559 O4' G A 18 -5.918 -5.927 6.109 1.00 0.00 O ATOM 560 C3' G A 18 -6.109 -8.277 6.193 1.00 0.00 C ATOM 561 O3' G A 18 -6.804 -9.353 6.810 1.00 0.00 O ATOM 562 C2' G A 18 -6.759 -7.794 4.895 1.00 0.00 C ATOM 563 O2' G A 18 -8.174 -7.780 4.982 1.00 0.00 O ATOM 564 C1' G A 18 -6.239 -6.353 4.791 1.00 0.00 C ATOM 565 N9 G A 18 -5.052 -6.278 3.900 1.00 0.00 N ATOM 566 C8 G A 18 -3.715 -6.245 4.217 1.00 0.00 C ATOM 567 N7 G A 18 -2.925 -6.059 3.197 1.00 0.00 N ATOM 568 C5 G A 18 -3.793 -5.989 2.112 1.00 0.00 C ATOM 569 C6 G A 18 -3.532 -5.779 0.715 1.00 0.00 C ATOM 570 O6 G A 18 -2.462 -5.526 0.170 1.00 0.00 O ATOM 571 N1 G A 18 -4.676 -5.888 -0.079 1.00 0.00 N ATOM 572 C2 G A 18 -5.942 -6.143 0.418 1.00 0.00 C ATOM 573 N2 G A 18 -6.925 -6.237 -0.476 1.00 0.00 N ATOM 574 N3 G A 18 -6.201 -6.290 1.732 1.00 0.00 N ATOM 575 C4 G A 18 -5.091 -6.203 2.527 1.00 0.00 C ATOM 0 H5' G A 18 -5.353 -6.052 8.786 1.00 0.00 H new ATOM 0 H5'' G A 18 -5.417 -7.801 8.873 1.00 0.00 H new ATOM 0 H4' G A 18 -7.163 -6.898 7.477 1.00 0.00 H new ATOM 0 H3' G A 18 -5.110 -8.694 6.064 1.00 0.00 H new ATOM 0 H2' G A 18 -6.522 -8.433 4.044 1.00 0.00 H new ATOM 0 HO2' G A 18 -8.461 -8.337 5.735 1.00 0.00 H new ATOM 0 H1' G A 18 -6.997 -5.703 4.354 1.00 0.00 H new ATOM 0 H8 G A 18 -3.350 -6.363 5.226 1.00 0.00 H new ATOM 0 H1 G A 18 -4.572 -5.773 -1.087 1.00 0.00 H new ATOM 0 H21 G A 18 -7.879 -6.424 -0.167 1.00 0.00 H new ATOM 0 H22 G A 18 -6.724 -6.122 -1.469 1.00 0.00 H new ATOM 587 P C A 19 -6.540 -10.899 6.411 1.00 0.00 P ATOM 588 OP1 C A 19 -7.498 -11.732 7.172 1.00 0.00 O ATOM 589 OP2 C A 19 -5.089 -11.154 6.538 1.00 0.00 O ATOM 590 O5' C A 19 -6.919 -10.991 4.843 1.00 0.00 O ATOM 591 C5' C A 19 -8.252 -11.109 4.377 1.00 0.00 C ATOM 592 C4' C A 19 -8.298 -10.997 2.844 1.00 0.00 C ATOM 593 O4' C A 19 -7.750 -9.764 2.391 1.00 0.00 O ATOM 594 C3' C A 19 -7.521 -12.086 2.097 1.00 0.00 C ATOM 595 O3' C A 19 -8.211 -13.328 2.046 1.00 0.00 O ATOM 596 C2' C A 19 -7.402 -11.416 0.726 1.00 0.00 C ATOM 597 O2' C A 19 -8.615 -11.516 -0.001 1.00 0.00 O ATOM 598 C1' C A 19 -7.154 -9.950 1.111 1.00 0.00 C ATOM 599 N1 C A 19 -5.686 -9.641 1.103 1.00 0.00 N ATOM 600 C2 C A 19 -5.105 -9.213 -0.103 1.00 0.00 C ATOM 601 O2 C A 19 -5.771 -9.127 -1.132 1.00 0.00 O ATOM 602 N3 C A 19 -3.779 -8.877 -0.119 1.00 0.00 N ATOM 603 C4 C A 19 -3.023 -8.994 0.985 1.00 0.00 C ATOM 604 N4 C A 19 -1.750 -8.603 0.927 1.00 0.00 N ATOM 605 C5 C A 19 -3.571 -9.494 2.218 1.00 0.00 C ATOM 606 C6 C A 19 -4.893 -9.805 2.224 1.00 0.00 C ATOM 0 H5' C A 19 -8.870 -10.330 4.823 1.00 0.00 H new ATOM 0 H5'' C A 19 -8.670 -12.066 4.690 1.00 0.00 H new ATOM 0 H4' C A 19 -9.361 -11.092 2.624 1.00 0.00 H new ATOM 0 H3' C A 19 -6.574 -12.370 2.557 1.00 0.00 H new ATOM 0 H2' C A 19 -6.633 -11.861 0.095 1.00 0.00 H new ATOM 0 HO2' C A 19 -9.114 -12.303 0.302 1.00 0.00 H new ATOM 0 H1' C A 19 -7.599 -9.260 0.394 1.00 0.00 H new ATOM 0 H41 C A 19 -1.154 -8.681 1.751 1.00 0.00 H new ATOM 0 H42 C A 19 -1.372 -8.226 0.058 1.00 0.00 H new ATOM 0 H5 C A 19 -2.959 -9.616 3.099 1.00 0.00 H new ATOM 0 H6 C A 19 -5.337 -10.191 3.129 1.00 0.00 H new ATOM 618 P G A 20 -7.454 -14.719 1.709 1.00 0.00 P ATOM 619 OP1 G A 20 -8.475 -15.790 1.688 1.00 0.00 O ATOM 620 OP2 G A 20 -6.295 -14.833 2.621 1.00 0.00 O ATOM 621 O5' G A 20 -6.885 -14.526 0.207 1.00 0.00 O ATOM 622 C5' G A 20 -7.680 -14.759 -0.945 1.00 0.00 C ATOM 623 C4' G A 20 -6.912 -14.376 -2.220 1.00 0.00 C ATOM 624 O4' G A 20 -6.458 -13.030 -2.175 1.00 0.00 O ATOM 625 C3' G A 20 -5.666 -15.227 -2.484 1.00 0.00 C ATOM 626 O3' G A 20 -5.981 -16.506 -3.021 1.00 0.00 O ATOM 627 C2' G A 20 -4.939 -14.314 -3.474 1.00 0.00 C ATOM 628 O2' G A 20 -5.483 -14.402 -4.780 1.00 0.00 O ATOM 629 C1' G A 20 -5.237 -12.924 -2.895 1.00 0.00 C ATOM 630 N9 G A 20 -4.120 -12.472 -2.023 1.00 0.00 N ATOM 631 C8 G A 20 -4.009 -12.476 -0.653 1.00 0.00 C ATOM 632 N7 G A 20 -2.900 -11.958 -0.202 1.00 0.00 N ATOM 633 C5 G A 20 -2.203 -11.604 -1.354 1.00 0.00 C ATOM 634 C6 G A 20 -0.910 -11.001 -1.521 1.00 0.00 C ATOM 635 O6 G A 20 -0.153 -10.580 -0.653 1.00 0.00 O ATOM 636 N1 G A 20 -0.509 -10.923 -2.857 1.00 0.00 N ATOM 637 C2 G A 20 -1.276 -11.367 -3.920 1.00 0.00 C ATOM 638 N2 G A 20 -0.730 -11.287 -5.132 1.00 0.00 N ATOM 639 N3 G A 20 -2.511 -11.883 -3.774 1.00 0.00 N ATOM 640 C4 G A 20 -2.918 -11.977 -2.473 1.00 0.00 C ATOM 0 H5' G A 20 -8.601 -14.179 -0.881 1.00 0.00 H new ATOM 0 H5'' G A 20 -7.967 -15.810 -0.989 1.00 0.00 H new ATOM 0 H4' G A 20 -7.641 -14.540 -3.013 1.00 0.00 H new ATOM 0 H3' G A 20 -5.085 -15.490 -1.600 1.00 0.00 H new ATOM 0 H2' G A 20 -3.883 -14.562 -3.577 1.00 0.00 H new ATOM 0 HO2' G A 20 -6.007 -15.226 -4.861 1.00 0.00 H new ATOM 0 H1' G A 20 -5.332 -12.178 -3.684 1.00 0.00 H new ATOM 0 H8 G A 20 -4.775 -12.874 -0.005 1.00 0.00 H new ATOM 0 H1 G A 20 0.403 -10.515 -3.061 1.00 0.00 H new ATOM 0 H21 G A 20 -1.254 -11.601 -5.949 1.00 0.00 H new ATOM 0 H22 G A 20 0.212 -10.912 -5.243 1.00 0.00 H new ATOM 652 P C A 21 -4.925 -17.732 -3.017 1.00 0.00 P ATOM 653 OP1 C A 21 -5.558 -18.874 -3.713 1.00 0.00 O ATOM 654 OP2 C A 21 -4.439 -17.901 -1.630 1.00 0.00 O ATOM 655 O5' C A 21 -3.680 -17.218 -3.911 1.00 0.00 O ATOM 656 C5' C A 21 -3.711 -17.194 -5.328 1.00 0.00 C ATOM 657 C4' C A 21 -2.445 -16.522 -5.888 1.00 0.00 C ATOM 658 O4' C A 21 -2.255 -15.213 -5.365 1.00 0.00 O ATOM 659 C3' C A 21 -1.144 -17.276 -5.593 1.00 0.00 C ATOM 660 O3' C A 21 -0.982 -18.407 -6.440 1.00 0.00 O ATOM 661 C2' C A 21 -0.130 -16.155 -5.849 1.00 0.00 C ATOM 662 O2' C A 21 0.094 -15.939 -7.233 1.00 0.00 O ATOM 663 C1' C A 21 -0.861 -14.937 -5.264 1.00 0.00 C ATOM 664 N1 C A 21 -0.417 -14.659 -3.858 1.00 0.00 N ATOM 665 C2 C A 21 0.771 -13.930 -3.673 1.00 0.00 C ATOM 666 O2 C A 21 1.473 -13.604 -4.627 1.00 0.00 O ATOM 667 N3 C A 21 1.138 -13.573 -2.406 1.00 0.00 N ATOM 668 C4 C A 21 0.404 -13.938 -1.344 1.00 0.00 C ATOM 669 N4 C A 21 0.784 -13.516 -0.137 1.00 0.00 N ATOM 670 C5 C A 21 -0.775 -14.751 -1.491 1.00 0.00 C ATOM 671 C6 C A 21 -1.138 -15.084 -2.757 1.00 0.00 C ATOM 0 H5' C A 21 -4.595 -16.656 -5.668 1.00 0.00 H new ATOM 0 H5'' C A 21 -3.789 -18.211 -5.712 1.00 0.00 H new ATOM 0 H4' C A 21 -2.631 -16.512 -6.962 1.00 0.00 H new ATOM 0 H3' C A 21 -1.067 -17.721 -4.601 1.00 0.00 H new ATOM 0 H2' C A 21 0.849 -16.369 -5.421 1.00 0.00 H new ATOM 0 HO2' C A 21 0.745 -15.216 -7.350 1.00 0.00 H new ATOM 0 H1' C A 21 -0.626 -14.027 -5.815 1.00 0.00 H new ATOM 0 H41 C A 21 0.245 -13.778 0.688 1.00 0.00 H new ATOM 0 H42 C A 21 1.614 -12.931 -0.039 1.00 0.00 H new ATOM 0 H5 C A 21 -1.344 -15.081 -0.635 1.00 0.00 H new ATOM 0 H6 C A 21 -2.014 -15.698 -2.908 1.00 0.00 H new ATOM 683 P C A 22 0.048 -19.609 -6.102 1.00 0.00 P ATOM 684 OP1 C A 22 -0.106 -20.643 -7.149 1.00 0.00 O ATOM 685 OP2 C A 22 -0.132 -19.980 -4.681 1.00 0.00 O ATOM 686 O5' C A 22 1.521 -18.965 -6.252 1.00 0.00 O ATOM 687 C5' C A 22 2.074 -18.613 -7.508 1.00 0.00 C ATOM 688 C4' C A 22 3.475 -18.005 -7.326 1.00 0.00 C ATOM 689 O4' C A 22 3.438 -16.962 -6.353 1.00 0.00 O ATOM 690 C3' C A 22 4.513 -19.043 -6.860 1.00 0.00 C ATOM 691 O3' C A 22 5.746 -18.826 -7.526 1.00 0.00 O ATOM 692 C2' C A 22 4.624 -18.729 -5.368 1.00 0.00 C ATOM 693 O2' C A 22 5.852 -19.128 -4.786 1.00 0.00 O ATOM 694 C1' C A 22 4.436 -17.210 -5.376 1.00 0.00 C ATOM 695 N1 C A 22 4.045 -16.697 -4.027 1.00 0.00 N ATOM 696 C2 C A 22 4.969 -15.941 -3.283 1.00 0.00 C ATOM 697 O2 C A 22 6.069 -15.641 -3.740 1.00 0.00 O ATOM 698 N3 C A 22 4.626 -15.533 -2.022 1.00 0.00 N ATOM 699 C4 C A 22 3.434 -15.852 -1.494 1.00 0.00 C ATOM 700 N4 C A 22 3.164 -15.449 -0.254 1.00 0.00 N ATOM 701 C5 C A 22 2.474 -16.641 -2.222 1.00 0.00 C ATOM 702 C6 C A 22 2.826 -17.037 -3.473 1.00 0.00 C ATOM 0 H5' C A 22 1.423 -17.898 -8.012 1.00 0.00 H new ATOM 0 H5'' C A 22 2.133 -19.495 -8.146 1.00 0.00 H new ATOM 0 H4' C A 22 3.772 -17.623 -8.303 1.00 0.00 H new ATOM 0 H3' C A 22 4.244 -20.079 -7.065 1.00 0.00 H new ATOM 0 H2' C A 22 3.903 -19.271 -4.756 1.00 0.00 H new ATOM 0 HO2' C A 22 5.854 -18.895 -3.834 1.00 0.00 H new ATOM 0 HO3' C A 22 6.482 -18.896 -6.883 1.00 0.00 H new ATOM 0 H1' C A 22 5.362 -16.688 -5.616 1.00 0.00 H new ATOM 0 H41 C A 22 2.266 -15.677 0.172 1.00 0.00 H new ATOM 0 H42 C A 22 3.855 -14.912 0.270 1.00 0.00 H new ATOM 0 H5 C A 22 1.519 -16.906 -1.793 1.00 0.00 H new ATOM 0 H6 C A 22 2.135 -17.633 -4.050 1.00 0.00 H new TER 714 C A 22