USER MOD reduce.3.24.130724 H: found=0, std=0, add=163, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 163 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 -21:sc= 0.013 USER MOD Single : A 1 G O5' : rot 18:sc= 0.0782 USER MOD Single : A 2 A O2' : rot -15:sc= 0.0102 USER MOD Single : A 3 G O2' : rot 180:sc= 0 USER MOD Single : A 4 G O2' : rot 180:sc= 0 USER MOD Single : A 5 A O2' : rot -17:sc= 0.0477 USER MOD Single : A 6 C O2' : rot -16:sc= 0.0799 USER MOD Single : A 7 A O2' : rot -15:sc= 0.687 USER MOD Single : A 8 U O2' : rot 28:sc= 0.0656 USER MOD Single : A 9 A O2' : rot -84:sc= 0.752 USER MOD Single : A 10 G O2' : rot 138:sc= 0.319 USER MOD Single : A 11 U O2' : rot -20:sc= 0.0141 USER MOD Single : A 12 C O2' : rot -19:sc= 0.0255 USER MOD Single : A 13 U O2' : rot -114:sc= 0.0995 USER MOD Single : A 14 U O2' : rot -119:sc= 0.00682 USER MOD Single : A 15 C O2' : rot -17:sc= 0.0266 USER MOD Single : A 15 C O3' : rot 180:sc= 0.0217 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -1.335 -6.998 13.439 1.00 0.00 O ATOM 2 C5' G A 1 -1.730 -8.018 12.543 1.00 0.00 C ATOM 3 C4' G A 1 -0.509 -8.747 11.961 1.00 0.00 C ATOM 4 O4' G A 1 -0.921 -9.831 11.136 1.00 0.00 O ATOM 5 C3' G A 1 0.371 -7.865 11.066 1.00 0.00 C ATOM 6 O3' G A 1 1.245 -7.028 11.814 1.00 0.00 O ATOM 7 C2' G A 1 1.079 -8.931 10.225 1.00 0.00 C ATOM 8 O2' G A 1 2.154 -9.567 10.901 1.00 0.00 O ATOM 9 C1' G A 1 -0.058 -9.933 10.004 1.00 0.00 C ATOM 10 N9 G A 1 -0.804 -9.669 8.741 1.00 0.00 N ATOM 11 C8 G A 1 -2.045 -9.103 8.565 1.00 0.00 C ATOM 12 N7 G A 1 -2.434 -9.029 7.323 1.00 0.00 N ATOM 13 C5 G A 1 -1.379 -9.587 6.604 1.00 0.00 C ATOM 14 C6 G A 1 -1.212 -9.786 5.185 1.00 0.00 C ATOM 15 O6 G A 1 -1.990 -9.495 4.280 1.00 0.00 O ATOM 16 N1 G A 1 0.006 -10.392 4.848 1.00 0.00 N ATOM 17 C2 G A 1 0.961 -10.760 5.785 1.00 0.00 C ATOM 18 N2 G A 1 2.073 -11.323 5.316 1.00 0.00 N ATOM 19 N3 G A 1 0.812 -10.578 7.115 1.00 0.00 N ATOM 20 C4 G A 1 -0.376 -9.986 7.470 1.00 0.00 C ATOM 0 H5' G A 1 -2.320 -7.587 11.734 1.00 0.00 H new ATOM 0 H5'' G A 1 -2.371 -8.732 13.060 1.00 0.00 H new ATOM 0 H4' G A 1 0.059 -9.067 12.834 1.00 0.00 H new ATOM 0 H3' G A 1 -0.169 -7.133 10.465 1.00 0.00 H new ATOM 0 H2' G A 1 1.536 -8.517 9.326 1.00 0.00 H new ATOM 0 HO2' G A 1 2.456 -9.000 11.641 1.00 0.00 H new ATOM 0 HO5' G A 1 -0.392 -6.778 13.289 1.00 0.00 H new ATOM 0 H1' G A 1 0.347 -10.940 9.903 1.00 0.00 H new ATOM 0 H8 G A 1 -2.648 -8.749 9.388 1.00 0.00 H new ATOM 0 H1 G A 1 0.200 -10.572 3.863 1.00 0.00 H new ATOM 0 H21 G A 1 2.809 -11.613 5.960 1.00 0.00 H new ATOM 0 H22 G A 1 2.189 -11.464 4.312 1.00 0.00 H new ATOM 33 P A A 2 1.841 -5.647 11.213 1.00 0.00 P ATOM 34 OP1 A A 2 2.694 -5.034 12.255 1.00 0.00 O ATOM 35 OP2 A A 2 0.716 -4.875 10.642 1.00 0.00 O ATOM 36 O5' A A 2 2.781 -6.143 9.990 1.00 0.00 O ATOM 37 C5' A A 2 4.039 -6.767 10.205 1.00 0.00 C ATOM 38 C4' A A 2 4.634 -7.321 8.901 1.00 0.00 C ATOM 39 O4' A A 2 3.766 -8.251 8.263 1.00 0.00 O ATOM 40 C3' A A 2 4.930 -6.250 7.845 1.00 0.00 C ATOM 41 O3' A A 2 6.105 -5.508 8.150 1.00 0.00 O ATOM 42 C2' A A 2 5.027 -7.123 6.589 1.00 0.00 C ATOM 43 O2' A A 2 6.273 -7.789 6.450 1.00 0.00 O ATOM 44 C1' A A 2 3.914 -8.152 6.848 1.00 0.00 C ATOM 45 N9 A A 2 2.640 -7.729 6.199 1.00 0.00 N ATOM 46 C8 A A 2 1.501 -7.205 6.766 1.00 0.00 C ATOM 47 N7 A A 2 0.552 -6.928 5.915 1.00 0.00 N ATOM 48 C5 A A 2 1.092 -7.291 4.681 1.00 0.00 C ATOM 49 C6 A A 2 0.604 -7.265 3.340 1.00 0.00 C ATOM 50 N6 A A 2 -0.610 -6.823 2.998 1.00 0.00 N ATOM 51 N1 A A 2 1.400 -7.709 2.337 1.00 0.00 N ATOM 52 C2 A A 2 2.624 -8.159 2.640 1.00 0.00 C ATOM 53 N3 A A 2 3.196 -8.240 3.849 1.00 0.00 N ATOM 54 C4 A A 2 2.371 -7.785 4.848 1.00 0.00 C ATOM 0 H5' A A 2 3.924 -7.578 10.925 1.00 0.00 H new ATOM 0 H5'' A A 2 4.731 -6.048 10.643 1.00 0.00 H new ATOM 0 H4' A A 2 5.561 -7.789 9.234 1.00 0.00 H new ATOM 0 H3' A A 2 4.189 -5.455 7.756 1.00 0.00 H new ATOM 0 H2' A A 2 4.934 -6.538 5.674 1.00 0.00 H new ATOM 0 HO2' A A 2 6.929 -7.386 7.057 1.00 0.00 H new ATOM 0 H1' A A 2 4.171 -9.122 6.422 1.00 0.00 H new ATOM 0 H8 A A 2 1.401 -7.037 7.828 1.00 0.00 H new ATOM 0 H61 A A 2 -0.899 -6.831 2.020 1.00 0.00 H new ATOM 0 H62 A A 2 -1.248 -6.478 3.715 1.00 0.00 H new ATOM 0 H2 A A 2 3.224 -8.498 1.808 1.00 0.00 H new ATOM 66 P G A 3 6.340 -3.998 7.609 1.00 0.00 P ATOM 67 OP1 G A 3 7.611 -3.506 8.189 1.00 0.00 O ATOM 68 OP2 G A 3 5.096 -3.226 7.817 1.00 0.00 O ATOM 69 O5' G A 3 6.539 -4.204 6.017 1.00 0.00 O ATOM 70 C5' G A 3 7.721 -4.771 5.471 1.00 0.00 C ATOM 71 C4' G A 3 7.592 -5.011 3.960 1.00 0.00 C ATOM 72 O4' G A 3 6.478 -5.836 3.644 1.00 0.00 O ATOM 73 C3' G A 3 7.375 -3.740 3.135 1.00 0.00 C ATOM 74 O3' G A 3 8.548 -2.941 3.029 1.00 0.00 O ATOM 75 C2' G A 3 6.888 -4.357 1.818 1.00 0.00 C ATOM 76 O2' G A 3 7.926 -4.864 0.989 1.00 0.00 O ATOM 77 C1' G A 3 6.024 -5.523 2.329 1.00 0.00 C ATOM 78 N9 G A 3 4.580 -5.155 2.318 1.00 0.00 N ATOM 79 C8 G A 3 3.743 -4.854 3.366 1.00 0.00 C ATOM 80 N7 G A 3 2.519 -4.569 3.014 1.00 0.00 N ATOM 81 C5 G A 3 2.528 -4.683 1.625 1.00 0.00 C ATOM 82 C6 G A 3 1.476 -4.496 0.655 1.00 0.00 C ATOM 83 O6 G A 3 0.300 -4.192 0.840 1.00 0.00 O ATOM 84 N1 G A 3 1.897 -4.702 -0.664 1.00 0.00 N ATOM 85 C2 G A 3 3.190 -5.054 -1.012 1.00 0.00 C ATOM 86 N2 G A 3 3.428 -5.211 -2.314 1.00 0.00 N ATOM 87 N3 G A 3 4.180 -5.238 -0.113 1.00 0.00 N ATOM 88 C4 G A 3 3.794 -5.042 1.192 1.00 0.00 C ATOM 0 H5' G A 3 7.937 -5.715 5.972 1.00 0.00 H new ATOM 0 H5'' G A 3 8.565 -4.108 5.663 1.00 0.00 H new ATOM 0 H4' G A 3 8.547 -5.472 3.707 1.00 0.00 H new ATOM 0 H3' G A 3 6.677 -3.018 3.559 1.00 0.00 H new ATOM 0 H2' G A 3 6.386 -3.621 1.190 1.00 0.00 H new ATOM 0 HO2' G A 3 7.538 -5.241 0.172 1.00 0.00 H new ATOM 0 H1' G A 3 6.123 -6.395 1.682 1.00 0.00 H new ATOM 0 H8 G A 3 4.071 -4.853 4.395 1.00 0.00 H new ATOM 0 H1 G A 3 1.212 -4.586 -1.411 1.00 0.00 H new ATOM 0 H21 G A 3 4.361 -5.470 -2.634 1.00 0.00 H new ATOM 0 H22 G A 3 2.677 -5.072 -2.990 1.00 0.00 H new ATOM 100 P G A 4 8.488 -1.353 2.703 1.00 0.00 P ATOM 101 OP1 G A 4 9.874 -0.833 2.727 1.00 0.00 O ATOM 102 OP2 G A 4 7.463 -0.736 3.574 1.00 0.00 O ATOM 103 O5' G A 4 7.938 -1.296 1.181 1.00 0.00 O ATOM 104 C5' G A 4 8.742 -1.681 0.075 1.00 0.00 C ATOM 105 C4' G A 4 7.936 -1.724 -1.231 1.00 0.00 C ATOM 106 O4' G A 4 6.824 -2.609 -1.147 1.00 0.00 O ATOM 107 C3' G A 4 7.347 -0.375 -1.663 1.00 0.00 C ATOM 108 O3' G A 4 8.324 0.505 -2.213 1.00 0.00 O ATOM 109 C2' G A 4 6.294 -0.861 -2.665 1.00 0.00 C ATOM 110 O2' G A 4 6.829 -1.214 -3.932 1.00 0.00 O ATOM 111 C1' G A 4 5.765 -2.117 -1.964 1.00 0.00 C ATOM 112 N9 G A 4 4.543 -1.831 -1.161 1.00 0.00 N ATOM 113 C8 G A 4 4.393 -1.721 0.202 1.00 0.00 C ATOM 114 N7 G A 4 3.173 -1.484 0.594 1.00 0.00 N ATOM 115 C5 G A 4 2.441 -1.428 -0.591 1.00 0.00 C ATOM 116 C6 G A 4 1.034 -1.198 -0.817 1.00 0.00 C ATOM 117 O6 G A 4 0.152 -0.995 0.012 1.00 0.00 O ATOM 118 N1 G A 4 0.680 -1.217 -2.173 1.00 0.00 N ATOM 119 C2 G A 4 1.587 -1.435 -3.197 1.00 0.00 C ATOM 120 N2 G A 4 1.105 -1.420 -4.438 1.00 0.00 N ATOM 121 N3 G A 4 2.903 -1.659 -2.994 1.00 0.00 N ATOM 122 C4 G A 4 3.277 -1.643 -1.672 1.00 0.00 C ATOM 0 H5' G A 4 9.176 -2.662 0.266 1.00 0.00 H new ATOM 0 H5'' G A 4 9.571 -0.981 -0.033 1.00 0.00 H new ATOM 0 H4' G A 4 8.677 -2.055 -1.958 1.00 0.00 H new ATOM 0 H3' G A 4 6.941 0.239 -0.859 1.00 0.00 H new ATOM 0 H2' G A 4 5.557 -0.090 -2.890 1.00 0.00 H new ATOM 0 HO2' G A 4 6.105 -1.516 -4.520 1.00 0.00 H new ATOM 0 H1' G A 4 5.464 -2.864 -2.698 1.00 0.00 H new ATOM 0 H8 G A 4 5.219 -1.823 0.891 1.00 0.00 H new ATOM 0 H1 G A 4 -0.298 -1.062 -2.419 1.00 0.00 H new ATOM 0 H21 G A 4 1.729 -1.575 -5.230 1.00 0.00 H new ATOM 0 H22 G A 4 0.111 -1.254 -4.597 1.00 0.00 H new ATOM 134 P A A 5 8.105 2.112 -2.286 1.00 0.00 P ATOM 135 OP1 A A 5 9.326 2.709 -2.872 1.00 0.00 O ATOM 136 OP2 A A 5 7.625 2.583 -0.968 1.00 0.00 O ATOM 137 O5' A A 5 6.889 2.286 -3.339 1.00 0.00 O ATOM 138 C5' A A 5 7.055 2.088 -4.736 1.00 0.00 C ATOM 139 C4' A A 5 5.707 2.162 -5.472 1.00 0.00 C ATOM 140 O4' A A 5 4.763 1.239 -4.948 1.00 0.00 O ATOM 141 C3' A A 5 5.041 3.536 -5.377 1.00 0.00 C ATOM 142 O3' A A 5 5.627 4.455 -6.294 1.00 0.00 O ATOM 143 C2' A A 5 3.582 3.183 -5.677 1.00 0.00 C ATOM 144 O2' A A 5 3.295 3.102 -7.065 1.00 0.00 O ATOM 145 C1' A A 5 3.453 1.792 -5.036 1.00 0.00 C ATOM 146 N9 A A 5 2.816 1.855 -3.689 1.00 0.00 N ATOM 147 C8 A A 5 3.383 1.705 -2.444 1.00 0.00 C ATOM 148 N7 A A 5 2.542 1.787 -1.451 1.00 0.00 N ATOM 149 C5 A A 5 1.316 2.007 -2.072 1.00 0.00 C ATOM 150 C6 A A 5 -0.016 2.186 -1.592 1.00 0.00 C ATOM 151 N6 A A 5 -0.342 2.171 -0.298 1.00 0.00 N ATOM 152 N1 A A 5 -1.020 2.393 -2.480 1.00 0.00 N ATOM 153 C2 A A 5 -0.725 2.414 -3.786 1.00 0.00 C ATOM 154 N3 A A 5 0.473 2.253 -4.364 1.00 0.00 N ATOM 155 C4 A A 5 1.474 2.051 -3.444 1.00 0.00 C ATOM 0 H5' A A 5 7.518 1.118 -4.916 1.00 0.00 H new ATOM 0 H5'' A A 5 7.732 2.843 -5.135 1.00 0.00 H new ATOM 0 H4' A A 5 5.961 1.934 -6.507 1.00 0.00 H new ATOM 0 H3' A A 5 5.154 4.048 -4.422 1.00 0.00 H new ATOM 0 H2' A A 5 2.893 3.939 -5.300 1.00 0.00 H new ATOM 0 HO2' A A 5 4.006 3.546 -7.573 1.00 0.00 H new ATOM 0 H1' A A 5 2.807 1.165 -5.650 1.00 0.00 H new ATOM 0 H8 A A 5 4.440 1.533 -2.301 1.00 0.00 H new ATOM 0 H61 A A 5 -1.313 2.305 -0.015 1.00 0.00 H new ATOM 0 H62 A A 5 0.380 2.026 0.408 1.00 0.00 H new ATOM 0 H2 A A 5 -1.555 2.581 -4.456 1.00 0.00 H new ATOM 167 P C A 6 5.912 6.000 -5.911 1.00 0.00 P ATOM 168 OP1 C A 6 6.563 6.643 -7.074 1.00 0.00 O ATOM 169 OP2 C A 6 6.584 6.022 -4.592 1.00 0.00 O ATOM 170 O5' C A 6 4.412 6.600 -5.751 1.00 0.00 O ATOM 171 C5' C A 6 3.573 6.834 -6.877 1.00 0.00 C ATOM 172 C4' C A 6 2.110 7.084 -6.477 1.00 0.00 C ATOM 173 O4' C A 6 1.597 5.994 -5.728 1.00 0.00 O ATOM 174 C3' C A 6 1.892 8.324 -5.604 1.00 0.00 C ATOM 175 O3' C A 6 1.862 9.525 -6.375 1.00 0.00 O ATOM 176 C2' C A 6 0.546 7.987 -4.950 1.00 0.00 C ATOM 177 O2' C A 6 -0.573 8.371 -5.738 1.00 0.00 O ATOM 178 C1' C A 6 0.585 6.453 -4.838 1.00 0.00 C ATOM 179 N1 C A 6 0.813 6.010 -3.420 1.00 0.00 N ATOM 180 C2 C A 6 -0.285 6.008 -2.526 1.00 0.00 C ATOM 181 O2 C A 6 -1.411 6.360 -2.879 1.00 0.00 O ATOM 182 N3 C A 6 -0.094 5.606 -1.230 1.00 0.00 N ATOM 183 C4 C A 6 1.118 5.220 -0.799 1.00 0.00 C ATOM 184 N4 C A 6 1.240 4.836 0.470 1.00 0.00 N ATOM 185 C5 C A 6 2.256 5.203 -1.685 1.00 0.00 C ATOM 186 C6 C A 6 2.063 5.607 -2.971 1.00 0.00 C ATOM 0 H5' C A 6 3.622 5.976 -7.547 1.00 0.00 H new ATOM 0 H5'' C A 6 3.947 7.694 -7.433 1.00 0.00 H new ATOM 0 H4' C A 6 1.600 7.222 -7.430 1.00 0.00 H new ATOM 0 H3' C A 6 2.687 8.521 -4.885 1.00 0.00 H new ATOM 0 H2' C A 6 0.426 8.515 -4.004 1.00 0.00 H new ATOM 0 HO2' C A 6 -0.286 9.007 -6.426 1.00 0.00 H new ATOM 0 H1' C A 6 -0.374 6.018 -5.119 1.00 0.00 H new ATOM 0 H41 C A 6 2.147 4.537 0.827 1.00 0.00 H new ATOM 0 H42 C A 6 0.426 4.841 1.085 1.00 0.00 H new ATOM 0 H5 C A 6 3.228 4.881 -1.340 1.00 0.00 H new ATOM 0 H6 C A 6 2.899 5.614 -3.655 1.00 0.00 H new ATOM 198 P A A 7 2.703 10.853 -5.979 1.00 0.00 P ATOM 199 OP1 A A 7 2.154 11.985 -6.759 1.00 0.00 O ATOM 200 OP2 A A 7 4.141 10.524 -6.082 1.00 0.00 O ATOM 201 O5' A A 7 2.372 11.109 -4.416 1.00 0.00 O ATOM 202 C5' A A 7 1.067 11.405 -3.940 1.00 0.00 C ATOM 203 C4' A A 7 0.972 11.218 -2.412 1.00 0.00 C ATOM 204 O4' A A 7 1.452 9.925 -2.055 1.00 0.00 O ATOM 205 C3' A A 7 1.781 12.246 -1.604 1.00 0.00 C ATOM 206 O3' A A 7 1.054 12.570 -0.423 1.00 0.00 O ATOM 207 C2' A A 7 3.075 11.471 -1.322 1.00 0.00 C ATOM 208 O2' A A 7 3.796 11.902 -0.182 1.00 0.00 O ATOM 209 C1' A A 7 2.557 10.036 -1.172 1.00 0.00 C ATOM 210 N9 A A 7 3.578 9.017 -1.528 1.00 0.00 N ATOM 211 C8 A A 7 4.251 8.874 -2.717 1.00 0.00 C ATOM 212 N7 A A 7 5.080 7.874 -2.753 1.00 0.00 N ATOM 213 C5 A A 7 4.960 7.292 -1.497 1.00 0.00 C ATOM 214 C6 A A 7 5.578 6.167 -0.874 1.00 0.00 C ATOM 215 N6 A A 7 6.483 5.396 -1.483 1.00 0.00 N ATOM 216 N1 A A 7 5.235 5.845 0.398 1.00 0.00 N ATOM 217 C2 A A 7 4.324 6.603 1.026 1.00 0.00 C ATOM 218 N3 A A 7 3.672 7.676 0.554 1.00 0.00 N ATOM 219 C4 A A 7 4.037 7.984 -0.734 1.00 0.00 C ATOM 0 H5' A A 7 0.342 10.758 -4.433 1.00 0.00 H new ATOM 0 H5'' A A 7 0.807 12.431 -4.200 1.00 0.00 H new ATOM 0 H4' A A 7 -0.082 11.352 -2.167 1.00 0.00 H new ATOM 0 H3' A A 7 1.976 13.199 -2.095 1.00 0.00 H new ATOM 0 H2' A A 7 3.813 11.610 -2.112 1.00 0.00 H new ATOM 0 HO2' A A 7 3.468 12.781 0.100 1.00 0.00 H new ATOM 0 H1' A A 7 2.290 9.850 -0.132 1.00 0.00 H new ATOM 0 H8 A A 7 4.103 9.539 -3.555 1.00 0.00 H new ATOM 0 H61 A A 7 6.893 4.603 -0.989 1.00 0.00 H new ATOM 0 H62 A A 7 6.764 5.600 -2.442 1.00 0.00 H new ATOM 0 H2 A A 7 4.085 6.313 2.039 1.00 0.00 H new ATOM 231 P U A 8 1.071 14.050 0.226 1.00 0.00 P ATOM 232 OP1 U A 8 0.395 14.982 -0.704 1.00 0.00 O ATOM 233 OP2 U A 8 2.449 14.333 0.684 1.00 0.00 O ATOM 234 O5' U A 8 0.142 13.839 1.529 1.00 0.00 O ATOM 235 C5' U A 8 -1.253 13.574 1.440 1.00 0.00 C ATOM 236 C4' U A 8 -1.767 12.836 2.689 1.00 0.00 C ATOM 237 O4' U A 8 -1.117 11.573 2.766 1.00 0.00 O ATOM 238 C3' U A 8 -1.510 13.583 4.016 1.00 0.00 C ATOM 239 O3' U A 8 -2.601 13.449 4.930 1.00 0.00 O ATOM 240 C2' U A 8 -0.256 12.865 4.527 1.00 0.00 C ATOM 241 O2' U A 8 -0.069 12.941 5.930 1.00 0.00 O ATOM 242 C1' U A 8 -0.477 11.438 4.024 1.00 0.00 C ATOM 243 N1 U A 8 0.814 10.679 3.952 1.00 0.00 N ATOM 244 C2 U A 8 1.157 9.823 5.023 1.00 0.00 C ATOM 245 O2 U A 8 0.447 9.644 6.012 1.00 0.00 O ATOM 246 N3 U A 8 2.381 9.156 4.928 1.00 0.00 N ATOM 247 C4 U A 8 3.283 9.265 3.871 1.00 0.00 C ATOM 248 O4 U A 8 4.330 8.624 3.887 1.00 0.00 O ATOM 249 C5 U A 8 2.860 10.171 2.809 1.00 0.00 C ATOM 250 C6 U A 8 1.673 10.837 2.872 1.00 0.00 C ATOM 0 H5' U A 8 -1.455 12.974 0.553 1.00 0.00 H new ATOM 0 H5'' U A 8 -1.796 14.512 1.321 1.00 0.00 H new ATOM 0 H4' U A 8 -2.848 12.751 2.574 1.00 0.00 H new ATOM 0 H3' U A 8 -1.395 14.661 3.899 1.00 0.00 H new ATOM 0 H2' U A 8 0.665 13.321 4.164 1.00 0.00 H new ATOM 0 HO2' U A 8 -0.939 13.035 6.371 1.00 0.00 H new ATOM 0 H1' U A 8 -1.098 10.853 4.703 1.00 0.00 H new ATOM 0 H3 U A 8 2.636 8.537 5.697 1.00 0.00 H new ATOM 0 H5 U A 8 3.502 10.317 1.953 1.00 0.00 H new ATOM 0 H6 U A 8 1.395 11.501 2.067 1.00 0.00 H new ATOM 261 P A A 9 -3.973 14.315 4.824 1.00 0.00 P ATOM 262 OP1 A A 9 -3.746 15.486 3.947 1.00 0.00 O ATOM 263 OP2 A A 9 -4.491 14.518 6.195 1.00 0.00 O ATOM 264 O5' A A 9 -4.958 13.298 4.044 1.00 0.00 O ATOM 265 C5' A A 9 -5.365 12.057 4.603 1.00 0.00 C ATOM 266 C4' A A 9 -5.715 11.076 3.476 1.00 0.00 C ATOM 267 O4' A A 9 -4.568 10.855 2.663 1.00 0.00 O ATOM 268 C3' A A 9 -6.113 9.688 3.989 1.00 0.00 C ATOM 269 O3' A A 9 -7.473 9.579 4.396 1.00 0.00 O ATOM 270 C2' A A 9 -5.784 8.829 2.766 1.00 0.00 C ATOM 271 O2' A A 9 -6.797 8.846 1.769 1.00 0.00 O ATOM 272 C1' A A 9 -4.542 9.514 2.202 1.00 0.00 C ATOM 273 N9 A A 9 -3.261 8.886 2.616 1.00 0.00 N ATOM 274 C8 A A 9 -2.884 8.359 3.831 1.00 0.00 C ATOM 275 N7 A A 9 -1.663 7.900 3.865 1.00 0.00 N ATOM 276 C5 A A 9 -1.182 8.140 2.580 1.00 0.00 C ATOM 277 C6 A A 9 0.060 7.892 1.923 1.00 0.00 C ATOM 278 N6 A A 9 1.106 7.307 2.508 1.00 0.00 N ATOM 279 N1 A A 9 0.216 8.265 0.630 1.00 0.00 N ATOM 280 C2 A A 9 -0.816 8.847 0.006 1.00 0.00 C ATOM 281 N3 A A 9 -2.028 9.128 0.499 1.00 0.00 N ATOM 282 C4 A A 9 -2.155 8.747 1.811 1.00 0.00 C ATOM 0 H5' A A 9 -6.228 12.204 5.252 1.00 0.00 H new ATOM 0 H5'' A A 9 -4.567 11.646 5.222 1.00 0.00 H new ATOM 0 H4' A A 9 -6.548 11.530 2.940 1.00 0.00 H new ATOM 0 H3' A A 9 -5.595 9.399 4.903 1.00 0.00 H new ATOM 0 H2' A A 9 -5.667 7.782 3.044 1.00 0.00 H new ATOM 0 HO2' A A 9 -7.488 8.188 1.993 1.00 0.00 H new ATOM 0 H1' A A 9 -4.576 9.431 1.116 1.00 0.00 H new ATOM 0 H8 A A 9 -3.544 8.328 4.685 1.00 0.00 H new ATOM 0 H61 A A 9 1.967 7.158 1.982 1.00 0.00 H new ATOM 0 H62 A A 9 1.045 7.008 3.481 1.00 0.00 H new ATOM 0 H2 A A 9 -0.649 9.124 -1.024 1.00 0.00 H new ATOM 294 P G A 10 -7.929 8.654 5.649 1.00 0.00 P ATOM 295 OP1 G A 10 -8.082 9.549 6.817 1.00 0.00 O ATOM 296 OP2 G A 10 -7.022 7.485 5.744 1.00 0.00 O ATOM 297 O5' G A 10 -9.420 8.153 5.219 1.00 0.00 O ATOM 298 C5' G A 10 -9.724 6.831 4.777 1.00 0.00 C ATOM 299 C4' G A 10 -9.413 6.587 3.287 1.00 0.00 C ATOM 300 O4' G A 10 -8.015 6.678 3.059 1.00 0.00 O ATOM 301 C3' G A 10 -9.828 5.180 2.818 1.00 0.00 C ATOM 302 O3' G A 10 -10.374 5.286 1.502 1.00 0.00 O ATOM 303 C2' G A 10 -8.473 4.452 2.837 1.00 0.00 C ATOM 304 O2' G A 10 -8.431 3.264 2.073 1.00 0.00 O ATOM 305 C1' G A 10 -7.563 5.566 2.310 1.00 0.00 C ATOM 306 N9 G A 10 -6.104 5.360 2.517 1.00 0.00 N ATOM 307 C8 G A 10 -5.440 4.962 3.651 1.00 0.00 C ATOM 308 N7 G A 10 -4.147 4.859 3.515 1.00 0.00 N ATOM 309 C5 G A 10 -3.914 5.224 2.191 1.00 0.00 C ATOM 310 C6 G A 10 -2.681 5.314 1.443 1.00 0.00 C ATOM 311 O6 G A 10 -1.536 5.070 1.821 1.00 0.00 O ATOM 312 N1 G A 10 -2.866 5.741 0.121 1.00 0.00 N ATOM 313 C2 G A 10 -4.107 6.045 -0.417 1.00 0.00 C ATOM 314 N2 G A 10 -4.131 6.428 -1.691 1.00 0.00 N ATOM 315 N3 G A 10 -5.265 5.956 0.274 1.00 0.00 N ATOM 316 C4 G A 10 -5.113 5.535 1.573 1.00 0.00 C ATOM 0 H5' G A 10 -10.781 6.632 4.955 1.00 0.00 H new ATOM 0 H5'' G A 10 -9.160 6.118 5.378 1.00 0.00 H new ATOM 0 H4' G A 10 -9.975 7.343 2.739 1.00 0.00 H new ATOM 0 H3' G A 10 -10.586 4.672 3.414 1.00 0.00 H new ATOM 0 H2' G A 10 -8.193 4.060 3.815 1.00 0.00 H new ATOM 0 HO2' G A 10 -7.583 3.219 1.584 1.00 0.00 H new ATOM 0 H1' G A 10 -7.635 5.651 1.226 1.00 0.00 H new ATOM 0 H8 G A 10 -5.948 4.751 4.581 1.00 0.00 H new ATOM 0 H1 G A 10 -2.045 5.833 -0.477 1.00 0.00 H new ATOM 0 H21 G A 10 -5.018 6.663 -2.136 1.00 0.00 H new ATOM 0 H22 G A 10 -3.262 6.486 -2.222 1.00 0.00 H new ATOM 328 P U A 11 -11.459 4.252 0.891 1.00 0.00 P ATOM 329 OP1 U A 11 -12.769 4.939 0.859 1.00 0.00 O ATOM 330 OP2 U A 11 -11.330 2.943 1.577 1.00 0.00 O ATOM 331 O5' U A 11 -10.913 4.134 -0.632 1.00 0.00 O ATOM 332 C5' U A 11 -10.241 2.983 -1.125 1.00 0.00 C ATOM 333 C4' U A 11 -9.446 3.320 -2.396 1.00 0.00 C ATOM 334 O4' U A 11 -8.380 4.232 -2.126 1.00 0.00 O ATOM 335 C3' U A 11 -8.784 2.079 -3.009 1.00 0.00 C ATOM 336 O3' U A 11 -9.673 1.324 -3.826 1.00 0.00 O ATOM 337 C2' U A 11 -7.619 2.716 -3.771 1.00 0.00 C ATOM 338 O2' U A 11 -8.002 3.301 -5.008 1.00 0.00 O ATOM 339 C1' U A 11 -7.185 3.809 -2.789 1.00 0.00 C ATOM 340 N1 U A 11 -6.122 3.323 -1.840 1.00 0.00 N ATOM 341 C2 U A 11 -4.790 3.231 -2.306 1.00 0.00 C ATOM 342 O2 U A 11 -4.447 3.507 -3.456 1.00 0.00 O ATOM 343 N3 U A 11 -3.831 2.797 -1.389 1.00 0.00 N ATOM 344 C4 U A 11 -4.076 2.444 -0.063 1.00 0.00 C ATOM 345 O4 U A 11 -3.156 2.077 0.660 1.00 0.00 O ATOM 346 C5 U A 11 -5.468 2.559 0.341 1.00 0.00 C ATOM 347 C6 U A 11 -6.425 2.987 -0.528 1.00 0.00 C ATOM 0 H5' U A 11 -10.965 2.198 -1.341 1.00 0.00 H new ATOM 0 H5'' U A 11 -9.567 2.594 -0.361 1.00 0.00 H new ATOM 0 H4' U A 11 -10.177 3.752 -3.079 1.00 0.00 H new ATOM 0 H3' U A 11 -8.466 1.330 -2.284 1.00 0.00 H new ATOM 0 H2' U A 11 -6.854 1.990 -4.046 1.00 0.00 H new ATOM 0 HO2' U A 11 -8.859 2.924 -5.297 1.00 0.00 H new ATOM 0 H1' U A 11 -6.717 4.649 -3.303 1.00 0.00 H new ATOM 0 H3 U A 11 -2.868 2.733 -1.718 1.00 0.00 H new ATOM 0 H5 U A 11 -5.749 2.300 1.351 1.00 0.00 H new ATOM 0 H6 U A 11 -7.447 3.067 -0.187 1.00 0.00 H new ATOM 358 P C A 12 -9.494 -0.272 -4.052 1.00 0.00 P ATOM 359 OP1 C A 12 -10.551 -0.721 -4.986 1.00 0.00 O ATOM 360 OP2 C A 12 -9.373 -0.914 -2.724 1.00 0.00 O ATOM 361 O5' C A 12 -8.058 -0.399 -4.793 1.00 0.00 O ATOM 362 C5' C A 12 -7.860 -0.017 -6.147 1.00 0.00 C ATOM 363 C4' C A 12 -6.374 -0.064 -6.537 1.00 0.00 C ATOM 364 O4' C A 12 -5.576 0.767 -5.702 1.00 0.00 O ATOM 365 C3' C A 12 -5.749 -1.459 -6.442 1.00 0.00 C ATOM 366 O3' C A 12 -6.101 -2.292 -7.544 1.00 0.00 O ATOM 367 C2' C A 12 -4.265 -1.088 -6.382 1.00 0.00 C ATOM 368 O2' C A 12 -3.700 -0.792 -7.651 1.00 0.00 O ATOM 369 C1' C A 12 -4.286 0.185 -5.519 1.00 0.00 C ATOM 370 N1 C A 12 -3.964 -0.121 -4.080 1.00 0.00 N ATOM 371 C2 C A 12 -2.629 -0.460 -3.741 1.00 0.00 C ATOM 372 O2 C A 12 -1.736 -0.517 -4.586 1.00 0.00 O ATOM 373 N3 C A 12 -2.320 -0.738 -2.437 1.00 0.00 N ATOM 374 C4 C A 12 -3.258 -0.694 -1.477 1.00 0.00 C ATOM 375 N4 C A 12 -2.888 -0.973 -0.229 1.00 0.00 N ATOM 376 C5 C A 12 -4.628 -0.360 -1.785 1.00 0.00 C ATOM 377 C6 C A 12 -4.931 -0.082 -3.084 1.00 0.00 C ATOM 0 H5' C A 12 -8.245 0.991 -6.301 1.00 0.00 H new ATOM 0 H5'' C A 12 -8.429 -0.679 -6.799 1.00 0.00 H new ATOM 0 H4' C A 12 -6.376 0.276 -7.573 1.00 0.00 H new ATOM 0 H3' C A 12 -6.083 -2.062 -5.598 1.00 0.00 H new ATOM 0 H2' C A 12 -3.660 -1.909 -5.998 1.00 0.00 H new ATOM 0 HO2' C A 12 -4.269 -1.164 -8.357 1.00 0.00 H new ATOM 0 H1' C A 12 -3.516 0.894 -5.822 1.00 0.00 H new ATOM 0 H41 C A 12 -3.575 -0.949 0.524 1.00 0.00 H new ATOM 0 H42 C A 12 -1.917 -1.211 -0.026 1.00 0.00 H new ATOM 0 H5 C A 12 -5.385 -0.332 -1.015 1.00 0.00 H new ATOM 0 H6 C A 12 -5.947 0.175 -3.345 1.00 0.00 H new ATOM 389 P U A 13 -6.128 -3.909 -7.437 1.00 0.00 P ATOM 390 OP1 U A 13 -6.505 -4.447 -8.764 1.00 0.00 O ATOM 391 OP2 U A 13 -6.922 -4.282 -6.247 1.00 0.00 O ATOM 392 O5' U A 13 -4.585 -4.301 -7.139 1.00 0.00 O ATOM 393 C5' U A 13 -3.569 -4.231 -8.130 1.00 0.00 C ATOM 394 C4' U A 13 -2.175 -4.451 -7.519 1.00 0.00 C ATOM 395 O4' U A 13 -1.894 -3.508 -6.491 1.00 0.00 O ATOM 396 C3' U A 13 -1.990 -5.825 -6.867 1.00 0.00 C ATOM 397 O3' U A 13 -1.795 -6.857 -7.829 1.00 0.00 O ATOM 398 C2' U A 13 -0.784 -5.544 -5.963 1.00 0.00 C ATOM 399 O2' U A 13 0.462 -5.589 -6.640 1.00 0.00 O ATOM 400 C1' U A 13 -1.071 -4.108 -5.493 1.00 0.00 C ATOM 401 N1 U A 13 -1.693 -4.102 -4.123 1.00 0.00 N ATOM 402 C2 U A 13 -0.837 -4.237 -3.007 1.00 0.00 C ATOM 403 O2 U A 13 0.383 -4.369 -3.104 1.00 0.00 O ATOM 404 N3 U A 13 -1.434 -4.231 -1.743 1.00 0.00 N ATOM 405 C4 U A 13 -2.802 -4.119 -1.498 1.00 0.00 C ATOM 406 O4 U A 13 -3.225 -4.133 -0.346 1.00 0.00 O ATOM 407 C5 U A 13 -3.620 -3.989 -2.698 1.00 0.00 C ATOM 408 C6 U A 13 -3.065 -3.985 -3.942 1.00 0.00 C ATOM 0 H5' U A 13 -3.604 -3.258 -8.621 1.00 0.00 H new ATOM 0 H5'' U A 13 -3.755 -4.982 -8.898 1.00 0.00 H new ATOM 0 H4' U A 13 -1.506 -4.347 -8.373 1.00 0.00 H new ATOM 0 H3' U A 13 -2.851 -6.206 -6.318 1.00 0.00 H new ATOM 0 H2' U A 13 -0.686 -6.289 -5.174 1.00 0.00 H new ATOM 0 HO2' U A 13 0.991 -6.341 -6.302 1.00 0.00 H new ATOM 0 H1' U A 13 -0.155 -3.528 -5.385 1.00 0.00 H new ATOM 0 H3 U A 13 -0.819 -4.315 -0.934 1.00 0.00 H new ATOM 0 H5 U A 13 -4.691 -3.894 -2.598 1.00 0.00 H new ATOM 0 H6 U A 13 -3.706 -3.889 -4.806 1.00 0.00 H new ATOM 419 P U A 14 -2.041 -8.424 -7.489 1.00 0.00 P ATOM 420 OP1 U A 14 -1.955 -9.184 -8.755 1.00 0.00 O ATOM 421 OP2 U A 14 -3.253 -8.542 -6.647 1.00 0.00 O ATOM 422 O5' U A 14 -0.768 -8.804 -6.565 1.00 0.00 O ATOM 423 C5' U A 14 0.535 -8.993 -7.099 1.00 0.00 C ATOM 424 C4' U A 14 1.570 -9.210 -5.982 1.00 0.00 C ATOM 425 O4' U A 14 1.631 -8.100 -5.096 1.00 0.00 O ATOM 426 C3' U A 14 1.283 -10.420 -5.086 1.00 0.00 C ATOM 427 O3' U A 14 1.606 -11.654 -5.722 1.00 0.00 O ATOM 428 C2' U A 14 2.154 -10.075 -3.872 1.00 0.00 C ATOM 429 O2' U A 14 3.528 -10.386 -4.052 1.00 0.00 O ATOM 430 C1' U A 14 1.979 -8.552 -3.786 1.00 0.00 C ATOM 431 N1 U A 14 0.951 -8.175 -2.759 1.00 0.00 N ATOM 432 C2 U A 14 1.372 -8.005 -1.421 1.00 0.00 C ATOM 433 O2 U A 14 2.531 -8.166 -1.042 1.00 0.00 O ATOM 434 N3 U A 14 0.395 -7.633 -0.498 1.00 0.00 N ATOM 435 C4 U A 14 -0.953 -7.427 -0.778 1.00 0.00 C ATOM 436 O4 U A 14 -1.725 -7.099 0.117 1.00 0.00 O ATOM 437 C5 U A 14 -1.314 -7.637 -2.175 1.00 0.00 C ATOM 438 C6 U A 14 -0.383 -7.998 -3.100 1.00 0.00 C ATOM 0 H5' U A 14 0.816 -8.124 -7.694 1.00 0.00 H new ATOM 0 H5'' U A 14 0.535 -9.852 -7.769 1.00 0.00 H new ATOM 0 H4' U A 14 2.500 -9.361 -6.530 1.00 0.00 H new ATOM 0 H3' U A 14 0.235 -10.579 -4.831 1.00 0.00 H new ATOM 0 H2' U A 14 1.861 -10.638 -2.986 1.00 0.00 H new ATOM 0 HO2' U A 14 3.806 -11.042 -3.379 1.00 0.00 H new ATOM 0 H1' U A 14 2.901 -8.071 -3.459 1.00 0.00 H new ATOM 0 H3 U A 14 0.695 -7.500 0.468 1.00 0.00 H new ATOM 0 H5 U A 14 -2.341 -7.503 -2.482 1.00 0.00 H new ATOM 0 H6 U A 14 -0.690 -8.150 -4.124 1.00 0.00 H new ATOM 449 P C A 15 0.930 -13.062 -5.286 1.00 0.00 P ATOM 450 OP1 C A 15 1.426 -14.112 -6.204 1.00 0.00 O ATOM 451 OP2 C A 15 -0.528 -12.856 -5.131 1.00 0.00 O ATOM 452 O5' C A 15 1.545 -13.331 -3.814 1.00 0.00 O ATOM 453 C5' C A 15 2.894 -13.728 -3.609 1.00 0.00 C ATOM 454 C4' C A 15 3.271 -13.675 -2.119 1.00 0.00 C ATOM 455 O4' C A 15 3.065 -12.377 -1.582 1.00 0.00 O ATOM 456 C3' C A 15 2.450 -14.610 -1.223 1.00 0.00 C ATOM 457 O3' C A 15 2.847 -15.967 -1.318 1.00 0.00 O ATOM 458 C2' C A 15 2.675 -13.972 0.154 1.00 0.00 C ATOM 459 O2' C A 15 3.885 -14.370 0.784 1.00 0.00 O ATOM 460 C1' C A 15 2.744 -12.472 -0.196 1.00 0.00 C ATOM 461 N1 C A 15 1.452 -11.785 0.145 1.00 0.00 N ATOM 462 C2 C A 15 1.270 -11.298 1.462 1.00 0.00 C ATOM 463 O2 C A 15 2.142 -11.413 2.324 1.00 0.00 O ATOM 464 N3 C A 15 0.086 -10.695 1.793 1.00 0.00 N ATOM 465 C4 C A 15 -0.898 -10.554 0.890 1.00 0.00 C ATOM 466 N4 C A 15 -2.022 -9.958 1.279 1.00 0.00 N ATOM 467 C5 C A 15 -0.748 -11.039 -0.462 1.00 0.00 C ATOM 468 C6 C A 15 0.429 -11.646 -0.784 1.00 0.00 C ATOM 0 H5' C A 15 3.558 -13.077 -4.178 1.00 0.00 H new ATOM 0 H5'' C A 15 3.039 -14.740 -3.987 1.00 0.00 H new ATOM 0 H4' C A 15 4.317 -13.980 -2.112 1.00 0.00 H new ATOM 0 H3' C A 15 1.396 -14.684 -1.492 1.00 0.00 H new ATOM 0 H2' C A 15 1.897 -14.259 0.861 1.00 0.00 H new ATOM 0 HO2' C A 15 4.227 -15.181 0.353 1.00 0.00 H new ATOM 0 HO3' C A 15 2.290 -16.513 -0.724 1.00 0.00 H new ATOM 0 H1' C A 15 3.511 -11.965 0.389 1.00 0.00 H new ATOM 0 H41 C A 15 -2.789 -9.835 0.618 1.00 0.00 H new ATOM 0 H42 C A 15 -2.117 -9.624 2.238 1.00 0.00 H new ATOM 0 H5 C A 15 -1.538 -10.925 -1.190 1.00 0.00 H new ATOM 0 H6 C A 15 0.569 -12.028 -1.785 1.00 0.00 H new TER 481 C A 15