USER MOD reduce.3.24.130724 H: found=0, std=0, add=260, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 260 hydrogens (20 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 -18:sc= 0.0727 USER MOD Single : A 1 G O5' : rot 33:sc= -1.1! USER MOD Single : A 2 C O2' : rot 180:sc= 0 USER MOD Single : A 3 G O2' : rot 180:sc= -2.86! USER MOD Single : A 4 G O2' : rot 180:sc= -0.319 USER MOD Single : A 5 U O2' : rot 180:sc= -0.115 USER MOD Single : A 6 G O2' : rot 180:sc= -2.79! USER MOD Single : A 7 U O2' : rot -118:sc= 0.632 USER MOD Single : A 8 A O2' : rot 180:sc= -3.16! USER MOD Single : A 9 A O2' : rot -125:sc= -0.49 USER MOD Single : A 10 A O2' : rot -24:sc= 0.0788 USER MOD Single : A 11 A O2' : rot 180:sc= -1.35 USER MOD Single : A 12 G O2' : rot -16:sc= 0.115 USER MOD Single : A 12 G O3' : rot 180:sc= 0.134 USER MOD Single : B 1 C O2' : rot -18:sc= -1.16 USER MOD Single : B 1 C O5' : rot 28:sc= 0.661 USER MOD Single : B 2 U O2' : rot -150:sc= -3.23! USER MOD Single : B 3 SUR O2' : rot -119:sc= 0.332 USER MOD Single : B 4 U O2' : rot 180:sc= -1.31 USER MOD Single : B 5 U O2' : rot -133:sc= 0.479 USER MOD Single : B 6 A O2' : rot -28:sc= 0.12 USER MOD Single : B 7 A O2' : rot 180:sc= -0.0559 USER MOD Single : B 8 PSU O2' : rot -127:sc= -1.68! USER MOD Single : B 9 C O2' : rot 180:sc= -1.46 USER MOD Single : B 10 U O2' : rot -134:sc= -0.725 USER MOD Single : B 11 G O2' : rot 180:sc= 0 USER MOD Single : B 12 C O2' : rot -17:sc= 0.0983 USER MOD Single : B 12 C O3' : rot 180:sc= 0.12 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -12.759 10.741 3.269 1.00 0.00 O ATOM 2 C5' G A 1 -13.743 9.743 3.557 1.00 0.00 C ATOM 3 C4' G A 1 -14.163 9.014 2.300 1.00 0.00 C ATOM 4 O4' G A 1 -14.463 9.993 1.266 1.00 0.00 O ATOM 5 C3' G A 1 -13.103 8.111 1.684 1.00 0.00 C ATOM 6 O3' G A 1 -13.127 6.807 2.259 1.00 0.00 O ATOM 7 C2' G A 1 -13.491 8.109 0.210 1.00 0.00 C ATOM 8 O2' G A 1 -14.596 7.260 -0.036 1.00 0.00 O ATOM 9 C1' G A 1 -13.938 9.557 0.025 1.00 0.00 C ATOM 10 N9 G A 1 -12.857 10.460 -0.359 1.00 0.00 N ATOM 11 C8 G A 1 -11.937 11.051 0.472 1.00 0.00 C ATOM 12 N7 G A 1 -11.086 11.812 -0.160 1.00 0.00 N ATOM 13 C5 G A 1 -11.468 11.719 -1.491 1.00 0.00 C ATOM 14 C6 G A 1 -10.919 12.328 -2.650 1.00 0.00 C ATOM 15 O6 G A 1 -9.951 13.094 -2.734 1.00 0.00 O ATOM 16 N1 G A 1 -11.617 11.966 -3.796 1.00 0.00 N ATOM 17 C2 G A 1 -12.699 11.123 -3.827 1.00 0.00 C ATOM 18 N2 G A 1 -13.235 10.894 -5.032 1.00 0.00 N ATOM 19 N3 G A 1 -13.219 10.547 -2.758 1.00 0.00 N ATOM 20 C4 G A 1 -12.559 10.888 -1.631 1.00 0.00 C ATOM 0 H5' G A 1 -14.613 10.209 4.019 1.00 0.00 H new ATOM 0 H5'' G A 1 -13.342 9.030 4.278 1.00 0.00 H new ATOM 0 H4' G A 1 -15.006 8.397 2.612 1.00 0.00 H new ATOM 0 H3' G A 1 -12.081 8.452 1.852 1.00 0.00 H new ATOM 0 H2' G A 1 -12.691 7.767 -0.447 1.00 0.00 H new ATOM 0 HO2' G A 1 -14.701 6.635 0.711 1.00 0.00 H new ATOM 0 HO5' G A 1 -12.926 11.118 2.380 1.00 0.00 H new ATOM 0 H1' G A 1 -14.668 9.581 -0.784 1.00 0.00 H new ATOM 0 H8 G A 1 -11.920 10.901 1.541 1.00 0.00 H new ATOM 0 H1 G A 1 -11.300 12.358 -4.683 1.00 0.00 H new ATOM 0 H21 G A 1 -14.042 10.276 -5.122 1.00 0.00 H new ATOM 0 H22 G A 1 -12.837 11.337 -5.860 1.00 0.00 H new ATOM 33 P C A 2 -11.839 5.852 2.129 1.00 0.00 P ATOM 34 OP1 C A 2 -12.186 4.550 2.754 1.00 0.00 O ATOM 35 OP2 C A 2 -10.652 6.604 2.611 1.00 0.00 O ATOM 36 O5' C A 2 -11.679 5.631 0.559 1.00 0.00 O ATOM 37 C5' C A 2 -12.482 4.679 -0.138 1.00 0.00 C ATOM 38 C4' C A 2 -12.280 4.817 -1.630 1.00 0.00 C ATOM 39 O4' C A 2 -12.395 6.219 -1.989 1.00 0.00 O ATOM 40 C3' C A 2 -10.910 4.395 -2.146 1.00 0.00 C ATOM 41 O3' C A 2 -10.879 2.999 -2.433 1.00 0.00 O ATOM 42 C2' C A 2 -10.734 5.249 -3.398 1.00 0.00 C ATOM 43 O2' C A 2 -11.399 4.681 -4.511 1.00 0.00 O ATOM 44 C1' C A 2 -11.460 6.535 -3.004 1.00 0.00 C ATOM 45 N1 C A 2 -10.565 7.590 -2.499 1.00 0.00 N ATOM 46 C2 C A 2 -9.917 8.418 -3.418 1.00 0.00 C ATOM 47 O2 C A 2 -10.102 8.230 -4.629 1.00 0.00 O ATOM 48 N3 C A 2 -9.109 9.404 -2.966 1.00 0.00 N ATOM 49 C4 C A 2 -8.942 9.577 -1.653 1.00 0.00 C ATOM 50 N4 C A 2 -8.149 10.570 -1.251 1.00 0.00 N ATOM 51 C5 C A 2 -9.583 8.742 -0.693 1.00 0.00 C ATOM 52 C6 C A 2 -10.374 7.766 -1.157 1.00 0.00 C ATOM 0 H5' C A 2 -13.533 4.829 0.109 1.00 0.00 H new ATOM 0 H5'' C A 2 -12.220 3.670 0.180 1.00 0.00 H new ATOM 0 H4' C A 2 -13.032 4.162 -2.069 1.00 0.00 H new ATOM 0 H3' C A 2 -10.106 4.545 -1.425 1.00 0.00 H new ATOM 0 H2' C A 2 -9.689 5.367 -3.686 1.00 0.00 H new ATOM 0 HO2' C A 2 -11.268 5.252 -5.297 1.00 0.00 H new ATOM 0 H1' C A 2 -11.934 6.926 -3.904 1.00 0.00 H new ATOM 0 H41 C A 2 -7.999 10.731 -0.255 1.00 0.00 H new ATOM 0 H42 C A 2 -7.693 11.169 -1.939 1.00 0.00 H new ATOM 0 H5 C A 2 -9.437 8.890 0.367 1.00 0.00 H new ATOM 0 H6 C A 2 -10.869 7.107 -0.459 1.00 0.00 H new ATOM 64 P G A 3 -9.473 2.270 -2.716 1.00 0.00 P ATOM 65 OP1 G A 3 -9.732 0.813 -2.844 1.00 0.00 O ATOM 66 OP2 G A 3 -8.500 2.756 -1.706 1.00 0.00 O ATOM 67 O5' G A 3 -9.029 2.827 -4.142 1.00 0.00 O ATOM 68 C5' G A 3 -9.533 2.249 -5.345 1.00 0.00 C ATOM 69 C4' G A 3 -8.846 2.857 -6.546 1.00 0.00 C ATOM 70 O4' G A 3 -8.997 4.301 -6.501 1.00 0.00 O ATOM 71 C3' G A 3 -7.341 2.648 -6.619 1.00 0.00 C ATOM 72 O3' G A 3 -7.014 1.378 -7.177 1.00 0.00 O ATOM 73 C2' G A 3 -6.891 3.810 -7.498 1.00 0.00 C ATOM 74 O2' G A 3 -7.133 3.553 -8.868 1.00 0.00 O ATOM 75 C1' G A 3 -7.839 4.917 -7.038 1.00 0.00 C ATOM 76 N9 G A 3 -7.261 5.785 -6.017 1.00 0.00 N ATOM 77 C8 G A 3 -7.442 5.702 -4.659 1.00 0.00 C ATOM 78 N7 G A 3 -6.808 6.629 -3.996 1.00 0.00 N ATOM 79 C5 G A 3 -6.158 7.365 -4.977 1.00 0.00 C ATOM 80 C6 G A 3 -5.309 8.495 -4.865 1.00 0.00 C ATOM 81 O6 G A 3 -4.956 9.093 -3.843 1.00 0.00 O ATOM 82 N1 G A 3 -4.861 8.925 -6.110 1.00 0.00 N ATOM 83 C2 G A 3 -5.188 8.342 -7.308 1.00 0.00 C ATOM 84 N2 G A 3 -4.656 8.901 -8.400 1.00 0.00 N ATOM 85 N3 G A 3 -5.978 7.288 -7.428 1.00 0.00 N ATOM 86 C4 G A 3 -6.424 6.855 -6.230 1.00 0.00 C ATOM 0 H5' G A 3 -10.609 2.411 -5.412 1.00 0.00 H new ATOM 0 H5'' G A 3 -9.374 1.171 -5.333 1.00 0.00 H new ATOM 0 H4' G A 3 -9.316 2.361 -7.395 1.00 0.00 H new ATOM 0 H3' G A 3 -6.849 2.639 -5.646 1.00 0.00 H new ATOM 0 H2' G A 3 -5.826 4.025 -7.409 1.00 0.00 H new ATOM 0 HO2' G A 3 -6.834 4.318 -9.402 1.00 0.00 H new ATOM 0 H1' G A 3 -8.060 5.544 -7.902 1.00 0.00 H new ATOM 0 H8 G A 3 -8.049 4.944 -4.186 1.00 0.00 H new ATOM 0 H1 G A 3 -4.242 9.736 -6.134 1.00 0.00 H new ATOM 0 H21 G A 3 -4.860 8.515 -9.322 1.00 0.00 H new ATOM 0 H22 G A 3 -4.046 9.714 -8.311 1.00 0.00 H new ATOM 98 P G A 4 -5.526 0.789 -7.008 1.00 0.00 P ATOM 99 OP1 G A 4 -5.564 -0.632 -7.439 1.00 0.00 O ATOM 100 OP2 G A 4 -5.033 1.131 -5.649 1.00 0.00 O ATOM 101 O5' G A 4 -4.666 1.605 -8.073 1.00 0.00 O ATOM 102 C5' G A 4 -5.026 1.617 -9.454 1.00 0.00 C ATOM 103 C4' G A 4 -3.974 2.341 -10.262 1.00 0.00 C ATOM 104 O4' G A 4 -4.092 3.770 -10.013 1.00 0.00 O ATOM 105 C3' G A 4 -2.534 1.988 -9.911 1.00 0.00 C ATOM 106 O3' G A 4 -2.065 0.901 -10.703 1.00 0.00 O ATOM 107 C2' G A 4 -1.787 3.285 -10.199 1.00 0.00 C ATOM 108 O2' G A 4 -1.555 3.445 -11.586 1.00 0.00 O ATOM 109 C1' G A 4 -2.815 4.320 -9.753 1.00 0.00 C ATOM 110 N9 G A 4 -2.750 4.665 -8.335 1.00 0.00 N ATOM 111 C8 G A 4 -3.455 4.080 -7.314 1.00 0.00 C ATOM 112 N7 G A 4 -3.224 4.620 -6.150 1.00 0.00 N ATOM 113 C5 G A 4 -2.296 5.618 -6.415 1.00 0.00 C ATOM 114 C6 G A 4 -1.665 6.540 -5.542 1.00 0.00 C ATOM 115 O6 G A 4 -1.804 6.663 -4.321 1.00 0.00 O ATOM 116 N1 G A 4 -0.791 7.376 -6.227 1.00 0.00 N ATOM 117 C2 G A 4 -0.547 7.327 -7.576 1.00 0.00 C ATOM 118 N2 G A 4 0.337 8.214 -8.047 1.00 0.00 N ATOM 119 N3 G A 4 -1.125 6.470 -8.402 1.00 0.00 N ATOM 120 C4 G A 4 -1.984 5.652 -7.759 1.00 0.00 C ATOM 0 H5' G A 4 -5.992 2.105 -9.581 1.00 0.00 H new ATOM 0 H5'' G A 4 -5.135 0.595 -9.818 1.00 0.00 H new ATOM 0 H4' G A 4 -4.159 2.042 -11.294 1.00 0.00 H new ATOM 0 H3' G A 4 -2.401 1.651 -8.883 1.00 0.00 H new ATOM 0 H2' G A 4 -0.813 3.343 -9.713 1.00 0.00 H new ATOM 0 HO2' G A 4 -1.076 4.285 -11.743 1.00 0.00 H new ATOM 0 H1' G A 4 -2.611 5.240 -10.300 1.00 0.00 H new ATOM 0 H8 G A 4 -4.135 3.253 -7.460 1.00 0.00 H new ATOM 0 H1 G A 4 -0.292 8.081 -5.684 1.00 0.00 H new ATOM 0 H21 G A 4 0.563 8.230 -9.042 1.00 0.00 H new ATOM 0 H22 G A 4 0.785 8.874 -7.411 1.00 0.00 H new ATOM 132 P U A 5 -1.041 -0.167 -10.073 1.00 0.00 P ATOM 133 OP1 U A 5 -0.973 -1.336 -10.986 1.00 0.00 O ATOM 134 OP2 U A 5 -1.413 -0.369 -8.650 1.00 0.00 O ATOM 135 O5' U A 5 0.365 0.583 -10.115 1.00 0.00 O ATOM 136 C5' U A 5 0.854 1.152 -11.327 1.00 0.00 C ATOM 137 C4' U A 5 2.021 2.067 -11.040 1.00 0.00 C ATOM 138 O4' U A 5 1.522 3.307 -10.470 1.00 0.00 O ATOM 139 C3' U A 5 3.018 1.553 -10.011 1.00 0.00 C ATOM 140 O3' U A 5 3.987 0.696 -10.606 1.00 0.00 O ATOM 141 C2' U A 5 3.627 2.841 -9.475 1.00 0.00 C ATOM 142 O2' U A 5 4.579 3.371 -10.379 1.00 0.00 O ATOM 143 C1' U A 5 2.405 3.759 -9.458 1.00 0.00 C ATOM 144 N1 U A 5 1.683 3.761 -8.177 1.00 0.00 N ATOM 145 C2 U A 5 2.013 4.736 -7.255 1.00 0.00 C ATOM 146 O2 U A 5 2.868 5.579 -7.460 1.00 0.00 O ATOM 147 N3 U A 5 1.303 4.691 -6.083 1.00 0.00 N ATOM 148 C4 U A 5 0.316 3.792 -5.745 1.00 0.00 C ATOM 149 O4 U A 5 -0.237 3.885 -4.650 1.00 0.00 O ATOM 150 C5 U A 5 0.033 2.815 -6.749 1.00 0.00 C ATOM 151 C6 U A 5 0.709 2.826 -7.902 1.00 0.00 C ATOM 0 H5' U A 5 0.059 1.709 -11.822 1.00 0.00 H new ATOM 0 H5'' U A 5 1.162 0.361 -12.010 1.00 0.00 H new ATOM 0 H4' U A 5 2.526 2.166 -12.001 1.00 0.00 H new ATOM 0 H3' U A 5 2.569 0.940 -9.229 1.00 0.00 H new ATOM 0 H2' U A 5 4.140 2.716 -8.522 1.00 0.00 H new ATOM 0 HO2' U A 5 4.954 4.198 -10.011 1.00 0.00 H new ATOM 0 H1' U A 5 2.754 4.779 -9.620 1.00 0.00 H new ATOM 0 H3 U A 5 1.530 5.400 -5.386 1.00 0.00 H new ATOM 0 H5 U A 5 -0.727 2.068 -6.576 1.00 0.00 H new ATOM 0 H6 U A 5 0.484 2.075 -8.645 1.00 0.00 H new ATOM 162 P G A 6 4.655 -0.478 -9.734 1.00 0.00 P ATOM 163 OP1 G A 6 5.612 -1.191 -10.618 1.00 0.00 O ATOM 164 OP2 G A 6 3.570 -1.239 -9.063 1.00 0.00 O ATOM 165 O5' G A 6 5.488 0.299 -8.620 1.00 0.00 O ATOM 166 C5' G A 6 6.584 1.138 -8.978 1.00 0.00 C ATOM 167 C4' G A 6 6.930 2.064 -7.834 1.00 0.00 C ATOM 168 O4' G A 6 5.764 2.852 -7.481 1.00 0.00 O ATOM 169 C3' G A 6 7.313 1.387 -6.528 1.00 0.00 C ATOM 170 O3' G A 6 8.676 0.975 -6.534 1.00 0.00 O ATOM 171 C2' G A 6 7.039 2.481 -5.503 1.00 0.00 C ATOM 172 O2' G A 6 8.088 3.430 -5.479 1.00 0.00 O ATOM 173 C1' G A 6 5.794 3.145 -6.095 1.00 0.00 C ATOM 174 N9 G A 6 4.545 2.683 -5.498 1.00 0.00 N ATOM 175 C8 G A 6 3.640 1.801 -6.035 1.00 0.00 C ATOM 176 N7 G A 6 2.610 1.585 -5.264 1.00 0.00 N ATOM 177 C5 G A 6 2.851 2.372 -4.145 1.00 0.00 C ATOM 178 C6 G A 6 2.084 2.552 -2.964 1.00 0.00 C ATOM 179 O6 G A 6 1.002 2.037 -2.660 1.00 0.00 O ATOM 180 N1 G A 6 2.700 3.438 -2.086 1.00 0.00 N ATOM 181 C2 G A 6 3.896 4.071 -2.315 1.00 0.00 C ATOM 182 N2 G A 6 4.324 4.895 -1.354 1.00 0.00 N ATOM 183 N3 G A 6 4.621 3.910 -3.408 1.00 0.00 N ATOM 184 C4 G A 6 4.042 3.054 -4.274 1.00 0.00 C ATOM 0 H5' G A 6 6.331 1.721 -9.863 1.00 0.00 H new ATOM 0 H5'' G A 6 7.449 0.527 -9.235 1.00 0.00 H new ATOM 0 H4' G A 6 7.783 2.627 -8.212 1.00 0.00 H new ATOM 0 H3' G A 6 6.761 0.469 -6.328 1.00 0.00 H new ATOM 0 H2' G A 6 6.934 2.104 -4.486 1.00 0.00 H new ATOM 0 HO2' G A 6 7.888 4.122 -4.815 1.00 0.00 H new ATOM 0 H1' G A 6 5.865 4.214 -5.892 1.00 0.00 H new ATOM 0 H8 G A 6 3.768 1.333 -7.000 1.00 0.00 H new ATOM 0 H1 G A 6 2.226 3.632 -1.204 1.00 0.00 H new ATOM 0 H21 G A 6 5.206 5.394 -1.466 1.00 0.00 H new ATOM 0 H22 G A 6 3.768 5.024 -0.508 1.00 0.00 H new ATOM 196 P U A 7 9.170 -0.161 -5.508 1.00 0.00 P ATOM 197 OP1 U A 7 10.641 -0.285 -5.662 1.00 0.00 O ATOM 198 OP2 U A 7 8.311 -1.359 -5.685 1.00 0.00 O ATOM 199 O5' U A 7 8.874 0.463 -4.072 1.00 0.00 O ATOM 200 C5' U A 7 9.567 1.625 -3.621 1.00 0.00 C ATOM 201 C4' U A 7 9.310 1.849 -2.149 1.00 0.00 C ATOM 202 O4' U A 7 7.972 2.372 -1.967 1.00 0.00 O ATOM 203 C3' U A 7 9.322 0.604 -1.278 1.00 0.00 C ATOM 204 O3' U A 7 10.652 0.220 -0.940 1.00 0.00 O ATOM 205 C2' U A 7 8.513 1.042 -0.060 1.00 0.00 C ATOM 206 O2' U A 7 9.319 1.771 0.847 1.00 0.00 O ATOM 207 C1' U A 7 7.496 2.003 -0.685 1.00 0.00 C ATOM 208 N1 U A 7 6.151 1.427 -0.836 1.00 0.00 N ATOM 209 C2 U A 7 5.291 1.507 0.247 1.00 0.00 C ATOM 210 O2 U A 7 5.604 2.023 1.305 1.00 0.00 O ATOM 211 N3 U A 7 4.050 0.959 0.043 1.00 0.00 N ATOM 212 C4 U A 7 3.589 0.353 -1.104 1.00 0.00 C ATOM 213 O4 U A 7 2.439 -0.087 -1.135 1.00 0.00 O ATOM 214 C5 U A 7 4.536 0.308 -2.175 1.00 0.00 C ATOM 215 C6 U A 7 5.755 0.831 -2.013 1.00 0.00 C ATOM 0 H5' U A 7 9.241 2.495 -4.191 1.00 0.00 H new ATOM 0 H5'' U A 7 10.637 1.511 -3.797 1.00 0.00 H new ATOM 0 H4' U A 7 10.123 2.510 -1.849 1.00 0.00 H new ATOM 0 H3' U A 7 8.905 -0.278 -1.765 1.00 0.00 H new ATOM 0 H2' U A 7 8.087 0.205 0.493 1.00 0.00 H new ATOM 0 HO2' U A 7 9.357 1.297 1.704 1.00 0.00 H new ATOM 0 H1' U A 7 7.400 2.854 -0.011 1.00 0.00 H new ATOM 0 H3 U A 7 3.398 1.006 0.826 1.00 0.00 H new ATOM 0 H5 U A 7 4.266 -0.149 -3.115 1.00 0.00 H new ATOM 0 H6 U A 7 6.455 0.785 -2.834 1.00 0.00 H new ATOM 226 P A A 8 10.970 -1.308 -0.551 1.00 0.00 P ATOM 227 OP1 A A 8 12.447 -1.448 -0.491 1.00 0.00 O ATOM 228 OP2 A A 8 10.184 -2.195 -1.446 1.00 0.00 O ATOM 229 O5' A A 8 10.394 -1.454 0.929 1.00 0.00 O ATOM 230 C5' A A 8 11.047 -0.832 2.035 1.00 0.00 C ATOM 231 C4' A A 8 10.114 -0.759 3.225 1.00 0.00 C ATOM 232 O4' A A 8 8.827 -0.245 2.795 1.00 0.00 O ATOM 233 C3' A A 8 9.771 -2.084 3.888 1.00 0.00 C ATOM 234 O3' A A 8 10.787 -2.493 4.800 1.00 0.00 O ATOM 235 C2' A A 8 8.456 -1.765 4.590 1.00 0.00 C ATOM 236 O2' A A 8 8.677 -1.055 5.793 1.00 0.00 O ATOM 237 C1' A A 8 7.799 -0.817 3.585 1.00 0.00 C ATOM 238 N9 A A 8 6.845 -1.478 2.696 1.00 0.00 N ATOM 239 C8 A A 8 7.059 -1.937 1.419 1.00 0.00 C ATOM 240 N7 A A 8 6.005 -2.493 0.875 1.00 0.00 N ATOM 241 C5 A A 8 5.031 -2.395 1.859 1.00 0.00 C ATOM 242 C6 A A 8 3.687 -2.802 1.902 1.00 0.00 C ATOM 243 N6 A A 8 3.067 -3.411 0.892 1.00 0.00 N ATOM 244 N1 A A 8 2.992 -2.559 3.034 1.00 0.00 N ATOM 245 C2 A A 8 3.615 -1.942 4.047 1.00 0.00 C ATOM 246 N3 A A 8 4.872 -1.510 4.125 1.00 0.00 N ATOM 247 C4 A A 8 5.534 -1.771 2.985 1.00 0.00 C ATOM 0 H5' A A 8 11.371 0.171 1.757 1.00 0.00 H new ATOM 0 H5'' A A 8 11.942 -1.395 2.300 1.00 0.00 H new ATOM 0 H4' A A 8 10.659 -0.138 3.935 1.00 0.00 H new ATOM 0 H3' A A 8 9.691 -2.917 3.190 1.00 0.00 H new ATOM 0 H2' A A 8 7.882 -2.654 4.850 1.00 0.00 H new ATOM 0 HO2' A A 8 7.817 -0.862 6.222 1.00 0.00 H new ATOM 0 H1' A A 8 7.239 -0.073 4.152 1.00 0.00 H new ATOM 0 H8 A A 8 8.008 -1.848 0.911 1.00 0.00 H new ATOM 0 H61 A A 8 2.088 -3.683 0.984 1.00 0.00 H new ATOM 0 H62 A A 8 3.571 -3.605 0.027 1.00 0.00 H new ATOM 0 H2 A A 8 3.011 -1.771 4.926 1.00 0.00 H new ATOM 259 P A A 9 10.776 -3.989 5.394 1.00 0.00 P ATOM 260 OP1 A A 9 12.007 -4.174 6.204 1.00 0.00 O ATOM 261 OP2 A A 9 10.488 -4.921 4.274 1.00 0.00 O ATOM 262 O5' A A 9 9.522 -4.006 6.379 1.00 0.00 O ATOM 263 C5' A A 9 9.468 -3.148 7.518 1.00 0.00 C ATOM 264 C4' A A 9 8.191 -3.388 8.290 1.00 0.00 C ATOM 265 O4' A A 9 7.060 -3.138 7.411 1.00 0.00 O ATOM 266 C3' A A 9 8.002 -4.812 8.798 1.00 0.00 C ATOM 267 O3' A A 9 8.564 -4.964 10.099 1.00 0.00 O ATOM 268 C2' A A 9 6.486 -4.984 8.790 1.00 0.00 C ATOM 269 O2' A A 9 5.892 -4.407 9.938 1.00 0.00 O ATOM 270 C1' A A 9 6.089 -4.154 7.571 1.00 0.00 C ATOM 271 N9 A A 9 6.016 -4.917 6.325 1.00 0.00 N ATOM 272 C8 A A 9 7.000 -5.064 5.379 1.00 0.00 C ATOM 273 N7 A A 9 6.636 -5.780 4.344 1.00 0.00 N ATOM 274 C5 A A 9 5.327 -6.140 4.631 1.00 0.00 C ATOM 275 C6 A A 9 4.379 -6.902 3.926 1.00 0.00 C ATOM 276 N6 A A 9 4.612 -7.457 2.736 1.00 0.00 N ATOM 277 N1 A A 9 3.166 -7.075 4.491 1.00 0.00 N ATOM 278 C2 A A 9 2.930 -6.518 5.685 1.00 0.00 C ATOM 279 N3 A A 9 3.736 -5.776 6.443 1.00 0.00 N ATOM 280 C4 A A 9 4.934 -5.622 5.852 1.00 0.00 C ATOM 0 H5' A A 9 9.520 -2.106 7.201 1.00 0.00 H new ATOM 0 H5'' A A 9 10.330 -3.329 8.160 1.00 0.00 H new ATOM 0 H4' A A 9 8.254 -2.723 9.151 1.00 0.00 H new ATOM 0 H3' A A 9 8.504 -5.567 8.192 1.00 0.00 H new ATOM 0 H2' A A 9 6.177 -6.029 8.772 1.00 0.00 H new ATOM 0 HO2' A A 9 5.353 -5.082 10.402 1.00 0.00 H new ATOM 0 H1' A A 9 5.087 -3.767 7.757 1.00 0.00 H new ATOM 0 H8 A A 9 7.984 -4.629 5.479 1.00 0.00 H new ATOM 0 H61 A A 9 3.882 -8.000 2.275 1.00 0.00 H new ATOM 0 H62 A A 9 5.520 -7.339 2.287 1.00 0.00 H new ATOM 0 H2 A A 9 1.946 -6.695 6.092 1.00 0.00 H new ATOM 292 P A A 10 8.941 -6.430 10.645 1.00 0.00 P ATOM 293 OP1 A A 10 9.896 -6.248 11.768 1.00 0.00 O ATOM 294 OP2 A A 10 9.320 -7.287 9.493 1.00 0.00 O ATOM 295 O5' A A 10 7.573 -6.981 11.248 1.00 0.00 O ATOM 296 C5' A A 10 6.837 -6.230 12.213 1.00 0.00 C ATOM 297 C4' A A 10 5.503 -6.888 12.480 1.00 0.00 C ATOM 298 O4' A A 10 4.637 -6.664 11.331 1.00 0.00 O ATOM 299 C3' A A 10 5.554 -8.401 12.663 1.00 0.00 C ATOM 300 O3' A A 10 5.704 -8.749 14.037 1.00 0.00 O ATOM 301 C2' A A 10 4.218 -8.861 12.090 1.00 0.00 C ATOM 302 O2' A A 10 3.165 -8.659 13.014 1.00 0.00 O ATOM 303 C1' A A 10 4.043 -7.883 10.931 1.00 0.00 C ATOM 304 N9 A A 10 4.671 -8.307 9.679 1.00 0.00 N ATOM 305 C8 A A 10 5.978 -8.129 9.300 1.00 0.00 C ATOM 306 N7 A A 10 6.249 -8.587 8.103 1.00 0.00 N ATOM 307 C5 A A 10 5.041 -9.109 7.665 1.00 0.00 C ATOM 308 C6 A A 10 4.667 -9.746 6.472 1.00 0.00 C ATOM 309 N6 A A 10 5.505 -9.962 5.456 1.00 0.00 N ATOM 310 N1 A A 10 3.386 -10.157 6.354 1.00 0.00 N ATOM 311 C2 A A 10 2.546 -9.935 7.375 1.00 0.00 C ATOM 312 N3 A A 10 2.780 -9.346 8.545 1.00 0.00 N ATOM 313 C4 A A 10 4.062 -8.952 8.629 1.00 0.00 C ATOM 0 H5' A A 10 6.683 -5.213 11.853 1.00 0.00 H new ATOM 0 H5'' A A 10 7.407 -6.157 13.139 1.00 0.00 H new ATOM 0 H4' A A 10 5.149 -6.445 13.411 1.00 0.00 H new ATOM 0 H3' A A 10 6.403 -8.872 12.169 1.00 0.00 H new ATOM 0 H2' A A 10 4.201 -9.919 11.827 1.00 0.00 H new ATOM 0 HO2' A A 10 3.529 -8.629 13.923 1.00 0.00 H new ATOM 0 H1' A A 10 2.975 -7.808 10.724 1.00 0.00 H new ATOM 0 H8 A A 10 6.715 -7.655 9.931 1.00 0.00 H new ATOM 0 H61 A A 10 5.174 -10.431 4.613 1.00 0.00 H new ATOM 0 H62 A A 10 6.476 -9.658 5.523 1.00 0.00 H new ATOM 0 H2 A A 10 1.535 -10.284 7.227 1.00 0.00 H new ATOM 325 P A A 11 6.396 -10.145 14.437 1.00 0.00 P ATOM 326 OP1 A A 11 6.309 -10.303 15.911 1.00 0.00 O ATOM 327 OP2 A A 11 7.722 -10.195 13.771 1.00 0.00 O ATOM 328 O5' A A 11 5.464 -11.242 13.753 1.00 0.00 O ATOM 329 C5' A A 11 4.184 -11.561 14.296 1.00 0.00 C ATOM 330 C4' A A 11 3.345 -12.284 13.267 1.00 0.00 C ATOM 331 O4' A A 11 3.413 -11.571 12.007 1.00 0.00 O ATOM 332 C3' A A 11 3.803 -13.689 12.907 1.00 0.00 C ATOM 333 O3' A A 11 3.344 -14.645 13.858 1.00 0.00 O ATOM 334 C2' A A 11 3.188 -13.897 11.525 1.00 0.00 C ATOM 335 O2' A A 11 1.828 -14.278 11.615 1.00 0.00 O ATOM 336 C1' A A 11 3.253 -12.485 10.938 1.00 0.00 C ATOM 337 N9 A A 11 4.355 -12.295 9.996 1.00 0.00 N ATOM 338 C8 A A 11 5.496 -11.548 10.159 1.00 0.00 C ATOM 339 N7 A A 11 6.293 -11.568 9.119 1.00 0.00 N ATOM 340 C5 A A 11 5.636 -12.387 8.211 1.00 0.00 C ATOM 341 C6 A A 11 5.961 -12.811 6.912 1.00 0.00 C ATOM 342 N6 A A 11 7.074 -12.450 6.269 1.00 0.00 N ATOM 343 N1 A A 11 5.091 -13.629 6.283 1.00 0.00 N ATOM 344 C2 A A 11 3.971 -13.990 6.923 1.00 0.00 C ATOM 345 N3 A A 11 3.555 -13.656 8.142 1.00 0.00 N ATOM 346 C4 A A 11 4.443 -12.843 8.740 1.00 0.00 C ATOM 0 H5' A A 11 3.678 -10.649 14.613 1.00 0.00 H new ATOM 0 H5'' A A 11 4.302 -12.184 15.182 1.00 0.00 H new ATOM 0 H4' A A 11 2.360 -12.335 13.731 1.00 0.00 H new ATOM 0 H3' A A 11 4.886 -13.812 12.908 1.00 0.00 H new ATOM 0 H2' A A 11 3.694 -14.672 10.950 1.00 0.00 H new ATOM 0 HO2' A A 11 1.463 -14.402 10.714 1.00 0.00 H new ATOM 0 H1' A A 11 2.329 -12.320 10.384 1.00 0.00 H new ATOM 0 H8 A A 11 5.716 -10.995 11.061 1.00 0.00 H new ATOM 0 H61 A A 11 7.252 -12.793 5.325 1.00 0.00 H new ATOM 0 H62 A A 11 7.747 -11.831 6.722 1.00 0.00 H new ATOM 0 H2 A A 11 3.312 -14.645 6.372 1.00 0.00 H new ATOM 358 P G A 12 4.011 -16.107 13.908 1.00 0.00 P ATOM 359 OP1 G A 12 3.323 -16.868 14.981 1.00 0.00 O ATOM 360 OP2 G A 12 5.488 -15.951 13.952 1.00 0.00 O ATOM 361 O5' G A 12 3.620 -16.762 12.508 1.00 0.00 O ATOM 362 C5' G A 12 2.290 -17.214 12.255 1.00 0.00 C ATOM 363 C4' G A 12 2.242 -17.994 10.962 1.00 0.00 C ATOM 364 O4' G A 12 2.547 -17.103 9.858 1.00 0.00 O ATOM 365 C3' G A 12 3.266 -19.111 10.832 1.00 0.00 C ATOM 366 O3' G A 12 2.830 -20.322 11.459 1.00 0.00 O ATOM 367 C2' G A 12 3.406 -19.263 9.321 1.00 0.00 C ATOM 368 O2' G A 12 2.355 -20.047 8.789 1.00 0.00 O ATOM 369 C1' G A 12 3.227 -17.820 8.844 1.00 0.00 C ATOM 370 N9 G A 12 4.485 -17.135 8.563 1.00 0.00 N ATOM 371 C8 G A 12 5.178 -16.294 9.399 1.00 0.00 C ATOM 372 N7 G A 12 6.269 -15.820 8.865 1.00 0.00 N ATOM 373 C5 G A 12 6.304 -16.388 7.598 1.00 0.00 C ATOM 374 C6 G A 12 7.255 -16.249 6.554 1.00 0.00 C ATOM 375 O6 G A 12 8.288 -15.570 6.538 1.00 0.00 O ATOM 376 N1 G A 12 6.905 -17.006 5.440 1.00 0.00 N ATOM 377 C2 G A 12 5.784 -17.792 5.342 1.00 0.00 C ATOM 378 N2 G A 12 5.620 -18.445 4.186 1.00 0.00 N ATOM 379 N3 G A 12 4.890 -17.929 6.305 1.00 0.00 N ATOM 380 C4 G A 12 5.211 -17.204 7.397 1.00 0.00 C ATOM 0 H5' G A 12 1.613 -16.362 12.200 1.00 0.00 H new ATOM 0 H5'' G A 12 1.948 -17.840 13.079 1.00 0.00 H new ATOM 0 H4' G A 12 1.242 -18.427 10.952 1.00 0.00 H new ATOM 0 H3' G A 12 4.209 -18.886 11.330 1.00 0.00 H new ATOM 0 H2' G A 12 4.339 -19.742 9.024 1.00 0.00 H new ATOM 0 HO2' G A 12 1.913 -20.537 9.514 1.00 0.00 H new ATOM 0 HO3' G A 12 3.517 -21.013 11.350 1.00 0.00 H new ATOM 0 H1' G A 12 2.669 -17.857 7.909 1.00 0.00 H new ATOM 0 H8 G A 12 4.852 -16.050 10.399 1.00 0.00 H new ATOM 0 H1 G A 12 7.530 -16.974 4.634 1.00 0.00 H new ATOM 0 H21 G A 12 4.807 -19.046 4.050 1.00 0.00 H new ATOM 0 H22 G A 12 6.308 -18.342 3.440 1.00 0.00 H new TER 393 G A 12 ATOM 394 O5' C B 1 11.177 -15.644 -1.226 1.00 0.00 O ATOM 395 C5' C B 1 11.297 -16.805 -2.055 1.00 0.00 C ATOM 396 C4' C B 1 10.185 -17.788 -1.770 1.00 0.00 C ATOM 397 O4' C B 1 10.513 -18.521 -0.555 1.00 0.00 O ATOM 398 C3' C B 1 8.819 -17.163 -1.509 1.00 0.00 C ATOM 399 O3' C B 1 8.065 -17.042 -2.711 1.00 0.00 O ATOM 400 C2' C B 1 8.184 -18.137 -0.525 1.00 0.00 C ATOM 401 O2' C B 1 7.691 -19.285 -1.189 1.00 0.00 O ATOM 402 C1' C B 1 9.395 -18.536 0.312 1.00 0.00 C ATOM 403 N1 C B 1 9.670 -17.633 1.444 1.00 0.00 N ATOM 404 C2 C B 1 8.765 -17.591 2.510 1.00 0.00 C ATOM 405 O2 C B 1 7.757 -18.311 2.471 1.00 0.00 O ATOM 406 N3 C B 1 9.011 -16.768 3.554 1.00 0.00 N ATOM 407 C4 C B 1 10.108 -16.008 3.559 1.00 0.00 C ATOM 408 N4 C B 1 10.311 -15.211 4.609 1.00 0.00 N ATOM 409 C5 C B 1 11.047 -16.029 2.487 1.00 0.00 C ATOM 410 C6 C B 1 10.790 -16.848 1.460 1.00 0.00 C ATOM 0 H5' C B 1 12.262 -17.282 -1.883 1.00 0.00 H new ATOM 0 H5'' C B 1 11.269 -16.512 -3.104 1.00 0.00 H new ATOM 0 H4' C B 1 10.113 -18.401 -2.669 1.00 0.00 H new ATOM 0 H3' C B 1 8.872 -16.146 -1.120 1.00 0.00 H new ATOM 0 H2' C B 1 7.344 -17.715 0.027 1.00 0.00 H new ATOM 0 HO2' C B 1 7.599 -19.095 -2.146 1.00 0.00 H new ATOM 0 HO5' C B 1 10.724 -15.884 -0.391 1.00 0.00 H new ATOM 0 H1' C B 1 9.193 -19.515 0.747 1.00 0.00 H new ATOM 0 H41 C B 1 11.139 -14.617 4.646 1.00 0.00 H new ATOM 0 H42 C B 1 9.638 -15.196 5.375 1.00 0.00 H new ATOM 0 H5 C B 1 11.931 -15.409 2.503 1.00 0.00 H new ATOM 0 H6 C B 1 11.479 -16.890 0.629 1.00 0.00 H new ATOM 423 P U B 2 6.945 -15.894 -2.840 1.00 0.00 P ATOM 424 OP1 U B 2 6.284 -16.071 -4.157 1.00 0.00 O ATOM 425 OP2 U B 2 7.572 -14.591 -2.503 1.00 0.00 O ATOM 426 O5' U B 2 5.892 -16.250 -1.698 1.00 0.00 O ATOM 427 C5' U B 2 5.129 -17.454 -1.751 1.00 0.00 C ATOM 428 C4' U B 2 4.099 -17.467 -0.646 1.00 0.00 C ATOM 429 O4' U B 2 4.777 -17.618 0.629 1.00 0.00 O ATOM 430 C3' U B 2 3.286 -16.190 -0.497 1.00 0.00 C ATOM 431 O3' U B 2 2.171 -16.189 -1.383 1.00 0.00 O ATOM 432 C2' U B 2 2.879 -16.221 0.973 1.00 0.00 C ATOM 433 O2' U B 2 1.782 -17.087 1.194 1.00 0.00 O ATOM 434 C1' U B 2 4.118 -16.845 1.616 1.00 0.00 C ATOM 435 N1 U B 2 5.073 -15.861 2.147 1.00 0.00 N ATOM 436 C2 U B 2 4.823 -15.338 3.402 1.00 0.00 C ATOM 437 O2 U B 2 3.851 -15.649 4.068 1.00 0.00 O ATOM 438 N3 U B 2 5.753 -14.436 3.849 1.00 0.00 N ATOM 439 C4 U B 2 6.882 -14.009 3.188 1.00 0.00 C ATOM 440 O4 U B 2 7.627 -13.191 3.730 1.00 0.00 O ATOM 441 C5 U B 2 7.069 -14.592 1.897 1.00 0.00 C ATOM 442 C6 U B 2 6.183 -15.476 1.427 1.00 0.00 C ATOM 0 H5' U B 2 5.789 -18.316 -1.653 1.00 0.00 H new ATOM 0 H5'' U B 2 4.636 -17.538 -2.719 1.00 0.00 H new ATOM 0 H4' U B 2 3.426 -18.282 -0.914 1.00 0.00 H new ATOM 0 H3' U B 2 3.831 -15.282 -0.754 1.00 0.00 H new ATOM 0 H2' U B 2 2.584 -15.242 1.352 1.00 0.00 H new ATOM 0 HO2' U B 2 1.255 -16.760 1.952 1.00 0.00 H new ATOM 0 H1' U B 2 3.777 -17.440 2.463 1.00 0.00 H new ATOM 0 H3 U B 2 5.590 -14.037 4.774 1.00 0.00 H new ATOM 0 H5 U B 2 7.927 -14.318 1.300 1.00 0.00 H new ATOM 0 H6 U B 2 6.343 -15.904 0.448 1.00 0.00 H new HETATM 453 P SUR B 3 1.454 -14.802 -1.765 1.00 0.00 P HETATM 454 OP1 SUR B 3 0.523 -15.055 -2.893 1.00 0.00 O HETATM 455 OP2 SUR B 3 2.512 -13.768 -1.904 1.00 0.00 O HETATM 456 O5' SUR B 3 0.592 -14.452 -0.473 1.00 0.00 O HETATM 457 C5' SUR B 3 -0.324 -15.397 0.076 1.00 0.00 C HETATM 458 C4' SUR B 3 -1.065 -14.783 1.238 1.00 0.00 C HETATM 459 O4' SUR B 3 -0.192 -14.772 2.399 1.00 0.00 O HETATM 460 C3' SUR B 3 -1.469 -13.329 1.042 1.00 0.00 C HETATM 461 C1' SUR B 3 -0.368 -13.566 3.120 1.00 0.00 C HETATM 462 N1 SUR B 3 0.907 -12.845 3.126 1.00 0.00 N HETATM 463 C2' SUR B 3 -1.520 -12.798 2.471 1.00 0.00 C HETATM 464 C6 SUR B 3 1.794 -12.953 2.077 1.00 0.00 C HETATM 465 C2 SUR B 3 1.196 -12.059 4.229 1.00 0.00 C HETATM 466 C5 SUR B 3 2.975 -12.328 2.072 1.00 0.00 C HETATM 467 S2 SUR B 3 0.046 -11.660 5.370 1.00 0.00 S HETATM 468 N3 SUR B 3 2.419 -11.434 4.186 1.00 0.00 N HETATM 469 C4 SUR B 3 3.355 -11.507 3.178 1.00 0.00 C HETATM 470 O4 SUR B 3 4.415 -10.890 3.289 1.00 0.00 O HETATM 471 O2' SUR B 3 -2.725 -13.164 3.116 1.00 0.00 O HETATM 472 O3' SUR B 3 -2.720 -13.233 0.369 1.00 0.00 O HETATM 0 H5'2 SUR B 3 -1.032 -15.717 -0.689 1.00 0.00 H new HETATM 0 H5'1 SUR B 3 0.213 -16.287 0.406 1.00 0.00 H new HETATM 0 HO2 SUR B 3 -3.216 -12.356 3.376 1.00 0.00 H new HETATM 0 HN3 SUR B 3 2.660 -10.852 4.988 1.00 0.00 H new HETATM 0 HC6 SUR B 3 1.523 -13.570 1.221 1.00 0.00 H new HETATM 0 HC5 SUR B 3 3.649 -12.445 1.223 1.00 0.00 H new HETATM 0 H4' SUR B 3 -1.965 -15.388 1.347 1.00 0.00 H new HETATM 0 H3' SUR B 3 -0.785 -12.758 0.415 1.00 0.00 H new HETATM 0 H2' SUR B 3 -1.456 -11.711 2.526 1.00 0.00 H new HETATM 0 H1' SUR B 3 -0.639 -13.726 4.164 1.00 0.00 H new ATOM 483 P U B 4 -3.062 -11.923 -0.497 1.00 0.00 P ATOM 484 OP1 U B 4 -4.359 -12.164 -1.180 1.00 0.00 O ATOM 485 OP2 U B 4 -1.864 -11.566 -1.301 1.00 0.00 O ATOM 486 O5' U B 4 -3.274 -10.790 0.603 1.00 0.00 O ATOM 487 C5' U B 4 -4.465 -10.743 1.387 1.00 0.00 C ATOM 488 C4' U B 4 -4.251 -9.884 2.613 1.00 0.00 C ATOM 489 O4' U B 4 -3.009 -10.282 3.254 1.00 0.00 O ATOM 490 C3' U B 4 -4.088 -8.391 2.362 1.00 0.00 C ATOM 491 O3' U B 4 -5.353 -7.740 2.279 1.00 0.00 O ATOM 492 C2' U B 4 -3.278 -7.940 3.572 1.00 0.00 C ATOM 493 O2' U B 4 -4.101 -7.798 4.713 1.00 0.00 O ATOM 494 C1' U B 4 -2.357 -9.142 3.784 1.00 0.00 C ATOM 495 N1 U B 4 -1.046 -9.010 3.132 1.00 0.00 N ATOM 496 C2 U B 4 -0.038 -8.378 3.837 1.00 0.00 C ATOM 497 O2 U B 4 -0.196 -7.929 4.959 1.00 0.00 O ATOM 498 N3 U B 4 1.162 -8.290 3.181 1.00 0.00 N ATOM 499 C4 U B 4 1.457 -8.762 1.923 1.00 0.00 C ATOM 500 O4 U B 4 2.597 -8.625 1.478 1.00 0.00 O ATOM 501 C5 U B 4 0.366 -9.401 1.257 1.00 0.00 C ATOM 502 C6 U B 4 -0.822 -9.500 1.864 1.00 0.00 C ATOM 0 H5' U B 4 -4.752 -11.751 1.686 1.00 0.00 H new ATOM 0 H5'' U B 4 -5.285 -10.342 0.792 1.00 0.00 H new ATOM 0 H4' U B 4 -5.155 -10.037 3.202 1.00 0.00 H new ATOM 0 H3' U B 4 -3.601 -8.152 1.416 1.00 0.00 H new ATOM 0 H2' U B 4 -2.779 -6.982 3.424 1.00 0.00 H new ATOM 0 HO2' U B 4 -3.557 -7.509 5.475 1.00 0.00 H new ATOM 0 H1' U B 4 -2.166 -9.221 4.854 1.00 0.00 H new ATOM 0 H3 U B 4 1.919 -7.823 3.680 1.00 0.00 H new ATOM 0 H5 U B 4 0.501 -9.804 0.264 1.00 0.00 H new ATOM 0 H6 U B 4 -1.635 -9.982 1.341 1.00 0.00 H new ATOM 513 P U B 5 -5.441 -6.228 1.736 1.00 0.00 P ATOM 514 OP1 U B 5 -6.880 -5.891 1.589 1.00 0.00 O ATOM 515 OP2 U B 5 -4.532 -6.090 0.569 1.00 0.00 O ATOM 516 O5' U B 5 -4.848 -5.357 2.931 1.00 0.00 O ATOM 517 C5' U B 5 -5.535 -5.252 4.177 1.00 0.00 C ATOM 518 C4' U B 5 -4.787 -4.328 5.110 1.00 0.00 C ATOM 519 O4' U B 5 -3.444 -4.852 5.316 1.00 0.00 O ATOM 520 C3' U B 5 -4.574 -2.911 4.594 1.00 0.00 C ATOM 521 O3' U B 5 -5.678 -2.067 4.905 1.00 0.00 O ATOM 522 C2' U B 5 -3.299 -2.492 5.312 1.00 0.00 C ATOM 523 O2' U B 5 -3.555 -2.169 6.665 1.00 0.00 O ATOM 524 C1' U B 5 -2.503 -3.794 5.268 1.00 0.00 C ATOM 525 N1 U B 5 -1.685 -3.953 4.056 1.00 0.00 N ATOM 526 C2 U B 5 -0.410 -3.415 4.062 1.00 0.00 C ATOM 527 O2 U B 5 0.054 -2.818 5.017 1.00 0.00 O ATOM 528 N3 U B 5 0.303 -3.601 2.904 1.00 0.00 N ATOM 529 C4 U B 5 -0.120 -4.255 1.767 1.00 0.00 C ATOM 530 O4 U B 5 0.638 -4.345 0.803 1.00 0.00 O ATOM 531 C5 U B 5 -1.447 -4.777 1.840 1.00 0.00 C ATOM 532 C6 U B 5 -2.169 -4.617 2.950 1.00 0.00 C ATOM 0 H5' U B 5 -5.632 -6.238 4.631 1.00 0.00 H new ATOM 0 H5'' U B 5 -6.545 -4.876 4.013 1.00 0.00 H new ATOM 0 H4' U B 5 -5.409 -4.283 6.004 1.00 0.00 H new ATOM 0 H3' U B 5 -4.492 -2.845 3.509 1.00 0.00 H new ATOM 0 H2' U B 5 -2.817 -1.620 4.870 1.00 0.00 H new ATOM 0 HO2' U B 5 -3.109 -1.326 6.890 1.00 0.00 H new ATOM 0 H1' U B 5 -1.808 -3.792 6.108 1.00 0.00 H new ATOM 0 H3 U B 5 1.246 -3.214 2.883 1.00 0.00 H new ATOM 0 H5 U B 5 -1.867 -5.302 0.995 1.00 0.00 H new ATOM 0 H6 U B 5 -3.169 -5.023 2.983 1.00 0.00 H new ATOM 543 P A B 6 -5.808 -0.627 4.200 1.00 0.00 P ATOM 544 OP1 A B 6 -7.167 -0.109 4.499 1.00 0.00 O ATOM 545 OP2 A B 6 -5.363 -0.748 2.788 1.00 0.00 O ATOM 546 O5' A B 6 -4.752 0.278 4.979 1.00 0.00 O ATOM 547 C5' A B 6 -4.884 0.526 6.379 1.00 0.00 C ATOM 548 C4' A B 6 -3.629 1.177 6.915 1.00 0.00 C ATOM 549 O4' A B 6 -2.486 0.350 6.561 1.00 0.00 O ATOM 550 C3' A B 6 -3.323 2.559 6.348 1.00 0.00 C ATOM 551 O3' A B 6 -3.900 3.581 7.157 1.00 0.00 O ATOM 552 C2' A B 6 -1.799 2.608 6.357 1.00 0.00 C ATOM 553 O2' A B 6 -1.306 2.922 7.645 1.00 0.00 O ATOM 554 C1' A B 6 -1.449 1.156 6.038 1.00 0.00 C ATOM 555 N9 A B 6 -1.323 0.866 4.609 1.00 0.00 N ATOM 556 C8 A B 6 -2.318 0.492 3.740 1.00 0.00 C ATOM 557 N7 A B 6 -1.900 0.282 2.517 1.00 0.00 N ATOM 558 C5 A B 6 -0.539 0.539 2.581 1.00 0.00 C ATOM 559 C6 A B 6 0.476 0.494 1.613 1.00 0.00 C ATOM 560 N6 A B 6 0.268 0.156 0.341 1.00 0.00 N ATOM 561 N1 A B 6 1.730 0.812 2.001 1.00 0.00 N ATOM 562 C2 A B 6 1.938 1.148 3.280 1.00 0.00 C ATOM 563 N3 A B 6 1.066 1.225 4.284 1.00 0.00 N ATOM 564 C4 A B 6 -0.170 0.904 3.863 1.00 0.00 C ATOM 0 H5' A B 6 -5.070 -0.410 6.906 1.00 0.00 H new ATOM 0 H5'' A B 6 -5.743 1.171 6.562 1.00 0.00 H new ATOM 0 H4' A B 6 -3.802 1.279 7.986 1.00 0.00 H new ATOM 0 H3' A B 6 -3.737 2.724 5.354 1.00 0.00 H new ATOM 0 H2' A B 6 -1.386 3.352 5.676 1.00 0.00 H new ATOM 0 HO2' A B 6 -1.969 3.458 8.127 1.00 0.00 H new ATOM 0 H1' A B 6 -0.474 0.953 6.480 1.00 0.00 H new ATOM 0 H8 A B 6 -3.350 0.381 4.038 1.00 0.00 H new ATOM 0 H61 A B 6 1.047 0.142 -0.317 1.00 0.00 H new ATOM 0 H62 A B 6 -0.671 -0.088 0.025 1.00 0.00 H new ATOM 0 H2 A B 6 2.959 1.392 3.534 1.00 0.00 H new ATOM 576 P A B 7 -4.369 4.965 6.487 1.00 0.00 P ATOM 577 OP1 A B 7 -5.020 5.770 7.552 1.00 0.00 O ATOM 578 OP2 A B 7 -5.116 4.658 5.241 1.00 0.00 O ATOM 579 O5' A B 7 -3.004 5.682 6.083 1.00 0.00 O ATOM 580 C5' A B 7 -2.248 6.417 7.043 1.00 0.00 C ATOM 581 C4' A B 7 -0.836 6.633 6.546 1.00 0.00 C ATOM 582 O4' A B 7 -0.312 5.374 6.044 1.00 0.00 O ATOM 583 C3' A B 7 -0.681 7.585 5.368 1.00 0.00 C ATOM 584 O3' A B 7 -0.655 8.948 5.782 1.00 0.00 O ATOM 585 C2' A B 7 0.644 7.136 4.766 1.00 0.00 C ATOM 586 O2' A B 7 1.746 7.615 5.516 1.00 0.00 O ATOM 587 C1' A B 7 0.550 5.622 4.947 1.00 0.00 C ATOM 588 N9 A B 7 0.018 4.939 3.769 1.00 0.00 N ATOM 589 C8 A B 7 -1.270 4.526 3.528 1.00 0.00 C ATOM 590 N7 A B 7 -1.430 3.951 2.361 1.00 0.00 N ATOM 591 C5 A B 7 -0.162 3.986 1.796 1.00 0.00 C ATOM 592 C6 A B 7 0.336 3.538 0.561 1.00 0.00 C ATOM 593 N6 A B 7 -0.415 2.946 -0.368 1.00 0.00 N ATOM 594 N1 A B 7 1.650 3.726 0.309 1.00 0.00 N ATOM 595 C2 A B 7 2.402 4.325 1.242 1.00 0.00 C ATOM 596 N3 A B 7 2.048 4.792 2.435 1.00 0.00 N ATOM 597 C4 A B 7 0.738 4.589 2.654 1.00 0.00 C ATOM 0 H5' A B 7 -2.229 5.878 7.990 1.00 0.00 H new ATOM 0 H5'' A B 7 -2.725 7.379 7.233 1.00 0.00 H new ATOM 0 H4' A B 7 -0.321 7.053 7.410 1.00 0.00 H new ATOM 0 H3' A B 7 -1.511 7.546 4.662 1.00 0.00 H new ATOM 0 H2' A B 7 0.794 7.486 3.745 1.00 0.00 H new ATOM 0 HO2' A B 7 2.580 7.308 5.104 1.00 0.00 H new ATOM 0 H1' A B 7 1.556 5.237 5.113 1.00 0.00 H new ATOM 0 H8 A B 7 -2.076 4.662 4.234 1.00 0.00 H new ATOM 0 H61 A B 7 0.005 2.642 -1.246 1.00 0.00 H new ATOM 0 H62 A B 7 -1.410 2.797 -0.200 1.00 0.00 H new ATOM 0 H2 A B 7 3.445 4.446 0.989 1.00 0.00 H new HETATM 609 N1 PSU B 8 -0.046 7.398 0.871 1.00 0.00 N HETATM 610 C2 PSU B 8 0.127 6.699 -0.305 1.00 0.00 C HETATM 611 N3 PSU B 8 1.343 6.882 -0.913 1.00 0.00 N HETATM 612 C4 PSU B 8 2.382 7.671 -0.468 1.00 0.00 C HETATM 613 C5 PSU B 8 2.125 8.357 0.762 1.00 0.00 C HETATM 614 C6 PSU B 8 0.945 8.207 1.374 1.00 0.00 C HETATM 615 O2 PSU B 8 -0.727 5.965 -0.767 1.00 0.00 O HETATM 616 O4 PSU B 8 3.419 7.733 -1.129 1.00 0.00 O HETATM 617 C1' PSU B 8 3.184 9.204 1.315 1.00 0.00 C HETATM 618 C2' PSU B 8 3.159 10.643 0.802 1.00 0.00 C HETATM 619 O2' PSU B 8 4.487 11.129 0.768 1.00 0.00 O HETATM 620 C3' PSU B 8 2.341 11.336 1.887 1.00 0.00 C HETATM 621 C4' PSU B 8 2.782 10.612 3.151 1.00 0.00 C HETATM 622 O3' PSU B 8 2.615 12.732 1.967 1.00 0.00 O HETATM 623 O4' PSU B 8 3.033 9.246 2.724 1.00 0.00 O HETATM 624 C5' PSU B 8 1.769 10.597 4.272 1.00 0.00 C HETATM 625 O5' PSU B 8 0.553 9.996 3.828 1.00 0.00 O HETATM 626 P PSU B 8 -0.785 10.118 4.685 1.00 0.00 P HETATM 627 OP1 PSU B 8 -0.771 11.424 5.391 1.00 0.00 O HETATM 628 OP2 PSU B 8 -1.925 9.779 3.795 1.00 0.00 O HETATM 0 HO2' PSU B 8 4.537 11.977 1.256 1.00 0.00 H new HETATM 0 H5'' PSU B 8 2.166 10.045 5.124 1.00 0.00 H new HETATM 0 HN3 PSU B 8 1.495 6.380 -1.788 1.00 0.00 H new HETATM 0 HN1 PSU B 8 -0.927 7.313 1.378 1.00 0.00 H new HETATM 0 H6 PSU B 8 0.763 8.745 2.304 1.00 0.00 H new HETATM 0 H5' PSU B 8 1.577 11.614 4.613 1.00 0.00 H new HETATM 0 H4' PSU B 8 3.644 11.131 3.570 1.00 0.00 H new HETATM 0 H3' PSU B 8 1.268 11.284 1.702 1.00 0.00 H new HETATM 0 H2' PSU B 8 2.749 10.784 -0.198 1.00 0.00 H new HETATM 0 H1' PSU B 8 4.131 8.764 1.001 1.00 0.00 H new ATOM 639 P C B 9 1.787 13.763 1.053 1.00 0.00 P ATOM 640 OP1 C B 9 2.410 15.100 1.223 1.00 0.00 O ATOM 641 OP2 C B 9 0.340 13.586 1.339 1.00 0.00 O ATOM 642 O5' C B 9 2.063 13.268 -0.436 1.00 0.00 O ATOM 643 C5' C B 9 3.358 13.391 -1.023 1.00 0.00 C ATOM 644 C4' C B 9 3.277 13.154 -2.512 1.00 0.00 C ATOM 645 O4' C B 9 3.191 11.727 -2.761 1.00 0.00 O ATOM 646 C3' C B 9 2.047 13.738 -3.189 1.00 0.00 C ATOM 647 O3' C B 9 2.261 15.103 -3.535 1.00 0.00 O ATOM 648 C2' C B 9 1.870 12.834 -4.404 1.00 0.00 C ATOM 649 O2' C B 9 2.749 13.194 -5.453 1.00 0.00 O ATOM 650 C1' C B 9 2.313 11.481 -3.845 1.00 0.00 C ATOM 651 N1 C B 9 1.204 10.641 -3.359 1.00 0.00 N ATOM 652 C2 C B 9 0.622 9.719 -4.235 1.00 0.00 C ATOM 653 O2 C B 9 1.045 9.642 -5.398 1.00 0.00 O ATOM 654 N3 C B 9 -0.387 8.935 -3.794 1.00 0.00 N ATOM 655 C4 C B 9 -0.818 9.047 -2.535 1.00 0.00 C ATOM 656 N4 C B 9 -1.819 8.255 -2.144 1.00 0.00 N ATOM 657 C5 C B 9 -0.244 9.978 -1.621 1.00 0.00 C ATOM 658 C6 C B 9 0.753 10.750 -2.073 1.00 0.00 C ATOM 0 H5' C B 9 4.041 12.673 -0.569 1.00 0.00 H new ATOM 0 H5'' C B 9 3.762 14.384 -0.826 1.00 0.00 H new ATOM 0 H4' C B 9 4.167 13.637 -2.915 1.00 0.00 H new ATOM 0 H3' C B 9 1.156 13.758 -2.561 1.00 0.00 H new ATOM 0 H2' C B 9 0.862 12.871 -4.817 1.00 0.00 H new ATOM 0 HO2' C B 9 2.611 12.594 -6.216 1.00 0.00 H new ATOM 0 H1' C B 9 2.786 10.935 -4.661 1.00 0.00 H new ATOM 0 H41 C B 9 -2.173 8.314 -1.189 1.00 0.00 H new ATOM 0 H42 C B 9 -2.230 7.591 -2.800 1.00 0.00 H new ATOM 0 H5 C B 9 -0.599 10.058 -0.604 1.00 0.00 H new ATOM 0 H6 C B 9 1.208 11.471 -1.410 1.00 0.00 H new ATOM 670 P U B 10 1.016 16.118 -3.602 1.00 0.00 P ATOM 671 OP1 U B 10 1.564 17.488 -3.772 1.00 0.00 O ATOM 672 OP2 U B 10 0.106 15.828 -2.465 1.00 0.00 O ATOM 673 O5' U B 10 0.271 15.712 -4.949 1.00 0.00 O ATOM 674 C5' U B 10 0.980 15.631 -6.184 1.00 0.00 C ATOM 675 C4' U B 10 0.141 14.919 -7.215 1.00 0.00 C ATOM 676 O4' U B 10 0.069 13.505 -6.872 1.00 0.00 O ATOM 677 C3' U B 10 -1.308 15.380 -7.285 1.00 0.00 C ATOM 678 O3' U B 10 -1.457 16.483 -8.173 1.00 0.00 O ATOM 679 C2' U B 10 -2.031 14.127 -7.761 1.00 0.00 C ATOM 680 O2' U B 10 -1.845 13.912 -9.147 1.00 0.00 O ATOM 681 C1' U B 10 -1.267 13.049 -6.996 1.00 0.00 C ATOM 682 N1 U B 10 -1.793 12.782 -5.648 1.00 0.00 N ATOM 683 C2 U B 10 -2.671 11.724 -5.491 1.00 0.00 C ATOM 684 O2 U B 10 -3.036 11.017 -6.417 1.00 0.00 O ATOM 685 N3 U B 10 -3.108 11.522 -4.206 1.00 0.00 N ATOM 686 C4 U B 10 -2.769 12.251 -3.090 1.00 0.00 C ATOM 687 O4 U B 10 -3.236 11.934 -1.996 1.00 0.00 O ATOM 688 C5 U B 10 -1.866 13.329 -3.336 1.00 0.00 C ATOM 689 C6 U B 10 -1.419 13.557 -4.573 1.00 0.00 C ATOM 0 H5' U B 10 1.921 15.100 -6.039 1.00 0.00 H new ATOM 0 H5'' U B 10 1.230 16.632 -6.535 1.00 0.00 H new ATOM 0 H4' U B 10 0.626 15.132 -8.167 1.00 0.00 H new ATOM 0 H3' U B 10 -1.703 15.753 -6.340 1.00 0.00 H new ATOM 0 H2' U B 10 -3.108 14.161 -7.599 1.00 0.00 H new ATOM 0 HO2' U B 10 -2.704 13.686 -9.561 1.00 0.00 H new ATOM 0 H1' U B 10 -1.361 12.115 -7.550 1.00 0.00 H new ATOM 0 H3 U B 10 -3.755 10.747 -4.063 1.00 0.00 H new ATOM 0 H5 U B 10 -1.544 13.960 -2.521 1.00 0.00 H new ATOM 0 H6 U B 10 -0.739 14.380 -4.737 1.00 0.00 H new ATOM 700 P G B 11 -2.737 17.446 -8.041 1.00 0.00 P ATOM 701 OP1 G B 11 -2.513 18.641 -8.895 1.00 0.00 O ATOM 702 OP2 G B 11 -3.024 17.621 -6.594 1.00 0.00 O ATOM 703 O5' G B 11 -3.921 16.590 -8.676 1.00 0.00 O ATOM 704 C5' G B 11 -3.798 16.024 -9.979 1.00 0.00 C ATOM 705 C4' G B 11 -4.836 14.945 -10.178 1.00 0.00 C ATOM 706 O4' G B 11 -4.573 13.852 -9.260 1.00 0.00 O ATOM 707 C3' G B 11 -6.267 15.354 -9.866 1.00 0.00 C ATOM 708 O3' G B 11 -6.862 16.026 -10.972 1.00 0.00 O ATOM 709 C2' G B 11 -6.931 14.017 -9.556 1.00 0.00 C ATOM 710 O2' G B 11 -7.259 13.315 -10.741 1.00 0.00 O ATOM 711 C1' G B 11 -5.797 13.271 -8.848 1.00 0.00 C ATOM 712 N9 G B 11 -5.869 13.334 -7.391 1.00 0.00 N ATOM 713 C8 G B 11 -5.315 14.285 -6.569 1.00 0.00 C ATOM 714 N7 G B 11 -5.539 14.066 -5.302 1.00 0.00 N ATOM 715 C5 G B 11 -6.293 12.899 -5.286 1.00 0.00 C ATOM 716 C6 G B 11 -6.841 12.171 -4.197 1.00 0.00 C ATOM 717 O6 G B 11 -6.767 12.417 -2.987 1.00 0.00 O ATOM 718 N1 G B 11 -7.538 11.049 -4.633 1.00 0.00 N ATOM 719 C2 G B 11 -7.688 10.675 -5.944 1.00 0.00 C ATOM 720 N2 G B 11 -8.385 9.557 -6.164 1.00 0.00 N ATOM 721 N3 G B 11 -7.189 11.346 -6.967 1.00 0.00 N ATOM 722 C4 G B 11 -6.507 12.438 -6.568 1.00 0.00 C ATOM 0 H5' G B 11 -2.799 15.607 -10.110 1.00 0.00 H new ATOM 0 H5'' G B 11 -3.920 16.801 -10.734 1.00 0.00 H new ATOM 0 H4' G B 11 -4.757 14.694 -11.236 1.00 0.00 H new ATOM 0 H3' G B 11 -6.360 16.065 -9.045 1.00 0.00 H new ATOM 0 H2' G B 11 -7.857 14.121 -8.990 1.00 0.00 H new ATOM 0 HO2' G B 11 -7.682 12.462 -10.509 1.00 0.00 H new ATOM 0 H1' G B 11 -5.880 12.219 -9.121 1.00 0.00 H new ATOM 0 H8 G B 11 -4.750 15.130 -6.935 1.00 0.00 H new ATOM 0 H1 G B 11 -7.971 10.459 -3.923 1.00 0.00 H new ATOM 0 H21 G B 11 -8.531 9.227 -7.118 1.00 0.00 H new ATOM 0 H22 G B 11 -8.771 9.034 -5.378 1.00 0.00 H new ATOM 734 P C B 12 -7.954 17.178 -10.716 1.00 0.00 P ATOM 735 OP1 C B 12 -8.014 18.013 -11.943 1.00 0.00 O ATOM 736 OP2 C B 12 -7.675 17.819 -9.406 1.00 0.00 O ATOM 737 O5' C B 12 -9.330 16.384 -10.593 1.00 0.00 O ATOM 738 C5' C B 12 -9.821 15.592 -11.674 1.00 0.00 C ATOM 739 C4' C B 12 -11.089 14.882 -11.263 1.00 0.00 C ATOM 740 O4' C B 12 -10.734 13.758 -10.412 1.00 0.00 O ATOM 741 C3' C B 12 -12.062 15.718 -10.440 1.00 0.00 C ATOM 742 O3' C B 12 -12.987 16.435 -11.264 1.00 0.00 O ATOM 743 C2' C B 12 -12.754 14.675 -9.570 1.00 0.00 C ATOM 744 O2' C B 12 -13.766 13.997 -10.291 1.00 0.00 O ATOM 745 C1' C B 12 -11.608 13.702 -9.299 1.00 0.00 C ATOM 746 N1 C B 12 -10.834 14.011 -8.085 1.00 0.00 N ATOM 747 C2 C B 12 -11.130 13.326 -6.904 1.00 0.00 C ATOM 748 O2 C B 12 -12.041 12.485 -6.909 1.00 0.00 O ATOM 749 N3 C B 12 -10.419 13.597 -5.785 1.00 0.00 N ATOM 750 C4 C B 12 -9.445 14.508 -5.820 1.00 0.00 C ATOM 751 N4 C B 12 -8.764 14.736 -4.696 1.00 0.00 N ATOM 752 C5 C B 12 -9.124 15.225 -7.009 1.00 0.00 C ATOM 753 C6 C B 12 -9.838 14.948 -8.107 1.00 0.00 C ATOM 0 H5' C B 12 -9.067 14.863 -11.973 1.00 0.00 H new ATOM 0 H5'' C B 12 -10.014 16.225 -12.540 1.00 0.00 H new ATOM 0 H4' C B 12 -11.578 14.613 -12.199 1.00 0.00 H new ATOM 0 H3' C B 12 -11.570 16.498 -9.859 1.00 0.00 H new ATOM 0 H2' C B 12 -13.233 15.097 -8.687 1.00 0.00 H new ATOM 0 HO2' C B 12 -13.994 14.509 -11.095 1.00 0.00 H new ATOM 0 HO3' C B 12 -13.593 16.956 -10.698 1.00 0.00 H new ATOM 0 H1' C B 12 -12.045 12.715 -9.144 1.00 0.00 H new ATOM 0 H41 C B 12 -8.013 15.426 -4.686 1.00 0.00 H new ATOM 0 H42 C B 12 -8.995 14.221 -3.847 1.00 0.00 H new ATOM 0 H5 C B 12 -8.336 15.963 -7.024 1.00 0.00 H new ATOM 0 H6 C B 12 -9.624 15.473 -9.026 1.00 0.00 H new TER 766 C B 12