USER MOD reduce.3.24.130724 H: found=0, std=0, add=194, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 194 hydrogens (43 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 27 U O2' : rot -126:sc= 0.228 USER MOD Single : A 27 U O5' : rot 34:sc= 0.0109 USER MOD Single : A 28 C O2' : rot -15:sc= 0.111 USER MOD Single : A 29 A O2' : rot -27:sc= 0.114 USER MOD Single : A 30 G O2' : rot -25:sc= 0.0988 USER MOD Single : A 31 A O2' : rot -28:sc= 0.121 USER MOD Single : A 32 C O2' : rot -26:sc= 0.211 USER MOD Single : A 33 U O2' : rot -71:sc= 0.942 USER MOD Single : A 34 U8U O2' : rot -115:sc= -0.0621 USER MOD Single : A 35 U O2' : rot -10:sc= 0.177 USER MOD Single : A 36 U O2' : rot -29:sc= 0.123 USER MOD Single : A 37 T6A O14 : rot 180:sc= 0.0102 USER MOD Single : A 37 T6A O2' : rot -8:sc= 0.0096 USER MOD Single : A 37 T6A ODB : rot 180:sc= 0 USER MOD Single : A 38 A O2' : rot -34:sc= 0.124 USER MOD Single : A 39 PSU O2' : rot -123:sc= 0.115 USER MOD Single : A 40 C O2' : rot -14:sc= 0.19 USER MOD Single : A 41 U O2' : rot -17:sc= 0.131 USER MOD Single : A 42 G O2' : rot -18:sc= 0.116 USER MOD Single : A 43 A O2' : rot -26:sc= 0.172 USER MOD Single : A 43 A O3' : rot 180:sc= 0.193 USER MOD ----------------------------------------------------------------- ATOM 1 O5' U A 27 0.826 -5.943 5.665 1.00 0.00 O ATOM 2 C5' U A 27 1.971 -6.689 5.315 1.00 0.00 C ATOM 3 C4' U A 27 3.201 -5.784 5.248 1.00 0.00 C ATOM 4 O4' U A 27 3.011 -4.723 4.335 1.00 0.00 O ATOM 5 C3' U A 27 3.526 -5.093 6.564 1.00 0.00 C ATOM 6 O3' U A 27 4.117 -5.970 7.503 1.00 0.00 O ATOM 7 C2' U A 27 4.497 -4.040 6.054 1.00 0.00 C ATOM 8 O2' U A 27 5.773 -4.611 5.880 1.00 0.00 O ATOM 9 C1' U A 27 3.932 -3.698 4.675 1.00 0.00 C ATOM 10 N1 U A 27 3.291 -2.357 4.712 1.00 0.00 N ATOM 11 C2 U A 27 4.090 -1.247 4.463 1.00 0.00 C ATOM 12 O2 U A 27 5.294 -1.328 4.225 1.00 0.00 O ATOM 13 N3 U A 27 3.461 -0.012 4.504 1.00 0.00 N ATOM 14 C4 U A 27 2.128 0.216 4.804 1.00 0.00 C ATOM 15 O4 U A 27 1.671 1.357 4.804 1.00 0.00 O ATOM 16 C5 U A 27 1.387 -0.983 5.110 1.00 0.00 C ATOM 17 C6 U A 27 1.972 -2.200 5.057 1.00 0.00 C ATOM 0 H5' U A 27 1.816 -7.173 4.351 1.00 0.00 H new ATOM 0 H5'' U A 27 2.134 -7.480 6.047 1.00 0.00 H new ATOM 0 H4' U A 27 4.003 -6.462 4.958 1.00 0.00 H new ATOM 0 H3' U A 27 2.667 -4.704 7.111 1.00 0.00 H new ATOM 0 H2' U A 27 4.597 -3.188 6.726 1.00 0.00 H new ATOM 0 HO2' U A 27 6.438 -4.082 6.369 1.00 0.00 H new ATOM 0 HO5' U A 27 0.893 -5.043 5.283 1.00 0.00 H new ATOM 0 H1' U A 27 4.715 -3.650 3.918 1.00 0.00 H new ATOM 0 H3 U A 27 4.034 0.805 4.293 1.00 0.00 H new ATOM 0 H5 U A 27 0.346 -0.907 5.386 1.00 0.00 H new ATOM 0 H6 U A 27 1.384 -3.075 5.293 1.00 0.00 H new ATOM 29 P C A 28 4.366 -5.516 9.033 1.00 0.00 P ATOM 30 OP1 C A 28 4.798 -6.707 9.798 1.00 0.00 O ATOM 31 OP2 C A 28 3.183 -4.748 9.482 1.00 0.00 O ATOM 32 O5' C A 28 5.616 -4.504 8.951 1.00 0.00 O ATOM 33 C5' C A 28 6.936 -4.993 8.841 1.00 0.00 C ATOM 34 C4' C A 28 7.910 -3.819 8.767 1.00 0.00 C ATOM 35 O4' C A 28 7.496 -2.886 7.788 1.00 0.00 O ATOM 36 C3' C A 28 7.979 -3.020 10.061 1.00 0.00 C ATOM 37 O3' C A 28 8.765 -3.654 11.049 1.00 0.00 O ATOM 38 C2' C A 28 8.629 -1.752 9.533 1.00 0.00 C ATOM 39 O2' C A 28 10.014 -1.960 9.370 1.00 0.00 O ATOM 40 C1' C A 28 8.005 -1.610 8.146 1.00 0.00 C ATOM 41 N1 C A 28 6.940 -0.570 8.182 1.00 0.00 N ATOM 42 C2 C A 28 7.311 0.754 7.965 1.00 0.00 C ATOM 43 O2 C A 28 8.486 1.063 7.774 1.00 0.00 O ATOM 44 N3 C A 28 6.343 1.707 7.975 1.00 0.00 N ATOM 45 C4 C A 28 5.065 1.399 8.222 1.00 0.00 C ATOM 46 N4 C A 28 4.148 2.376 8.217 1.00 0.00 N ATOM 47 C5 C A 28 4.674 0.056 8.517 1.00 0.00 C ATOM 48 C6 C A 28 5.640 -0.885 8.486 1.00 0.00 C ATOM 0 H5' C A 28 7.032 -5.615 7.951 1.00 0.00 H new ATOM 0 H5'' C A 28 7.174 -5.623 9.698 1.00 0.00 H new ATOM 0 H4' C A 28 8.875 -4.272 8.542 1.00 0.00 H new ATOM 0 H3' C A 28 7.024 -2.878 10.568 1.00 0.00 H new ATOM 0 H2' C A 28 8.488 -0.892 10.187 1.00 0.00 H new ATOM 0 HO2' C A 28 10.280 -2.775 9.844 1.00 0.00 H new ATOM 0 H1' C A 28 8.733 -1.289 7.401 1.00 0.00 H new ATOM 0 H41 C A 28 3.169 2.158 8.403 1.00 0.00 H new ATOM 0 H42 C A 28 4.429 3.338 8.027 1.00 0.00 H new ATOM 0 H5 C A 28 3.650 -0.194 8.754 1.00 0.00 H new ATOM 0 H6 C A 28 5.384 -1.911 8.706 1.00 0.00 H new ATOM 60 P A A 29 8.714 -3.173 12.590 1.00 0.00 P ATOM 61 OP1 A A 29 9.601 -4.059 13.376 1.00 0.00 O ATOM 62 OP2 A A 29 7.292 -3.034 12.977 1.00 0.00 O ATOM 63 O5' A A 29 9.371 -1.703 12.572 1.00 0.00 O ATOM 64 C5' A A 29 10.772 -1.536 12.557 1.00 0.00 C ATOM 65 C4' A A 29 11.115 -0.049 12.493 1.00 0.00 C ATOM 66 O4' A A 29 10.419 0.594 11.439 1.00 0.00 O ATOM 67 C3' A A 29 10.711 0.714 13.747 1.00 0.00 C ATOM 68 O3' A A 29 11.599 0.530 14.829 1.00 0.00 O ATOM 69 C2' A A 29 10.779 2.132 13.206 1.00 0.00 C ATOM 70 O2' A A 29 12.123 2.544 13.092 1.00 0.00 O ATOM 71 C1' A A 29 10.211 1.952 11.802 1.00 0.00 C ATOM 72 N9 A A 29 8.768 2.264 11.824 1.00 0.00 N ATOM 73 C8 A A 29 7.705 1.432 12.065 1.00 0.00 C ATOM 74 N7 A A 29 6.546 2.030 12.036 1.00 0.00 N ATOM 75 C5 A A 29 6.864 3.357 11.764 1.00 0.00 C ATOM 76 C6 A A 29 6.078 4.510 11.614 1.00 0.00 C ATOM 77 N6 A A 29 4.741 4.510 11.712 1.00 0.00 N ATOM 78 N1 A A 29 6.715 5.663 11.366 1.00 0.00 N ATOM 79 C2 A A 29 8.037 5.666 11.272 1.00 0.00 C ATOM 80 N3 A A 29 8.887 4.658 11.388 1.00 0.00 N ATOM 81 C4 A A 29 8.218 3.509 11.639 1.00 0.00 C ATOM 0 H5' A A 29 11.200 -2.055 11.699 1.00 0.00 H new ATOM 0 H5'' A A 29 11.210 -1.982 13.450 1.00 0.00 H new ATOM 0 H4' A A 29 12.196 -0.028 12.359 1.00 0.00 H new ATOM 0 H3' A A 29 9.754 0.406 14.168 1.00 0.00 H new ATOM 0 H2' A A 29 10.263 2.864 13.828 1.00 0.00 H new ATOM 0 HO2' A A 29 12.669 2.064 13.749 1.00 0.00 H new ATOM 0 H1' A A 29 10.695 2.614 11.084 1.00 0.00 H new ATOM 0 H8 A A 29 7.817 0.376 12.261 1.00 0.00 H new ATOM 0 H61 A A 29 4.221 5.379 11.594 1.00 0.00 H new ATOM 0 H62 A A 29 4.244 3.641 11.905 1.00 0.00 H new ATOM 0 H2 A A 29 8.485 6.628 11.072 1.00 0.00 H new ATOM 93 P G A 30 11.131 0.852 16.340 1.00 0.00 P ATOM 94 OP1 G A 30 12.292 0.645 17.234 1.00 0.00 O ATOM 95 OP2 G A 30 9.875 0.110 16.590 1.00 0.00 O ATOM 96 O5' G A 30 10.783 2.427 16.335 1.00 0.00 O ATOM 97 C5' G A 30 11.799 3.400 16.442 1.00 0.00 C ATOM 98 C4' G A 30 11.190 4.802 16.421 1.00 0.00 C ATOM 99 O4' G A 30 10.351 4.988 15.295 1.00 0.00 O ATOM 100 C3' G A 30 10.302 5.092 17.623 1.00 0.00 C ATOM 101 O3' G A 30 11.034 5.385 18.794 1.00 0.00 O ATOM 102 C2' G A 30 9.561 6.309 17.097 1.00 0.00 C ATOM 103 O2' G A 30 10.401 7.442 17.130 1.00 0.00 O ATOM 104 C1' G A 30 9.337 5.923 15.637 1.00 0.00 C ATOM 105 N9 G A 30 8.006 5.301 15.496 1.00 0.00 N ATOM 106 C8 G A 30 7.672 3.972 15.473 1.00 0.00 C ATOM 107 N7 G A 30 6.395 3.749 15.344 1.00 0.00 N ATOM 108 C5 G A 30 5.838 5.022 15.277 1.00 0.00 C ATOM 109 C6 G A 30 4.480 5.412 15.138 1.00 0.00 C ATOM 110 O6 G A 30 3.487 4.695 15.042 1.00 0.00 O ATOM 111 N1 G A 30 4.348 6.793 15.119 1.00 0.00 N ATOM 112 C2 G A 30 5.390 7.692 15.220 1.00 0.00 C ATOM 113 N2 G A 30 5.067 8.992 15.184 1.00 0.00 N ATOM 114 N3 G A 30 6.670 7.325 15.350 1.00 0.00 N ATOM 115 C4 G A 30 6.817 5.979 15.371 1.00 0.00 C ATOM 0 H5' G A 30 12.506 3.290 15.620 1.00 0.00 H new ATOM 0 H5'' G A 30 12.359 3.252 17.366 1.00 0.00 H new ATOM 0 H4' G A 30 12.055 5.465 16.412 1.00 0.00 H new ATOM 0 H3' G A 30 9.675 4.257 17.936 1.00 0.00 H new ATOM 0 H2' G A 30 8.660 6.550 17.661 1.00 0.00 H new ATOM 0 HO2' G A 30 11.088 7.320 17.818 1.00 0.00 H new ATOM 0 H1' G A 30 9.381 6.794 14.983 1.00 0.00 H new ATOM 0 H8 G A 30 8.402 3.180 15.555 1.00 0.00 H new ATOM 0 H1 G A 30 3.407 7.174 15.023 1.00 0.00 H new ATOM 0 H21 G A 30 5.797 9.701 15.255 1.00 0.00 H new ATOM 0 H22 G A 30 4.091 9.272 15.086 1.00 0.00 H new ATOM 127 P A A 31 10.338 5.295 20.248 1.00 0.00 P ATOM 128 OP1 A A 31 11.344 5.682 21.263 1.00 0.00 O ATOM 129 OP2 A A 31 9.668 3.979 20.349 1.00 0.00 O ATOM 130 O5' A A 31 9.196 6.432 20.224 1.00 0.00 O ATOM 131 C5' A A 31 9.511 7.785 20.473 1.00 0.00 C ATOM 132 C4' A A 31 8.240 8.630 20.418 1.00 0.00 C ATOM 133 O4' A A 31 7.522 8.394 19.222 1.00 0.00 O ATOM 134 C3' A A 31 7.267 8.310 21.544 1.00 0.00 C ATOM 135 O3' A A 31 7.641 8.924 22.759 1.00 0.00 O ATOM 136 C2' A A 31 5.996 8.912 20.967 1.00 0.00 C ATOM 137 O2' A A 31 5.995 10.313 21.137 1.00 0.00 O ATOM 138 C1' A A 31 6.142 8.610 19.478 1.00 0.00 C ATOM 139 N9 A A 31 5.376 7.396 19.142 1.00 0.00 N ATOM 140 C8 A A 31 5.803 6.095 19.072 1.00 0.00 C ATOM 141 N7 A A 31 4.867 5.247 18.747 1.00 0.00 N ATOM 142 C5 A A 31 3.737 6.043 18.591 1.00 0.00 C ATOM 143 C6 A A 31 2.407 5.750 18.248 1.00 0.00 C ATOM 144 N6 A A 31 1.969 4.510 17.988 1.00 0.00 N ATOM 145 N1 A A 31 1.545 6.775 18.185 1.00 0.00 N ATOM 146 C2 A A 31 1.976 8.001 18.443 1.00 0.00 C ATOM 147 N3 A A 31 3.191 8.408 18.773 1.00 0.00 N ATOM 148 C4 A A 31 4.038 7.355 18.830 1.00 0.00 C ATOM 0 H5' A A 31 10.229 8.143 19.735 1.00 0.00 H new ATOM 0 H5'' A A 31 9.983 7.884 21.451 1.00 0.00 H new ATOM 0 H4' A A 31 8.588 9.660 20.495 1.00 0.00 H new ATOM 0 H3' A A 31 7.198 7.254 21.806 1.00 0.00 H new ATOM 0 H2' A A 31 5.089 8.523 21.430 1.00 0.00 H new ATOM 0 HO2' A A 31 6.521 10.547 21.930 1.00 0.00 H new ATOM 0 H1' A A 31 5.763 9.436 18.876 1.00 0.00 H new ATOM 0 H8 A A 31 6.823 5.799 19.268 1.00 0.00 H new ATOM 0 H61 A A 31 0.991 4.355 17.744 1.00 0.00 H new ATOM 0 H62 A A 31 2.614 3.721 18.035 1.00 0.00 H new ATOM 0 H2 A A 31 1.230 8.779 18.374 1.00 0.00 H new ATOM 160 P C A 32 7.155 8.324 24.176 1.00 0.00 P ATOM 161 OP1 C A 32 7.660 9.211 25.248 1.00 0.00 O ATOM 162 OP2 C A 32 7.493 6.884 24.198 1.00 0.00 O ATOM 163 O5' C A 32 5.551 8.457 24.136 1.00 0.00 O ATOM 164 C5' C A 32 4.915 9.694 24.367 1.00 0.00 C ATOM 165 C4' C A 32 3.401 9.511 24.272 1.00 0.00 C ATOM 166 O4' C A 32 3.034 8.920 23.041 1.00 0.00 O ATOM 167 C3' C A 32 2.836 8.586 25.340 1.00 0.00 C ATOM 168 O3' C A 32 2.699 9.240 26.582 1.00 0.00 O ATOM 169 C2' C A 32 1.484 8.281 24.720 1.00 0.00 C ATOM 170 O2' C A 32 0.604 9.357 24.958 1.00 0.00 O ATOM 171 C1' C A 32 1.810 8.225 23.228 1.00 0.00 C ATOM 172 N1 C A 32 1.905 6.804 22.792 1.00 0.00 N ATOM 173 C2 C A 32 0.726 6.154 22.438 1.00 0.00 C ATOM 174 O2 C A 32 -0.361 6.722 22.520 1.00 0.00 O ATOM 175 N3 C A 32 0.801 4.868 22.006 1.00 0.00 N ATOM 176 C4 C A 32 1.969 4.220 21.949 1.00 0.00 C ATOM 177 N4 C A 32 1.990 2.953 21.511 1.00 0.00 N ATOM 178 C5 C A 32 3.182 4.847 22.372 1.00 0.00 C ATOM 179 C6 C A 32 3.099 6.129 22.784 1.00 0.00 C ATOM 0 H5' C A 32 5.250 10.430 23.636 1.00 0.00 H new ATOM 0 H5'' C A 32 5.185 10.076 25.351 1.00 0.00 H new ATOM 0 H4' C A 32 3.001 10.518 24.390 1.00 0.00 H new ATOM 0 H3' C A 32 3.452 7.716 25.569 1.00 0.00 H new ATOM 0 H2' C A 32 1.016 7.377 25.109 1.00 0.00 H new ATOM 0 HO2' C A 32 0.882 9.834 25.768 1.00 0.00 H new ATOM 0 H1' C A 32 1.032 8.693 22.625 1.00 0.00 H new ATOM 0 H41 C A 32 2.873 2.445 21.462 1.00 0.00 H new ATOM 0 H42 C A 32 1.123 2.497 21.227 1.00 0.00 H new ATOM 0 H5 C A 32 4.123 4.318 22.362 1.00 0.00 H new ATOM 0 H6 C A 32 3.993 6.636 23.115 1.00 0.00 H new ATOM 191 P U A 33 3.604 8.812 27.843 1.00 0.00 P ATOM 192 OP1 U A 33 3.457 9.841 28.896 1.00 0.00 O ATOM 193 OP2 U A 33 4.952 8.444 27.353 1.00 0.00 O ATOM 194 O5' U A 33 2.863 7.474 28.342 1.00 0.00 O ATOM 195 C5' U A 33 1.610 7.554 28.984 1.00 0.00 C ATOM 196 C4' U A 33 1.056 6.158 29.260 1.00 0.00 C ATOM 197 O4' U A 33 0.879 5.427 28.067 1.00 0.00 O ATOM 198 C3' U A 33 1.967 5.283 30.108 1.00 0.00 C ATOM 199 O3' U A 33 1.932 5.655 31.469 1.00 0.00 O ATOM 200 C2' U A 33 1.324 3.929 29.855 1.00 0.00 C ATOM 201 O2' U A 33 0.220 3.769 30.716 1.00 0.00 O ATOM 202 C1' U A 33 0.816 4.053 28.416 1.00 0.00 C ATOM 203 N1 U A 33 1.627 3.201 27.506 1.00 0.00 N ATOM 204 C2 U A 33 1.294 1.854 27.427 1.00 0.00 C ATOM 205 O2 U A 33 0.389 1.353 28.090 1.00 0.00 O ATOM 206 N3 U A 33 2.047 1.082 26.555 1.00 0.00 N ATOM 207 C4 U A 33 3.104 1.525 25.777 1.00 0.00 C ATOM 208 O4 U A 33 3.697 0.755 25.024 1.00 0.00 O ATOM 209 C5 U A 33 3.411 2.924 25.955 1.00 0.00 C ATOM 210 C6 U A 33 2.687 3.699 26.791 1.00 0.00 C ATOM 0 H5' U A 33 0.911 8.112 28.360 1.00 0.00 H new ATOM 0 H5'' U A 33 1.710 8.103 29.920 1.00 0.00 H new ATOM 0 H4' U A 33 0.122 6.358 29.784 1.00 0.00 H new ATOM 0 H3' U A 33 3.028 5.336 29.864 1.00 0.00 H new ATOM 0 H2' U A 33 2.001 3.090 30.014 1.00 0.00 H new ATOM 0 HO2' U A 33 0.537 3.641 31.634 1.00 0.00 H new ATOM 0 H1' U A 33 -0.212 3.702 28.324 1.00 0.00 H new ATOM 0 H3 U A 33 1.799 0.095 26.479 1.00 0.00 H new ATOM 0 H5 U A 33 4.235 3.359 25.409 1.00 0.00 H new ATOM 0 H6 U A 33 2.950 4.741 26.900 1.00 0.00 H new HETATM 221 N1 U8U A 34 -2.039 1.261 33.695 1.00 0.00 N HETATM 222 C2 U8U A 34 -3.150 0.565 33.953 1.00 0.00 C HETATM 223 S2 U8U A 34 -3.086 -1.148 34.534 1.00 0.00 S HETATM 224 N3 U8U A 34 -4.385 1.169 33.783 1.00 0.00 N HETATM 225 C4 U8U A 34 -4.609 2.469 33.366 1.00 0.00 C HETATM 226 O4 U8U A 34 -5.757 2.898 33.272 1.00 0.00 O HETATM 227 C5 U8U A 34 -3.400 3.201 33.060 1.00 0.00 C HETATM 228 C6 U8U A 34 -2.182 2.624 33.197 1.00 0.00 C HETATM 229 C U8U A 34 -3.496 4.636 32.581 1.00 0.00 C HETATM 230 N U8U A 34 -3.288 4.681 31.123 1.00 0.00 N HETATM 231 CA U8U A 34 -3.435 6.029 30.547 1.00 0.00 C HETATM 232 C1' U8U A 34 -0.699 0.731 33.901 1.00 0.00 C HETATM 233 O2' U8U A 34 -0.051 -1.352 32.908 1.00 0.00 O HETATM 234 C2' U8U A 34 -0.164 0.030 32.651 1.00 0.00 C HETATM 235 O3' U8U A 34 2.221 -0.313 32.083 1.00 0.00 O HETATM 236 C3' U8U A 34 1.214 0.652 32.404 1.00 0.00 C HETATM 237 C4' U8U A 34 1.525 1.324 33.735 1.00 0.00 C HETATM 238 O4' U8U A 34 0.260 1.728 34.243 1.00 0.00 O HETATM 239 C5' U8U A 34 2.490 2.504 33.653 1.00 0.00 C HETATM 240 O5' U8U A 34 1.978 3.510 32.806 1.00 0.00 O HETATM 241 P U8U A 34 2.810 4.866 32.565 1.00 0.00 P HETATM 242 OP1 U8U A 34 2.784 5.647 33.823 1.00 0.00 O HETATM 243 OP2 U8U A 34 4.107 4.511 31.948 1.00 0.00 O HETATM 0 HO2' U8U A 34 0.893 -1.614 32.878 1.00 0.00 H new HETATM 0 H5'' U8U A 34 2.659 2.912 34.650 1.00 0.00 H new HETATM 0 HN3 U8U A 34 -5.208 0.601 33.985 1.00 0.00 H new HETATM 0 HN1 U8U A 34 -3.064 3.857 30.565 1.00 0.00 H new HETATM 0 HC2 U8U A 34 -4.472 5.050 32.833 1.00 0.00 H new HETATM 0 HC1 U8U A 34 -2.749 5.250 33.085 1.00 0.00 H new HETATM 0 HA3 U8U A 34 -4.441 6.401 30.743 1.00 0.00 H new HETATM 0 HA2 U8U A 34 -2.705 6.700 31.000 1.00 0.00 H new HETATM 0 HA1 U8U A 34 -3.268 5.985 29.471 1.00 0.00 H new HETATM 0 H6 U8U A 34 -1.290 3.191 32.929 1.00 0.00 H new HETATM 0 H5' U8U A 34 3.456 2.165 33.280 1.00 0.00 H new HETATM 0 H4' U8U A 34 2.050 0.623 34.384 1.00 0.00 H new HETATM 0 H3' U8U A 34 1.205 1.327 31.548 1.00 0.00 H new HETATM 0 H2' U8U A 34 -0.815 0.150 31.785 1.00 0.00 H new HETATM 0 H1' U8U A 34 -0.817 0.033 34.730 1.00 0.00 H new ATOM 260 P U A 35 2.126 -0.807 30.542 1.00 0.00 P ATOM 261 OP1 U A 35 3.082 -1.925 30.382 1.00 0.00 O ATOM 262 OP2 U A 35 2.260 0.383 29.673 1.00 0.00 O ATOM 263 O5' U A 35 0.640 -1.400 30.335 1.00 0.00 O ATOM 264 C5' U A 35 0.408 -2.794 30.333 1.00 0.00 C ATOM 265 C4' U A 35 -1.048 -3.082 29.969 1.00 0.00 C ATOM 266 O4' U A 35 -1.953 -2.326 30.745 1.00 0.00 O ATOM 267 C3' U A 35 -1.386 -2.680 28.542 1.00 0.00 C ATOM 268 O3' U A 35 -0.853 -3.579 27.590 1.00 0.00 O ATOM 269 C2' U A 35 -2.906 -2.731 28.615 1.00 0.00 C ATOM 270 O2' U A 35 -3.345 -4.049 28.381 1.00 0.00 O ATOM 271 C1' U A 35 -3.203 -2.390 30.078 1.00 0.00 C ATOM 272 N1 U A 35 -3.935 -1.101 30.172 1.00 0.00 N ATOM 273 C2 U A 35 -5.309 -1.113 30.389 1.00 0.00 C ATOM 274 O2 U A 35 -5.966 -2.146 30.510 1.00 0.00 O ATOM 275 N3 U A 35 -5.929 0.125 30.459 1.00 0.00 N ATOM 276 C4 U A 35 -5.317 1.358 30.305 1.00 0.00 C ATOM 277 O4 U A 35 -5.966 2.398 30.392 1.00 0.00 O ATOM 278 C5 U A 35 -3.902 1.275 30.039 1.00 0.00 C ATOM 279 C6 U A 35 -3.272 0.082 29.983 1.00 0.00 C ATOM 0 H5' U A 35 0.635 -3.210 31.315 1.00 0.00 H new ATOM 0 H5'' U A 35 1.073 -3.280 29.619 1.00 0.00 H new ATOM 0 H4' U A 35 -1.145 -4.155 30.132 1.00 0.00 H new ATOM 0 H3' U A 35 -0.977 -1.722 28.221 1.00 0.00 H new ATOM 0 H2' U A 35 -3.386 -2.070 27.893 1.00 0.00 H new ATOM 0 HO2' U A 35 -2.591 -4.595 28.075 1.00 0.00 H new ATOM 0 H1' U A 35 -3.840 -3.145 30.539 1.00 0.00 H new ATOM 0 H3 U A 35 -6.933 0.128 30.641 1.00 0.00 H new ATOM 0 H5 U A 35 -3.337 2.182 29.882 1.00 0.00 H new ATOM 0 H6 U A 35 -2.211 0.060 29.783 1.00 0.00 H new ATOM 290 P U A 36 -0.707 -3.164 26.035 1.00 0.00 P ATOM 291 OP1 U A 36 -0.045 -4.280 25.324 1.00 0.00 O ATOM 292 OP2 U A 36 -0.116 -1.808 25.977 1.00 0.00 O ATOM 293 O5' U A 36 -2.225 -3.071 25.504 1.00 0.00 O ATOM 294 C5' U A 36 -2.932 -4.234 25.132 1.00 0.00 C ATOM 295 C4' U A 36 -4.363 -3.864 24.748 1.00 0.00 C ATOM 296 O4' U A 36 -4.962 -3.059 25.746 1.00 0.00 O ATOM 297 C3' U A 36 -4.441 -3.028 23.478 1.00 0.00 C ATOM 298 O3' U A 36 -4.293 -3.795 22.301 1.00 0.00 O ATOM 299 C2' U A 36 -5.854 -2.488 23.627 1.00 0.00 C ATOM 300 O2' U A 36 -6.785 -3.488 23.277 1.00 0.00 O ATOM 301 C1' U A 36 -5.958 -2.253 25.132 1.00 0.00 C ATOM 302 N1 U A 36 -5.777 -0.804 25.422 1.00 0.00 N ATOM 303 C2 U A 36 -6.898 0.013 25.346 1.00 0.00 C ATOM 304 O2 U A 36 -8.013 -0.408 25.043 1.00 0.00 O ATOM 305 N3 U A 36 -6.702 1.358 25.622 1.00 0.00 N ATOM 306 C4 U A 36 -5.494 1.962 25.927 1.00 0.00 C ATOM 307 O4 U A 36 -5.435 3.166 26.164 1.00 0.00 O ATOM 308 C5 U A 36 -4.373 1.054 25.924 1.00 0.00 C ATOM 309 C6 U A 36 -4.541 -0.264 25.679 1.00 0.00 C ATOM 0 H5' U A 36 -2.939 -4.947 25.957 1.00 0.00 H new ATOM 0 H5'' U A 36 -2.434 -4.721 24.294 1.00 0.00 H new ATOM 0 H4' U A 36 -4.868 -4.821 24.614 1.00 0.00 H new ATOM 0 H3' U A 36 -3.655 -2.279 23.377 1.00 0.00 H new ATOM 0 H2' U A 36 -6.048 -1.610 23.010 1.00 0.00 H new ATOM 0 HO2' U A 36 -6.388 -4.086 22.610 1.00 0.00 H new ATOM 0 H1' U A 36 -6.936 -2.530 25.526 1.00 0.00 H new ATOM 0 H3 U A 36 -7.526 1.959 25.598 1.00 0.00 H new ATOM 0 H5 U A 36 -3.382 1.435 26.121 1.00 0.00 H new ATOM 0 H6 U A 36 -3.677 -0.912 25.685 1.00 0.00 H new HETATM 320 P T6A A 37 -3.905 -3.094 20.899 1.00 0.00 P HETATM 321 OP1 T6A A 37 -3.852 -4.146 19.859 1.00 0.00 O HETATM 322 OP2 T6A A 37 -2.720 -2.239 21.134 1.00 0.00 O HETATM 323 O5' T6A A 37 -5.153 -2.130 20.566 1.00 0.00 O HETATM 324 C5' T6A A 37 -6.295 -2.618 19.894 1.00 0.00 C HETATM 325 C4' T6A A 37 -7.322 -1.499 19.781 1.00 0.00 C HETATM 326 O4' T6A A 37 -7.443 -0.818 21.027 1.00 0.00 O HETATM 327 C3' T6A A 37 -6.948 -0.427 18.769 1.00 0.00 C HETATM 328 O3' T6A A 37 -7.377 -0.799 17.453 1.00 0.00 O HETATM 329 C2' T6A A 37 -7.675 0.800 19.312 1.00 0.00 C HETATM 330 O2' T6A A 37 -8.946 0.924 18.719 1.00 0.00 O HETATM 331 C1' T6A A 37 -7.841 0.534 20.805 1.00 0.00 C HETATM 332 N9 T6A A 37 -7.030 1.457 21.573 1.00 0.00 N HETATM 333 C8 T6A A 37 -5.693 1.333 21.813 1.00 0.00 C HETATM 334 N7 T6A A 37 -5.224 2.381 22.438 1.00 0.00 N HETATM 335 C5 T6A A 37 -6.332 3.223 22.590 1.00 0.00 C HETATM 336 C6 T6A A 37 -6.498 4.497 23.144 1.00 0.00 C HETATM 337 N6 T6A A 37 -5.352 5.196 23.715 1.00 0.00 N HETATM 338 N1 T6A A 37 -7.733 5.024 23.106 1.00 0.00 N HETATM 339 C2 T6A A 37 -8.796 4.401 22.565 1.00 0.00 C HETATM 340 N3 T6A A 37 -8.702 3.184 22.005 1.00 0.00 N HETATM 341 C4 T6A A 37 -7.456 2.662 22.053 1.00 0.00 C HETATM 342 C10 T6A A 37 -5.395 6.470 24.266 1.00 0.00 C HETATM 343 O10 T6A A 37 -4.355 6.961 24.704 1.00 0.00 O HETATM 344 N11 T6A A 37 -6.565 7.204 24.333 1.00 0.00 N HETATM 345 C12 T6A A 37 -6.509 8.534 24.909 1.00 0.00 C HETATM 346 C13 T6A A 37 -6.105 8.443 26.374 1.00 0.00 C HETATM 347 ODA T6A A 37 -6.294 7.348 26.947 1.00 0.00 O HETATM 348 ODB T6A A 37 -5.616 9.469 26.893 1.00 0.00 O HETATM 349 C14 T6A A 37 -7.879 9.199 24.768 1.00 0.00 C HETATM 350 O14 T6A A 37 -8.871 8.248 25.083 1.00 0.00 O HETATM 351 C15 T6A A 37 -8.124 9.720 23.353 1.00 0.00 C HETATM 0 HO2' T6A A 37 -9.035 0.268 17.996 1.00 0.00 H new HETATM 0 H5'' T6A A 37 -6.022 -2.980 18.903 1.00 0.00 H new HETATM 0 H153 T6A A 37 -7.362 10.457 23.100 1.00 0.00 H new HETATM 0 H152 T6A A 37 -8.076 8.891 22.647 1.00 0.00 H new HETATM 0 H151 T6A A 37 -9.109 10.184 23.301 1.00 0.00 H new HETATM 0 HO4 T6A A 37 -9.757 8.659 24.999 1.00 0.00 H new HETATM 0 HN6 T6A A 37 -4.453 4.714 23.709 1.00 0.00 H new HETATM 0 HN1 T6A A 37 -7.444 6.820 23.986 1.00 0.00 H new HETATM 0 H8 T6A A 37 -5.093 0.471 21.521 1.00 0.00 H new HETATM 0 H5' T6A A 37 -6.718 -3.463 20.436 1.00 0.00 H new HETATM 0 H4' T6A A 37 -8.242 -1.993 19.469 1.00 0.00 H new HETATM 0 H3' T6A A 37 -5.876 -0.259 18.661 1.00 0.00 H new HETATM 0 H2' T6A A 37 -7.124 1.717 19.104 1.00 0.00 H new HETATM 0 H2 T6A A 37 -9.765 4.900 22.582 1.00 0.00 H new HETATM 0 H14 T6A A 37 -7.914 10.052 25.446 1.00 0.00 H new HETATM 0 H13 T6A A 37 -5.399 9.289 27.832 1.00 0.00 H new HETATM 0 H12 T6A A 37 -5.767 9.135 24.384 1.00 0.00 H new HETATM 0 H1' T6A A 37 -8.873 0.682 21.124 1.00 0.00 H new ATOM 369 P A A 38 -6.791 0.190 16.305 1.00 0.00 P ATOM 370 OP1 A A 38 -7.380 -0.233 15.015 1.00 0.00 O ATOM 371 OP2 A A 38 -5.318 0.232 16.445 1.00 0.00 O ATOM 372 O5' A A 38 -7.354 1.664 16.629 1.00 0.00 O ATOM 373 C5' A A 38 -8.534 2.149 16.024 1.00 0.00 C ATOM 374 C4' A A 38 -8.784 3.580 16.498 1.00 0.00 C ATOM 375 O4' A A 38 -8.464 3.728 17.872 1.00 0.00 O ATOM 376 C3' A A 38 -7.906 4.598 15.783 1.00 0.00 C ATOM 377 O3' A A 38 -8.378 4.939 14.497 1.00 0.00 O ATOM 378 C2' A A 38 -8.051 5.766 16.743 1.00 0.00 C ATOM 379 O2' A A 38 -9.309 6.381 16.575 1.00 0.00 O ATOM 380 C1' A A 38 -8.030 5.064 18.094 1.00 0.00 C ATOM 381 N9 A A 38 -6.646 5.096 18.610 1.00 0.00 N ATOM 382 C8 A A 38 -5.622 4.205 18.414 1.00 0.00 C ATOM 383 N7 A A 38 -4.498 4.553 18.976 1.00 0.00 N ATOM 384 C5 A A 38 -4.791 5.773 19.575 1.00 0.00 C ATOM 385 C6 A A 38 -4.013 6.677 20.316 1.00 0.00 C ATOM 386 N6 A A 38 -2.723 6.470 20.612 1.00 0.00 N ATOM 387 N1 A A 38 -4.606 7.806 20.730 1.00 0.00 N ATOM 388 C2 A A 38 -5.880 8.015 20.433 1.00 0.00 C ATOM 389 N3 A A 38 -6.719 7.246 19.755 1.00 0.00 N ATOM 390 C4 A A 38 -6.095 6.118 19.348 1.00 0.00 C ATOM 0 H5' A A 38 -9.380 1.513 16.285 1.00 0.00 H new ATOM 0 H5'' A A 38 -8.439 2.123 14.938 1.00 0.00 H new ATOM 0 H4' A A 38 -9.839 3.759 16.292 1.00 0.00 H new ATOM 0 H3' A A 38 -6.890 4.253 15.591 1.00 0.00 H new ATOM 0 H2' A A 38 -7.291 6.537 16.611 1.00 0.00 H new ATOM 0 HO2' A A 38 -9.570 6.339 15.631 1.00 0.00 H new ATOM 0 H1' A A 38 -8.680 5.545 18.825 1.00 0.00 H new ATOM 0 H8 A A 38 -5.737 3.295 17.844 1.00 0.00 H new ATOM 0 H61 A A 38 -2.207 7.163 21.154 1.00 0.00 H new ATOM 0 H62 A A 38 -2.257 5.620 20.295 1.00 0.00 H new ATOM 0 H2 A A 38 -6.293 8.945 20.795 1.00 0.00 H new HETATM 402 N1 PSU A 39 -2.382 5.841 15.921 1.00 0.00 N HETATM 403 C2 PSU A 39 -1.327 6.137 16.683 1.00 0.00 C HETATM 404 N3 PSU A 39 -1.283 7.367 17.317 1.00 0.00 N HETATM 405 C4 PSU A 39 -2.255 8.351 17.252 1.00 0.00 C HETATM 406 C5 PSU A 39 -3.405 8.001 16.451 1.00 0.00 C HETATM 407 C6 PSU A 39 -3.440 6.826 15.778 1.00 0.00 C HETATM 408 O2 PSU A 39 -0.398 5.347 16.834 1.00 0.00 O HETATM 409 O4 PSU A 39 -2.103 9.417 17.846 1.00 0.00 O HETATM 410 C1' PSU A 39 -4.482 9.061 16.206 1.00 0.00 C HETATM 411 C2' PSU A 39 -4.165 9.885 14.960 1.00 0.00 C HETATM 412 O2' PSU A 39 -4.301 11.253 15.267 1.00 0.00 O HETATM 413 C3' PSU A 39 -5.222 9.463 13.941 1.00 0.00 C HETATM 414 C4' PSU A 39 -6.375 9.038 14.834 1.00 0.00 C HETATM 415 O3' PSU A 39 -5.633 10.525 13.072 1.00 0.00 O HETATM 416 O4' PSU A 39 -5.768 8.479 15.996 1.00 0.00 O HETATM 417 C5' PSU A 39 -7.315 8.030 14.178 1.00 0.00 C HETATM 418 O5' PSU A 39 -6.660 6.785 14.068 1.00 0.00 O HETATM 419 P PSU A 39 -7.371 5.515 13.374 1.00 0.00 P HETATM 420 OP1 PSU A 39 -8.183 6.009 12.239 1.00 0.00 O HETATM 421 OP2 PSU A 39 -6.331 4.489 13.136 1.00 0.00 O HETATM 0 HO2' PSU A 39 -4.947 11.663 14.655 1.00 0.00 H new HETATM 0 H5'' PSU A 39 -8.224 7.925 14.770 1.00 0.00 H new HETATM 0 HN3 PSU A 39 -0.459 7.567 17.884 1.00 0.00 H new HETATM 0 HN1 PSU A 39 -2.444 4.940 15.448 1.00 0.00 H new HETATM 0 H6 PSU A 39 -4.279 6.615 15.115 1.00 0.00 H new HETATM 0 H5' PSU A 39 -7.616 8.384 13.192 1.00 0.00 H new HETATM 0 H4' PSU A 39 -7.007 9.897 15.059 1.00 0.00 H new HETATM 0 H3' PSU A 39 -4.852 8.693 13.264 1.00 0.00 H new HETATM 0 H2' PSU A 39 -3.153 9.727 14.587 1.00 0.00 H new HETATM 0 H1' PSU A 39 -4.493 9.685 17.100 1.00 0.00 H new ATOM 432 P C A 40 -4.540 10.850 11.918 1.00 0.00 P ATOM 433 OP1 C A 40 -5.051 12.001 11.141 1.00 0.00 O ATOM 434 OP2 C A 40 -4.232 9.587 11.210 1.00 0.00 O ATOM 435 O5' C A 40 -3.195 11.327 12.670 1.00 0.00 O ATOM 436 C5' C A 40 -2.935 12.690 12.934 1.00 0.00 C ATOM 437 C4' C A 40 -1.517 12.812 13.487 1.00 0.00 C ATOM 438 O4' C A 40 -1.247 11.793 14.430 1.00 0.00 O ATOM 439 C3' C A 40 -0.482 12.615 12.391 1.00 0.00 C ATOM 440 O3' C A 40 -0.310 13.790 11.626 1.00 0.00 O ATOM 441 C2' C A 40 0.744 12.286 13.229 1.00 0.00 C ATOM 442 O2' C A 40 1.334 13.478 13.697 1.00 0.00 O ATOM 443 C1' C A 40 0.151 11.540 14.424 1.00 0.00 C ATOM 444 N1 C A 40 0.442 10.084 14.311 1.00 0.00 N ATOM 445 C2 C A 40 1.596 9.588 14.913 1.00 0.00 C ATOM 446 O2 C A 40 2.391 10.333 15.483 1.00 0.00 O ATOM 447 N3 C A 40 1.833 8.251 14.852 1.00 0.00 N ATOM 448 C4 C A 40 1.005 7.425 14.203 1.00 0.00 C ATOM 449 N4 C A 40 1.281 6.115 14.176 1.00 0.00 N ATOM 450 C5 C A 40 -0.145 7.925 13.515 1.00 0.00 C ATOM 451 C6 C A 40 -0.379 9.251 13.597 1.00 0.00 C ATOM 0 H5' C A 40 -3.657 13.082 13.651 1.00 0.00 H new ATOM 0 H5'' C A 40 -3.039 13.279 12.023 1.00 0.00 H new ATOM 0 H4' C A 40 -1.456 13.805 13.932 1.00 0.00 H new ATOM 0 H3' C A 40 -0.733 11.858 11.649 1.00 0.00 H new ATOM 0 H2' C A 40 1.501 11.726 12.680 1.00 0.00 H new ATOM 0 HO2' C A 40 0.962 14.241 13.208 1.00 0.00 H new ATOM 0 H1' C A 40 0.591 11.882 15.361 1.00 0.00 H new ATOM 0 H41 C A 40 0.659 5.473 13.685 1.00 0.00 H new ATOM 0 H42 C A 40 2.113 5.759 14.646 1.00 0.00 H new ATOM 0 H5 C A 40 -0.797 7.270 12.955 1.00 0.00 H new ATOM 0 H6 C A 40 -1.235 9.667 13.087 1.00 0.00 H new ATOM 463 P U A 41 0.312 13.736 10.139 1.00 0.00 P ATOM 464 OP1 U A 41 0.352 15.116 9.607 1.00 0.00 O ATOM 465 OP2 U A 41 -0.404 12.682 9.385 1.00 0.00 O ATOM 466 O5' U A 41 1.829 13.245 10.359 1.00 0.00 O ATOM 467 C5' U A 41 2.844 14.152 10.732 1.00 0.00 C ATOM 468 C4' U A 41 4.189 13.426 10.799 1.00 0.00 C ATOM 469 O4' U A 41 4.121 12.302 11.655 1.00 0.00 O ATOM 470 C3' U A 41 4.639 12.870 9.454 1.00 0.00 C ATOM 471 O3' U A 41 5.184 13.867 8.615 1.00 0.00 O ATOM 472 C2' U A 41 5.685 11.870 9.919 1.00 0.00 C ATOM 473 O2' U A 41 6.897 12.530 10.212 1.00 0.00 O ATOM 474 C1' U A 41 5.083 11.349 11.223 1.00 0.00 C ATOM 475 N1 U A 41 4.474 10.011 10.990 1.00 0.00 N ATOM 476 C2 U A 41 5.295 8.895 11.105 1.00 0.00 C ATOM 477 O2 U A 41 6.493 8.969 11.370 1.00 0.00 O ATOM 478 N3 U A 41 4.693 7.664 10.895 1.00 0.00 N ATOM 479 C4 U A 41 3.370 7.448 10.547 1.00 0.00 C ATOM 480 O4 U A 41 2.937 6.308 10.394 1.00 0.00 O ATOM 481 C5 U A 41 2.607 8.661 10.387 1.00 0.00 C ATOM 482 C6 U A 41 3.164 9.871 10.606 1.00 0.00 C ATOM 0 H5' U A 41 2.611 14.595 11.700 1.00 0.00 H new ATOM 0 H5'' U A 41 2.897 14.969 10.012 1.00 0.00 H new ATOM 0 H4' U A 41 4.888 14.183 11.154 1.00 0.00 H new ATOM 0 H3' U A 41 3.841 12.447 8.844 1.00 0.00 H new ATOM 0 H2' U A 41 5.904 11.101 9.179 1.00 0.00 H new ATOM 0 HO2' U A 41 6.891 13.421 9.804 1.00 0.00 H new ATOM 0 H1' U A 41 5.841 11.226 11.997 1.00 0.00 H new ATOM 0 H3 U A 41 5.281 6.838 11.008 1.00 0.00 H new ATOM 0 H5 U A 41 1.571 8.600 10.087 1.00 0.00 H new ATOM 0 H6 U A 41 2.560 10.757 10.475 1.00 0.00 H new ATOM 493 P G A 42 5.362 13.612 7.032 1.00 0.00 P ATOM 494 OP1 G A 42 5.948 14.833 6.433 1.00 0.00 O ATOM 495 OP2 G A 42 4.084 13.082 6.508 1.00 0.00 O ATOM 496 O5' G A 42 6.462 12.440 6.942 1.00 0.00 O ATOM 497 C5' G A 42 7.840 12.731 7.026 1.00 0.00 C ATOM 498 C4' G A 42 8.648 11.438 6.925 1.00 0.00 C ATOM 499 O4' G A 42 8.213 10.494 7.886 1.00 0.00 O ATOM 500 C3' G A 42 8.497 10.735 5.581 1.00 0.00 C ATOM 501 O3' G A 42 9.273 11.330 4.563 1.00 0.00 O ATOM 502 C2' G A 42 9.010 9.357 5.963 1.00 0.00 C ATOM 503 O2' G A 42 10.418 9.371 6.034 1.00 0.00 O ATOM 504 C1' G A 42 8.456 9.192 7.376 1.00 0.00 C ATOM 505 N9 G A 42 7.191 8.432 7.327 1.00 0.00 N ATOM 506 C8 G A 42 5.917 8.890 7.108 1.00 0.00 C ATOM 507 N7 G A 42 5.009 7.956 7.122 1.00 0.00 N ATOM 508 C5 G A 42 5.730 6.792 7.367 1.00 0.00 C ATOM 509 C6 G A 42 5.274 5.453 7.489 1.00 0.00 C ATOM 510 O6 G A 42 4.124 5.027 7.405 1.00 0.00 O ATOM 511 N1 G A 42 6.325 4.580 7.734 1.00 0.00 N ATOM 512 C2 G A 42 7.650 4.945 7.847 1.00 0.00 C ATOM 513 N2 G A 42 8.526 3.960 8.084 1.00 0.00 N ATOM 514 N3 G A 42 8.080 6.207 7.731 1.00 0.00 N ATOM 515 C4 G A 42 7.066 7.073 7.493 1.00 0.00 C ATOM 0 H5' G A 42 8.058 13.235 7.968 1.00 0.00 H new ATOM 0 H5'' G A 42 8.127 13.413 6.226 1.00 0.00 H new ATOM 0 H4' G A 42 9.682 11.750 7.076 1.00 0.00 H new ATOM 0 H3' G A 42 7.491 10.760 5.161 1.00 0.00 H new ATOM 0 H2' G A 42 8.721 8.574 5.262 1.00 0.00 H new ATOM 0 HO2' G A 42 10.762 10.152 5.552 1.00 0.00 H new ATOM 0 H1' G A 42 9.159 8.652 8.010 1.00 0.00 H new ATOM 0 H8 G A 42 5.687 9.932 6.939 1.00 0.00 H new ATOM 0 H1 G A 42 6.100 3.591 7.839 1.00 0.00 H new ATOM 0 H21 G A 42 9.519 4.172 8.177 1.00 0.00 H new ATOM 0 H22 G A 42 8.200 2.998 8.172 1.00 0.00 H new ATOM 527 P A A 43 8.997 10.990 3.010 1.00 0.00 P ATOM 528 OP1 A A 43 9.966 11.753 2.193 1.00 0.00 O ATOM 529 OP2 A A 43 7.546 11.145 2.759 1.00 0.00 O ATOM 530 O5' A A 43 9.360 9.427 2.880 1.00 0.00 O ATOM 531 C5' A A 43 10.698 9.007 2.721 1.00 0.00 C ATOM 532 C4' A A 43 10.758 7.484 2.613 1.00 0.00 C ATOM 533 O4' A A 43 10.141 6.859 3.722 1.00 0.00 O ATOM 534 C3' A A 43 10.027 6.937 1.395 1.00 0.00 C ATOM 535 O3' A A 43 10.773 7.089 0.208 1.00 0.00 O ATOM 536 C2' A A 43 9.915 5.479 1.802 1.00 0.00 C ATOM 537 O2' A A 43 11.145 4.826 1.581 1.00 0.00 O ATOM 538 C1' A A 43 9.668 5.587 3.306 1.00 0.00 C ATOM 539 N9 A A 43 8.220 5.486 3.575 1.00 0.00 N ATOM 540 C8 A A 43 7.266 6.471 3.547 1.00 0.00 C ATOM 541 N7 A A 43 6.063 6.051 3.824 1.00 0.00 N ATOM 542 C5 A A 43 6.229 4.689 4.052 1.00 0.00 C ATOM 543 C6 A A 43 5.330 3.664 4.389 1.00 0.00 C ATOM 544 N6 A A 43 4.017 3.863 4.564 1.00 0.00 N ATOM 545 N1 A A 43 5.830 2.429 4.537 1.00 0.00 N ATOM 546 C2 A A 43 7.128 2.230 4.362 1.00 0.00 C ATOM 547 N3 A A 43 8.074 3.101 4.045 1.00 0.00 N ATOM 548 C4 A A 43 7.543 4.336 3.902 1.00 0.00 C ATOM 0 H5' A A 43 11.297 9.344 3.567 1.00 0.00 H new ATOM 0 H5'' A A 43 11.126 9.460 1.827 1.00 0.00 H new ATOM 0 H4' A A 43 11.824 7.266 2.552 1.00 0.00 H new ATOM 0 H3' A A 43 9.084 7.434 1.167 1.00 0.00 H new ATOM 0 H2' A A 43 9.151 4.925 1.257 1.00 0.00 H new ATOM 0 HO2' A A 43 11.640 5.291 0.875 1.00 0.00 H new ATOM 0 HO3' A A 43 10.266 6.723 -0.546 1.00 0.00 H new ATOM 0 H1' A A 43 10.180 4.789 3.843 1.00 0.00 H new ATOM 0 H8 A A 43 7.491 7.502 3.316 1.00 0.00 H new ATOM 0 H61 A A 43 3.411 3.080 4.808 1.00 0.00 H new ATOM 0 H62 A A 43 3.624 4.797 4.453 1.00 0.00 H new ATOM 0 H2 A A 43 7.463 1.212 4.497 1.00 0.00 H new TER 561 A A 43