USER MOD reduce.3.24.130724 H: found=0, std=0, add=176, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 176 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 -19:sc= 0.0873 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 A O2' : rot 180:sc= -0.0328 USER MOD Single : A 3 G O2' : rot 180:sc= -1.91 USER MOD Single : A 4 G O2' : rot -31:sc= -0.0875 USER MOD Single : A 5 U O2' : rot 180:sc= -0.335 USER MOD Single : A 6 C O2' : rot -14:sc= -0.313 USER MOD Single : A 7 U O2' : rot 180:sc= -0.442 USER MOD Single : A 8 C O2' : rot -17:sc= 0.12 USER MOD Single : A 8 C O3' : rot 180:sc= 0.152 USER MOD Single : B 9 G O2' : rot 180:sc= -0.397 USER MOD Single : B 9 G O5' : rot 180:sc=-0.00207 USER MOD Single : B 10 A O2' : rot 180:sc= -0.23 USER MOD Single : B 11 G O2' : rot 180:sc= -0.405 USER MOD Single : B 12 G O2' : rot -22:sc= -0.248 USER MOD Single : B 13 U O2' : rot -17:sc= -0.301 USER MOD Single : B 14 C O2' : rot -21:sc= 0.0542 USER MOD Single : B 15 U O2' : rot -75:sc= 0.354 USER MOD Single : B 16 C O2' : rot -23:sc= 0.121 USER MOD Single : B 16 C O3' : rot 180:sc= 0.108 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 6.641 -10.279 3.461 1.00 0.00 O ATOM 2 C5' G A 1 6.347 -9.218 4.344 1.00 0.00 C ATOM 3 C4' G A 1 7.258 -8.029 4.038 1.00 0.00 C ATOM 4 O4' G A 1 6.993 -7.493 2.741 1.00 0.00 O ATOM 5 C3' G A 1 7.023 -6.878 4.994 1.00 0.00 C ATOM 6 O3' G A 1 7.643 -7.073 6.251 1.00 0.00 O ATOM 7 C2' G A 1 7.663 -5.762 4.213 1.00 0.00 C ATOM 8 O2' G A 1 9.068 -5.892 4.260 1.00 0.00 O ATOM 9 C1' G A 1 7.192 -6.072 2.801 1.00 0.00 C ATOM 10 N9 G A 1 5.911 -5.383 2.552 1.00 0.00 N ATOM 11 C8 G A 1 4.637 -5.848 2.737 1.00 0.00 C ATOM 12 N7 G A 1 3.707 -4.990 2.422 1.00 0.00 N ATOM 13 C5 G A 1 4.417 -3.869 2.006 1.00 0.00 C ATOM 14 C6 G A 1 3.944 -2.604 1.550 1.00 0.00 C ATOM 15 O6 G A 1 2.782 -2.231 1.408 1.00 0.00 O ATOM 16 N1 G A 1 4.994 -1.741 1.253 1.00 0.00 N ATOM 17 C2 G A 1 6.331 -2.054 1.374 1.00 0.00 C ATOM 18 N2 G A 1 7.205 -1.095 1.050 1.00 0.00 N ATOM 19 N3 G A 1 6.778 -3.242 1.793 1.00 0.00 N ATOM 20 C4 G A 1 5.769 -4.097 2.092 1.00 0.00 C ATOM 0 H5' G A 1 6.487 -9.541 5.376 1.00 0.00 H new ATOM 0 H5'' G A 1 5.302 -8.925 4.241 1.00 0.00 H new ATOM 0 H4' G A 1 8.273 -8.417 4.121 1.00 0.00 H new ATOM 0 H3' G A 1 5.979 -6.718 5.262 1.00 0.00 H new ATOM 0 H2' G A 1 7.413 -4.765 4.575 1.00 0.00 H new ATOM 0 HO2' G A 1 9.318 -6.469 5.012 1.00 0.00 H new ATOM 0 HO5' G A 1 6.057 -11.041 3.659 1.00 0.00 H new ATOM 0 H1' G A 1 7.915 -5.741 2.056 1.00 0.00 H new ATOM 0 H8 G A 1 4.421 -6.838 3.111 1.00 0.00 H new ATOM 0 H1 G A 1 4.757 -0.806 0.921 1.00 0.00 H new ATOM 0 H21 G A 1 8.207 -1.273 1.121 1.00 0.00 H new ATOM 0 H22 G A 1 6.870 -0.186 0.732 1.00 0.00 H new ATOM 33 P A A 2 7.213 -6.181 7.528 1.00 0.00 P ATOM 34 OP1 A A 2 8.039 -6.602 8.681 1.00 0.00 O ATOM 35 OP2 A A 2 5.737 -6.220 7.631 1.00 0.00 O ATOM 36 O5' A A 2 7.645 -4.682 7.122 1.00 0.00 O ATOM 37 C5' A A 2 8.989 -4.258 7.223 1.00 0.00 C ATOM 38 C4' A A 2 9.097 -2.796 6.788 1.00 0.00 C ATOM 39 O4' A A 2 8.636 -2.609 5.453 1.00 0.00 O ATOM 40 C3' A A 2 8.232 -1.881 7.626 1.00 0.00 C ATOM 41 O3' A A 2 8.784 -1.632 8.907 1.00 0.00 O ATOM 42 C2' A A 2 8.215 -0.655 6.751 1.00 0.00 C ATOM 43 O2' A A 2 9.449 0.028 6.847 1.00 0.00 O ATOM 44 C1' A A 2 8.094 -1.279 5.361 1.00 0.00 C ATOM 45 N9 A A 2 6.665 -1.330 4.967 1.00 0.00 N ATOM 46 C8 A A 2 5.782 -2.380 5.035 1.00 0.00 C ATOM 47 N7 A A 2 4.575 -2.082 4.637 1.00 0.00 N ATOM 48 C5 A A 2 4.662 -0.741 4.276 1.00 0.00 C ATOM 49 C6 A A 2 3.718 0.178 3.775 1.00 0.00 C ATOM 50 N6 A A 2 2.437 -0.134 3.545 1.00 0.00 N ATOM 51 N1 A A 2 4.140 1.432 3.521 1.00 0.00 N ATOM 52 C2 A A 2 5.412 1.744 3.753 1.00 0.00 C ATOM 53 N3 A A 2 6.388 0.977 4.224 1.00 0.00 N ATOM 54 C4 A A 2 5.935 -0.276 4.468 1.00 0.00 C ATOM 0 H5' A A 2 9.626 -4.883 6.597 1.00 0.00 H new ATOM 0 H5'' A A 2 9.341 -4.370 8.249 1.00 0.00 H new ATOM 0 H4' A A 2 10.155 -2.555 6.896 1.00 0.00 H new ATOM 0 H3' A A 2 7.246 -2.280 7.865 1.00 0.00 H new ATOM 0 H2' A A 2 7.434 0.062 7.004 1.00 0.00 H new ATOM 0 HO2' A A 2 9.429 0.823 6.274 1.00 0.00 H new ATOM 0 H1' A A 2 8.631 -0.697 4.612 1.00 0.00 H new ATOM 0 H8 A A 2 6.061 -3.363 5.386 1.00 0.00 H new ATOM 0 H61 A A 2 1.797 0.572 3.181 1.00 0.00 H new ATOM 0 H62 A A 2 2.100 -1.078 3.733 1.00 0.00 H new ATOM 0 H2 A A 2 5.689 2.763 3.527 1.00 0.00 H new ATOM 66 P G A 3 7.893 -0.960 10.076 1.00 0.00 P ATOM 67 OP1 G A 3 8.730 -0.862 11.293 1.00 0.00 O ATOM 68 OP2 G A 3 6.600 -1.676 10.132 1.00 0.00 O ATOM 69 O5' G A 3 7.613 0.532 9.543 1.00 0.00 O ATOM 70 C5' G A 3 8.613 1.528 9.605 1.00 0.00 C ATOM 71 C4' G A 3 8.071 2.820 8.992 1.00 0.00 C ATOM 72 O4' G A 3 7.672 2.606 7.636 1.00 0.00 O ATOM 73 C3' G A 3 6.810 3.307 9.673 1.00 0.00 C ATOM 74 O3' G A 3 6.973 3.847 10.998 1.00 0.00 O ATOM 75 C2' G A 3 6.298 4.283 8.622 1.00 0.00 C ATOM 76 O2' G A 3 7.068 5.462 8.561 1.00 0.00 O ATOM 77 C1' G A 3 6.568 3.486 7.352 1.00 0.00 C ATOM 78 N9 G A 3 5.347 2.724 7.029 1.00 0.00 N ATOM 79 C8 G A 3 5.046 1.406 7.268 1.00 0.00 C ATOM 80 N7 G A 3 3.833 1.071 6.924 1.00 0.00 N ATOM 81 C5 G A 3 3.287 2.253 6.431 1.00 0.00 C ATOM 82 C6 G A 3 1.981 2.522 5.924 1.00 0.00 C ATOM 83 O6 G A 3 1.039 1.745 5.790 1.00 0.00 O ATOM 84 N1 G A 3 1.840 3.857 5.562 1.00 0.00 N ATOM 85 C2 G A 3 2.830 4.813 5.658 1.00 0.00 C ATOM 86 N2 G A 3 2.523 6.048 5.251 1.00 0.00 N ATOM 87 N3 G A 3 4.053 4.561 6.126 1.00 0.00 N ATOM 88 C4 G A 3 4.209 3.267 6.495 1.00 0.00 C ATOM 0 H5' G A 3 9.503 1.201 9.067 1.00 0.00 H new ATOM 0 H5'' G A 3 8.910 1.699 10.640 1.00 0.00 H new ATOM 0 H4' G A 3 8.882 3.540 9.097 1.00 0.00 H new ATOM 0 H3' G A 3 6.110 2.511 9.925 1.00 0.00 H new ATOM 0 H2' G A 3 5.271 4.600 8.803 1.00 0.00 H new ATOM 0 HO2' G A 3 6.702 6.056 7.873 1.00 0.00 H new ATOM 0 H1' G A 3 6.818 4.120 6.501 1.00 0.00 H new ATOM 0 H8 G A 3 5.749 0.710 7.701 1.00 0.00 H new ATOM 0 H1 G A 3 0.934 4.152 5.197 1.00 0.00 H new ATOM 0 H21 G A 3 3.221 6.790 5.302 1.00 0.00 H new ATOM 0 H22 G A 3 1.591 6.249 4.889 1.00 0.00 H new ATOM 100 P G A 4 7.762 5.242 11.324 1.00 0.00 P ATOM 101 OP1 G A 4 8.908 5.360 10.395 1.00 0.00 O ATOM 102 OP2 G A 4 7.998 5.301 12.783 1.00 0.00 O ATOM 103 O5' G A 4 6.681 6.396 10.952 1.00 0.00 O ATOM 104 C5' G A 4 7.114 7.703 10.612 1.00 0.00 C ATOM 105 C4' G A 4 5.922 8.604 10.254 1.00 0.00 C ATOM 106 O4' G A 4 5.220 8.123 9.107 1.00 0.00 O ATOM 107 C3' G A 4 4.875 8.688 11.348 1.00 0.00 C ATOM 108 O3' G A 4 5.244 9.555 12.404 1.00 0.00 O ATOM 109 C2' G A 4 3.734 9.271 10.552 1.00 0.00 C ATOM 110 O2' G A 4 3.992 10.639 10.308 1.00 0.00 O ATOM 111 C1' G A 4 3.845 8.527 9.233 1.00 0.00 C ATOM 112 N9 G A 4 2.977 7.339 9.234 1.00 0.00 N ATOM 113 C8 G A 4 3.312 6.048 9.507 1.00 0.00 C ATOM 114 N7 G A 4 2.334 5.199 9.360 1.00 0.00 N ATOM 115 C5 G A 4 1.259 5.995 8.974 1.00 0.00 C ATOM 116 C6 G A 4 -0.089 5.635 8.679 1.00 0.00 C ATOM 117 O6 G A 4 -0.595 4.517 8.672 1.00 0.00 O ATOM 118 N1 G A 4 -0.862 6.751 8.379 1.00 0.00 N ATOM 119 C2 G A 4 -0.397 8.048 8.343 1.00 0.00 C ATOM 120 N2 G A 4 -1.291 8.997 8.044 1.00 0.00 N ATOM 121 N3 G A 4 0.871 8.387 8.599 1.00 0.00 N ATOM 122 C4 G A 4 1.640 7.313 8.912 1.00 0.00 C ATOM 0 H5' G A 4 7.803 7.654 9.769 1.00 0.00 H new ATOM 0 H5'' G A 4 7.664 8.136 11.448 1.00 0.00 H new ATOM 0 H4' G A 4 6.378 9.579 10.084 1.00 0.00 H new ATOM 0 H3' G A 4 4.680 7.742 11.852 1.00 0.00 H new ATOM 0 H2' G A 4 2.765 9.183 11.044 1.00 0.00 H new ATOM 0 HO2' G A 4 4.512 11.011 11.050 1.00 0.00 H new ATOM 0 H1' G A 4 3.534 9.162 8.403 1.00 0.00 H new ATOM 0 H8 G A 4 4.303 5.753 9.819 1.00 0.00 H new ATOM 0 H1 G A 4 -1.849 6.598 8.170 1.00 0.00 H new ATOM 0 H21 G A 4 -1.003 9.975 8.003 1.00 0.00 H new ATOM 0 H22 G A 4 -2.261 8.743 7.857 1.00 0.00 H new ATOM 134 P U A 5 4.484 9.488 13.830 1.00 0.00 P ATOM 135 OP1 U A 5 4.872 10.681 14.614 1.00 0.00 O ATOM 136 OP2 U A 5 4.701 8.138 14.393 1.00 0.00 O ATOM 137 O5' U A 5 2.917 9.619 13.452 1.00 0.00 O ATOM 138 C5' U A 5 2.325 10.870 13.161 1.00 0.00 C ATOM 139 C4' U A 5 0.826 10.683 12.873 1.00 0.00 C ATOM 140 O4' U A 5 0.557 9.938 11.677 1.00 0.00 O ATOM 141 C3' U A 5 0.103 9.965 13.978 1.00 0.00 C ATOM 142 O3' U A 5 -0.122 10.790 15.106 1.00 0.00 O ATOM 143 C2' U A 5 -1.170 9.651 13.239 1.00 0.00 C ATOM 144 O2' U A 5 -1.939 10.823 13.065 1.00 0.00 O ATOM 145 C1' U A 5 -0.658 9.193 11.896 1.00 0.00 C ATOM 146 N1 U A 5 -0.346 7.745 11.925 1.00 0.00 N ATOM 147 C2 U A 5 -1.353 6.837 11.612 1.00 0.00 C ATOM 148 O2 U A 5 -2.500 7.188 11.336 1.00 0.00 O ATOM 149 N3 U A 5 -0.991 5.498 11.627 1.00 0.00 N ATOM 150 C4 U A 5 0.266 4.998 11.930 1.00 0.00 C ATOM 151 O4 U A 5 0.477 3.788 11.918 1.00 0.00 O ATOM 152 C5 U A 5 1.245 6.015 12.242 1.00 0.00 C ATOM 153 C6 U A 5 0.913 7.326 12.226 1.00 0.00 C ATOM 0 H5' U A 5 2.816 11.324 12.300 1.00 0.00 H new ATOM 0 H5'' U A 5 2.461 11.551 14.001 1.00 0.00 H new ATOM 0 H4' U A 5 0.468 11.707 12.769 1.00 0.00 H new ATOM 0 H3' U A 5 0.628 9.112 14.408 1.00 0.00 H new ATOM 0 H2' U A 5 -1.801 8.927 13.754 1.00 0.00 H new ATOM 0 HO2' U A 5 -2.763 10.605 12.582 1.00 0.00 H new ATOM 0 H1' U A 5 -1.397 9.356 11.111 1.00 0.00 H new ATOM 0 H3 U A 5 -1.716 4.819 11.394 1.00 0.00 H new ATOM 0 H5 U A 5 2.255 5.724 12.491 1.00 0.00 H new ATOM 0 H6 U A 5 1.669 8.061 12.459 1.00 0.00 H new ATOM 164 P C A 6 -0.589 10.152 16.513 1.00 0.00 P ATOM 165 OP1 C A 6 -0.845 11.258 17.462 1.00 0.00 O ATOM 166 OP2 C A 6 0.372 9.085 16.871 1.00 0.00 O ATOM 167 O5' C A 6 -1.995 9.456 16.162 1.00 0.00 O ATOM 168 C5' C A 6 -3.159 10.226 15.963 1.00 0.00 C ATOM 169 C4' C A 6 -4.310 9.308 15.548 1.00 0.00 C ATOM 170 O4' C A 6 -4.021 8.609 14.336 1.00 0.00 O ATOM 171 C3' C A 6 -4.591 8.230 16.573 1.00 0.00 C ATOM 172 O3' C A 6 -5.321 8.708 17.685 1.00 0.00 O ATOM 173 C2' C A 6 -5.405 7.280 15.731 1.00 0.00 C ATOM 174 O2' C A 6 -6.705 7.798 15.534 1.00 0.00 O ATOM 175 C1' C A 6 -4.656 7.321 14.405 1.00 0.00 C ATOM 176 N1 C A 6 -3.646 6.232 14.370 1.00 0.00 N ATOM 177 C2 C A 6 -4.109 4.953 14.099 1.00 0.00 C ATOM 178 O2 C A 6 -5.299 4.767 13.863 1.00 0.00 O ATOM 179 N3 C A 6 -3.215 3.926 14.106 1.00 0.00 N ATOM 180 C4 C A 6 -1.921 4.141 14.374 1.00 0.00 C ATOM 181 N4 C A 6 -1.079 3.103 14.376 1.00 0.00 N ATOM 182 C5 C A 6 -1.426 5.457 14.648 1.00 0.00 C ATOM 183 C6 C A 6 -2.323 6.467 14.630 1.00 0.00 C ATOM 0 H5' C A 6 -2.984 10.978 15.194 1.00 0.00 H new ATOM 0 H5'' C A 6 -3.416 10.760 16.878 1.00 0.00 H new ATOM 0 H4' C A 6 -5.164 9.976 15.437 1.00 0.00 H new ATOM 0 H3' C A 6 -3.701 7.800 17.032 1.00 0.00 H new ATOM 0 H2' C A 6 -5.513 6.288 16.169 1.00 0.00 H new ATOM 0 HO2' C A 6 -6.860 8.539 16.156 1.00 0.00 H new ATOM 0 H1' C A 6 -5.325 7.177 13.557 1.00 0.00 H new ATOM 0 H41 C A 6 -0.090 3.249 14.578 1.00 0.00 H new ATOM 0 H42 C A 6 -1.426 2.165 14.175 1.00 0.00 H new ATOM 0 H5 C A 6 -0.382 5.634 14.860 1.00 0.00 H new ATOM 0 H6 C A 6 -1.991 7.476 14.824 1.00 0.00 H new ATOM 195 P U A 7 -5.417 7.838 19.044 1.00 0.00 P ATOM 196 OP1 U A 7 -6.283 8.568 19.996 1.00 0.00 O ATOM 197 OP2 U A 7 -4.041 7.467 19.441 1.00 0.00 O ATOM 198 O5' U A 7 -6.185 6.492 18.598 1.00 0.00 O ATOM 199 C5' U A 7 -7.576 6.494 18.353 1.00 0.00 C ATOM 200 C4' U A 7 -8.044 5.071 18.035 1.00 0.00 C ATOM 201 O4' U A 7 -7.390 4.534 16.879 1.00 0.00 O ATOM 202 C3' U A 7 -7.720 4.099 19.151 1.00 0.00 C ATOM 203 O3' U A 7 -8.606 4.202 20.250 1.00 0.00 O ATOM 204 C2' U A 7 -7.892 2.799 18.415 1.00 0.00 C ATOM 205 O2' U A 7 -9.267 2.527 18.232 1.00 0.00 O ATOM 206 C1' U A 7 -7.276 3.109 17.060 1.00 0.00 C ATOM 207 N1 U A 7 -5.851 2.676 17.019 1.00 0.00 N ATOM 208 C2 U A 7 -5.607 1.319 16.855 1.00 0.00 C ATOM 209 O2 U A 7 -6.515 0.495 16.770 1.00 0.00 O ATOM 210 N3 U A 7 -4.278 0.937 16.788 1.00 0.00 N ATOM 211 C4 U A 7 -3.183 1.779 16.873 1.00 0.00 C ATOM 212 O4 U A 7 -2.043 1.326 16.812 1.00 0.00 O ATOM 213 C5 U A 7 -3.524 3.177 17.030 1.00 0.00 C ATOM 214 C6 U A 7 -4.818 3.578 17.094 1.00 0.00 C ATOM 0 H5' U A 7 -7.808 7.158 17.521 1.00 0.00 H new ATOM 0 H5'' U A 7 -8.108 6.877 19.224 1.00 0.00 H new ATOM 0 H4' U A 7 -9.119 5.167 17.884 1.00 0.00 H new ATOM 0 H3' U A 7 -6.744 4.253 19.611 1.00 0.00 H new ATOM 0 H2' U A 7 -7.451 1.947 18.932 1.00 0.00 H new ATOM 0 HO2' U A 7 -9.372 1.680 17.751 1.00 0.00 H new ATOM 0 H1' U A 7 -7.788 2.573 16.260 1.00 0.00 H new ATOM 0 H3 U A 7 -4.088 -0.058 16.664 1.00 0.00 H new ATOM 0 H5 U A 7 -2.736 3.912 17.097 1.00 0.00 H new ATOM 0 H6 U A 7 -5.041 4.629 17.206 1.00 0.00 H new ATOM 225 P C A 8 -8.276 3.454 21.647 1.00 0.00 P ATOM 226 OP1 C A 8 -9.390 3.719 22.585 1.00 0.00 O ATOM 227 OP2 C A 8 -6.893 3.807 22.035 1.00 0.00 O ATOM 228 O5' C A 8 -8.301 1.884 21.273 1.00 0.00 O ATOM 229 C5' C A 8 -9.522 1.200 21.079 1.00 0.00 C ATOM 230 C4' C A 8 -9.244 -0.278 20.783 1.00 0.00 C ATOM 231 O4' C A 8 -8.454 -0.449 19.611 1.00 0.00 O ATOM 232 C3' C A 8 -8.444 -0.946 21.878 1.00 0.00 C ATOM 233 O3' C A 8 -9.218 -1.234 23.022 1.00 0.00 O ATOM 234 C2' C A 8 -7.991 -2.193 21.173 1.00 0.00 C ATOM 235 O2' C A 8 -9.052 -3.125 21.106 1.00 0.00 O ATOM 236 C1' C A 8 -7.691 -1.660 19.771 1.00 0.00 C ATOM 237 N1 C A 8 -6.234 -1.385 19.646 1.00 0.00 N ATOM 238 C2 C A 8 -5.390 -2.474 19.458 1.00 0.00 C ATOM 239 O2 C A 8 -5.853 -3.609 19.373 1.00 0.00 O ATOM 240 N3 C A 8 -4.049 -2.245 19.374 1.00 0.00 N ATOM 241 C4 C A 8 -3.555 -1.002 19.472 1.00 0.00 C ATOM 242 N4 C A 8 -2.234 -0.821 19.374 1.00 0.00 N ATOM 243 C5 C A 8 -4.412 0.127 19.672 1.00 0.00 C ATOM 244 C6 C A 8 -5.737 -0.116 19.749 1.00 0.00 C ATOM 0 H5' C A 8 -10.074 1.649 20.253 1.00 0.00 H new ATOM 0 H5'' C A 8 -10.147 1.292 21.967 1.00 0.00 H new ATOM 0 H4' C A 8 -10.235 -0.720 20.680 1.00 0.00 H new ATOM 0 H3' C A 8 -7.637 -0.330 22.276 1.00 0.00 H new ATOM 0 H2' C A 8 -7.156 -2.700 21.656 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.747 -2.876 21.750 1.00 0.00 H new ATOM 0 HO3' C A 8 -8.655 -1.666 23.698 1.00 0.00 H new ATOM 0 H1' C A 8 -7.961 -2.383 19.001 1.00 0.00 H new ATOM 0 H41 C A 8 -1.841 0.118 19.446 1.00 0.00 H new ATOM 0 H42 C A 8 -1.619 -1.621 19.227 1.00 0.00 H new ATOM 0 H5 C A 8 -4.016 1.128 19.757 1.00 0.00 H new ATOM 0 H6 C A 8 -6.419 0.709 19.895 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.604 -9.267 16.401 1.00 0.00 O ATOM 259 C5' G B 9 3.000 -10.531 16.568 1.00 0.00 C ATOM 260 C4' G B 9 1.506 -10.364 16.854 1.00 0.00 C ATOM 261 O4' G B 9 1.282 -9.616 18.046 1.00 0.00 O ATOM 262 C3' G B 9 0.781 -9.596 15.767 1.00 0.00 C ATOM 263 O3' G B 9 0.530 -10.384 14.619 1.00 0.00 O ATOM 264 C2' G B 9 -0.488 -9.243 16.503 1.00 0.00 C ATOM 265 O2' G B 9 -1.334 -10.373 16.581 1.00 0.00 O ATOM 266 C1' G B 9 0.032 -8.923 17.899 1.00 0.00 C ATOM 267 N9 G B 9 0.245 -7.467 18.019 1.00 0.00 N ATOM 268 C8 G B 9 1.390 -6.744 17.820 1.00 0.00 C ATOM 269 N7 G B 9 1.248 -5.461 18.005 1.00 0.00 N ATOM 270 C5 G B 9 -0.094 -5.320 18.342 1.00 0.00 C ATOM 271 C6 G B 9 -0.844 -4.147 18.648 1.00 0.00 C ATOM 272 O6 G B 9 -0.451 -2.984 18.698 1.00 0.00 O ATOM 273 N1 G B 9 -2.177 -4.444 18.907 1.00 0.00 N ATOM 274 C2 G B 9 -2.724 -5.709 18.883 1.00 0.00 C ATOM 275 N2 G B 9 -4.030 -5.806 19.152 1.00 0.00 N ATOM 276 N3 G B 9 -2.023 -6.812 18.605 1.00 0.00 N ATOM 277 C4 G B 9 -0.719 -6.544 18.344 1.00 0.00 C ATOM 0 H5' G B 9 3.478 -11.066 17.389 1.00 0.00 H new ATOM 0 H5'' G B 9 3.142 -11.132 15.670 1.00 0.00 H new ATOM 0 H4' G B 9 1.129 -11.384 16.929 1.00 0.00 H new ATOM 0 H3' G B 9 1.334 -8.747 15.364 1.00 0.00 H new ATOM 0 H2' G B 9 -1.057 -8.441 16.032 1.00 0.00 H new ATOM 0 HO2' G B 9 -2.154 -10.135 17.061 1.00 0.00 H new ATOM 0 HO5' G B 9 4.560 -9.383 16.220 1.00 0.00 H new ATOM 0 H1' G B 9 -0.675 -9.232 18.669 1.00 0.00 H new ATOM 0 H8 G B 9 2.328 -7.196 17.535 1.00 0.00 H new ATOM 0 H1 G B 9 -2.798 -3.667 19.132 1.00 0.00 H new ATOM 0 H21 G B 9 -4.485 -6.719 19.148 1.00 0.00 H new ATOM 0 H22 G B 9 -4.571 -4.967 19.362 1.00 0.00 H new ATOM 290 P A B 10 0.079 -9.697 13.229 1.00 0.00 P ATOM 291 OP1 A B 10 -0.158 -10.772 12.240 1.00 0.00 O ATOM 292 OP2 A B 10 1.044 -8.619 12.922 1.00 0.00 O ATOM 293 O5' A B 10 -1.338 -9.013 13.575 1.00 0.00 O ATOM 294 C5' A B 10 -2.512 -9.788 13.698 1.00 0.00 C ATOM 295 C4' A B 10 -3.688 -8.872 14.043 1.00 0.00 C ATOM 296 O4' A B 10 -3.449 -8.152 15.246 1.00 0.00 O ATOM 297 C3' A B 10 -3.907 -7.805 12.993 1.00 0.00 C ATOM 298 O3' A B 10 -4.554 -8.313 11.838 1.00 0.00 O ATOM 299 C2' A B 10 -4.771 -6.838 13.760 1.00 0.00 C ATOM 300 O2' A B 10 -6.096 -7.324 13.825 1.00 0.00 O ATOM 301 C1' A B 10 -4.152 -6.905 15.156 1.00 0.00 C ATOM 302 N9 A B 10 -3.219 -5.772 15.353 1.00 0.00 N ATOM 303 C8 A B 10 -1.848 -5.750 15.267 1.00 0.00 C ATOM 304 N7 A B 10 -1.323 -4.577 15.495 1.00 0.00 N ATOM 305 C5 A B 10 -2.423 -3.762 15.751 1.00 0.00 C ATOM 306 C6 A B 10 -2.546 -2.394 16.065 1.00 0.00 C ATOM 307 N6 A B 10 -1.500 -1.568 16.180 1.00 0.00 N ATOM 308 N1 A B 10 -3.787 -1.907 16.257 1.00 0.00 N ATOM 309 C2 A B 10 -4.827 -2.728 16.144 1.00 0.00 C ATOM 310 N3 A B 10 -4.842 -4.023 15.856 1.00 0.00 N ATOM 311 C4 A B 10 -3.582 -4.483 15.667 1.00 0.00 C ATOM 0 H5' A B 10 -2.384 -10.543 14.474 1.00 0.00 H new ATOM 0 H5'' A B 10 -2.710 -10.319 12.767 1.00 0.00 H new ATOM 0 H4' A B 10 -4.548 -9.537 14.123 1.00 0.00 H new ATOM 0 H3' A B 10 -2.992 -7.369 12.591 1.00 0.00 H new ATOM 0 H2' A B 10 -4.810 -5.840 13.324 1.00 0.00 H new ATOM 0 HO2' A B 10 -6.652 -6.691 14.326 1.00 0.00 H new ATOM 0 H1' A B 10 -4.920 -6.840 15.927 1.00 0.00 H new ATOM 0 H8 A B 10 -1.258 -6.624 15.032 1.00 0.00 H new ATOM 0 H61 A B 10 -1.649 -0.585 16.410 1.00 0.00 H new ATOM 0 H62 A B 10 -0.554 -1.921 16.038 1.00 0.00 H new ATOM 0 H2 A B 10 -5.795 -2.278 16.310 1.00 0.00 H new ATOM 323 P G B 11 -4.569 -7.474 10.455 1.00 0.00 P ATOM 324 OP1 G B 11 -5.339 -8.248 9.457 1.00 0.00 O ATOM 325 OP2 G B 11 -3.178 -7.070 10.155 1.00 0.00 O ATOM 326 O5' G B 11 -5.405 -6.147 10.813 1.00 0.00 O ATOM 327 C5' G B 11 -6.813 -6.179 10.933 1.00 0.00 C ATOM 328 C4' G B 11 -7.300 -4.784 11.327 1.00 0.00 C ATOM 329 O4' G B 11 -6.702 -4.370 12.547 1.00 0.00 O ATOM 330 C3' G B 11 -6.916 -3.733 10.322 1.00 0.00 C ATOM 331 O3' G B 11 -7.756 -3.759 9.179 1.00 0.00 O ATOM 332 C2' G B 11 -7.134 -2.494 11.162 1.00 0.00 C ATOM 333 O2' G B 11 -8.510 -2.188 11.227 1.00 0.00 O ATOM 334 C1' G B 11 -6.672 -2.943 12.546 1.00 0.00 C ATOM 335 N9 G B 11 -5.304 -2.447 12.778 1.00 0.00 N ATOM 336 C8 G B 11 -4.105 -3.103 12.667 1.00 0.00 C ATOM 337 N7 G B 11 -3.067 -2.347 12.897 1.00 0.00 N ATOM 338 C5 G B 11 -3.619 -1.099 13.176 1.00 0.00 C ATOM 339 C6 G B 11 -2.985 0.139 13.496 1.00 0.00 C ATOM 340 O6 G B 11 -1.784 0.375 13.609 1.00 0.00 O ATOM 341 N1 G B 11 -3.915 1.154 13.689 1.00 0.00 N ATOM 342 C2 G B 11 -5.282 1.001 13.597 1.00 0.00 C ATOM 343 N2 G B 11 -6.028 2.085 13.821 1.00 0.00 N ATOM 344 N3 G B 11 -5.877 -0.155 13.304 1.00 0.00 N ATOM 345 C4 G B 11 -4.988 -1.157 13.105 1.00 0.00 C ATOM 0 H5' G B 11 -7.112 -6.910 11.684 1.00 0.00 H new ATOM 0 H5'' G B 11 -7.266 -6.486 9.990 1.00 0.00 H new ATOM 0 H4' G B 11 -8.384 -4.869 11.400 1.00 0.00 H new ATOM 0 H3' G B 11 -5.916 -3.836 9.901 1.00 0.00 H new ATOM 0 H2' G B 11 -6.617 -1.617 10.773 1.00 0.00 H new ATOM 0 HO2' G B 11 -8.641 -1.385 11.773 1.00 0.00 H new ATOM 0 H1' G B 11 -7.312 -2.553 13.338 1.00 0.00 H new ATOM 0 H8 G B 11 -4.027 -4.150 12.412 1.00 0.00 H new ATOM 0 H1 G B 11 -3.559 2.083 13.916 1.00 0.00 H new ATOM 0 H21 G B 11 -7.045 2.025 13.765 1.00 0.00 H new ATOM 0 H22 G B 11 -5.581 2.973 14.048 1.00 0.00 H new ATOM 357 P G B 12 -7.515 -2.749 7.940 1.00 0.00 P ATOM 358 OP1 G B 12 -8.366 -3.195 6.815 1.00 0.00 O ATOM 359 OP2 G B 12 -6.055 -2.611 7.743 1.00 0.00 O ATOM 360 O5' G B 12 -8.085 -1.330 8.462 1.00 0.00 O ATOM 361 C5' G B 12 -9.478 -1.104 8.593 1.00 0.00 C ATOM 362 C4' G B 12 -9.729 0.357 8.987 1.00 0.00 C ATOM 363 O4' G B 12 -9.089 0.684 10.223 1.00 0.00 O ATOM 364 C3' G B 12 -9.164 1.320 7.960 1.00 0.00 C ATOM 365 O3' G B 12 -10.043 1.495 6.863 1.00 0.00 O ATOM 366 C2' G B 12 -9.061 2.575 8.790 1.00 0.00 C ATOM 367 O2' G B 12 -10.344 3.146 8.949 1.00 0.00 O ATOM 368 C1' G B 12 -8.605 2.034 10.136 1.00 0.00 C ATOM 369 N9 G B 12 -7.132 2.037 10.234 1.00 0.00 N ATOM 370 C8 G B 12 -6.275 0.973 10.185 1.00 0.00 C ATOM 371 N7 G B 12 -5.022 1.288 10.368 1.00 0.00 N ATOM 372 C5 G B 12 -5.049 2.668 10.554 1.00 0.00 C ATOM 373 C6 G B 12 -3.980 3.581 10.806 1.00 0.00 C ATOM 374 O6 G B 12 -2.781 3.340 10.922 1.00 0.00 O ATOM 375 N1 G B 12 -4.438 4.889 10.918 1.00 0.00 N ATOM 376 C2 G B 12 -5.759 5.274 10.822 1.00 0.00 C ATOM 377 N2 G B 12 -6.013 6.580 10.959 1.00 0.00 N ATOM 378 N3 G B 12 -6.765 4.420 10.597 1.00 0.00 N ATOM 379 C4 G B 12 -6.338 3.137 10.470 1.00 0.00 C ATOM 0 H5' G B 12 -9.895 -1.771 9.347 1.00 0.00 H new ATOM 0 H5'' G B 12 -9.983 -1.329 7.654 1.00 0.00 H new ATOM 0 H4' G B 12 -10.812 0.455 9.063 1.00 0.00 H new ATOM 0 H3' G B 12 -8.229 0.996 7.502 1.00 0.00 H new ATOM 0 H2' G B 12 -8.407 3.333 8.358 1.00 0.00 H new ATOM 0 HO2' G B 12 -10.935 2.827 8.235 1.00 0.00 H new ATOM 0 H1' G B 12 -8.990 2.655 10.945 1.00 0.00 H new ATOM 0 H8 G B 12 -6.606 -0.040 10.010 1.00 0.00 H new ATOM 0 H1 G B 12 -3.745 5.619 11.084 1.00 0.00 H new ATOM 0 H21 G B 12 -6.972 6.922 10.897 1.00 0.00 H new ATOM 0 H22 G B 12 -5.248 7.234 11.125 1.00 0.00 H new ATOM 391 P U B 13 -9.504 2.055 5.450 1.00 0.00 P ATOM 392 OP1 U B 13 -10.674 2.357 4.597 1.00 0.00 O ATOM 393 OP2 U B 13 -8.461 1.126 4.963 1.00 0.00 O ATOM 394 O5' U B 13 -8.787 3.445 5.832 1.00 0.00 O ATOM 395 C5' U B 13 -9.532 4.607 6.124 1.00 0.00 C ATOM 396 C4' U B 13 -8.569 5.767 6.419 1.00 0.00 C ATOM 397 O4' U B 13 -7.827 5.594 7.633 1.00 0.00 O ATOM 398 C3' U B 13 -7.547 5.956 5.329 1.00 0.00 C ATOM 399 O3' U B 13 -8.078 6.614 4.194 1.00 0.00 O ATOM 400 C2' U B 13 -6.568 6.822 6.074 1.00 0.00 C ATOM 401 O2' U B 13 -7.085 8.129 6.220 1.00 0.00 O ATOM 402 C1' U B 13 -6.518 6.162 7.429 1.00 0.00 C ATOM 403 N1 U B 13 -5.507 5.081 7.450 1.00 0.00 N ATOM 404 C2 U B 13 -4.196 5.402 7.778 1.00 0.00 C ATOM 405 O2 U B 13 -3.833 6.557 7.998 1.00 0.00 O ATOM 406 N3 U B 13 -3.308 4.339 7.847 1.00 0.00 N ATOM 407 C4 U B 13 -3.615 3.006 7.621 1.00 0.00 C ATOM 408 O4 U B 13 -2.750 2.140 7.718 1.00 0.00 O ATOM 409 C5 U B 13 -4.999 2.770 7.280 1.00 0.00 C ATOM 410 C6 U B 13 -5.879 3.796 7.209 1.00 0.00 C ATOM 0 H5' U B 13 -10.181 4.431 6.982 1.00 0.00 H new ATOM 0 H5'' U B 13 -10.177 4.860 5.283 1.00 0.00 H new ATOM 0 H4' U B 13 -9.226 6.633 6.498 1.00 0.00 H new ATOM 0 H3' U B 13 -7.141 5.035 4.909 1.00 0.00 H new ATOM 0 H2' U B 13 -5.602 6.909 5.576 1.00 0.00 H new ATOM 0 HO2' U B 13 -7.824 8.261 5.590 1.00 0.00 H new ATOM 0 H1' U B 13 -6.248 6.879 8.205 1.00 0.00 H new ATOM 0 H3 U B 13 -2.341 4.558 8.086 1.00 0.00 H new ATOM 0 H5 U B 13 -5.335 1.763 7.079 1.00 0.00 H new ATOM 0 H6 U B 13 -6.907 3.587 6.953 1.00 0.00 H new ATOM 421 P C B 14 -7.295 6.584 2.783 1.00 0.00 P ATOM 422 OP1 C B 14 -7.989 7.498 1.849 1.00 0.00 O ATOM 423 OP2 C B 14 -7.091 5.168 2.407 1.00 0.00 O ATOM 424 O5' C B 14 -5.859 7.216 3.133 1.00 0.00 O ATOM 425 C5' C B 14 -5.701 8.602 3.340 1.00 0.00 C ATOM 426 C4' C B 14 -4.252 8.888 3.740 1.00 0.00 C ATOM 427 O4' C B 14 -3.894 8.218 4.950 1.00 0.00 O ATOM 428 C3' C B 14 -3.263 8.403 2.701 1.00 0.00 C ATOM 429 O3' C B 14 -3.161 9.283 1.597 1.00 0.00 O ATOM 430 C2' C B 14 -2.008 8.401 3.530 1.00 0.00 C ATOM 431 O2' C B 14 -1.582 9.731 3.736 1.00 0.00 O ATOM 432 C1' C B 14 -2.509 7.853 4.860 1.00 0.00 C ATOM 433 N1 C B 14 -2.353 6.377 4.904 1.00 0.00 N ATOM 434 C2 C B 14 -1.080 5.887 5.152 1.00 0.00 C ATOM 435 O2 C B 14 -0.150 6.662 5.353 1.00 0.00 O ATOM 436 N3 C B 14 -0.896 4.539 5.162 1.00 0.00 N ATOM 437 C4 C B 14 -1.916 3.703 4.936 1.00 0.00 C ATOM 438 N4 C B 14 -1.684 2.387 4.942 1.00 0.00 N ATOM 439 C5 C B 14 -3.242 4.191 4.702 1.00 0.00 C ATOM 440 C6 C B 14 -3.412 5.532 4.703 1.00 0.00 C ATOM 0 H5' C B 14 -6.381 8.945 4.120 1.00 0.00 H new ATOM 0 H5'' C B 14 -5.955 9.149 2.432 1.00 0.00 H new ATOM 0 H4' C B 14 -4.204 9.971 3.852 1.00 0.00 H new ATOM 0 H3' C B 14 -3.520 7.450 2.238 1.00 0.00 H new ATOM 0 H2' C B 14 -1.185 7.843 3.083 1.00 0.00 H new ATOM 0 HO2' C B 14 -1.974 10.310 3.049 1.00 0.00 H new ATOM 0 H1' C B 14 -1.940 8.260 5.696 1.00 0.00 H new ATOM 0 H41 C B 14 -2.449 1.734 4.772 1.00 0.00 H new ATOM 0 H42 C B 14 -0.742 2.036 5.117 1.00 0.00 H new ATOM 0 H5 C B 14 -4.069 3.518 4.532 1.00 0.00 H new ATOM 0 H6 C B 14 -4.398 5.943 4.543 1.00 0.00 H new ATOM 452 P U B 15 -2.473 8.801 0.216 1.00 0.00 P ATOM 453 OP1 U B 15 -2.483 9.943 -0.724 1.00 0.00 O ATOM 454 OP2 U B 15 -3.102 7.522 -0.179 1.00 0.00 O ATOM 455 O5' U B 15 -0.940 8.496 0.617 1.00 0.00 O ATOM 456 C5' U B 15 -0.006 9.543 0.797 1.00 0.00 C ATOM 457 C4' U B 15 1.382 8.946 1.035 1.00 0.00 C ATOM 458 O4' U B 15 1.403 8.085 2.173 1.00 0.00 O ATOM 459 C3' U B 15 1.824 8.083 -0.125 1.00 0.00 C ATOM 460 O3' U B 15 2.287 8.860 -1.215 1.00 0.00 O ATOM 461 C2' U B 15 2.928 7.287 0.522 1.00 0.00 C ATOM 462 O2' U B 15 4.098 8.077 0.591 1.00 0.00 O ATOM 463 C1' U B 15 2.404 7.076 1.943 1.00 0.00 C ATOM 464 N1 U B 15 1.826 5.717 2.120 1.00 0.00 N ATOM 465 C2 U B 15 2.718 4.674 2.335 1.00 0.00 C ATOM 466 O2 U B 15 3.936 4.844 2.342 1.00 0.00 O ATOM 467 N3 U B 15 2.164 3.424 2.545 1.00 0.00 N ATOM 468 C4 U B 15 0.813 3.122 2.554 1.00 0.00 C ATOM 469 O4 U B 15 0.434 1.966 2.725 1.00 0.00 O ATOM 470 C5 U B 15 -0.050 4.269 2.356 1.00 0.00 C ATOM 471 C6 U B 15 0.468 5.506 2.155 1.00 0.00 C ATOM 0 H5' U B 15 -0.297 10.164 1.644 1.00 0.00 H new ATOM 0 H5'' U B 15 0.009 10.188 -0.082 1.00 0.00 H new ATOM 0 H4' U B 15 2.040 9.804 1.172 1.00 0.00 H new ATOM 0 H3' U B 15 1.034 7.474 -0.565 1.00 0.00 H new ATOM 0 H2' U B 15 3.168 6.367 -0.010 1.00 0.00 H new ATOM 0 HO2' U B 15 4.506 8.136 -0.298 1.00 0.00 H new ATOM 0 H1' U B 15 3.221 7.159 2.660 1.00 0.00 H new ATOM 0 H3 U B 15 2.811 2.653 2.708 1.00 0.00 H new ATOM 0 H5 U B 15 -1.122 4.137 2.369 1.00 0.00 H new ATOM 0 H6 U B 15 -0.201 6.343 2.020 1.00 0.00 H new ATOM 482 P C B 16 2.717 8.161 -2.598 1.00 0.00 P ATOM 483 OP1 C B 16 3.050 9.220 -3.575 1.00 0.00 O ATOM 484 OP2 C B 16 1.700 7.139 -2.933 1.00 0.00 O ATOM 485 O5' C B 16 4.077 7.408 -2.188 1.00 0.00 O ATOM 486 C5' C B 16 4.440 6.197 -2.804 1.00 0.00 C ATOM 487 C4' C B 16 5.703 5.641 -2.146 1.00 0.00 C ATOM 488 O4' C B 16 5.509 5.422 -0.744 1.00 0.00 O ATOM 489 C3' C B 16 6.044 4.288 -2.729 1.00 0.00 C ATOM 490 O3' C B 16 6.798 4.382 -3.918 1.00 0.00 O ATOM 491 C2' C B 16 6.824 3.662 -1.617 1.00 0.00 C ATOM 492 O2' C B 16 8.137 4.181 -1.580 1.00 0.00 O ATOM 493 C1' C B 16 6.047 4.133 -0.403 1.00 0.00 C ATOM 494 N1 C B 16 4.946 3.170 -0.140 1.00 0.00 N ATOM 495 C2 C B 16 5.288 1.903 0.319 1.00 0.00 C ATOM 496 O2 C B 16 6.461 1.627 0.560 1.00 0.00 O ATOM 497 N3 C B 16 4.292 0.987 0.487 1.00 0.00 N ATOM 498 C4 C B 16 3.016 1.304 0.226 1.00 0.00 C ATOM 499 N4 C B 16 2.069 0.379 0.410 1.00 0.00 N ATOM 500 C5 C B 16 2.651 2.611 -0.230 1.00 0.00 C ATOM 501 C6 C B 16 3.651 3.502 -0.392 1.00 0.00 C ATOM 0 H5' C B 16 4.613 6.357 -3.868 1.00 0.00 H new ATOM 0 H5'' C B 16 3.627 5.476 -2.718 1.00 0.00 H new ATOM 0 H4' C B 16 6.491 6.373 -2.321 1.00 0.00 H new ATOM 0 H3' C B 16 5.167 3.715 -3.031 1.00 0.00 H new ATOM 0 H2' C B 16 6.927 2.580 -1.699 1.00 0.00 H new ATOM 0 HO2' C B 16 8.373 4.537 -2.462 1.00 0.00 H new ATOM 0 HO3' C B 16 6.994 3.482 -4.253 1.00 0.00 H new ATOM 0 H1' C B 16 6.671 4.197 0.488 1.00 0.00 H new ATOM 0 H41 C B 16 1.093 0.603 0.216 1.00 0.00 H new ATOM 0 H42 C B 16 2.322 -0.551 0.744 1.00 0.00 H new ATOM 0 H5 C B 16 1.623 2.872 -0.435 1.00 0.00 H new ATOM 0 H6 C B 16 3.418 4.501 -0.729 1.00 0.00 H new TER 514 C B 16