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 180:sc= -0.344 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 A O2' : rot 180:sc= -0.07 USER MOD Single : A 3 G O2' : rot 23:sc= -1.19 USER MOD Single : A 4 G O2' : rot -16:sc= -0.471 USER MOD Single : A 5 U O2' : rot 180:sc= -0.306 USER MOD Single : A 6 C O2' : rot -14:sc= -0.272 USER MOD Single : A 7 U O2' : rot 180:sc= -0.424 USER MOD Single : A 8 C O2' : rot -17:sc= 0.13 USER MOD Single : A 8 C O3' : rot 180:sc= 0.149 USER MOD Single : B 9 G O2' : rot 180:sc= -0.392 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 A O2' : rot -27:sc= 0.119 USER MOD Single : B 11 G O2' : rot 180:sc= -0.598 USER MOD Single : B 12 G O2' : rot -28:sc= -0.451 USER MOD Single : B 13 U O2' : rot -15:sc= 0.135 USER MOD Single : B 14 C O2' : rot -23:sc= -0.0699 USER MOD Single : B 15 U O2' : rot 180:sc= -0.402 USER MOD Single : B 16 C O2' : rot -30:sc= 0.14 USER MOD Single : B 16 C O3' : rot 180:sc= 0.14 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 6.696 -10.258 2.898 1.00 0.00 O ATOM 2 C5' G A 1 6.354 -9.228 3.799 1.00 0.00 C ATOM 3 C4' G A 1 7.307 -8.046 3.614 1.00 0.00 C ATOM 4 O4' G A 1 7.149 -7.453 2.324 1.00 0.00 O ATOM 5 C3' G A 1 7.017 -6.931 4.598 1.00 0.00 C ATOM 6 O3' G A 1 7.550 -7.184 5.883 1.00 0.00 O ATOM 7 C2' G A 1 7.713 -5.784 3.912 1.00 0.00 C ATOM 8 O2' G A 1 9.113 -5.894 4.075 1.00 0.00 O ATOM 9 C1' G A 1 7.365 -6.039 2.455 1.00 0.00 C ATOM 10 N9 G A 1 6.126 -5.310 2.123 1.00 0.00 N ATOM 11 C8 G A 1 4.832 -5.753 2.158 1.00 0.00 C ATOM 12 N7 G A 1 3.952 -4.852 1.819 1.00 0.00 N ATOM 13 C5 G A 1 4.720 -3.723 1.547 1.00 0.00 C ATOM 14 C6 G A 1 4.317 -2.417 1.141 1.00 0.00 C ATOM 15 O6 G A 1 3.181 -2.004 0.920 1.00 0.00 O ATOM 16 N1 G A 1 5.408 -1.566 1.001 1.00 0.00 N ATOM 17 C2 G A 1 6.722 -1.922 1.220 1.00 0.00 C ATOM 18 N2 G A 1 7.641 -0.968 1.044 1.00 0.00 N ATOM 19 N3 G A 1 7.103 -3.147 1.595 1.00 0.00 N ATOM 20 C4 G A 1 6.053 -3.993 1.740 1.00 0.00 C ATOM 0 H5' G A 1 6.408 -9.595 4.824 1.00 0.00 H new ATOM 0 H5'' G A 1 5.326 -8.909 3.629 1.00 0.00 H new ATOM 0 H4' G A 1 8.307 -8.455 3.757 1.00 0.00 H new ATOM 0 H3' G A 1 5.958 -6.773 4.799 1.00 0.00 H new ATOM 0 H2' G A 1 7.422 -4.804 4.290 1.00 0.00 H new ATOM 0 HO2' G A 1 9.555 -5.144 3.624 1.00 0.00 H new ATOM 0 HO5' G A 1 6.085 -11.015 3.019 1.00 0.00 H new ATOM 0 H1' G A 1 8.157 -5.703 1.786 1.00 0.00 H new ATOM 0 H8 G A 1 4.563 -6.760 2.441 1.00 0.00 H new ATOM 0 H1 G A 1 5.222 -0.605 0.714 1.00 0.00 H new ATOM 0 H21 G A 1 8.628 -1.177 1.193 1.00 0.00 H new ATOM 0 H22 G A 1 7.355 -0.031 0.761 1.00 0.00 H new ATOM 33 P A A 2 7.079 -6.307 7.157 1.00 0.00 P ATOM 34 OP1 A A 2 7.844 -6.763 8.338 1.00 0.00 O ATOM 35 OP2 A A 2 5.600 -6.320 7.192 1.00 0.00 O ATOM 36 O5' A A 2 7.555 -4.809 6.797 1.00 0.00 O ATOM 37 C5' A A 2 8.912 -4.432 6.900 1.00 0.00 C ATOM 38 C4' A A 2 9.068 -2.964 6.492 1.00 0.00 C ATOM 39 O4' A A 2 8.618 -2.738 5.158 1.00 0.00 O ATOM 40 C3' A A 2 8.229 -2.036 7.345 1.00 0.00 C ATOM 41 O3' A A 2 8.790 -1.814 8.626 1.00 0.00 O ATOM 42 C2' A A 2 8.243 -0.799 6.487 1.00 0.00 C ATOM 43 O2' A A 2 9.495 -0.152 6.587 1.00 0.00 O ATOM 44 C1' A A 2 8.099 -1.398 5.091 1.00 0.00 C ATOM 45 N9 A A 2 6.667 -1.418 4.709 1.00 0.00 N ATOM 46 C8 A A 2 5.773 -2.459 4.750 1.00 0.00 C ATOM 47 N7 A A 2 4.567 -2.139 4.366 1.00 0.00 N ATOM 48 C5 A A 2 4.666 -0.787 4.052 1.00 0.00 C ATOM 49 C6 A A 2 3.727 0.157 3.589 1.00 0.00 C ATOM 50 N6 A A 2 2.443 -0.136 3.350 1.00 0.00 N ATOM 51 N1 A A 2 4.157 1.417 3.385 1.00 0.00 N ATOM 52 C2 A A 2 5.432 1.710 3.625 1.00 0.00 C ATOM 53 N3 A A 2 6.405 0.918 4.059 1.00 0.00 N ATOM 54 C4 A A 2 5.942 -0.339 4.256 1.00 0.00 C ATOM 0 H5' A A 2 9.526 -5.065 6.260 1.00 0.00 H new ATOM 0 H5'' A A 2 9.264 -4.576 7.922 1.00 0.00 H new ATOM 0 H4' A A 2 10.132 -2.759 6.608 1.00 0.00 H new ATOM 0 H3' A A 2 7.235 -2.415 7.582 1.00 0.00 H new ATOM 0 H2' A A 2 7.483 -0.064 6.753 1.00 0.00 H new ATOM 0 HO2' A A 2 9.494 0.651 6.025 1.00 0.00 H new ATOM 0 H1' A A 2 8.640 -0.814 4.346 1.00 0.00 H new ATOM 0 H8 A A 2 6.043 -3.454 5.071 1.00 0.00 H new ATOM 0 H61 A A 2 1.808 0.589 3.015 1.00 0.00 H new ATOM 0 H62 A A 2 2.099 -1.084 3.502 1.00 0.00 H new ATOM 0 H2 A A 2 5.715 2.736 3.441 1.00 0.00 H new ATOM 66 P G A 3 7.909 -1.166 9.817 1.00 0.00 P ATOM 67 OP1 G A 3 8.770 -1.048 11.015 1.00 0.00 O ATOM 68 OP2 G A 3 6.637 -1.916 9.901 1.00 0.00 O ATOM 69 O5' G A 3 7.575 0.320 9.295 1.00 0.00 O ATOM 70 C5' G A 3 8.550 1.343 9.328 1.00 0.00 C ATOM 71 C4' G A 3 7.954 2.623 8.739 1.00 0.00 C ATOM 72 O4' G A 3 7.507 2.401 7.399 1.00 0.00 O ATOM 73 C3' G A 3 6.712 3.082 9.471 1.00 0.00 C ATOM 74 O3' G A 3 6.921 3.631 10.787 1.00 0.00 O ATOM 75 C2' G A 3 6.136 4.043 8.441 1.00 0.00 C ATOM 76 O2' G A 3 6.878 5.237 8.344 1.00 0.00 O ATOM 77 C1' G A 3 6.367 3.247 7.163 1.00 0.00 C ATOM 78 N9 G A 3 5.155 2.447 6.897 1.00 0.00 N ATOM 79 C8 G A 3 4.944 1.099 7.044 1.00 0.00 C ATOM 80 N7 G A 3 3.726 0.722 6.768 1.00 0.00 N ATOM 81 C5 G A 3 3.081 1.905 6.423 1.00 0.00 C ATOM 82 C6 G A 3 1.726 2.136 6.041 1.00 0.00 C ATOM 83 O6 G A 3 0.822 1.316 5.904 1.00 0.00 O ATOM 84 N1 G A 3 1.483 3.487 5.814 1.00 0.00 N ATOM 85 C2 G A 3 2.422 4.489 5.927 1.00 0.00 C ATOM 86 N2 G A 3 2.011 5.733 5.671 1.00 0.00 N ATOM 87 N3 G A 3 3.692 4.274 6.271 1.00 0.00 N ATOM 88 C4 G A 3 3.949 2.964 6.506 1.00 0.00 C ATOM 0 H5' G A 3 9.430 1.042 8.760 1.00 0.00 H new ATOM 0 H5'' G A 3 8.877 1.518 10.353 1.00 0.00 H new ATOM 0 H4' G A 3 8.752 3.362 8.812 1.00 0.00 H new ATOM 0 H3' G A 3 6.040 2.271 9.754 1.00 0.00 H new ATOM 0 H2' G A 3 5.112 4.340 8.665 1.00 0.00 H new ATOM 0 HO2' G A 3 7.789 5.084 8.671 1.00 0.00 H new ATOM 0 H1' G A 3 6.556 3.884 6.299 1.00 0.00 H new ATOM 0 H8 G A 3 5.716 0.413 7.359 1.00 0.00 H new ATOM 0 H1 G A 3 0.537 3.756 5.543 1.00 0.00 H new ATOM 0 H21 G A 3 2.667 6.511 5.740 1.00 0.00 H new ATOM 0 H22 G A 3 1.041 5.905 5.406 1.00 0.00 H new ATOM 100 P G A 4 7.705 5.038 11.076 1.00 0.00 P ATOM 101 OP1 G A 4 8.816 5.164 10.106 1.00 0.00 O ATOM 102 OP2 G A 4 7.992 5.109 12.525 1.00 0.00 O ATOM 103 O5' G A 4 6.600 6.176 10.734 1.00 0.00 O ATOM 104 C5' G A 4 7.006 7.483 10.361 1.00 0.00 C ATOM 105 C4' G A 4 5.789 8.360 10.028 1.00 0.00 C ATOM 106 O4' G A 4 5.054 7.839 8.922 1.00 0.00 O ATOM 107 C3' G A 4 4.785 8.449 11.160 1.00 0.00 C ATOM 108 O3' G A 4 5.187 9.340 12.184 1.00 0.00 O ATOM 109 C2' G A 4 3.600 8.994 10.397 1.00 0.00 C ATOM 110 O2' G A 4 3.796 10.370 10.143 1.00 0.00 O ATOM 111 C1' G A 4 3.686 8.251 9.075 1.00 0.00 C ATOM 112 N9 G A 4 2.805 7.071 9.088 1.00 0.00 N ATOM 113 C8 G A 4 3.126 5.776 9.370 1.00 0.00 C ATOM 114 N7 G A 4 2.133 4.939 9.237 1.00 0.00 N ATOM 115 C5 G A 4 1.068 5.747 8.849 1.00 0.00 C ATOM 116 C6 G A 4 -0.287 5.404 8.558 1.00 0.00 C ATOM 117 O6 G A 4 -0.810 4.293 8.556 1.00 0.00 O ATOM 118 N1 G A 4 -1.045 6.528 8.251 1.00 0.00 N ATOM 119 C2 G A 4 -0.562 7.818 8.201 1.00 0.00 C ATOM 120 N2 G A 4 -1.442 8.775 7.891 1.00 0.00 N ATOM 121 N3 G A 4 0.712 8.142 8.451 1.00 0.00 N ATOM 122 C4 G A 4 1.467 7.059 8.772 1.00 0.00 C ATOM 0 H5' G A 4 7.669 7.430 9.497 1.00 0.00 H new ATOM 0 H5'' G A 4 7.576 7.937 11.172 1.00 0.00 H new ATOM 0 H4' G A 4 6.219 9.339 9.818 1.00 0.00 H new ATOM 0 H3' G A 4 4.622 7.512 11.692 1.00 0.00 H new ATOM 0 H2' G A 4 2.653 8.874 10.924 1.00 0.00 H new ATOM 0 HO2' G A 4 4.507 10.712 10.724 1.00 0.00 H new ATOM 0 H1' G A 4 3.369 8.890 8.251 1.00 0.00 H new ATOM 0 H8 G A 4 4.115 5.470 9.677 1.00 0.00 H new ATOM 0 H1 G A 4 -2.034 6.387 8.047 1.00 0.00 H new ATOM 0 H21 G A 4 -1.140 9.748 7.840 1.00 0.00 H new ATOM 0 H22 G A 4 -2.415 8.532 7.706 1.00 0.00 H new ATOM 134 P U A 5 4.461 9.319 13.628 1.00 0.00 P ATOM 135 OP1 U A 5 4.909 10.508 14.386 1.00 0.00 O ATOM 136 OP2 U A 5 4.644 7.969 14.205 1.00 0.00 O ATOM 137 O5' U A 5 2.893 9.501 13.284 1.00 0.00 O ATOM 138 C5' U A 5 2.347 10.762 12.961 1.00 0.00 C ATOM 139 C4' U A 5 0.842 10.619 12.673 1.00 0.00 C ATOM 140 O4' U A 5 0.553 9.847 11.500 1.00 0.00 O ATOM 141 C3' U A 5 0.088 9.963 13.797 1.00 0.00 C ATOM 142 O3' U A 5 -0.120 10.832 14.894 1.00 0.00 O ATOM 143 C2' U A 5 -1.192 9.664 13.062 1.00 0.00 C ATOM 144 O2' U A 5 -1.921 10.854 12.846 1.00 0.00 O ATOM 145 C1' U A 5 -0.687 9.148 11.734 1.00 0.00 C ATOM 146 N1 U A 5 -0.422 7.691 11.800 1.00 0.00 N ATOM 147 C2 U A 5 -1.444 6.809 11.461 1.00 0.00 C ATOM 148 O2 U A 5 -2.573 7.189 11.152 1.00 0.00 O ATOM 149 N3 U A 5 -1.117 5.461 11.488 1.00 0.00 N ATOM 150 C4 U A 5 0.120 4.929 11.820 1.00 0.00 C ATOM 151 O4 U A 5 0.302 3.715 11.808 1.00 0.00 O ATOM 152 C5 U A 5 1.114 5.920 12.163 1.00 0.00 C ATOM 153 C6 U A 5 0.815 7.239 12.139 1.00 0.00 C ATOM 0 H5' U A 5 2.856 11.177 12.091 1.00 0.00 H new ATOM 0 H5'' U A 5 2.505 11.459 13.784 1.00 0.00 H new ATOM 0 H4' U A 5 0.520 11.651 12.537 1.00 0.00 H new ATOM 0 H3' U A 5 0.585 9.109 14.258 1.00 0.00 H new ATOM 0 H2' U A 5 -1.848 8.976 13.596 1.00 0.00 H new ATOM 0 HO2' U A 5 -2.750 10.647 12.366 1.00 0.00 H new ATOM 0 H1' U A 5 -1.419 9.311 10.943 1.00 0.00 H new ATOM 0 H3 U A 5 -1.854 4.801 11.241 1.00 0.00 H new ATOM 0 H5 U A 5 2.108 5.604 12.442 1.00 0.00 H new ATOM 0 H6 U A 5 1.582 7.955 12.397 1.00 0.00 H new ATOM 164 P C A 6 -0.597 10.252 16.324 1.00 0.00 P ATOM 165 OP1 C A 6 -0.862 11.398 17.222 1.00 0.00 O ATOM 166 OP2 C A 6 0.364 9.204 16.733 1.00 0.00 O ATOM 167 O5' C A 6 -1.999 9.539 15.991 1.00 0.00 O ATOM 168 C5' C A 6 -3.167 10.296 15.764 1.00 0.00 C ATOM 169 C4' C A 6 -4.312 9.355 15.383 1.00 0.00 C ATOM 170 O4' C A 6 -4.025 8.629 14.187 1.00 0.00 O ATOM 171 C3' C A 6 -4.569 8.300 16.437 1.00 0.00 C ATOM 172 O3' C A 6 -5.282 8.801 17.551 1.00 0.00 O ATOM 173 C2' C A 6 -5.393 7.333 15.627 1.00 0.00 C ATOM 174 O2' C A 6 -6.691 7.854 15.435 1.00 0.00 O ATOM 175 C1' C A 6 -4.661 7.346 14.290 1.00 0.00 C ATOM 176 N1 C A 6 -3.653 6.256 14.263 1.00 0.00 N ATOM 177 C2 C A 6 -4.122 4.974 14.020 1.00 0.00 C ATOM 178 O2 C A 6 -5.314 4.788 13.795 1.00 0.00 O ATOM 179 N3 C A 6 -3.232 3.944 14.043 1.00 0.00 N ATOM 180 C4 C A 6 -1.935 4.160 14.298 1.00 0.00 C ATOM 181 N4 C A 6 -1.098 3.117 14.321 1.00 0.00 N ATOM 182 C5 C A 6 -1.433 5.480 14.538 1.00 0.00 C ATOM 183 C6 C A 6 -2.326 6.493 14.505 1.00 0.00 C ATOM 0 H5' C A 6 -2.996 11.020 14.968 1.00 0.00 H new ATOM 0 H5'' C A 6 -3.428 10.861 16.659 1.00 0.00 H new ATOM 0 H4' C A 6 -5.176 10.009 15.263 1.00 0.00 H new ATOM 0 H3' C A 6 -3.671 7.883 16.892 1.00 0.00 H new ATOM 0 H2' C A 6 -5.497 6.350 16.086 1.00 0.00 H new ATOM 0 HO2' C A 6 -6.834 8.608 16.044 1.00 0.00 H new ATOM 0 H1' C A 6 -5.342 7.186 13.454 1.00 0.00 H new ATOM 0 H41 C A 6 -0.107 3.263 14.513 1.00 0.00 H new ATOM 0 H42 C A 6 -1.451 2.176 14.146 1.00 0.00 H new ATOM 0 H5 C A 6 -0.386 5.658 14.737 1.00 0.00 H new ATOM 0 H6 C A 6 -1.988 7.505 14.672 1.00 0.00 H new ATOM 195 P U A 7 -5.359 7.958 18.926 1.00 0.00 P ATOM 196 OP1 U A 7 -6.210 8.707 19.877 1.00 0.00 O ATOM 197 OP2 U A 7 -3.978 7.594 19.311 1.00 0.00 O ATOM 198 O5' U A 7 -6.134 6.604 18.518 1.00 0.00 O ATOM 199 C5' U A 7 -7.529 6.599 18.298 1.00 0.00 C ATOM 200 C4' U A 7 -7.999 5.167 18.027 1.00 0.00 C ATOM 201 O4' U A 7 -7.371 4.605 16.869 1.00 0.00 O ATOM 202 C3' U A 7 -7.641 4.227 19.158 1.00 0.00 C ATOM 203 O3' U A 7 -8.487 4.362 20.283 1.00 0.00 O ATOM 204 C2' U A 7 -7.845 2.912 18.458 1.00 0.00 C ATOM 205 O2' U A 7 -9.226 2.659 18.312 1.00 0.00 O ATOM 206 C1' U A 7 -7.257 3.184 17.082 1.00 0.00 C ATOM 207 N1 U A 7 -5.836 2.747 17.021 1.00 0.00 N ATOM 208 C2 U A 7 -5.598 1.386 16.884 1.00 0.00 C ATOM 209 O2 U A 7 -6.511 0.563 16.837 1.00 0.00 O ATOM 210 N3 U A 7 -4.272 0.998 16.800 1.00 0.00 N ATOM 211 C4 U A 7 -3.174 1.839 16.846 1.00 0.00 C ATOM 212 O4 U A 7 -2.036 1.383 16.773 1.00 0.00 O ATOM 213 C5 U A 7 -3.508 3.242 16.978 1.00 0.00 C ATOM 214 C6 U A 7 -4.799 3.647 17.057 1.00 0.00 C ATOM 0 H5' U A 7 -7.777 7.240 17.452 1.00 0.00 H new ATOM 0 H5'' U A 7 -8.046 7.004 19.168 1.00 0.00 H new ATOM 0 H4' U A 7 -9.078 5.253 17.900 1.00 0.00 H new ATOM 0 H3' U A 7 -6.651 4.388 19.584 1.00 0.00 H new ATOM 0 H2' U A 7 -7.403 2.065 18.984 1.00 0.00 H new ATOM 0 HO2' U A 7 -9.355 1.802 17.855 1.00 0.00 H new ATOM 0 H1' U A 7 -7.786 2.629 16.308 1.00 0.00 H new ATOM 0 H3 U A 7 -4.087 0.000 16.694 1.00 0.00 H new ATOM 0 H5 U A 7 -2.717 3.976 17.014 1.00 0.00 H new ATOM 0 H6 U A 7 -5.017 4.701 17.150 1.00 0.00 H new ATOM 225 P C A 8 -8.113 3.648 21.686 1.00 0.00 P ATOM 226 OP1 C A 8 -9.196 3.936 22.652 1.00 0.00 O ATOM 227 OP2 C A 8 -6.718 4.008 22.021 1.00 0.00 O ATOM 228 O5' C A 8 -8.151 2.070 21.348 1.00 0.00 O ATOM 229 C5' C A 8 -9.378 1.385 21.202 1.00 0.00 C ATOM 230 C4' C A 8 -9.109 -0.097 20.920 1.00 0.00 C ATOM 231 O4' C A 8 -8.342 -0.284 19.735 1.00 0.00 O ATOM 232 C3' C A 8 -8.289 -0.752 22.009 1.00 0.00 C ATOM 233 O3' C A 8 -9.044 -1.037 23.166 1.00 0.00 O ATOM 234 C2' C A 8 -7.850 -2.006 21.311 1.00 0.00 C ATOM 235 O2' C A 8 -8.916 -2.934 21.275 1.00 0.00 O ATOM 236 C1' C A 8 -7.574 -1.493 19.898 1.00 0.00 C ATOM 237 N1 C A 8 -6.119 -1.220 19.745 1.00 0.00 N ATOM 238 C2 C A 8 -5.277 -2.313 19.572 1.00 0.00 C ATOM 239 O2 C A 8 -5.741 -3.450 19.521 1.00 0.00 O ATOM 240 N3 C A 8 -3.937 -2.087 19.461 1.00 0.00 N ATOM 241 C4 C A 8 -3.442 -0.843 19.522 1.00 0.00 C ATOM 242 N4 C A 8 -2.123 -0.664 19.398 1.00 0.00 N ATOM 243 C5 C A 8 -4.297 0.291 19.710 1.00 0.00 C ATOM 244 C6 C A 8 -5.621 0.050 19.812 1.00 0.00 C ATOM 0 H5' C A 8 -9.955 1.822 20.387 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.975 1.491 22.108 1.00 0.00 H new ATOM 0 H4' C A 8 -10.102 -0.539 20.841 1.00 0.00 H new ATOM 0 H3' C A 8 -7.479 -0.128 22.386 1.00 0.00 H new ATOM 0 H2' C A 8 -7.006 -2.508 21.784 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.597 -2.675 21.930 1.00 0.00 H new ATOM 0 HO3' C A 8 -8.468 -1.460 23.836 1.00 0.00 H new ATOM 0 H1' C A 8 -7.856 -2.226 19.142 1.00 0.00 H new ATOM 0 H41 C A 8 -1.730 0.276 19.442 1.00 0.00 H new ATOM 0 H42 C A 8 -1.510 -1.467 19.259 1.00 0.00 H new ATOM 0 H5 C A 8 -3.900 1.294 19.768 1.00 0.00 H new ATOM 0 H6 C A 8 -6.300 0.878 19.949 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.781 -10.996 17.518 1.00 0.00 O ATOM 259 C5' G B 9 3.120 -10.250 16.520 1.00 0.00 C ATOM 260 C4' G B 9 1.631 -10.157 16.850 1.00 0.00 C ATOM 261 O4' G B 9 1.412 -9.411 18.047 1.00 0.00 O ATOM 262 C3' G B 9 0.861 -9.410 15.781 1.00 0.00 C ATOM 263 O3' G B 9 0.604 -10.204 14.638 1.00 0.00 O ATOM 264 C2' G B 9 -0.397 -9.091 16.546 1.00 0.00 C ATOM 265 O2' G B 9 -1.192 -10.251 16.668 1.00 0.00 O ATOM 266 C1' G B 9 0.154 -8.732 17.918 1.00 0.00 C ATOM 267 N9 G B 9 0.363 -7.273 17.993 1.00 0.00 N ATOM 268 C8 G B 9 1.496 -6.551 17.731 1.00 0.00 C ATOM 269 N7 G B 9 1.355 -5.265 17.892 1.00 0.00 N ATOM 270 C5 G B 9 0.027 -5.121 18.281 1.00 0.00 C ATOM 271 C6 G B 9 -0.716 -3.944 18.591 1.00 0.00 C ATOM 272 O6 G B 9 -0.328 -2.779 18.600 1.00 0.00 O ATOM 273 N1 G B 9 -2.036 -4.241 18.912 1.00 0.00 N ATOM 274 C2 G B 9 -2.577 -5.509 18.938 1.00 0.00 C ATOM 275 N2 G B 9 -3.870 -5.606 19.262 1.00 0.00 N ATOM 276 N3 G B 9 -1.882 -6.616 18.656 1.00 0.00 N ATOM 277 C4 G B 9 -0.591 -6.347 18.335 1.00 0.00 C ATOM 0 H5' G B 9 3.258 -10.722 15.547 1.00 0.00 H new ATOM 0 H5'' G B 9 3.551 -9.251 16.453 1.00 0.00 H new ATOM 0 H4' G B 9 1.293 -11.189 16.940 1.00 0.00 H new ATOM 0 H3' G B 9 1.381 -8.547 15.365 1.00 0.00 H new ATOM 0 H2' G B 9 -1.010 -8.319 16.081 1.00 0.00 H new ATOM 0 HO2' G B 9 -2.008 -10.037 17.167 1.00 0.00 H new ATOM 0 HO5' G B 9 4.735 -11.056 17.304 1.00 0.00 H new ATOM 0 H1' G B 9 -0.532 -9.024 18.713 1.00 0.00 H new ATOM 0 H8 G B 9 2.424 -7.006 17.419 1.00 0.00 H new ATOM 0 H1 G B 9 -2.651 -3.462 19.146 1.00 0.00 H new ATOM 0 H21 G B 9 -4.320 -6.521 19.296 1.00 0.00 H new ATOM 0 H22 G B 9 -4.407 -4.765 19.475 1.00 0.00 H new ATOM 290 P A B 10 0.081 -9.531 13.266 1.00 0.00 P ATOM 291 OP1 A B 10 -0.148 -10.611 12.281 1.00 0.00 O ATOM 292 OP2 A B 10 0.994 -8.415 12.932 1.00 0.00 O ATOM 293 O5' A B 10 -1.349 -8.902 13.663 1.00 0.00 O ATOM 294 C5' A B 10 -2.486 -9.723 13.831 1.00 0.00 C ATOM 295 C4' A B 10 -3.679 -8.855 14.238 1.00 0.00 C ATOM 296 O4' A B 10 -3.405 -8.124 15.430 1.00 0.00 O ATOM 297 C3' A B 10 -4.000 -7.801 13.202 1.00 0.00 C ATOM 298 O3' A B 10 -4.691 -8.334 12.083 1.00 0.00 O ATOM 299 C2' A B 10 -4.865 -6.883 14.022 1.00 0.00 C ATOM 300 O2' A B 10 -6.140 -7.465 14.191 1.00 0.00 O ATOM 301 C1' A B 10 -4.146 -6.895 15.368 1.00 0.00 C ATOM 302 N9 A B 10 -3.230 -5.737 15.464 1.00 0.00 N ATOM 303 C8 A B 10 -1.871 -5.688 15.277 1.00 0.00 C ATOM 304 N7 A B 10 -1.355 -4.502 15.448 1.00 0.00 N ATOM 305 C5 A B 10 -2.449 -3.705 15.769 1.00 0.00 C ATOM 306 C6 A B 10 -2.578 -2.335 16.070 1.00 0.00 C ATOM 307 N6 A B 10 -1.542 -1.488 16.100 1.00 0.00 N ATOM 308 N1 A B 10 -3.812 -1.866 16.338 1.00 0.00 N ATOM 309 C2 A B 10 -4.841 -2.709 16.310 1.00 0.00 C ATOM 310 N3 A B 10 -4.850 -4.009 16.046 1.00 0.00 N ATOM 311 C4 A B 10 -3.597 -4.449 15.779 1.00 0.00 C ATOM 0 H5' A B 10 -2.294 -10.479 14.593 1.00 0.00 H new ATOM 0 H5'' A B 10 -2.706 -10.253 12.905 1.00 0.00 H new ATOM 0 H4' A B 10 -4.506 -9.555 14.362 1.00 0.00 H new ATOM 0 H3' A B 10 -3.129 -7.327 12.749 1.00 0.00 H new ATOM 0 H2' A B 10 -5.002 -5.894 13.584 1.00 0.00 H new ATOM 0 HO2' A B 10 -6.330 -8.060 13.436 1.00 0.00 H new ATOM 0 H1' A B 10 -4.854 -6.826 16.194 1.00 0.00 H new ATOM 0 H8 A B 10 -1.282 -6.554 15.012 1.00 0.00 H new ATOM 0 H61 A B 10 -1.694 -0.505 16.324 1.00 0.00 H new ATOM 0 H62 A B 10 -0.601 -1.826 15.899 1.00 0.00 H new ATOM 0 H2 A B 10 -5.804 -2.274 16.534 1.00 0.00 H new ATOM 323 P G B 11 -4.759 -7.528 10.680 1.00 0.00 P ATOM 324 OP1 G B 11 -5.575 -8.321 9.734 1.00 0.00 O ATOM 325 OP2 G B 11 -3.378 -7.144 10.312 1.00 0.00 O ATOM 326 O5' G B 11 -5.570 -6.183 11.034 1.00 0.00 O ATOM 327 C5' G B 11 -6.979 -6.185 11.162 1.00 0.00 C ATOM 328 C4' G B 11 -7.434 -4.779 11.551 1.00 0.00 C ATOM 329 O4' G B 11 -6.792 -4.362 12.749 1.00 0.00 O ATOM 330 C3' G B 11 -7.059 -3.745 10.525 1.00 0.00 C ATOM 331 O3' G B 11 -7.928 -3.773 9.403 1.00 0.00 O ATOM 332 C2' G B 11 -7.246 -2.499 11.359 1.00 0.00 C ATOM 333 O2' G B 11 -8.617 -2.191 11.466 1.00 0.00 O ATOM 334 C1' G B 11 -6.746 -2.938 12.732 1.00 0.00 C ATOM 335 N9 G B 11 -5.368 -2.449 12.914 1.00 0.00 N ATOM 336 C8 G B 11 -4.177 -3.117 12.784 1.00 0.00 C ATOM 337 N7 G B 11 -3.127 -2.361 12.960 1.00 0.00 N ATOM 338 C5 G B 11 -3.663 -1.102 13.221 1.00 0.00 C ATOM 339 C6 G B 11 -3.013 0.141 13.485 1.00 0.00 C ATOM 340 O6 G B 11 -1.808 0.374 13.554 1.00 0.00 O ATOM 341 N1 G B 11 -3.933 1.166 13.679 1.00 0.00 N ATOM 342 C2 G B 11 -5.302 1.019 13.632 1.00 0.00 C ATOM 343 N2 G B 11 -6.035 2.113 13.849 1.00 0.00 N ATOM 344 N3 G B 11 -5.912 -0.141 13.390 1.00 0.00 N ATOM 345 C4 G B 11 -5.034 -1.153 13.193 1.00 0.00 C ATOM 0 H5' G B 11 -7.289 -6.906 11.918 1.00 0.00 H new ATOM 0 H5'' G B 11 -7.444 -6.487 10.224 1.00 0.00 H new ATOM 0 H4' G B 11 -8.517 -4.845 11.653 1.00 0.00 H new ATOM 0 H3' G B 11 -6.071 -3.863 10.080 1.00 0.00 H new ATOM 0 H2' G B 11 -6.738 -1.628 10.946 1.00 0.00 H new ATOM 0 HO2' G B 11 -8.729 -1.383 12.009 1.00 0.00 H new ATOM 0 H1' G B 11 -7.355 -2.536 13.542 1.00 0.00 H new ATOM 0 H8 G B 11 -4.114 -4.171 12.557 1.00 0.00 H new ATOM 0 H1 G B 11 -3.566 2.098 13.871 1.00 0.00 H new ATOM 0 H21 G B 11 -7.053 2.058 13.825 1.00 0.00 H new ATOM 0 H22 G B 11 -5.577 3.004 14.039 1.00 0.00 H new ATOM 357 P G B 12 -7.724 -2.761 8.158 1.00 0.00 P ATOM 358 OP1 G B 12 -8.604 -3.208 7.056 1.00 0.00 O ATOM 359 OP2 G B 12 -6.270 -2.619 7.922 1.00 0.00 O ATOM 360 O5' G B 12 -8.284 -1.342 8.697 1.00 0.00 O ATOM 361 C5' G B 12 -9.672 -1.128 8.891 1.00 0.00 C ATOM 362 C4' G B 12 -9.918 0.334 9.286 1.00 0.00 C ATOM 363 O4' G B 12 -9.205 0.684 10.477 1.00 0.00 O ATOM 364 C3' G B 12 -9.438 1.293 8.213 1.00 0.00 C ATOM 365 O3' G B 12 -10.409 1.467 7.199 1.00 0.00 O ATOM 366 C2' G B 12 -9.261 2.556 9.019 1.00 0.00 C ATOM 367 O2' G B 12 -10.522 3.143 9.265 1.00 0.00 O ATOM 368 C1' G B 12 -8.716 2.029 10.334 1.00 0.00 C ATOM 369 N9 G B 12 -7.240 2.021 10.333 1.00 0.00 N ATOM 370 C8 G B 12 -6.395 0.949 10.265 1.00 0.00 C ATOM 371 N7 G B 12 -5.132 1.258 10.370 1.00 0.00 N ATOM 372 C5 G B 12 -5.138 2.643 10.518 1.00 0.00 C ATOM 373 C6 G B 12 -4.050 3.552 10.687 1.00 0.00 C ATOM 374 O6 G B 12 -2.849 3.303 10.746 1.00 0.00 O ATOM 375 N1 G B 12 -4.492 4.867 10.788 1.00 0.00 N ATOM 376 C2 G B 12 -5.812 5.261 10.751 1.00 0.00 C ATOM 377 N2 G B 12 -6.049 6.573 10.864 1.00 0.00 N ATOM 378 N3 G B 12 -6.836 4.410 10.606 1.00 0.00 N ATOM 379 C4 G B 12 -6.426 3.121 10.492 1.00 0.00 C ATOM 0 H5' G B 12 -10.047 -1.793 9.669 1.00 0.00 H new ATOM 0 H5'' G B 12 -10.218 -1.365 7.978 1.00 0.00 H new ATOM 0 H4' G B 12 -10.995 0.418 9.433 1.00 0.00 H new ATOM 0 H3' G B 12 -8.545 0.962 7.684 1.00 0.00 H new ATOM 0 H2' G B 12 -8.632 3.299 8.530 1.00 0.00 H new ATOM 0 HO2' G B 12 -11.139 2.909 8.540 1.00 0.00 H new ATOM 0 H1' G B 12 -9.039 2.666 11.158 1.00 0.00 H new ATOM 0 H8 G B 12 -6.743 -0.065 10.136 1.00 0.00 H new ATOM 0 H1 G B 12 -3.786 5.595 10.898 1.00 0.00 H new ATOM 0 H21 G B 12 -7.007 6.922 10.843 1.00 0.00 H new ATOM 0 H22 G B 12 -5.271 7.224 10.971 1.00 0.00 H new ATOM 391 P U B 13 -9.998 2.025 5.745 1.00 0.00 P ATOM 392 OP1 U B 13 -11.238 2.360 5.011 1.00 0.00 O ATOM 393 OP2 U B 13 -9.031 1.074 5.154 1.00 0.00 O ATOM 394 O5' U B 13 -9.212 3.394 6.060 1.00 0.00 O ATOM 395 C5' U B 13 -9.894 4.578 6.419 1.00 0.00 C ATOM 396 C4' U B 13 -8.876 5.717 6.563 1.00 0.00 C ATOM 397 O4' U B 13 -7.997 5.566 7.679 1.00 0.00 O ATOM 398 C3' U B 13 -8.017 5.857 5.343 1.00 0.00 C ATOM 399 O3' U B 13 -8.721 6.520 4.307 1.00 0.00 O ATOM 400 C2' U B 13 -6.904 6.693 5.913 1.00 0.00 C ATOM 401 O2' U B 13 -7.325 8.037 6.033 1.00 0.00 O ATOM 402 C1' U B 13 -6.718 6.104 7.304 1.00 0.00 C ATOM 403 N1 U B 13 -5.733 4.999 7.305 1.00 0.00 N ATOM 404 C2 U B 13 -4.400 5.295 7.568 1.00 0.00 C ATOM 405 O2 U B 13 -3.997 6.448 7.721 1.00 0.00 O ATOM 406 N3 U B 13 -3.541 4.210 7.654 1.00 0.00 N ATOM 407 C4 U B 13 -3.894 2.877 7.505 1.00 0.00 C ATOM 408 O4 U B 13 -3.047 1.993 7.595 1.00 0.00 O ATOM 409 C5 U B 13 -5.301 2.666 7.253 1.00 0.00 C ATOM 410 C6 U B 13 -6.155 3.712 7.167 1.00 0.00 C ATOM 0 H5' U B 13 -10.432 4.433 7.356 1.00 0.00 H new ATOM 0 H5'' U B 13 -10.636 4.830 5.661 1.00 0.00 H new ATOM 0 H4' U B 13 -9.493 6.603 6.712 1.00 0.00 H new ATOM 0 H3' U B 13 -7.687 4.927 4.881 1.00 0.00 H new ATOM 0 H2' U B 13 -6.001 6.685 5.302 1.00 0.00 H new ATOM 0 HO2' U B 13 -8.136 8.175 5.501 1.00 0.00 H new ATOM 0 H1' U B 13 -6.355 6.872 7.987 1.00 0.00 H new ATOM 0 H3 U B 13 -2.559 4.411 7.844 1.00 0.00 H new ATOM 0 H5 U B 13 -5.676 1.660 7.132 1.00 0.00 H new ATOM 0 H6 U B 13 -7.202 3.520 6.984 1.00 0.00 H new ATOM 421 P C B 14 -8.083 6.674 2.844 1.00 0.00 P ATOM 422 OP1 C B 14 -9.044 7.405 1.989 1.00 0.00 O ATOM 423 OP2 C B 14 -7.578 5.349 2.422 1.00 0.00 O ATOM 424 O5' C B 14 -6.828 7.630 3.123 1.00 0.00 O ATOM 425 C5' C B 14 -5.643 7.476 2.389 1.00 0.00 C ATOM 426 C4' C B 14 -4.546 8.340 3.001 1.00 0.00 C ATOM 427 O4' C B 14 -4.352 8.017 4.385 1.00 0.00 O ATOM 428 C3' C B 14 -3.235 8.050 2.303 1.00 0.00 C ATOM 429 O3' C B 14 -3.045 8.870 1.168 1.00 0.00 O ATOM 430 C2' C B 14 -2.240 8.342 3.392 1.00 0.00 C ATOM 431 O2' C B 14 -2.073 9.737 3.538 1.00 0.00 O ATOM 432 C1' C B 14 -2.959 7.796 4.618 1.00 0.00 C ATOM 433 N1 C B 14 -2.685 6.343 4.769 1.00 0.00 N ATOM 434 C2 C B 14 -1.384 5.977 5.087 1.00 0.00 C ATOM 435 O2 C B 14 -0.535 6.839 5.295 1.00 0.00 O ATOM 436 N3 C B 14 -1.083 4.651 5.157 1.00 0.00 N ATOM 437 C4 C B 14 -2.018 3.721 4.922 1.00 0.00 C ATOM 438 N4 C B 14 -1.676 2.430 4.982 1.00 0.00 N ATOM 439 C5 C B 14 -3.373 4.081 4.637 1.00 0.00 C ATOM 440 C6 C B 14 -3.662 5.399 4.583 1.00 0.00 C ATOM 0 H5' C B 14 -5.807 7.761 1.350 1.00 0.00 H new ATOM 0 H5'' C B 14 -5.338 6.430 2.388 1.00 0.00 H new ATOM 0 H4' C B 14 -4.845 9.383 2.893 1.00 0.00 H new ATOM 0 H3' C B 14 -3.162 7.039 1.903 1.00 0.00 H new ATOM 0 H2' C B 14 -1.252 7.919 3.213 1.00 0.00 H new ATOM 0 HO2' C B 14 -2.335 10.186 2.707 1.00 0.00 H new ATOM 0 H1' C B 14 -2.624 8.286 5.532 1.00 0.00 H new ATOM 0 H41 C B 14 -2.375 1.708 4.806 1.00 0.00 H new ATOM 0 H42 C B 14 -0.716 2.167 5.204 1.00 0.00 H new ATOM 0 H5 C B 14 -4.132 3.331 4.472 1.00 0.00 H new ATOM 0 H6 C B 14 -4.677 5.714 4.391 1.00 0.00 H new ATOM 452 P U B 15 -2.083 8.401 -0.035 1.00 0.00 P ATOM 453 OP1 U B 15 -2.012 9.500 -1.023 1.00 0.00 O ATOM 454 OP2 U B 15 -2.521 7.055 -0.466 1.00 0.00 O ATOM 455 O5' U B 15 -0.637 8.254 0.656 1.00 0.00 O ATOM 456 C5' U B 15 0.120 9.390 1.014 1.00 0.00 C ATOM 457 C4' U B 15 1.496 8.937 1.505 1.00 0.00 C ATOM 458 O4' U B 15 1.397 8.113 2.672 1.00 0.00 O ATOM 459 C3' U B 15 2.204 8.086 0.470 1.00 0.00 C ATOM 460 O3' U B 15 2.807 8.855 -0.553 1.00 0.00 O ATOM 461 C2' U B 15 3.226 7.409 1.339 1.00 0.00 C ATOM 462 O2' U B 15 4.260 8.316 1.662 1.00 0.00 O ATOM 463 C1' U B 15 2.430 7.112 2.600 1.00 0.00 C ATOM 464 N1 U B 15 1.839 5.746 2.550 1.00 0.00 N ATOM 465 C2 U B 15 2.708 4.677 2.715 1.00 0.00 C ATOM 466 O2 U B 15 3.919 4.834 2.855 1.00 0.00 O ATOM 467 N3 U B 15 2.139 3.416 2.721 1.00 0.00 N ATOM 468 C4 U B 15 0.791 3.129 2.592 1.00 0.00 C ATOM 469 O4 U B 15 0.399 1.964 2.606 1.00 0.00 O ATOM 470 C5 U B 15 -0.053 4.299 2.457 1.00 0.00 C ATOM 471 C6 U B 15 0.482 5.546 2.442 1.00 0.00 C ATOM 0 H5' U B 15 -0.392 9.953 1.795 1.00 0.00 H new ATOM 0 H5'' U B 15 0.226 10.057 0.158 1.00 0.00 H new ATOM 0 H4' U B 15 2.044 9.856 1.712 1.00 0.00 H new ATOM 0 H3' U B 15 1.548 7.414 -0.083 1.00 0.00 H new ATOM 0 H2' U B 15 3.685 6.537 0.873 1.00 0.00 H new ATOM 0 HO2' U B 15 4.922 7.869 2.230 1.00 0.00 H new ATOM 0 H1' U B 15 3.070 7.141 3.482 1.00 0.00 H new ATOM 0 H3 U B 15 2.772 2.624 2.831 1.00 0.00 H new ATOM 0 H5 U B 15 -1.122 4.177 2.367 1.00 0.00 H new ATOM 0 H6 U B 15 -0.172 6.400 2.343 1.00 0.00 H new ATOM 482 P C B 16 3.356 8.149 -1.902 1.00 0.00 P ATOM 483 OP1 C B 16 3.945 9.199 -2.763 1.00 0.00 O ATOM 484 OP2 C B 16 2.278 7.286 -2.432 1.00 0.00 O ATOM 485 O5' C B 16 4.551 7.192 -1.392 1.00 0.00 O ATOM 486 C5' C B 16 5.811 7.724 -1.036 1.00 0.00 C ATOM 487 C4' C B 16 6.760 6.583 -0.657 1.00 0.00 C ATOM 488 O4' C B 16 6.269 5.825 0.443 1.00 0.00 O ATOM 489 C3' C B 16 6.917 5.574 -1.770 1.00 0.00 C ATOM 490 O3' C B 16 7.753 6.034 -2.811 1.00 0.00 O ATOM 491 C2' C B 16 7.530 4.428 -1.019 1.00 0.00 C ATOM 492 O2' C B 16 8.898 4.687 -0.781 1.00 0.00 O ATOM 493 C1' C B 16 6.766 4.481 0.302 1.00 0.00 C ATOM 494 N1 C B 16 5.644 3.505 0.262 1.00 0.00 N ATOM 495 C2 C B 16 5.960 2.160 0.411 1.00 0.00 C ATOM 496 O2 C B 16 7.125 1.815 0.595 1.00 0.00 O ATOM 497 N3 C B 16 4.949 1.247 0.345 1.00 0.00 N ATOM 498 C4 C B 16 3.683 1.637 0.138 1.00 0.00 C ATOM 499 N4 C B 16 2.720 0.711 0.090 1.00 0.00 N ATOM 500 C5 C B 16 3.345 3.018 -0.026 1.00 0.00 C ATOM 501 C6 C B 16 4.357 3.909 0.046 1.00 0.00 C ATOM 0 H5' C B 16 5.703 8.414 -0.199 1.00 0.00 H new ATOM 0 H5'' C B 16 6.225 8.294 -1.868 1.00 0.00 H new ATOM 0 H4' C B 16 7.701 7.081 -0.426 1.00 0.00 H new ATOM 0 H3' C B 16 5.988 5.335 -2.288 1.00 0.00 H new ATOM 0 H2' C B 16 7.472 3.472 -1.539 1.00 0.00 H new ATOM 0 HO2' C B 16 9.255 5.247 -1.502 1.00 0.00 H new ATOM 0 HO3' C B 16 7.823 5.344 -3.504 1.00 0.00 H new ATOM 0 H1' C B 16 7.404 4.223 1.147 1.00 0.00 H new ATOM 0 H41 C B 16 1.751 0.990 -0.067 1.00 0.00 H new ATOM 0 H42 C B 16 2.954 -0.275 0.210 1.00 0.00 H new ATOM 0 H5 C B 16 2.327 3.333 -0.199 1.00 0.00 H new ATOM 0 H6 C B 16 4.145 4.962 -0.069 1.00 0.00 H new TER 514 C B 16