USER MOD reduce.3.24.130724 H: found=0, std=0, add=232, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 256 hydrogens (24 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 C O2' : rot -120:sc= 0.461 USER MOD Single : A 1 C O5' : rot 180:sc= 0 USER MOD Single : A 2 C O2' : rot -71:sc= 0.0683 USER MOD Single : A 3 G O2' : rot -25:sc= 0.0139 USER MOD Single : A 4 G O2' : rot -21:sc= 0.0606 USER MOD Single : A 5 C O2' : rot -23:sc= 0.0895 USER MOD Single : A 6 A O2' : rot 180:sc= 0 USER MOD Single : A 7 G O2' : rot -74:sc= 0.0289 USER MOD Single : A 8 U O2' : rot -27:sc= 0.0174 USER MOD Single : A 9 G O2' : rot -19:sc= 0.00458 USER MOD Single : A 10 U O2' : rot -23:sc= 0.0736 USER MOD Single : A 11 G O2' : rot 180:sc= 0 USER MOD Single : A 11 G O3' : rot 141:sc= 0.0813 USER MOD Single : B 12 C O2' : rot -14:sc= 0.0456 USER MOD Single : B 12 C O5' : rot 180:sc= 0 USER MOD Single : B 13 A O2' : rot -19:sc= 0.017 USER MOD Single : B 14 C O2' : rot -26:sc= 0.00261 USER MOD Single : B 15 A O2' : rot -23:sc= 0.00458 USER MOD Single : B 16 C O2' : rot -17:sc= 0.0438 USER MOD Single : B 17 G O2' : rot -22:sc= 0.0408 USER MOD Single : B 18 U O2' : rot -16:sc= 0.0213 USER MOD Single : B 19 C O2' : rot -67:sc= 0.167 USER MOD Single : B 20 G O2' : rot -95:sc= 0.35 USER MOD Single : B 21 G O2' : rot 171:sc= 0.00317 USER MOD Single : B 21 G O3' : rot 131:sc= 0.0167 USER MOD ----------------------------------------------------------------- ATOM 1 O5' C A 1 -5.589 -10.999 12.808 1.00 0.00 O ATOM 2 C5' C A 1 -4.683 -9.983 12.410 1.00 0.00 C ATOM 3 C4' C A 1 -3.244 -10.521 12.332 1.00 0.00 C ATOM 4 O4' C A 1 -3.084 -11.378 11.210 1.00 0.00 O ATOM 5 C3' C A 1 -2.224 -9.408 12.117 1.00 0.00 C ATOM 6 O3' C A 1 -1.936 -8.647 13.289 1.00 0.00 O ATOM 7 C2' C A 1 -1.038 -10.225 11.586 1.00 0.00 C ATOM 8 O2' C A 1 -0.270 -10.850 12.615 1.00 0.00 O ATOM 9 C1' C A 1 -1.728 -11.336 10.783 1.00 0.00 C ATOM 10 N1 C A 1 -1.628 -11.107 9.308 1.00 0.00 N ATOM 11 C2 C A 1 -0.540 -11.646 8.617 1.00 0.00 C ATOM 12 O2 C A 1 0.353 -12.267 9.193 1.00 0.00 O ATOM 13 N3 C A 1 -0.452 -11.533 7.269 1.00 0.00 N ATOM 14 C4 C A 1 -1.416 -10.904 6.628 1.00 0.00 C ATOM 15 N4 C A 1 -1.325 -10.876 5.323 1.00 0.00 N ATOM 16 C5 C A 1 -2.548 -10.318 7.271 1.00 0.00 C ATOM 17 C6 C A 1 -2.608 -10.434 8.623 1.00 0.00 C ATOM 0 H5' C A 1 -4.727 -9.155 13.118 1.00 0.00 H new ATOM 0 H5'' C A 1 -4.980 -9.588 11.438 1.00 0.00 H new ATOM 0 H4' C A 1 -3.078 -11.034 13.279 1.00 0.00 H new ATOM 0 H3' C A 1 -2.556 -8.615 11.447 1.00 0.00 H new ATOM 0 H2' C A 1 -0.345 -9.588 11.036 1.00 0.00 H new ATOM 0 HO2' C A 1 0.653 -10.524 12.578 1.00 0.00 H new ATOM 0 HO5' C A 1 -6.496 -10.630 12.851 1.00 0.00 H new ATOM 0 H1' C A 1 -1.236 -12.291 10.966 1.00 0.00 H new ATOM 0 H41 C A 1 -2.042 -10.404 4.772 1.00 0.00 H new ATOM 0 H42 C A 1 -0.537 -11.327 4.857 1.00 0.00 H new ATOM 0 H5 C A 1 -3.318 -9.808 6.711 1.00 0.00 H new ATOM 0 H6 C A 1 -3.433 -9.993 9.163 1.00 0.00 H new ATOM 30 P C A 2 -1.230 -7.210 13.191 1.00 0.00 P ATOM 31 OP1 C A 2 -1.178 -6.631 14.561 1.00 0.00 O ATOM 32 OP2 C A 2 -1.908 -6.450 12.115 1.00 0.00 O1- ATOM 33 O5' C A 2 0.280 -7.488 12.689 1.00 0.00 O ATOM 34 C5' C A 2 1.258 -8.022 13.557 1.00 0.00 C ATOM 35 C4' C A 2 2.515 -8.457 12.801 1.00 0.00 C ATOM 36 O4' C A 2 2.211 -9.461 11.833 1.00 0.00 O ATOM 37 C3' C A 2 3.238 -7.327 12.047 1.00 0.00 C ATOM 38 O3' C A 2 4.007 -6.471 12.900 1.00 0.00 O ATOM 39 C2' C A 2 4.060 -8.169 11.074 1.00 0.00 C ATOM 40 O2' C A 2 5.254 -8.684 11.662 1.00 0.00 O ATOM 41 C1' C A 2 3.134 -9.345 10.755 1.00 0.00 C ATOM 42 N1 C A 2 2.429 -9.118 9.458 1.00 0.00 N ATOM 43 C2 C A 2 3.005 -9.648 8.291 1.00 0.00 C ATOM 44 O2 C A 2 4.028 -10.331 8.316 1.00 0.00 O ATOM 45 N3 C A 2 2.469 -9.418 7.067 1.00 0.00 N ATOM 46 C4 C A 2 1.400 -8.644 6.998 1.00 0.00 C ATOM 47 N4 C A 2 0.930 -8.439 5.802 1.00 0.00 N ATOM 48 C5 C A 2 0.787 -8.048 8.137 1.00 0.00 C ATOM 49 C6 C A 2 1.327 -8.297 9.345 1.00 0.00 C ATOM 0 H5' C A 2 0.842 -8.876 14.091 1.00 0.00 H new ATOM 0 H5'' C A 2 1.525 -7.276 14.306 1.00 0.00 H new ATOM 0 H4' C A 2 3.174 -8.825 13.587 1.00 0.00 H new ATOM 0 H3' C A 2 2.591 -6.592 11.568 1.00 0.00 H new ATOM 0 H2' C A 2 4.374 -7.578 10.214 1.00 0.00 H new ATOM 0 HO2' C A 2 5.889 -7.952 11.808 1.00 0.00 H new ATOM 0 H1' C A 2 3.702 -10.269 10.648 1.00 0.00 H new ATOM 0 H41 C A 2 0.106 -7.852 5.671 1.00 0.00 H new ATOM 0 H42 C A 2 1.385 -8.866 4.995 1.00 0.00 H new ATOM 0 H5 C A 2 -0.083 -7.416 8.035 1.00 0.00 H new ATOM 0 H6 C A 2 0.895 -7.852 10.229 1.00 0.00 H new ATOM 61 P G A 3 4.681 -5.141 12.317 1.00 0.00 P ATOM 62 OP1 G A 3 5.339 -4.433 13.439 1.00 0.00 O ATOM 63 OP2 G A 3 3.669 -4.433 11.487 1.00 0.00 O1- ATOM 64 O5' G A 3 5.816 -5.736 11.359 1.00 0.00 O ATOM 65 C5' G A 3 6.177 -5.126 10.126 1.00 0.00 C ATOM 66 C4' G A 3 7.107 -6.049 9.312 1.00 0.00 C ATOM 67 O4' G A 3 6.432 -7.223 8.873 1.00 0.00 O ATOM 68 C3' G A 3 7.640 -5.368 8.039 1.00 0.00 C ATOM 69 O3' G A 3 8.753 -4.509 8.258 1.00 0.00 O ATOM 70 C2' G A 3 7.982 -6.600 7.191 1.00 0.00 C ATOM 71 O2' G A 3 9.179 -7.249 7.617 1.00 0.00 O ATOM 72 C1' G A 3 6.789 -7.514 7.517 1.00 0.00 C ATOM 73 N9 G A 3 5.635 -7.235 6.605 1.00 0.00 N ATOM 74 C8 G A 3 4.503 -6.501 6.867 1.00 0.00 C ATOM 75 N7 G A 3 3.732 -6.319 5.825 1.00 0.00 N ATOM 76 C5 G A 3 4.367 -7.047 4.804 1.00 0.00 C ATOM 77 C6 G A 3 4.022 -7.269 3.424 1.00 0.00 C ATOM 78 O6 G A 3 3.038 -6.881 2.793 1.00 0.00 O ATOM 79 N1 G A 3 4.942 -8.054 2.743 1.00 0.00 N ATOM 80 C2 G A 3 6.076 -8.553 3.312 1.00 0.00 C ATOM 81 N2 G A 3 6.889 -9.229 2.547 1.00 0.00 N ATOM 82 N3 G A 3 6.418 -8.382 4.591 1.00 0.00 N ATOM 83 C4 G A 3 5.526 -7.619 5.286 1.00 0.00 C ATOM 0 H5' G A 3 6.676 -4.176 10.317 1.00 0.00 H new ATOM 0 H5'' G A 3 5.280 -4.904 9.548 1.00 0.00 H new ATOM 0 H4' G A 3 7.924 -6.291 9.992 1.00 0.00 H new ATOM 0 H3' G A 3 6.932 -4.678 7.579 1.00 0.00 H new ATOM 0 H2' G A 3 8.140 -6.357 6.140 1.00 0.00 H new ATOM 0 HO2' G A 3 9.752 -6.605 8.083 1.00 0.00 H new ATOM 0 H1' G A 3 7.050 -8.564 7.383 1.00 0.00 H new ATOM 0 H8 G A 3 4.270 -6.109 7.846 1.00 0.00 H new ATOM 0 H1 G A 3 4.760 -8.269 1.763 1.00 0.00 H new ATOM 0 H21 G A 3 7.748 -9.619 2.935 1.00 0.00 H new ATOM 0 H22 G A 3 6.665 -9.367 1.562 1.00 0.00 H new ATOM 95 P G A 4 9.041 -3.278 7.266 1.00 0.00 P ATOM 96 OP1 G A 4 10.221 -2.541 7.798 1.00 0.00 O ATOM 97 OP2 G A 4 7.768 -2.545 7.070 1.00 0.00 O1- ATOM 98 O5' G A 4 9.441 -3.945 5.860 1.00 0.00 O ATOM 99 C5' G A 4 10.692 -4.586 5.705 1.00 0.00 C ATOM 100 C4' G A 4 10.884 -5.170 4.303 1.00 0.00 C ATOM 101 O4' G A 4 9.909 -6.147 3.970 1.00 0.00 O ATOM 102 C3' G A 4 10.873 -4.132 3.181 1.00 0.00 C ATOM 103 O3' G A 4 12.088 -3.400 3.110 1.00 0.00 O ATOM 104 C2' G A 4 10.649 -5.051 1.975 1.00 0.00 C ATOM 105 O2' G A 4 11.849 -5.726 1.590 1.00 0.00 O ATOM 106 C1' G A 4 9.665 -6.067 2.560 1.00 0.00 C ATOM 107 N9 G A 4 8.276 -5.653 2.290 1.00 0.00 N ATOM 108 C8 G A 4 7.355 -5.081 3.133 1.00 0.00 C ATOM 109 N7 G A 4 6.183 -4.869 2.581 1.00 0.00 N ATOM 110 C5 G A 4 6.344 -5.315 1.265 1.00 0.00 C ATOM 111 C6 G A 4 5.435 -5.373 0.143 1.00 0.00 C ATOM 112 O6 G A 4 4.239 -5.072 0.077 1.00 0.00 O ATOM 113 N1 G A 4 6.025 -5.837 -1.013 1.00 0.00 N ATOM 114 C2 G A 4 7.285 -6.289 -1.085 1.00 0.00 C ATOM 115 N2 G A 4 7.695 -6.699 -2.255 1.00 0.00 N ATOM 116 N3 G A 4 8.152 -6.298 -0.075 1.00 0.00 N ATOM 117 C4 G A 4 7.624 -5.787 1.078 1.00 0.00 C ATOM 0 H5' G A 4 10.781 -5.384 6.442 1.00 0.00 H new ATOM 0 H5'' G A 4 11.490 -3.872 5.910 1.00 0.00 H new ATOM 0 H4' G A 4 11.875 -5.620 4.367 1.00 0.00 H new ATOM 0 H3' G A 4 10.131 -3.341 3.288 1.00 0.00 H new ATOM 0 H2' G A 4 10.310 -4.521 1.085 1.00 0.00 H new ATOM 0 HO2' G A 4 12.625 -5.239 1.939 1.00 0.00 H new ATOM 0 H1' G A 4 9.807 -7.045 2.100 1.00 0.00 H new ATOM 0 H8 G A 4 7.575 -4.828 4.160 1.00 0.00 H new ATOM 0 H1 G A 4 5.468 -5.836 -1.867 1.00 0.00 H new ATOM 0 H21 G A 4 8.645 -7.053 -2.367 1.00 0.00 H new ATOM 0 H22 G A 4 7.065 -6.665 -3.057 1.00 0.00 H new ATOM 129 P C A 5 12.111 -1.889 2.546 1.00 0.00 P ATOM 130 OP1 C A 5 13.523 -1.440 2.539 1.00 0.00 O ATOM 131 OP2 C A 5 11.113 -1.086 3.298 1.00 0.00 O1- ATOM 132 O5' C A 5 11.609 -1.996 1.025 1.00 0.00 O ATOM 133 C5' C A 5 12.457 -2.489 0.003 1.00 0.00 C ATOM 134 C4' C A 5 11.719 -2.576 -1.343 1.00 0.00 C ATOM 135 O4' C A 5 10.587 -3.443 -1.306 1.00 0.00 O ATOM 136 C3' C A 5 11.208 -1.231 -1.859 1.00 0.00 C ATOM 137 O3' C A 5 12.215 -0.427 -2.475 1.00 0.00 O ATOM 138 C2' C A 5 10.155 -1.680 -2.869 1.00 0.00 C ATOM 139 O2' C A 5 10.741 -2.075 -4.112 1.00 0.00 O ATOM 140 C1' C A 5 9.591 -2.948 -2.204 1.00 0.00 C ATOM 141 N1 C A 5 8.302 -2.656 -1.503 1.00 0.00 N ATOM 142 C2 C A 5 7.102 -2.745 -2.224 1.00 0.00 C ATOM 143 O2 C A 5 7.069 -3.056 -3.417 1.00 0.00 O ATOM 144 N3 C A 5 5.911 -2.470 -1.644 1.00 0.00 N ATOM 145 C4 C A 5 5.900 -2.079 -0.396 1.00 0.00 C ATOM 146 N4 C A 5 4.712 -1.832 0.088 1.00 0.00 N ATOM 147 C5 C A 5 7.074 -1.949 0.400 1.00 0.00 C ATOM 148 C6 C A 5 8.265 -2.239 -0.184 1.00 0.00 C ATOM 0 H5' C A 5 12.829 -3.475 0.281 1.00 0.00 H new ATOM 0 H5'' C A 5 13.325 -1.838 -0.098 1.00 0.00 H new ATOM 0 H4' C A 5 12.487 -2.966 -2.011 1.00 0.00 H new ATOM 0 H3' C A 5 10.839 -0.586 -1.062 1.00 0.00 H new ATOM 0 H2' C A 5 9.437 -0.890 -3.089 1.00 0.00 H new ATOM 0 HO2' C A 5 11.617 -1.648 -4.211 1.00 0.00 H new ATOM 0 H1' C A 5 9.364 -3.706 -2.953 1.00 0.00 H new ATOM 0 H41 C A 5 4.609 -1.522 1.054 1.00 0.00 H new ATOM 0 H42 C A 5 3.887 -1.949 -0.500 1.00 0.00 H new ATOM 0 H5 C A 5 7.019 -1.631 1.431 1.00 0.00 H new ATOM 0 H6 C A 5 9.181 -2.144 0.380 1.00 0.00 H new ATOM 160 P A A 6 12.256 1.175 -2.290 1.00 0.00 P ATOM 161 OP1 A A 6 13.483 1.684 -2.952 1.00 0.00 O ATOM 162 OP2 A A 6 12.070 1.467 -0.845 1.00 0.00 O1- ATOM 163 O5' A A 6 10.955 1.764 -3.055 1.00 0.00 O ATOM 164 C5' A A 6 10.631 1.516 -4.430 1.00 0.00 C ATOM 165 C4' A A 6 11.684 1.959 -5.460 1.00 0.00 C ATOM 166 O4' A A 6 12.539 0.847 -5.752 1.00 0.00 O ATOM 167 C3' A A 6 11.018 2.377 -6.788 1.00 0.00 C ATOM 168 O3' A A 6 11.747 3.451 -7.369 1.00 0.00 O ATOM 169 C2' A A 6 11.112 1.076 -7.597 1.00 0.00 C ATOM 170 O2' A A 6 11.033 1.262 -9.008 1.00 0.00 O ATOM 171 C1' A A 6 12.495 0.597 -7.144 1.00 0.00 C ATOM 172 N9 A A 6 12.803 -0.818 -7.472 1.00 0.00 N ATOM 173 C8 A A 6 12.036 -1.953 -7.269 1.00 0.00 C ATOM 174 N7 A A 6 12.572 -3.056 -7.743 1.00 0.00 N ATOM 175 C5 A A 6 13.794 -2.613 -8.289 1.00 0.00 C ATOM 176 C6 A A 6 14.884 -3.235 -8.944 1.00 0.00 C ATOM 177 N6 A A 6 14.979 -4.528 -9.182 1.00 0.00 N ATOM 178 N1 A A 6 15.934 -2.523 -9.361 1.00 0.00 N ATOM 179 C2 A A 6 15.937 -1.212 -9.141 1.00 0.00 C ATOM 180 N3 A A 6 14.988 -0.486 -8.533 1.00 0.00 N ATOM 181 C4 A A 6 13.938 -1.254 -8.124 1.00 0.00 C ATOM 0 H5' A A 6 9.693 2.021 -4.659 1.00 0.00 H new ATOM 0 H5'' A A 6 10.456 0.447 -4.555 1.00 0.00 H new ATOM 0 H4' A A 6 12.235 2.801 -5.041 1.00 0.00 H new ATOM 0 H3' A A 6 9.995 2.746 -6.712 1.00 0.00 H new ATOM 0 H2' A A 6 10.291 0.381 -7.422 1.00 0.00 H new ATOM 0 HO2' A A 6 11.101 0.393 -9.457 1.00 0.00 H new ATOM 0 H1' A A 6 13.269 1.137 -7.689 1.00 0.00 H new ATOM 0 H8 A A 6 11.081 -1.934 -6.765 1.00 0.00 H new ATOM 0 H61 A A 6 15.799 -4.899 -9.661 1.00 0.00 H new ATOM 0 H62 A A 6 14.232 -5.157 -8.887 1.00 0.00 H new ATOM 0 H2 A A 6 16.803 -0.670 -9.492 1.00 0.00 H new ATOM 193 P G A 7 11.329 4.981 -7.136 1.00 0.00 P ATOM 194 OP1 G A 7 12.258 5.847 -7.906 1.00 0.00 O ATOM 195 OP2 G A 7 11.165 5.210 -5.683 1.00 0.00 O1- ATOM 196 O5' G A 7 9.874 5.053 -7.837 1.00 0.00 O ATOM 197 C5' G A 7 9.705 4.721 -9.220 1.00 0.00 C ATOM 198 C4' G A 7 8.236 4.774 -9.653 1.00 0.00 C ATOM 199 O4' G A 7 7.398 3.870 -8.932 1.00 0.00 O ATOM 200 C3' G A 7 7.589 6.149 -9.506 1.00 0.00 C ATOM 201 O3' G A 7 8.070 7.101 -10.449 1.00 0.00 O ATOM 202 C2' G A 7 6.120 5.738 -9.710 1.00 0.00 C ATOM 203 O2' G A 7 5.767 5.546 -11.085 1.00 0.00 O ATOM 204 C1' G A 7 6.056 4.370 -9.012 1.00 0.00 C ATOM 205 N9 G A 7 5.449 4.503 -7.657 1.00 0.00 N ATOM 206 C8 G A 7 6.034 4.754 -6.440 1.00 0.00 C ATOM 207 N7 G A 7 5.181 4.813 -5.438 1.00 0.00 N ATOM 208 C5 G A 7 3.936 4.603 -6.048 1.00 0.00 C ATOM 209 C6 G A 7 2.581 4.546 -5.523 1.00 0.00 C ATOM 210 O6 G A 7 2.173 4.662 -4.365 1.00 0.00 O ATOM 211 N1 G A 7 1.621 4.360 -6.500 1.00 0.00 N ATOM 212 C2 G A 7 1.902 4.186 -7.813 1.00 0.00 C ATOM 213 N2 G A 7 0.900 3.981 -8.628 1.00 0.00 N ATOM 214 N3 G A 7 3.125 4.202 -8.336 1.00 0.00 N ATOM 215 C4 G A 7 4.099 4.423 -7.403 1.00 0.00 C ATOM 0 H5' G A 7 10.100 3.722 -9.403 1.00 0.00 H new ATOM 0 H5'' G A 7 10.287 5.411 -9.831 1.00 0.00 H new ATOM 0 H4' G A 7 8.298 4.497 -10.705 1.00 0.00 H new ATOM 0 H3' G A 7 7.791 6.672 -8.571 1.00 0.00 H new ATOM 0 H2' G A 7 5.444 6.505 -9.332 1.00 0.00 H new ATOM 0 HO2' G A 7 5.689 6.417 -11.527 1.00 0.00 H new ATOM 0 H1' G A 7 5.429 3.677 -9.573 1.00 0.00 H new ATOM 0 H8 G A 7 7.098 4.891 -6.316 1.00 0.00 H new ATOM 0 H1 G A 7 0.642 4.353 -6.215 1.00 0.00 H new ATOM 0 H21 G A 7 1.072 3.846 -9.624 1.00 0.00 H new ATOM 0 H22 G A 7 -0.054 3.956 -8.267 1.00 0.00 H new ATOM 227 P U A 8 7.589 8.632 -10.389 1.00 0.00 P ATOM 228 OP1 U A 8 8.297 9.348 -11.479 1.00 0.00 O ATOM 229 OP2 U A 8 7.736 9.102 -8.987 1.00 0.00 O1- ATOM 230 O5' U A 8 6.018 8.571 -10.772 1.00 0.00 O ATOM 231 C5' U A 8 5.060 9.364 -10.088 1.00 0.00 C ATOM 232 C4' U A 8 3.640 8.930 -10.496 1.00 0.00 C ATOM 233 O4' U A 8 3.250 7.708 -9.871 1.00 0.00 O ATOM 234 C3' U A 8 2.610 9.963 -10.068 1.00 0.00 C ATOM 235 O3' U A 8 2.546 11.076 -10.969 1.00 0.00 O ATOM 236 C2' U A 8 1.343 9.101 -10.082 1.00 0.00 C ATOM 237 O2' U A 8 0.880 8.814 -11.404 1.00 0.00 O ATOM 238 C1' U A 8 1.887 7.813 -9.438 1.00 0.00 C ATOM 239 N1 U A 8 1.776 7.815 -7.936 1.00 0.00 N ATOM 240 C2 U A 8 0.516 7.623 -7.357 1.00 0.00 C ATOM 241 O2 U A 8 -0.509 7.420 -8.014 1.00 0.00 O ATOM 242 N3 U A 8 0.432 7.670 -5.988 1.00 0.00 N ATOM 243 C4 U A 8 1.471 7.910 -5.121 1.00 0.00 C ATOM 244 O4 U A 8 1.274 7.989 -3.914 1.00 0.00 O ATOM 245 C5 U A 8 2.761 8.032 -5.766 1.00 0.00 C ATOM 246 C6 U A 8 2.881 7.989 -7.119 1.00 0.00 C ATOM 0 H5' U A 8 5.211 10.417 -10.324 1.00 0.00 H new ATOM 0 H5'' U A 8 5.188 9.257 -9.011 1.00 0.00 H new ATOM 0 H4' U A 8 3.672 8.815 -11.579 1.00 0.00 H new ATOM 0 H3' U A 8 2.812 10.447 -9.112 1.00 0.00 H new ATOM 0 H2' U A 8 0.493 9.572 -9.589 1.00 0.00 H new ATOM 0 HO2' U A 8 1.159 9.531 -12.011 1.00 0.00 H new ATOM 0 H1' U A 8 1.297 6.951 -9.750 1.00 0.00 H new ATOM 0 H3 U A 8 -0.487 7.512 -5.575 1.00 0.00 H new ATOM 0 H5 U A 8 3.646 8.160 -5.160 1.00 0.00 H new ATOM 0 H6 U A 8 3.858 8.093 -7.567 1.00 0.00 H new ATOM 257 P G A 9 2.128 12.533 -10.451 1.00 0.00 P ATOM 258 OP1 G A 9 2.252 13.477 -11.592 1.00 0.00 O ATOM 259 OP2 G A 9 2.892 12.823 -9.217 1.00 0.00 O1- ATOM 260 O5' G A 9 0.587 12.396 -10.059 1.00 0.00 O ATOM 261 C5' G A 9 -0.432 12.290 -11.055 1.00 0.00 C ATOM 262 C4' G A 9 -1.798 12.006 -10.422 1.00 0.00 C ATOM 263 O4' G A 9 -1.766 10.833 -9.623 1.00 0.00 O ATOM 264 C3' G A 9 -2.313 13.128 -9.516 1.00 0.00 C ATOM 265 O3' G A 9 -2.836 14.240 -10.232 1.00 0.00 O ATOM 266 C2' G A 9 -3.380 12.346 -8.740 1.00 0.00 C ATOM 267 O2' G A 9 -4.588 12.101 -9.476 1.00 0.00 O ATOM 268 C1' G A 9 -2.659 11.008 -8.518 1.00 0.00 C ATOM 269 N9 G A 9 -1.939 11.033 -7.221 1.00 0.00 N ATOM 270 C8 G A 9 -0.595 11.215 -6.962 1.00 0.00 C ATOM 271 N7 G A 9 -0.285 11.132 -5.693 1.00 0.00 N ATOM 272 C5 G A 9 -1.514 10.890 -5.053 1.00 0.00 C ATOM 273 C6 G A 9 -1.864 10.753 -3.658 1.00 0.00 C ATOM 274 O6 G A 9 -1.124 10.765 -2.672 1.00 0.00 O ATOM 275 N1 G A 9 -3.216 10.602 -3.456 1.00 0.00 N ATOM 276 C2 G A 9 -4.137 10.574 -4.444 1.00 0.00 C ATOM 277 N2 G A 9 -5.391 10.479 -4.097 1.00 0.00 N ATOM 278 N3 G A 9 -3.866 10.707 -5.747 1.00 0.00 N ATOM 279 C4 G A 9 -2.523 10.854 -5.992 1.00 0.00 C ATOM 0 H5' G A 9 -0.179 11.493 -11.754 1.00 0.00 H new ATOM 0 H5'' G A 9 -0.480 13.215 -11.630 1.00 0.00 H new ATOM 0 H4' G A 9 -2.465 11.900 -11.278 1.00 0.00 H new ATOM 0 H3' G A 9 -1.553 13.609 -8.900 1.00 0.00 H new ATOM 0 H2' G A 9 -3.709 12.886 -7.852 1.00 0.00 H new ATOM 0 HO2' G A 9 -4.642 12.722 -10.232 1.00 0.00 H new ATOM 0 H1' G A 9 -3.357 10.172 -8.472 1.00 0.00 H new ATOM 0 H8 G A 9 0.134 11.408 -7.735 1.00 0.00 H new ATOM 0 H1 G A 9 -3.546 10.505 -2.496 1.00 0.00 H new ATOM 0 H21 G A 9 -6.118 10.455 -4.812 1.00 0.00 H new ATOM 0 H22 G A 9 -5.645 10.429 -3.110 1.00 0.00 H new ATOM 291 P U A 10 -2.965 15.693 -9.554 1.00 0.00 P ATOM 292 OP1 U A 10 -3.557 16.605 -10.569 1.00 0.00 O ATOM 293 OP2 U A 10 -1.638 16.039 -8.979 1.00 0.00 O1- ATOM 294 O5' U A 10 -4.008 15.514 -8.334 1.00 0.00 O ATOM 295 C5' U A 10 -5.391 15.320 -8.564 1.00 0.00 C ATOM 296 C4' U A 10 -6.142 14.964 -7.271 1.00 0.00 C ATOM 297 O4' U A 10 -5.606 13.809 -6.618 1.00 0.00 O ATOM 298 C3' U A 10 -6.132 16.090 -6.230 1.00 0.00 C ATOM 299 O3' U A 10 -7.076 17.137 -6.431 1.00 0.00 O ATOM 300 C2' U A 10 -6.521 15.271 -5.002 1.00 0.00 C ATOM 301 O2' U A 10 -7.924 14.975 -4.947 1.00 0.00 O ATOM 302 C1' U A 10 -5.739 13.978 -5.206 1.00 0.00 C ATOM 303 N1 U A 10 -4.446 14.029 -4.473 1.00 0.00 N ATOM 304 C2 U A 10 -4.486 13.782 -3.100 1.00 0.00 C ATOM 305 O2 U A 10 -5.520 13.576 -2.473 1.00 0.00 O ATOM 306 N3 U A 10 -3.281 13.793 -2.433 1.00 0.00 N ATOM 307 C4 U A 10 -2.054 14.090 -2.969 1.00 0.00 C ATOM 308 O4 U A 10 -1.047 14.070 -2.260 1.00 0.00 O ATOM 309 C5 U A 10 -2.079 14.358 -4.395 1.00 0.00 C ATOM 310 C6 U A 10 -3.250 14.328 -5.097 1.00 0.00 C ATOM 0 H5' U A 10 -5.529 14.524 -9.295 1.00 0.00 H new ATOM 0 H5'' U A 10 -5.818 16.226 -8.994 1.00 0.00 H new ATOM 0 H4' U A 10 -7.160 14.778 -7.615 1.00 0.00 H new ATOM 0 H3' U A 10 -5.189 16.636 -6.214 1.00 0.00 H new ATOM 0 H2' U A 10 -6.305 15.804 -4.076 1.00 0.00 H new ATOM 0 HO2' U A 10 -8.418 15.631 -5.482 1.00 0.00 H new ATOM 0 H1' U A 10 -6.251 13.108 -4.794 1.00 0.00 H new ATOM 0 H3 U A 10 -3.303 13.557 -1.441 1.00 0.00 H new ATOM 0 H5 U A 10 -1.157 14.585 -4.909 1.00 0.00 H new ATOM 0 H6 U A 10 -3.241 14.541 -6.156 1.00 0.00 H new ATOM 321 P G A 11 -6.589 18.670 -6.398 1.00 0.00 P ATOM 322 OP1 G A 11 -7.782 19.538 -6.448 1.00 0.00 O ATOM 323 OP2 G A 11 -5.543 18.838 -7.437 1.00 0.00 O1- ATOM 324 O5' G A 11 -5.896 18.802 -4.946 1.00 0.00 O ATOM 325 C5' G A 11 -6.501 19.465 -3.844 1.00 0.00 C ATOM 326 C4' G A 11 -7.690 18.694 -3.232 1.00 0.00 C ATOM 327 O4' G A 11 -7.305 17.420 -2.717 1.00 0.00 O ATOM 328 C3' G A 11 -8.256 19.443 -2.017 1.00 0.00 C ATOM 329 O3' G A 11 -9.621 19.060 -1.796 1.00 0.00 O ATOM 330 C2' G A 11 -7.315 18.974 -0.904 1.00 0.00 C ATOM 331 O2' G A 11 -7.918 19.004 0.381 1.00 0.00 O ATOM 332 C1' G A 11 -6.916 17.548 -1.347 1.00 0.00 C ATOM 333 N9 G A 11 -5.459 17.264 -1.184 1.00 0.00 N ATOM 334 C8 G A 11 -4.488 17.212 -2.151 1.00 0.00 C ATOM 335 N7 G A 11 -3.274 16.992 -1.708 1.00 0.00 N ATOM 336 C5 G A 11 -3.461 16.863 -0.327 1.00 0.00 C ATOM 337 C6 G A 11 -2.516 16.619 0.733 1.00 0.00 C ATOM 338 O6 G A 11 -1.290 16.486 0.665 1.00 0.00 O ATOM 339 N1 G A 11 -3.093 16.560 1.983 1.00 0.00 N ATOM 340 C2 G A 11 -4.423 16.703 2.197 1.00 0.00 C ATOM 341 N2 G A 11 -4.825 16.625 3.436 1.00 0.00 N ATOM 342 N3 G A 11 -5.339 16.924 1.253 1.00 0.00 N ATOM 343 C4 G A 11 -4.792 16.999 -0.001 1.00 0.00 C ATOM 0 H5' G A 11 -6.844 20.448 -4.167 1.00 0.00 H new ATOM 0 H5'' G A 11 -5.749 19.628 -3.072 1.00 0.00 H new ATOM 0 H4' G A 11 -8.411 18.592 -4.043 1.00 0.00 H new ATOM 0 H3' G A 11 -8.289 20.529 -2.109 1.00 0.00 H new ATOM 0 H2' G A 11 -6.453 19.631 -0.784 1.00 0.00 H new ATOM 0 HO2' G A 11 -7.274 18.694 1.052 1.00 0.00 H new ATOM 0 HO3' G A 11 -9.786 18.977 -0.834 1.00 0.00 H new ATOM 0 H1' G A 11 -7.420 16.821 -0.711 1.00 0.00 H new ATOM 0 H8 G A 11 -4.707 17.343 -3.200 1.00 0.00 H new ATOM 0 H1 G A 11 -2.488 16.400 2.788 1.00 0.00 H new ATOM 0 H21 G A 11 -5.815 16.725 3.658 1.00 0.00 H new ATOM 0 H22 G A 11 -4.149 16.464 4.182 1.00 0.00 H new TER 356 G A 11 ATOM 357 O5' C B 12 1.501 16.404 11.081 1.00 0.00 O ATOM 358 C5' C B 12 1.038 15.197 10.509 1.00 0.00 C ATOM 359 C4' C B 12 -0.345 15.375 9.850 1.00 0.00 C ATOM 360 O4' C B 12 -0.270 16.162 8.663 1.00 0.00 O ATOM 361 C3' C B 12 -0.954 14.044 9.394 1.00 0.00 C ATOM 362 O3' C B 12 -1.498 13.282 10.474 1.00 0.00 O ATOM 363 C2' C B 12 -1.995 14.542 8.394 1.00 0.00 C ATOM 364 O2' C B 12 -3.190 14.980 9.046 1.00 0.00 O ATOM 365 C1' C B 12 -1.326 15.785 7.791 1.00 0.00 C ATOM 366 N1 C B 12 -0.817 15.519 6.414 1.00 0.00 N ATOM 367 C2 C B 12 -1.641 15.823 5.316 1.00 0.00 C ATOM 368 O2 C B 12 -2.800 16.220 5.454 1.00 0.00 O ATOM 369 N3 C B 12 -1.192 15.675 4.044 1.00 0.00 N ATOM 370 C4 C B 12 0.035 15.232 3.854 1.00 0.00 C ATOM 371 N4 C B 12 0.448 15.199 2.623 1.00 0.00 N ATOM 372 C5 C B 12 0.906 14.869 4.920 1.00 0.00 C ATOM 373 C6 C B 12 0.439 15.022 6.188 1.00 0.00 C ATOM 0 H5' C B 12 0.978 14.428 11.279 1.00 0.00 H new ATOM 0 H5'' C B 12 1.754 14.848 9.765 1.00 0.00 H new ATOM 0 H4' C B 12 -0.951 15.849 10.622 1.00 0.00 H new ATOM 0 H3' C B 12 -0.242 13.337 8.968 1.00 0.00 H new ATOM 0 H2' C B 12 -2.273 13.762 7.685 1.00 0.00 H new ATOM 0 HO2' C B 12 -3.187 14.672 9.976 1.00 0.00 H new ATOM 0 HO5' C B 12 2.379 16.256 11.491 1.00 0.00 H new ATOM 0 H1' C B 12 -2.051 16.593 7.697 1.00 0.00 H new ATOM 0 H41 C B 12 1.388 14.866 2.409 1.00 0.00 H new ATOM 0 H42 C B 12 -0.168 15.506 1.870 1.00 0.00 H new ATOM 0 H5 C B 12 1.898 14.487 4.729 1.00 0.00 H new ATOM 0 H6 C B 12 1.065 14.749 7.025 1.00 0.00 H new ATOM 386 P A B 13 -1.924 11.745 10.274 1.00 0.00 P ATOM 387 OP1 A B 13 -2.350 11.226 11.588 1.00 0.00 O ATOM 388 OP2 A B 13 -0.838 11.045 9.548 1.00 0.00 O1- ATOM 389 O5' A B 13 -3.226 11.864 9.346 1.00 0.00 O ATOM 390 C5' A B 13 -3.457 10.967 8.267 1.00 0.00 C ATOM 391 C4' A B 13 -4.585 11.468 7.373 1.00 0.00 C ATOM 392 O4' A B 13 -4.170 12.634 6.664 1.00 0.00 O ATOM 393 C3' A B 13 -5.002 10.450 6.308 1.00 0.00 C ATOM 394 O3' A B 13 -5.899 9.473 6.820 1.00 0.00 O ATOM 395 C2' A B 13 -5.617 11.374 5.250 1.00 0.00 C ATOM 396 O2' A B 13 -6.922 11.825 5.611 1.00 0.00 O ATOM 397 C1' A B 13 -4.671 12.578 5.326 1.00 0.00 C ATOM 398 N9 A B 13 -3.548 12.468 4.363 1.00 0.00 N ATOM 399 C8 A B 13 -2.218 12.158 4.588 1.00 0.00 C ATOM 400 N7 A B 13 -1.468 12.224 3.523 1.00 0.00 N ATOM 401 C5 A B 13 -2.357 12.634 2.525 1.00 0.00 C ATOM 402 C6 A B 13 -2.261 12.977 1.149 1.00 0.00 C ATOM 403 N6 A B 13 -1.153 12.991 0.439 1.00 0.00 N ATOM 404 N1 A B 13 -3.335 13.360 0.450 1.00 0.00 N ATOM 405 C2 A B 13 -4.503 13.419 1.071 1.00 0.00 C ATOM 406 N3 A B 13 -4.744 13.148 2.343 1.00 0.00 N ATOM 407 C4 A B 13 -3.625 12.762 3.023 1.00 0.00 C ATOM 0 H5' A B 13 -3.708 9.980 8.657 1.00 0.00 H new ATOM 0 H5'' A B 13 -2.545 10.856 7.680 1.00 0.00 H new ATOM 0 H4' A B 13 -5.423 11.663 8.042 1.00 0.00 H new ATOM 0 H3' A B 13 -4.193 9.832 5.919 1.00 0.00 H new ATOM 0 H2' A B 13 -5.718 10.887 4.280 1.00 0.00 H new ATOM 0 HO2' A B 13 -7.296 11.231 6.296 1.00 0.00 H new ATOM 0 H1' A B 13 -5.214 13.486 5.064 1.00 0.00 H new ATOM 0 H8 A B 13 -1.835 11.885 5.560 1.00 0.00 H new ATOM 0 H61 A B 13 -1.182 13.252 -0.547 1.00 0.00 H new ATOM 0 H62 A B 13 -0.265 12.741 0.874 1.00 0.00 H new ATOM 0 H2 A B 13 -5.351 13.721 0.474 1.00 0.00 H new ATOM 419 P C B 14 -6.024 8.022 6.136 1.00 0.00 P ATOM 420 OP1 C B 14 -7.038 7.256 6.897 1.00 0.00 O ATOM 421 OP2 C B 14 -4.659 7.457 6.020 1.00 0.00 O1- ATOM 422 O5' C B 14 -6.582 8.285 4.648 1.00 0.00 O ATOM 423 C5' C B 14 -7.927 8.695 4.445 1.00 0.00 C ATOM 424 C4' C B 14 -8.184 9.083 2.972 1.00 0.00 C ATOM 425 O4' C B 14 -7.373 10.164 2.535 1.00 0.00 O ATOM 426 C3' C B 14 -7.925 7.940 1.991 1.00 0.00 C ATOM 427 O3' C B 14 -8.939 6.941 1.986 1.00 0.00 O ATOM 428 C2' C B 14 -7.846 8.733 0.678 1.00 0.00 C ATOM 429 O2' C B 14 -9.113 9.183 0.194 1.00 0.00 O ATOM 430 C1' C B 14 -7.076 9.977 1.148 1.00 0.00 C ATOM 431 N1 C B 14 -5.607 9.833 0.906 1.00 0.00 N ATOM 432 C2 C B 14 -5.123 10.116 -0.378 1.00 0.00 C ATOM 433 O2 C B 14 -5.866 10.412 -1.302 1.00 0.00 O ATOM 434 N3 C B 14 -3.795 10.072 -0.643 1.00 0.00 N ATOM 435 C4 C B 14 -2.975 9.695 0.312 1.00 0.00 C ATOM 436 N4 C B 14 -1.710 9.672 -0.015 1.00 0.00 N ATOM 437 C5 C B 14 -3.408 9.315 1.620 1.00 0.00 C ATOM 438 C6 C B 14 -4.735 9.394 1.878 1.00 0.00 C ATOM 0 H5' C B 14 -8.151 9.544 5.091 1.00 0.00 H new ATOM 0 H5'' C B 14 -8.602 7.889 4.733 1.00 0.00 H new ATOM 0 H4' C B 14 -9.238 9.360 2.967 1.00 0.00 H new ATOM 0 H3' C B 14 -7.043 7.343 2.221 1.00 0.00 H new ATOM 0 H2' C B 14 -7.418 8.137 -0.128 1.00 0.00 H new ATOM 0 HO2' C B 14 -9.819 8.591 0.527 1.00 0.00 H new ATOM 0 H1' C B 14 -7.386 10.854 0.580 1.00 0.00 H new ATOM 0 H41 C B 14 -1.011 9.390 0.672 1.00 0.00 H new ATOM 0 H42 C B 14 -1.422 9.936 -0.957 1.00 0.00 H new ATOM 0 H5 C B 14 -2.707 8.979 2.370 1.00 0.00 H new ATOM 0 H6 C B 14 -5.111 9.112 2.850 1.00 0.00 H new ATOM 450 P A B 15 -8.610 5.469 1.452 1.00 0.00 P ATOM 451 OP1 A B 15 -9.827 4.647 1.673 1.00 0.00 O ATOM 452 OP2 A B 15 -7.331 5.022 2.054 1.00 0.00 O1- ATOM 453 O5' A B 15 -8.369 5.633 -0.138 1.00 0.00 O ATOM 454 C5' A B 15 -9.440 5.819 -1.049 1.00 0.00 C ATOM 455 C4' A B 15 -8.944 5.975 -2.489 1.00 0.00 C ATOM 456 O4' A B 15 -8.131 7.121 -2.684 1.00 0.00 O ATOM 457 C3' A B 15 -8.116 4.779 -2.974 1.00 0.00 C ATOM 458 O3' A B 15 -8.891 3.633 -3.280 1.00 0.00 O ATOM 459 C2' A B 15 -7.437 5.419 -4.200 1.00 0.00 C ATOM 460 O2' A B 15 -8.310 5.557 -5.331 1.00 0.00 O ATOM 461 C1' A B 15 -7.129 6.812 -3.649 1.00 0.00 C ATOM 462 N9 A B 15 -5.780 6.837 -3.026 1.00 0.00 N ATOM 463 C8 A B 15 -5.428 6.680 -1.705 1.00 0.00 C ATOM 464 N7 A B 15 -4.155 6.824 -1.473 1.00 0.00 N ATOM 465 C5 A B 15 -3.626 7.081 -2.752 1.00 0.00 C ATOM 466 C6 A B 15 -2.334 7.329 -3.282 1.00 0.00 C ATOM 467 N6 A B 15 -1.229 7.447 -2.574 1.00 0.00 N ATOM 468 N1 A B 15 -2.141 7.484 -4.592 1.00 0.00 N ATOM 469 C2 A B 15 -3.187 7.413 -5.400 1.00 0.00 C ATOM 470 N3 A B 15 -4.461 7.211 -5.065 1.00 0.00 N ATOM 471 C4 A B 15 -4.606 7.058 -3.715 1.00 0.00 C ATOM 0 H5' A B 15 -10.010 6.703 -0.764 1.00 0.00 H new ATOM 0 H5'' A B 15 -10.119 4.969 -0.989 1.00 0.00 H new ATOM 0 H4' A B 15 -9.869 6.062 -3.059 1.00 0.00 H new ATOM 0 H3' A B 15 -7.429 4.368 -2.234 1.00 0.00 H new ATOM 0 H2' A B 15 -6.595 4.831 -4.566 1.00 0.00 H new ATOM 0 HO2' A B 15 -9.044 4.912 -5.258 1.00 0.00 H new ATOM 0 H1' A B 15 -7.132 7.550 -4.451 1.00 0.00 H new ATOM 0 H8 A B 15 -6.145 6.457 -0.929 1.00 0.00 H new ATOM 0 H61 A B 15 -0.340 7.626 -3.042 1.00 0.00 H new ATOM 0 H62 A B 15 -1.262 7.359 -1.558 1.00 0.00 H new ATOM 0 H2 A B 15 -2.984 7.533 -6.454 1.00 0.00 H new ATOM 483 P C B 16 -8.247 2.183 -3.290 1.00 0.00 P ATOM 484 OP1 C B 16 -9.329 1.206 -3.583 1.00 0.00 O ATOM 485 OP2 C B 16 -7.444 2.023 -2.058 1.00 0.00 O1- ATOM 486 O5' C B 16 -7.222 2.184 -4.518 1.00 0.00 O ATOM 487 C5' C B 16 -7.666 2.165 -5.870 1.00 0.00 C ATOM 488 C4' C B 16 -6.474 2.110 -6.836 1.00 0.00 C ATOM 489 O4' C B 16 -5.690 3.305 -6.816 1.00 0.00 O ATOM 490 C3' C B 16 -5.519 0.939 -6.568 1.00 0.00 C ATOM 491 O3' C B 16 -6.060 -0.286 -7.033 1.00 0.00 O ATOM 492 C2' C B 16 -4.274 1.426 -7.313 1.00 0.00 C ATOM 493 O2' C B 16 -4.351 1.157 -8.717 1.00 0.00 O ATOM 494 C1' C B 16 -4.341 2.960 -7.118 1.00 0.00 C ATOM 495 N1 C B 16 -3.409 3.451 -6.057 1.00 0.00 N ATOM 496 C2 C B 16 -2.087 3.722 -6.426 1.00 0.00 C ATOM 497 O2 C B 16 -1.705 3.649 -7.595 1.00 0.00 O ATOM 498 N3 C B 16 -1.160 4.049 -5.498 1.00 0.00 N ATOM 499 C4 C B 16 -1.531 4.126 -4.235 1.00 0.00 C ATOM 500 N4 C B 16 -0.579 4.375 -3.385 1.00 0.00 N ATOM 501 C5 C B 16 -2.874 3.916 -3.798 1.00 0.00 C ATOM 502 C6 C B 16 -3.784 3.559 -4.742 1.00 0.00 C ATOM 0 H5' C B 16 -8.264 3.054 -6.073 1.00 0.00 H new ATOM 0 H5'' C B 16 -8.312 1.302 -6.033 1.00 0.00 H new ATOM 0 H4' C B 16 -6.944 1.980 -7.811 1.00 0.00 H new ATOM 0 H3' C B 16 -5.318 0.709 -5.522 1.00 0.00 H new ATOM 0 H2' C B 16 -3.368 0.943 -6.947 1.00 0.00 H new ATOM 0 HO2' C B 16 -5.040 0.480 -8.883 1.00 0.00 H new ATOM 0 H1' C B 16 -4.017 3.446 -8.038 1.00 0.00 H new ATOM 0 H41 C B 16 -0.790 4.449 -2.390 1.00 0.00 H new ATOM 0 H42 C B 16 0.379 4.496 -3.713 1.00 0.00 H new ATOM 0 H5 C B 16 -3.155 4.036 -2.762 1.00 0.00 H new ATOM 0 H6 C B 16 -4.806 3.360 -4.456 1.00 0.00 H new ATOM 514 P G B 17 -5.423 -1.700 -6.623 1.00 0.00 P ATOM 515 OP1 G B 17 -6.355 -2.757 -7.092 1.00 0.00 O ATOM 516 OP2 G B 17 -5.052 -1.655 -5.195 1.00 0.00 O1- ATOM 517 O5' G B 17 -4.087 -1.779 -7.498 1.00 0.00 O ATOM 518 C5' G B 17 -3.258 -2.934 -7.431 1.00 0.00 C ATOM 519 C4' G B 17 -1.910 -2.718 -8.137 1.00 0.00 C ATOM 520 O4' G B 17 -1.173 -1.645 -7.551 1.00 0.00 O ATOM 521 C3' G B 17 -1.025 -3.971 -8.022 1.00 0.00 C ATOM 522 O3' G B 17 -1.258 -4.927 -9.050 1.00 0.00 O ATOM 523 C2' G B 17 0.369 -3.352 -8.103 1.00 0.00 C ATOM 524 O2' G B 17 0.737 -3.000 -9.446 1.00 0.00 O ATOM 525 C1' G B 17 0.164 -2.066 -7.302 1.00 0.00 C ATOM 526 N9 G B 17 0.390 -2.287 -5.851 1.00 0.00 N ATOM 527 C8 G B 17 -0.539 -2.347 -4.838 1.00 0.00 C ATOM 528 N7 G B 17 -0.017 -2.394 -3.645 1.00 0.00 N ATOM 529 C5 G B 17 1.360 -2.367 -3.877 1.00 0.00 C ATOM 530 C6 G B 17 2.480 -2.369 -2.966 1.00 0.00 C ATOM 531 O6 G B 17 2.479 -2.355 -1.731 1.00 0.00 O ATOM 532 N1 G B 17 3.703 -2.405 -3.602 1.00 0.00 N ATOM 533 C2 G B 17 3.856 -2.410 -4.950 1.00 0.00 C ATOM 534 N2 G B 17 5.066 -2.542 -5.406 1.00 0.00 N ATOM 535 N3 G B 17 2.850 -2.382 -5.827 1.00 0.00 N ATOM 536 C4 G B 17 1.620 -2.352 -5.228 1.00 0.00 C ATOM 0 H5' G B 17 -3.775 -3.778 -7.887 1.00 0.00 H new ATOM 0 H5'' G B 17 -3.083 -3.194 -6.387 1.00 0.00 H new ATOM 0 H4' G B 17 -2.146 -2.494 -9.177 1.00 0.00 H new ATOM 0 H3' G B 17 -1.209 -4.553 -7.119 1.00 0.00 H new ATOM 0 H2' G B 17 1.150 -4.025 -7.749 1.00 0.00 H new ATOM 0 HO2' G B 17 0.201 -3.522 -10.079 1.00 0.00 H new ATOM 0 H1' G B 17 0.881 -1.304 -7.608 1.00 0.00 H new ATOM 0 H8 G B 17 -1.604 -2.354 -5.015 1.00 0.00 H new ATOM 0 H1 G B 17 4.543 -2.429 -3.024 1.00 0.00 H new ATOM 0 H21 G B 17 5.234 -2.552 -6.412 1.00 0.00 H new ATOM 0 H22 G B 17 5.848 -2.636 -4.758 1.00 0.00 H new ATOM 548 P U B 18 -1.224 -6.489 -8.731 1.00 0.00 P ATOM 549 OP1 U B 18 -1.312 -7.225 -10.017 1.00 0.00 O ATOM 550 OP2 U B 18 -2.235 -6.748 -7.680 1.00 0.00 O1- ATOM 551 O5' U B 18 0.231 -6.746 -8.084 1.00 0.00 O ATOM 552 C5' U B 18 1.403 -6.729 -8.879 1.00 0.00 C ATOM 553 C4' U B 18 2.685 -6.811 -8.034 1.00 0.00 C ATOM 554 O4' U B 18 2.819 -5.710 -7.139 1.00 0.00 O ATOM 555 C3' U B 18 2.759 -8.082 -7.179 1.00 0.00 C ATOM 556 O3' U B 18 3.097 -9.233 -7.930 1.00 0.00 O ATOM 557 C2' U B 18 3.845 -7.648 -6.181 1.00 0.00 C ATOM 558 O2' U B 18 5.148 -7.717 -6.728 1.00 0.00 O ATOM 559 C1' U B 18 3.490 -6.171 -5.963 1.00 0.00 C ATOM 560 N1 U B 18 2.664 -5.980 -4.734 1.00 0.00 N ATOM 561 C2 U B 18 3.337 -5.814 -3.513 1.00 0.00 C ATOM 562 O2 U B 18 4.567 -5.800 -3.414 1.00 0.00 O ATOM 563 N3 U B 18 2.565 -5.653 -2.383 1.00 0.00 N ATOM 564 C4 U B 18 1.190 -5.674 -2.351 1.00 0.00 C ATOM 565 O4 U B 18 0.600 -5.568 -1.276 1.00 0.00 O ATOM 566 C5 U B 18 0.553 -5.865 -3.632 1.00 0.00 C ATOM 567 C6 U B 18 1.286 -5.991 -4.775 1.00 0.00 C ATOM 0 H5' U B 18 1.421 -5.816 -9.475 1.00 0.00 H new ATOM 0 H5'' U B 18 1.377 -7.565 -9.578 1.00 0.00 H new ATOM 0 H4' U B 18 3.487 -6.808 -8.772 1.00 0.00 H new ATOM 0 H3' U B 18 1.821 -8.393 -6.720 1.00 0.00 H new ATOM 0 H2' U B 18 3.862 -8.277 -5.291 1.00 0.00 H new ATOM 0 HO2' U B 18 5.132 -8.261 -7.543 1.00 0.00 H new ATOM 0 H1' U B 18 4.395 -5.585 -5.802 1.00 0.00 H new ATOM 0 H3 U B 18 3.052 -5.506 -1.499 1.00 0.00 H new ATOM 0 H5 U B 18 -0.525 -5.909 -3.686 1.00 0.00 H new ATOM 0 H6 U B 18 0.781 -6.101 -5.723 1.00 0.00 H new ATOM 578 P C B 19 2.775 -10.695 -7.368 1.00 0.00 P ATOM 579 OP1 C B 19 3.164 -11.663 -8.428 1.00 0.00 O ATOM 580 OP2 C B 19 1.376 -10.709 -6.872 1.00 0.00 O1- ATOM 581 O5' C B 19 3.770 -10.870 -6.101 1.00 0.00 O ATOM 582 C5' C B 19 5.128 -11.264 -6.270 1.00 0.00 C ATOM 583 C4' C B 19 5.865 -11.395 -4.925 1.00 0.00 C ATOM 584 O4' C B 19 5.938 -10.160 -4.209 1.00 0.00 O ATOM 585 C3' C B 19 5.225 -12.410 -3.977 1.00 0.00 C ATOM 586 O3' C B 19 5.486 -13.756 -4.379 1.00 0.00 O ATOM 587 C2' C B 19 5.903 -11.991 -2.661 1.00 0.00 C ATOM 588 O2' C B 19 7.221 -12.516 -2.534 1.00 0.00 O ATOM 589 C1' C B 19 6.011 -10.464 -2.813 1.00 0.00 C ATOM 590 N1 C B 19 4.931 -9.763 -2.057 1.00 0.00 N ATOM 591 C2 C B 19 5.222 -9.265 -0.777 1.00 0.00 C ATOM 592 O2 C B 19 6.324 -9.391 -0.246 1.00 0.00 O ATOM 593 N3 C B 19 4.276 -8.630 -0.054 1.00 0.00 N ATOM 594 C4 C B 19 3.061 -8.526 -0.549 1.00 0.00 C ATOM 595 N4 C B 19 2.197 -7.902 0.202 1.00 0.00 N ATOM 596 C5 C B 19 2.692 -9.011 -1.836 1.00 0.00 C ATOM 597 C6 C B 19 3.664 -9.628 -2.562 1.00 0.00 C ATOM 0 H5' C B 19 5.642 -10.533 -6.895 1.00 0.00 H new ATOM 0 H5'' C B 19 5.165 -12.217 -6.798 1.00 0.00 H new ATOM 0 H4' C B 19 6.860 -11.731 -5.216 1.00 0.00 H new ATOM 0 H3' C B 19 4.136 -12.404 -3.929 1.00 0.00 H new ATOM 0 H2' C B 19 5.346 -12.344 -1.793 1.00 0.00 H new ATOM 0 HO2' C B 19 7.177 -13.490 -2.438 1.00 0.00 H new ATOM 0 H1' C B 19 6.957 -10.116 -2.398 1.00 0.00 H new ATOM 0 H41 C B 19 1.236 -7.784 -0.117 1.00 0.00 H new ATOM 0 H42 C B 19 2.483 -7.532 1.109 1.00 0.00 H new ATOM 0 H5 C B 19 1.688 -8.895 -2.218 1.00 0.00 H new ATOM 0 H6 C B 19 3.435 -10.014 -3.544 1.00 0.00 H new ATOM 609 P G B 20 4.808 -14.981 -3.601 1.00 0.00 P ATOM 610 OP1 G B 20 4.994 -16.198 -4.421 1.00 0.00 O ATOM 611 OP2 G B 20 3.443 -14.590 -3.180 1.00 0.00 O1- ATOM 612 O5' G B 20 5.732 -15.117 -2.306 1.00 0.00 O ATOM 613 C5' G B 20 5.305 -15.826 -1.159 1.00 0.00 C ATOM 614 C4' G B 20 6.364 -15.720 -0.053 1.00 0.00 C ATOM 615 O4' G B 20 6.479 -14.365 0.394 1.00 0.00 O ATOM 616 C3' G B 20 5.951 -16.578 1.153 1.00 0.00 C ATOM 617 O3' G B 20 7.098 -17.135 1.785 1.00 0.00 O ATOM 618 C2' G B 20 5.227 -15.552 2.043 1.00 0.00 C ATOM 619 O2' G B 20 5.326 -15.815 3.443 1.00 0.00 O ATOM 620 C1' G B 20 5.905 -14.234 1.686 1.00 0.00 C ATOM 621 N9 G B 20 4.940 -13.100 1.762 1.00 0.00 N ATOM 622 C8 G B 20 4.023 -12.681 0.832 1.00 0.00 C ATOM 623 N7 G B 20 3.230 -11.723 1.238 1.00 0.00 N ATOM 624 C5 G B 20 3.603 -11.541 2.583 1.00 0.00 C ATOM 625 C6 G B 20 3.083 -10.688 3.624 1.00 0.00 C ATOM 626 O6 G B 20 2.169 -9.869 3.576 1.00 0.00 O ATOM 627 N1 G B 20 3.736 -10.837 4.836 1.00 0.00 N ATOM 628 C2 G B 20 4.779 -11.686 5.034 1.00 0.00 C ATOM 629 N2 G B 20 5.302 -11.765 6.227 1.00 0.00 N ATOM 630 N3 G B 20 5.299 -12.479 4.100 1.00 0.00 N ATOM 631 C4 G B 20 4.666 -12.374 2.891 1.00 0.00 C ATOM 0 H5' G B 20 5.134 -16.873 -1.411 1.00 0.00 H new ATOM 0 H5'' G B 20 4.356 -15.424 -0.805 1.00 0.00 H new ATOM 0 H4' G B 20 7.314 -16.065 -0.460 1.00 0.00 H new ATOM 0 H3' G B 20 5.328 -17.438 0.908 1.00 0.00 H new ATOM 0 H2' G B 20 4.153 -15.567 1.860 1.00 0.00 H new ATOM 0 HO2' G B 20 4.540 -16.322 3.737 1.00 0.00 H new ATOM 0 H1' G B 20 6.694 -14.009 2.403 1.00 0.00 H new ATOM 0 H8 G B 20 3.961 -13.108 -0.158 1.00 0.00 H new ATOM 0 H1 G B 20 3.416 -10.277 5.626 1.00 0.00 H new ATOM 0 H21 G B 20 6.085 -12.395 6.400 1.00 0.00 H new ATOM 0 H22 G B 20 4.927 -11.197 6.987 1.00 0.00 H new ATOM 643 P G B 21 7.285 -18.720 1.836 1.00 0.00 P ATOM 644 OP1 G B 21 8.581 -19.004 2.503 1.00 0.00 O ATOM 645 OP2 G B 21 7.042 -19.253 0.469 1.00 0.00 O1- ATOM 646 O5' G B 21 6.073 -19.193 2.772 1.00 0.00 O ATOM 647 C5' G B 21 6.208 -19.298 4.188 1.00 0.00 C ATOM 648 C4' G B 21 4.852 -19.431 4.898 1.00 0.00 C ATOM 649 O4' G B 21 4.223 -18.155 4.989 1.00 0.00 O ATOM 650 C3' G B 21 3.866 -20.390 4.199 1.00 0.00 C ATOM 651 O3' G B 21 3.164 -21.170 5.163 1.00 0.00 O ATOM 652 C2' G B 21 2.940 -19.386 3.475 1.00 0.00 C ATOM 653 O2' G B 21 1.639 -19.864 3.133 1.00 0.00 O ATOM 654 C1' G B 21 2.888 -18.275 4.527 1.00 0.00 C ATOM 655 N9 G B 21 2.376 -16.965 4.043 1.00 0.00 N ATOM 656 C8 G B 21 2.036 -16.568 2.768 1.00 0.00 C ATOM 657 N7 G B 21 1.548 -15.360 2.681 1.00 0.00 N ATOM 658 C5 G B 21 1.540 -14.917 4.010 1.00 0.00 C ATOM 659 C6 G B 21 1.081 -13.680 4.596 1.00 0.00 C ATOM 660 O6 G B 21 0.607 -12.693 4.029 1.00 0.00 O ATOM 661 N1 G B 21 1.211 -13.632 5.968 1.00 0.00 N ATOM 662 C2 G B 21 1.706 -14.649 6.713 1.00 0.00 C ATOM 663 N2 G B 21 1.731 -14.488 8.008 1.00 0.00 N ATOM 664 N3 G B 21 2.122 -15.821 6.221 1.00 0.00 N ATOM 665 C4 G B 21 2.023 -15.900 4.852 1.00 0.00 C ATOM 0 H5' G B 21 6.728 -18.418 4.567 1.00 0.00 H new ATOM 0 H5'' G B 21 6.827 -20.163 4.428 1.00 0.00 H new ATOM 0 H4' G B 21 5.080 -19.846 5.880 1.00 0.00 H new ATOM 0 H3' G B 21 4.323 -21.121 3.531 1.00 0.00 H new ATOM 0 H2' G B 21 3.313 -19.108 2.489 1.00 0.00 H new ATOM 0 HO2' G B 21 1.089 -19.118 2.815 1.00 0.00 H new ATOM 0 HO3' G B 21 2.203 -21.137 4.973 1.00 0.00 H new ATOM 0 H1' G B 21 2.173 -18.546 5.304 1.00 0.00 H new ATOM 0 H8 G B 21 2.163 -17.207 1.907 1.00 0.00 H new ATOM 0 H1 G B 21 0.918 -12.782 6.449 1.00 0.00 H new ATOM 0 H21 G B 21 2.096 -15.229 8.607 1.00 0.00 H new ATOM 0 H22 G B 21 1.386 -13.621 8.421 1.00 0.00 H new TER 678 G B 21 HETATM 679 N1 QSV A 101 5.678 1.346 -0.176 1.00 0.00 N HETATM 680 C4 QSV A 101 6.922 1.195 -3.646 1.00 0.00 C HETATM 681 C5 QSV A 101 6.461 1.144 -4.964 1.00 0.00 C HETATM 682 C6 QSV A 101 6.535 1.331 -1.154 1.00 0.00 C HETATM 683 C7 QSV A 101 8.039 1.382 -0.930 1.00 0.00 C HETATM 684 C8 QSV A 101 5.176 1.319 2.214 1.00 0.00 C HETATM 685 C1 QSV A 101 4.190 1.134 -4.126 1.00 0.00 C HETATM 686 C2 QSV A 101 4.643 1.157 -2.803 1.00 0.00 C HETATM 687 C3 QSV A 101 6.032 1.224 -2.556 1.00 0.00 C HETATM 688 C9 QSV A 101 2.753 0.799 2.573 1.00 0.00 C HETATM 689 C4' QSV A 101 0.270 0.980 -5.776 1.00 0.00 C HETATM 690 C3' QSV A 101 0.353 0.974 -4.367 1.00 0.00 C HETATM 691 C2' QSV A 101 1.630 1.058 -3.776 1.00 0.00 C HETATM 692 C1' QSV A 101 2.780 1.095 -4.576 1.00 0.00 C HETATM 693 C5' QSV A 101 1.411 1.027 -6.570 1.00 0.00 C HETATM 694 C0' QSV A 101 2.658 1.070 -5.962 1.00 0.00 C HETATM 695 C0 QSV A 101 5.095 1.119 -5.178 1.00 0.00 C HETATM 696 S0 QSV A 101 4.260 1.068 -6.745 1.00 0.00 S HETATM 697 N2 QSV A 101 6.008 1.458 1.157 1.00 0.00 N1+ HETATM 698 N3 QSV A 101 5.507 1.615 3.406 1.00 0.00 N HETATM 699 N4 QSV A 101 4.043 0.712 1.895 1.00 0.00 N HETATM 700 C6' QSV A 101 -0.864 0.853 -3.500 1.00 0.00 C HETATM 701 C7' QSV A 101 -2.233 0.662 -4.140 1.00 0.00 C HETATM 702 N1' QSV A 101 -0.726 0.912 -2.210 1.00 0.00 N HETATM 703 N2' QSV A 101 -1.766 0.854 -1.310 1.00 0.00 N1+ HETATM 704 C8' QSV A 101 -1.664 1.023 0.016 1.00 0.00 C HETATM 705 N3' QSV A 101 -0.562 1.040 0.635 1.00 0.00 N HETATM 706 N4' QSV A 101 -2.823 1.139 0.662 1.00 0.00 N HETATM 707 C9' QSV A 101 -4.117 1.621 0.151 1.00 0.00 C