USER MOD reduce.3.24.130724 H: found=0, std=0, add=133, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 131 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 -22:sc= 0.0973 USER MOD Single : A 1 G O5' : rot -23:sc= 0.00102 USER MOD Single : A 2 G O2' : rot -136:sc= 0.00227 USER MOD Single : A 3 C O2' : rot -69:sc= 0.679 USER MOD Single : A 4 U O2' : rot -9:sc= 0.216 USER MOD Single : A 5 G O2' : rot -100:sc= 1.07 USER MOD Single : A 6 A O2' : rot -14:sc= 0.0584 USER MOD Single : A 7 A O2' : rot -69:sc= 0.232 USER MOD Single : A 8 G O2' : rot -67:sc= 0.624 USER MOD Single : A 9 G O2' : rot -21:sc= 0.0562 USER MOD Single : A 10 G O2' : rot -22:sc= 0.0327 USER MOD Single : A 11 C O2' : rot -16:sc= 0.044 USER MOD Single : A 12 C O2' : rot -23:sc= 0.062 USER MOD Single : A 12 C O3' : rot 180:sc= 0.0803 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 8.664 6.502 9.279 1.00 0.00 O ATOM 2 C5' G A 1 8.097 6.529 7.987 1.00 0.00 C ATOM 3 C4' G A 1 9.199 6.613 6.923 1.00 0.00 C ATOM 4 O4' G A 1 10.112 5.520 7.001 1.00 0.00 O ATOM 5 C3' G A 1 8.614 6.657 5.501 1.00 0.00 C ATOM 6 O3' G A 1 8.428 8.009 5.083 1.00 0.00 O ATOM 7 C2' G A 1 9.697 5.912 4.727 1.00 0.00 C ATOM 8 O2' G A 1 10.757 6.775 4.344 1.00 0.00 O ATOM 9 C1' G A 1 10.184 4.881 5.736 1.00 0.00 C ATOM 10 N9 G A 1 9.482 3.568 5.758 1.00 0.00 N ATOM 11 C8 G A 1 8.737 2.989 6.760 1.00 0.00 C ATOM 12 N7 G A 1 8.442 1.735 6.560 1.00 0.00 N ATOM 13 C5 G A 1 9.027 1.444 5.331 1.00 0.00 C ATOM 14 C6 G A 1 9.023 0.237 4.553 1.00 0.00 C ATOM 15 O6 G A 1 8.506 -0.842 4.829 1.00 0.00 O ATOM 16 N1 G A 1 9.697 0.366 3.333 1.00 0.00 N ATOM 17 C2 G A 1 10.324 1.531 2.919 1.00 0.00 C ATOM 18 N2 G A 1 10.898 1.521 1.717 1.00 0.00 N ATOM 19 N3 G A 1 10.341 2.658 3.651 1.00 0.00 N ATOM 20 C4 G A 1 9.671 2.560 4.839 1.00 0.00 C ATOM 0 H5' G A 1 7.427 7.384 7.894 1.00 0.00 H new ATOM 0 H5'' G A 1 7.496 5.634 7.828 1.00 0.00 H new ATOM 0 H4' G A 1 9.735 7.539 7.129 1.00 0.00 H new ATOM 0 H3' G A 1 7.626 6.214 5.373 1.00 0.00 H new ATOM 0 H2' G A 1 9.329 5.479 3.797 1.00 0.00 H new ATOM 0 HO2' G A 1 10.437 7.701 4.334 1.00 0.00 H new ATOM 0 HO5' G A 1 9.586 6.174 9.225 1.00 0.00 H new ATOM 0 H1' G A 1 11.192 4.587 5.444 1.00 0.00 H new ATOM 0 H8 G A 1 8.422 3.530 7.640 1.00 0.00 H new ATOM 0 H1 G A 1 9.729 -0.443 2.713 1.00 0.00 H new ATOM 0 H21 G A 1 11.371 2.356 1.371 1.00 0.00 H new ATOM 0 H22 G A 1 10.864 0.679 1.143 1.00 0.00 H new ATOM 32 P G A 2 7.029 8.561 4.485 1.00 0.00 P ATOM 33 OP1 G A 2 7.166 10.016 4.254 1.00 0.00 O ATOM 34 OP2 G A 2 5.930 8.045 5.329 1.00 0.00 O ATOM 35 O5' G A 2 6.985 7.811 3.062 1.00 0.00 O ATOM 36 C5' G A 2 7.844 8.173 1.988 1.00 0.00 C ATOM 37 C4' G A 2 8.024 6.958 1.068 1.00 0.00 C ATOM 38 O4' G A 2 8.384 5.869 1.899 1.00 0.00 O ATOM 39 C3' G A 2 6.773 6.487 0.329 1.00 0.00 C ATOM 40 O3' G A 2 6.551 7.163 -0.908 1.00 0.00 O ATOM 41 C2' G A 2 7.089 5.000 0.165 1.00 0.00 C ATOM 42 O2' G A 2 7.705 4.688 -1.071 1.00 0.00 O ATOM 43 C1' G A 2 8.083 4.651 1.271 1.00 0.00 C ATOM 44 N9 G A 2 7.566 3.573 2.143 1.00 0.00 N ATOM 45 C8 G A 2 7.158 3.612 3.448 1.00 0.00 C ATOM 46 N7 G A 2 6.580 2.516 3.859 1.00 0.00 N ATOM 47 C5 G A 2 6.660 1.660 2.761 1.00 0.00 C ATOM 48 C6 G A 2 6.233 0.297 2.590 1.00 0.00 C ATOM 49 O6 G A 2 5.649 -0.416 3.399 1.00 0.00 O ATOM 50 N1 G A 2 6.542 -0.227 1.327 1.00 0.00 N ATOM 51 C2 G A 2 7.248 0.469 0.361 1.00 0.00 C ATOM 52 N2 G A 2 7.461 -0.149 -0.799 1.00 0.00 N ATOM 53 N3 G A 2 7.662 1.740 0.521 1.00 0.00 N ATOM 54 C4 G A 2 7.332 2.282 1.732 1.00 0.00 C ATOM 0 H5' G A 2 8.810 8.502 2.372 1.00 0.00 H new ATOM 0 H5'' G A 2 7.420 9.009 1.431 1.00 0.00 H new ATOM 0 H4' G A 2 8.753 7.263 0.317 1.00 0.00 H new ATOM 0 H3' G A 2 5.840 6.691 0.855 1.00 0.00 H new ATOM 0 H2' G A 2 6.153 4.443 0.209 1.00 0.00 H new ATOM 0 HO2' G A 2 7.295 3.881 -1.446 1.00 0.00 H new ATOM 0 H1' G A 2 9.012 4.216 0.901 1.00 0.00 H new ATOM 0 H8 G A 2 7.301 4.474 4.083 1.00 0.00 H new ATOM 0 H1 G A 2 6.229 -1.173 1.108 1.00 0.00 H new ATOM 0 H21 G A 2 7.976 0.324 -1.542 1.00 0.00 H new ATOM 0 H22 G A 2 7.109 -1.095 -0.945 1.00 0.00 H new ATOM 66 P C A 3 5.241 6.897 -1.836 1.00 0.00 P ATOM 67 OP1 C A 3 5.175 7.990 -2.830 1.00 0.00 O ATOM 68 OP2 C A 3 4.090 6.671 -0.933 1.00 0.00 O ATOM 69 O5' C A 3 5.499 5.509 -2.642 1.00 0.00 O ATOM 70 C5' C A 3 6.410 5.404 -3.731 1.00 0.00 C ATOM 71 C4' C A 3 6.465 3.963 -4.281 1.00 0.00 C ATOM 72 O4' C A 3 6.718 3.013 -3.255 1.00 0.00 O ATOM 73 C3' C A 3 5.190 3.543 -5.024 1.00 0.00 C ATOM 74 O3' C A 3 5.311 3.853 -6.413 1.00 0.00 O ATOM 75 C2' C A 3 5.095 2.048 -4.694 1.00 0.00 C ATOM 76 O2' C A 3 5.726 1.229 -5.663 1.00 0.00 O ATOM 77 C1' C A 3 5.850 1.889 -3.372 1.00 0.00 C ATOM 78 N1 C A 3 4.965 1.644 -2.197 1.00 0.00 N ATOM 79 C2 C A 3 4.244 0.440 -2.122 1.00 0.00 C ATOM 80 O2 C A 3 4.140 -0.300 -3.097 1.00 0.00 O ATOM 81 N3 C A 3 3.669 0.089 -0.932 1.00 0.00 N ATOM 82 C4 C A 3 3.797 0.864 0.156 1.00 0.00 C ATOM 83 N4 C A 3 3.285 0.435 1.309 1.00 0.00 N ATOM 84 C5 C A 3 4.491 2.123 0.093 1.00 0.00 C ATOM 85 C6 C A 3 5.052 2.452 -1.096 1.00 0.00 C ATOM 0 H5' C A 3 7.405 5.709 -3.406 1.00 0.00 H new ATOM 0 H5'' C A 3 6.110 6.087 -4.526 1.00 0.00 H new ATOM 0 H4' C A 3 7.290 3.973 -4.993 1.00 0.00 H new ATOM 0 H3' C A 3 4.276 4.061 -4.732 1.00 0.00 H new ATOM 0 H2' C A 3 4.049 1.742 -4.657 1.00 0.00 H new ATOM 0 HO2' C A 3 5.218 1.263 -6.501 1.00 0.00 H new ATOM 0 H1' C A 3 6.448 0.977 -3.380 1.00 0.00 H new ATOM 0 H41 C A 3 3.370 1.007 2.149 1.00 0.00 H new ATOM 0 H42 C A 3 2.808 -0.466 1.351 1.00 0.00 H new ATOM 0 H5 C A 3 4.561 2.774 0.952 1.00 0.00 H new ATOM 0 H6 C A 3 5.587 3.386 -1.178 1.00 0.00 H new ATOM 97 P U A 4 4.155 3.557 -7.511 1.00 0.00 P ATOM 98 OP1 U A 4 3.745 2.139 -7.413 1.00 0.00 O ATOM 99 OP2 U A 4 4.620 4.092 -8.809 1.00 0.00 O ATOM 100 O5' U A 4 2.942 4.489 -7.001 1.00 0.00 O ATOM 101 C5' U A 4 1.610 4.357 -7.482 1.00 0.00 C ATOM 102 C4' U A 4 0.908 3.059 -7.017 1.00 0.00 C ATOM 103 O4' U A 4 1.419 2.615 -5.783 1.00 0.00 O ATOM 104 C3' U A 4 -0.584 3.265 -6.734 1.00 0.00 C ATOM 105 O3' U A 4 -1.341 3.124 -7.927 1.00 0.00 O ATOM 106 C2' U A 4 -0.900 2.202 -5.664 1.00 0.00 C ATOM 107 O2' U A 4 -1.625 1.100 -6.184 1.00 0.00 O ATOM 108 C1' U A 4 0.486 1.751 -5.164 1.00 0.00 C ATOM 109 N1 U A 4 0.616 1.793 -3.675 1.00 0.00 N ATOM 110 C2 U A 4 -0.178 0.920 -2.919 1.00 0.00 C ATOM 111 O2 U A 4 -0.971 0.124 -3.418 1.00 0.00 O ATOM 112 N3 U A 4 -0.024 0.979 -1.538 1.00 0.00 N ATOM 113 C4 U A 4 0.852 1.811 -0.853 1.00 0.00 C ATOM 114 O4 U A 4 0.869 1.803 0.373 1.00 0.00 O ATOM 115 C5 U A 4 1.686 2.638 -1.710 1.00 0.00 C ATOM 116 C6 U A 4 1.538 2.618 -3.055 1.00 0.00 C ATOM 0 H5' U A 4 1.622 4.383 -8.572 1.00 0.00 H new ATOM 0 H5'' U A 4 1.026 5.215 -7.149 1.00 0.00 H new ATOM 0 H4' U A 4 1.076 2.355 -7.832 1.00 0.00 H new ATOM 0 H3' U A 4 -0.838 4.263 -6.377 1.00 0.00 H new ATOM 0 H2' U A 4 -1.534 2.608 -4.876 1.00 0.00 H new ATOM 0 HO2' U A 4 -1.908 1.298 -7.101 1.00 0.00 H new ATOM 0 H1' U A 4 0.657 0.707 -5.426 1.00 0.00 H new ATOM 0 H3 U A 4 -0.606 0.356 -0.979 1.00 0.00 H new ATOM 0 H5 U A 4 2.435 3.278 -1.267 1.00 0.00 H new ATOM 0 H6 U A 4 2.156 3.264 -3.661 1.00 0.00 H new ATOM 127 P G A 5 -2.798 3.787 -8.123 1.00 0.00 P ATOM 128 OP1 G A 5 -3.423 3.141 -9.297 1.00 0.00 O ATOM 129 OP2 G A 5 -2.628 5.257 -8.102 1.00 0.00 O ATOM 130 O5' G A 5 -3.640 3.338 -6.812 1.00 0.00 O ATOM 131 C5' G A 5 -3.872 4.231 -5.733 1.00 0.00 C ATOM 132 C4' G A 5 -4.799 3.602 -4.683 1.00 0.00 C ATOM 133 O4' G A 5 -4.179 2.546 -3.963 1.00 0.00 O ATOM 134 C3' G A 5 -5.203 4.622 -3.617 1.00 0.00 C ATOM 135 O3' G A 5 -6.170 5.543 -4.109 1.00 0.00 O ATOM 136 C2' G A 5 -5.711 3.679 -2.524 1.00 0.00 C ATOM 137 O2' G A 5 -7.012 3.195 -2.812 1.00 0.00 O ATOM 138 C1' G A 5 -4.701 2.522 -2.638 1.00 0.00 C ATOM 139 N9 G A 5 -3.606 2.697 -1.650 1.00 0.00 N ATOM 140 C8 G A 5 -2.453 3.436 -1.761 1.00 0.00 C ATOM 141 N7 G A 5 -1.749 3.504 -0.666 1.00 0.00 N ATOM 142 C5 G A 5 -2.482 2.753 0.249 1.00 0.00 C ATOM 143 C6 G A 5 -2.246 2.487 1.642 1.00 0.00 C ATOM 144 O6 G A 5 -1.296 2.850 2.331 1.00 0.00 O ATOM 145 N1 G A 5 -3.251 1.715 2.234 1.00 0.00 N ATOM 146 C2 G A 5 -4.364 1.249 1.555 1.00 0.00 C ATOM 147 N2 G A 5 -5.245 0.543 2.264 1.00 0.00 N ATOM 148 N3 G A 5 -4.587 1.485 0.248 1.00 0.00 N ATOM 149 C4 G A 5 -3.618 2.246 -0.348 1.00 0.00 C ATOM 0 H5' G A 5 -4.316 5.153 -6.109 1.00 0.00 H new ATOM 0 H5'' G A 5 -2.923 4.500 -5.270 1.00 0.00 H new ATOM 0 H4' G A 5 -5.652 3.236 -5.254 1.00 0.00 H new ATOM 0 H3' G A 5 -4.416 5.292 -3.271 1.00 0.00 H new ATOM 0 H2' G A 5 -5.780 4.150 -1.544 1.00 0.00 H new ATOM 0 HO2' G A 5 -7.672 3.701 -2.293 1.00 0.00 H new ATOM 0 H1' G A 5 -5.184 1.567 -2.432 1.00 0.00 H new ATOM 0 H8 G A 5 -2.155 3.920 -2.679 1.00 0.00 H new ATOM 0 H1 G A 5 -3.159 1.482 3.223 1.00 0.00 H new ATOM 0 H21 G A 5 -6.084 0.175 1.815 1.00 0.00 H new ATOM 0 H22 G A 5 -5.080 0.371 3.256 1.00 0.00 H new ATOM 161 P A A 6 -6.363 7.018 -3.477 1.00 0.00 P ATOM 162 OP1 A A 6 -7.386 7.724 -4.281 1.00 0.00 O ATOM 163 OP2 A A 6 -5.027 7.627 -3.300 1.00 0.00 O ATOM 164 O5' A A 6 -6.992 6.744 -2.020 1.00 0.00 O ATOM 165 C5' A A 6 -7.137 7.786 -1.067 1.00 0.00 C ATOM 166 C4' A A 6 -8.001 7.321 0.113 1.00 0.00 C ATOM 167 O4' A A 6 -9.312 6.983 -0.319 1.00 0.00 O ATOM 168 C3' A A 6 -7.455 6.086 0.833 1.00 0.00 C ATOM 169 O3' A A 6 -6.404 6.408 1.736 1.00 0.00 O ATOM 170 C2' A A 6 -8.731 5.596 1.522 1.00 0.00 C ATOM 171 O2' A A 6 -9.001 6.317 2.712 1.00 0.00 O ATOM 172 C1' A A 6 -9.809 5.920 0.481 1.00 0.00 C ATOM 173 N9 A A 6 -10.123 4.736 -0.361 1.00 0.00 N ATOM 174 C8 A A 6 -9.629 4.381 -1.594 1.00 0.00 C ATOM 175 N7 A A 6 -10.184 3.320 -2.114 1.00 0.00 N ATOM 176 C5 A A 6 -11.114 2.933 -1.154 1.00 0.00 C ATOM 177 C6 A A 6 -12.080 1.894 -1.087 1.00 0.00 C ATOM 178 N6 A A 6 -12.273 1.009 -2.069 1.00 0.00 N ATOM 179 N1 A A 6 -12.858 1.787 0.014 1.00 0.00 N ATOM 180 C2 A A 6 -12.690 2.663 1.009 1.00 0.00 C ATOM 181 N3 A A 6 -11.830 3.685 1.065 1.00 0.00 N ATOM 182 C4 A A 6 -11.061 3.773 -0.065 1.00 0.00 C ATOM 0 H5' A A 6 -7.593 8.657 -1.538 1.00 0.00 H new ATOM 0 H5'' A A 6 -6.156 8.096 -0.707 1.00 0.00 H new ATOM 0 H4' A A 6 -7.998 8.167 0.800 1.00 0.00 H new ATOM 0 H3' A A 6 -6.984 5.341 0.192 1.00 0.00 H new ATOM 0 H2' A A 6 -8.671 4.548 1.814 1.00 0.00 H new ATOM 0 HO2' A A 6 -8.204 6.822 2.977 1.00 0.00 H new ATOM 0 H1' A A 6 -10.736 6.206 0.978 1.00 0.00 H new ATOM 0 H8 A A 6 -8.846 4.934 -2.091 1.00 0.00 H new ATOM 0 H61 A A 6 -12.981 0.282 -1.968 1.00 0.00 H new ATOM 0 H62 A A 6 -11.712 1.060 -2.919 1.00 0.00 H new ATOM 0 H2 A A 6 -13.326 2.529 1.872 1.00 0.00 H new ATOM 194 P A A 7 -5.392 5.288 2.313 1.00 0.00 P ATOM 195 OP1 A A 7 -4.481 5.946 3.275 1.00 0.00 O ATOM 196 OP2 A A 7 -4.831 4.559 1.157 1.00 0.00 O ATOM 197 O5' A A 7 -6.339 4.264 3.128 1.00 0.00 O ATOM 198 C5' A A 7 -6.829 4.545 4.427 1.00 0.00 C ATOM 199 C4' A A 7 -7.882 3.505 4.845 1.00 0.00 C ATOM 200 O4' A A 7 -8.987 3.454 3.949 1.00 0.00 O ATOM 201 C3' A A 7 -7.357 2.069 4.943 1.00 0.00 C ATOM 202 O3' A A 7 -6.543 1.874 6.091 1.00 0.00 O ATOM 203 C2' A A 7 -8.690 1.314 4.912 1.00 0.00 C ATOM 204 O2' A A 7 -9.374 1.402 6.152 1.00 0.00 O ATOM 205 C1' A A 7 -9.453 2.113 3.845 1.00 0.00 C ATOM 206 N9 A A 7 -9.222 1.571 2.475 1.00 0.00 N ATOM 207 C8 A A 7 -8.220 1.849 1.572 1.00 0.00 C ATOM 208 N7 A A 7 -8.292 1.187 0.451 1.00 0.00 N ATOM 209 C5 A A 7 -9.427 0.402 0.610 1.00 0.00 C ATOM 210 C6 A A 7 -10.080 -0.551 -0.215 1.00 0.00 C ATOM 211 N6 A A 7 -9.646 -0.881 -1.435 1.00 0.00 N ATOM 212 N1 A A 7 -11.204 -1.155 0.236 1.00 0.00 N ATOM 213 C2 A A 7 -11.660 -0.837 1.452 1.00 0.00 C ATOM 214 N3 A A 7 -11.143 0.039 2.320 1.00 0.00 N ATOM 215 C4 A A 7 -10.008 0.635 1.838 1.00 0.00 C ATOM 0 H5' A A 7 -7.267 5.543 4.448 1.00 0.00 H new ATOM 0 H5'' A A 7 -6.005 4.543 5.141 1.00 0.00 H new ATOM 0 H4' A A 7 -8.179 3.856 5.834 1.00 0.00 H new ATOM 0 H3' A A 7 -6.669 1.739 4.165 1.00 0.00 H new ATOM 0 H2' A A 7 -8.582 0.248 4.714 1.00 0.00 H new ATOM 0 HO2' A A 7 -8.890 0.885 6.830 1.00 0.00 H new ATOM 0 H1' A A 7 -10.528 2.049 4.011 1.00 0.00 H new ATOM 0 H8 A A 7 -7.434 2.561 1.777 1.00 0.00 H new ATOM 0 H61 A A 7 -10.153 -1.573 -1.987 1.00 0.00 H new ATOM 0 H62 A A 7 -8.808 -0.441 -1.814 1.00 0.00 H new ATOM 0 H2 A A 7 -12.555 -1.350 1.772 1.00 0.00 H new ATOM 227 P G A 8 -6.006 0.418 6.551 1.00 0.00 P ATOM 228 OP1 G A 8 -7.152 -0.336 7.105 1.00 0.00 O ATOM 229 OP2 G A 8 -4.803 0.626 7.385 1.00 0.00 O ATOM 230 O5' G A 8 -5.526 -0.283 5.168 1.00 0.00 O ATOM 231 C5' G A 8 -5.600 -1.687 4.950 1.00 0.00 C ATOM 232 C4' G A 8 -7.011 -2.130 4.529 1.00 0.00 C ATOM 233 O4' G A 8 -7.397 -1.520 3.306 1.00 0.00 O ATOM 234 C3' G A 8 -7.155 -3.633 4.274 1.00 0.00 C ATOM 235 O3' G A 8 -7.157 -4.400 5.473 1.00 0.00 O ATOM 236 C2' G A 8 -8.462 -3.642 3.478 1.00 0.00 C ATOM 237 O2' G A 8 -9.591 -3.499 4.325 1.00 0.00 O ATOM 238 C1' G A 8 -8.289 -2.384 2.617 1.00 0.00 C ATOM 239 N9 G A 8 -7.755 -2.702 1.265 1.00 0.00 N ATOM 240 C8 G A 8 -6.565 -2.336 0.684 1.00 0.00 C ATOM 241 N7 G A 8 -6.433 -2.705 -0.560 1.00 0.00 N ATOM 242 C5 G A 8 -7.619 -3.380 -0.833 1.00 0.00 C ATOM 243 C6 G A 8 -8.082 -4.003 -2.040 1.00 0.00 C ATOM 244 O6 G A 8 -7.501 -4.092 -3.119 1.00 0.00 O ATOM 245 N1 G A 8 -9.363 -4.551 -1.921 1.00 0.00 N ATOM 246 C2 G A 8 -10.112 -4.510 -0.756 1.00 0.00 C ATOM 247 N2 G A 8 -11.321 -5.072 -0.794 1.00 0.00 N ATOM 248 N3 G A 8 -9.680 -3.933 0.380 1.00 0.00 N ATOM 249 C4 G A 8 -8.431 -3.386 0.282 1.00 0.00 C ATOM 0 H5' G A 8 -5.312 -2.211 5.861 1.00 0.00 H new ATOM 0 H5'' G A 8 -4.885 -1.972 4.178 1.00 0.00 H new ATOM 0 H4' G A 8 -7.631 -1.834 5.375 1.00 0.00 H new ATOM 0 H3' G A 8 -6.329 -4.107 3.744 1.00 0.00 H new ATOM 0 H2' G A 8 -8.632 -4.565 2.924 1.00 0.00 H new ATOM 0 HO2' G A 8 -9.678 -4.294 4.891 1.00 0.00 H new ATOM 0 H1' G A 8 -9.259 -1.912 2.464 1.00 0.00 H new ATOM 0 H8 G A 8 -5.801 -1.787 1.214 1.00 0.00 H new ATOM 0 H1 G A 8 -9.769 -5.007 -2.738 1.00 0.00 H new ATOM 0 H21 G A 8 -11.912 -5.068 0.038 1.00 0.00 H new ATOM 0 H22 G A 8 -11.655 -5.506 -1.655 1.00 0.00 H new ATOM 261 P G A 9 -7.549 -5.972 5.503 1.00 0.00 P ATOM 262 OP1 G A 9 -9.024 -6.063 5.454 1.00 0.00 O ATOM 263 OP2 G A 9 -6.811 -6.610 6.615 1.00 0.00 O ATOM 264 O5' G A 9 -6.979 -6.554 4.108 1.00 0.00 O ATOM 265 C5' G A 9 -5.601 -6.797 3.887 1.00 0.00 C ATOM 266 C4' G A 9 -5.372 -6.981 2.380 1.00 0.00 C ATOM 267 O4' G A 9 -5.719 -5.798 1.667 1.00 0.00 O ATOM 268 C3' G A 9 -3.909 -7.278 2.032 1.00 0.00 C ATOM 269 O3' G A 9 -3.579 -8.653 2.185 1.00 0.00 O ATOM 270 C2' G A 9 -3.878 -6.805 0.578 1.00 0.00 C ATOM 271 O2' G A 9 -4.451 -7.755 -0.307 1.00 0.00 O ATOM 272 C1' G A 9 -4.768 -5.561 0.639 1.00 0.00 C ATOM 273 N9 G A 9 -3.968 -4.345 0.942 1.00 0.00 N ATOM 274 C8 G A 9 -3.713 -3.747 2.153 1.00 0.00 C ATOM 275 N7 G A 9 -3.080 -2.610 2.074 1.00 0.00 N ATOM 276 C5 G A 9 -2.863 -2.449 0.710 1.00 0.00 C ATOM 277 C6 G A 9 -2.215 -1.392 -0.011 1.00 0.00 C ATOM 278 O6 G A 9 -1.724 -0.361 0.439 1.00 0.00 O ATOM 279 N1 G A 9 -2.158 -1.618 -1.388 1.00 0.00 N ATOM 280 C2 G A 9 -2.669 -2.745 -2.007 1.00 0.00 C ATOM 281 N2 G A 9 -2.509 -2.823 -3.327 1.00 0.00 N ATOM 282 N3 G A 9 -3.294 -3.734 -1.338 1.00 0.00 N ATOM 283 C4 G A 9 -3.361 -3.531 0.014 1.00 0.00 C ATOM 0 H5' G A 9 -5.282 -7.687 4.430 1.00 0.00 H new ATOM 0 H5'' G A 9 -5.005 -5.965 4.261 1.00 0.00 H new ATOM 0 H4' G A 9 -5.999 -7.826 2.096 1.00 0.00 H new ATOM 0 H3' G A 9 -3.175 -6.793 2.676 1.00 0.00 H new ATOM 0 H2' G A 9 -2.866 -6.638 0.209 1.00 0.00 H new ATOM 0 HO2' G A 9 -4.453 -8.638 0.118 1.00 0.00 H new ATOM 0 H1' G A 9 -5.254 -5.386 -0.321 1.00 0.00 H new ATOM 0 H8 G A 9 -4.013 -4.184 3.094 1.00 0.00 H new ATOM 0 H1 G A 9 -1.713 -0.910 -1.972 1.00 0.00 H new ATOM 0 H21 G A 9 -2.865 -3.631 -3.837 1.00 0.00 H new ATOM 0 H22 G A 9 -2.030 -2.074 -3.828 1.00 0.00 H new ATOM 295 P G A 10 -2.048 -9.161 2.325 1.00 0.00 P ATOM 296 OP1 G A 10 -2.064 -10.641 2.359 1.00 0.00 O ATOM 297 OP2 G A 10 -1.430 -8.412 3.440 1.00 0.00 O ATOM 298 O5' G A 10 -1.333 -8.688 0.954 1.00 0.00 O ATOM 299 C5' G A 10 -1.470 -9.398 -0.264 1.00 0.00 C ATOM 300 C4' G A 10 -0.848 -8.614 -1.431 1.00 0.00 C ATOM 301 O4' G A 10 -1.456 -7.335 -1.608 1.00 0.00 O ATOM 302 C3' G A 10 0.659 -8.349 -1.306 1.00 0.00 C ATOM 303 O3' G A 10 1.480 -9.452 -1.657 1.00 0.00 O ATOM 304 C2' G A 10 0.775 -7.217 -2.322 1.00 0.00 C ATOM 305 O2' G A 10 0.666 -7.702 -3.652 1.00 0.00 O ATOM 306 C1' G A 10 -0.462 -6.391 -1.991 1.00 0.00 C ATOM 307 N9 G A 10 -0.203 -5.379 -0.931 1.00 0.00 N ATOM 308 C8 G A 10 -0.384 -5.449 0.429 1.00 0.00 C ATOM 309 N7 G A 10 -0.070 -4.360 1.075 1.00 0.00 N ATOM 310 C5 G A 10 0.384 -3.503 0.077 1.00 0.00 C ATOM 311 C6 G A 10 0.952 -2.188 0.164 1.00 0.00 C ATOM 312 O6 G A 10 1.085 -1.486 1.161 1.00 0.00 O ATOM 313 N1 G A 10 1.409 -1.708 -1.066 1.00 0.00 N ATOM 314 C2 G A 10 1.269 -2.390 -2.263 1.00 0.00 C ATOM 315 N2 G A 10 1.742 -1.800 -3.360 1.00 0.00 N ATOM 316 N3 G A 10 0.715 -3.612 -2.352 1.00 0.00 N ATOM 317 C4 G A 10 0.312 -4.124 -1.151 1.00 0.00 C ATOM 0 H5' G A 10 -2.525 -9.581 -0.466 1.00 0.00 H new ATOM 0 H5'' G A 10 -0.988 -10.372 -0.178 1.00 0.00 H new ATOM 0 H4' G A 10 -1.027 -9.275 -2.279 1.00 0.00 H new ATOM 0 H3' G A 10 0.993 -8.137 -0.290 1.00 0.00 H new ATOM 0 H2' G A 10 1.724 -6.684 -2.269 1.00 0.00 H new ATOM 0 HO2' G A 10 0.897 -8.654 -3.673 1.00 0.00 H new ATOM 0 H1' G A 10 -0.785 -5.801 -2.849 1.00 0.00 H new ATOM 0 H8 G A 10 -0.756 -6.334 0.923 1.00 0.00 H new ATOM 0 H1 G A 10 1.874 -0.800 -1.083 1.00 0.00 H new ATOM 0 H21 G A 10 1.661 -2.265 -4.264 1.00 0.00 H new ATOM 0 H22 G A 10 2.185 -0.883 -3.295 1.00 0.00 H new ATOM 329 P C A 11 3.059 -9.495 -1.287 1.00 0.00 P ATOM 330 OP1 C A 11 3.632 -10.699 -1.930 1.00 0.00 O ATOM 331 OP2 C A 11 3.177 -9.323 0.177 1.00 0.00 O ATOM 332 O5' C A 11 3.708 -8.185 -1.988 1.00 0.00 O ATOM 333 C5' C A 11 4.013 -8.129 -3.373 1.00 0.00 C ATOM 334 C4' C A 11 4.635 -6.776 -3.753 1.00 0.00 C ATOM 335 O4' C A 11 3.833 -5.651 -3.402 1.00 0.00 O ATOM 336 C3' C A 11 5.988 -6.538 -3.087 1.00 0.00 C ATOM 337 O3' C A 11 7.017 -7.305 -3.704 1.00 0.00 O ATOM 338 C2' C A 11 6.116 -5.034 -3.326 1.00 0.00 C ATOM 339 O2' C A 11 6.475 -4.758 -4.670 1.00 0.00 O ATOM 340 C1' C A 11 4.675 -4.541 -3.074 1.00 0.00 C ATOM 341 N1 C A 11 4.479 -4.050 -1.668 1.00 0.00 N ATOM 342 C2 C A 11 5.241 -2.948 -1.229 1.00 0.00 C ATOM 343 O2 C A 11 5.998 -2.357 -1.994 1.00 0.00 O ATOM 344 N3 C A 11 5.135 -2.535 0.073 1.00 0.00 N ATOM 345 C4 C A 11 4.295 -3.153 0.920 1.00 0.00 C ATOM 346 N4 C A 11 4.211 -2.705 2.172 1.00 0.00 N ATOM 347 C5 C A 11 3.458 -4.241 0.489 1.00 0.00 C ATOM 348 C6 C A 11 3.573 -4.639 -0.804 1.00 0.00 C ATOM 0 H5' C A 11 3.105 -8.291 -3.954 1.00 0.00 H new ATOM 0 H5'' C A 11 4.703 -8.933 -3.629 1.00 0.00 H new ATOM 0 H4' C A 11 4.730 -6.851 -4.836 1.00 0.00 H new ATOM 0 H3' C A 11 6.069 -6.833 -2.041 1.00 0.00 H new ATOM 0 H2' C A 11 6.877 -4.566 -2.701 1.00 0.00 H new ATOM 0 HO2' C A 11 6.809 -5.576 -5.094 1.00 0.00 H new ATOM 0 H1' C A 11 4.433 -3.674 -3.688 1.00 0.00 H new ATOM 0 H41 C A 11 3.581 -3.157 2.834 1.00 0.00 H new ATOM 0 H42 C A 11 4.777 -1.910 2.468 1.00 0.00 H new ATOM 0 H5 C A 11 2.767 -4.721 1.166 1.00 0.00 H new ATOM 0 H6 C A 11 2.941 -5.436 -1.167 1.00 0.00 H new ATOM 360 P C A 12 8.394 -7.685 -2.945 1.00 0.00 P ATOM 361 OP1 C A 12 9.208 -8.509 -3.866 1.00 0.00 O ATOM 362 OP2 C A 12 8.053 -8.206 -1.604 1.00 0.00 O ATOM 363 O5' C A 12 9.144 -6.273 -2.744 1.00 0.00 O ATOM 364 C5' C A 12 9.786 -5.595 -3.809 1.00 0.00 C ATOM 365 C4' C A 12 10.326 -4.247 -3.315 1.00 0.00 C ATOM 366 O4' C A 12 9.318 -3.478 -2.676 1.00 0.00 O ATOM 367 C3' C A 12 11.450 -4.377 -2.287 1.00 0.00 C ATOM 368 O3' C A 12 12.703 -4.681 -2.868 1.00 0.00 O ATOM 369 C2' C A 12 11.415 -2.987 -1.655 1.00 0.00 C ATOM 370 O2' C A 12 12.073 -2.027 -2.465 1.00 0.00 O ATOM 371 C1' C A 12 9.903 -2.707 -1.631 1.00 0.00 C ATOM 372 N1 C A 12 9.335 -2.958 -0.280 1.00 0.00 N ATOM 373 C2 C A 12 9.616 -2.029 0.738 1.00 0.00 C ATOM 374 O2 C A 12 10.449 -1.141 0.578 1.00 0.00 O ATOM 375 N3 C A 12 8.933 -2.114 1.918 1.00 0.00 N ATOM 376 C4 C A 12 8.003 -3.062 2.105 1.00 0.00 C ATOM 377 N4 C A 12 7.328 -3.066 3.254 1.00 0.00 N ATOM 378 C5 C A 12 7.725 -4.039 1.085 1.00 0.00 C ATOM 379 C6 C A 12 8.417 -3.955 -0.073 1.00 0.00 C ATOM 0 H5' C A 12 9.084 -5.438 -4.628 1.00 0.00 H new ATOM 0 H5'' C A 12 10.602 -6.203 -4.200 1.00 0.00 H new ATOM 0 H4' C A 12 10.696 -3.769 -4.222 1.00 0.00 H new ATOM 0 H3' C A 12 11.315 -5.198 -1.583 1.00 0.00 H new ATOM 0 H2' C A 12 11.911 -2.936 -0.686 1.00 0.00 H new ATOM 0 HO2' C A 12 12.711 -2.479 -3.056 1.00 0.00 H new ATOM 0 HO3' C A 12 13.382 -4.750 -2.164 1.00 0.00 H new ATOM 0 H1' C A 12 9.679 -1.657 -1.819 1.00 0.00 H new ATOM 0 H41 C A 12 6.615 -3.775 3.424 1.00 0.00 H new ATOM 0 H42 C A 12 7.525 -2.360 3.963 1.00 0.00 H new ATOM 0 H5 C A 12 6.988 -4.813 1.240 1.00 0.00 H new ATOM 0 H6 C A 12 8.244 -4.686 -0.849 1.00 0.00 H new TER 391 C A 12