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= -0.481 USER MOD Single : A 1 G O5' : rot 180:sc=-0.00322 USER MOD Single : A 2 G O2' : rot 180:sc= -0.522 USER MOD Single : A 3 A O2' : rot -12:sc= -0.904 USER MOD Single : A 4 G O2' : rot -17:sc= -0.582 USER MOD Single : A 5 U O2' : rot -7:sc= 0.142 USER MOD Single : A 6 U O2' : rot -16:sc= -0.435 USER MOD Single : A 7 C O2' : rot -6:sc= -0.469 USER MOD Single : A 8 C O2' : rot -27:sc= 0.2 USER MOD Single : A 8 C O3' : rot 180:sc= 0.209 USER MOD Single : B 9 G O2' : rot 180:sc= -0.491 USER MOD Single : B 9 G O5' : rot 180:sc=-0.00419 USER MOD Single : B 10 G O2' : rot 180:sc= -0.519 USER MOD Single : B 11 A O2' : rot -10:sc= -0.979 USER MOD Single : B 12 G O2' : rot -23:sc= -0.63 USER MOD Single : B 13 U O2' : rot -16:sc= 0.147 USER MOD Single : B 14 U O2' : rot -13:sc= -0.523 USER MOD Single : B 15 C O2' : rot -16:sc= 0.0736 USER MOD Single : B 16 C O2' : rot -34:sc= 0.192 USER MOD Single : B 16 C O3' : rot 180:sc= 0.184 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 4.923 -7.919 3.849 1.00 0.00 O ATOM 2 C5' G A 1 6.276 -8.291 3.700 1.00 0.00 C ATOM 3 C4' G A 1 7.117 -7.068 3.326 1.00 0.00 C ATOM 4 O4' G A 1 6.704 -6.513 2.076 1.00 0.00 O ATOM 5 C3' G A 1 6.981 -5.937 4.327 1.00 0.00 C ATOM 6 O3' G A 1 7.749 -6.141 5.496 1.00 0.00 O ATOM 7 C2' G A 1 7.509 -4.793 3.500 1.00 0.00 C ATOM 8 O2' G A 1 8.916 -4.875 3.398 1.00 0.00 O ATOM 9 C1' G A 1 6.905 -5.090 2.137 1.00 0.00 C ATOM 10 N9 G A 1 5.613 -4.387 2.000 1.00 0.00 N ATOM 11 C8 G A 1 4.339 -4.875 2.150 1.00 0.00 C ATOM 12 N7 G A 1 3.405 -3.986 1.953 1.00 0.00 N ATOM 13 C5 G A 1 4.108 -2.823 1.652 1.00 0.00 C ATOM 14 C6 G A 1 3.629 -1.516 1.343 1.00 0.00 C ATOM 15 O6 G A 1 2.465 -1.128 1.275 1.00 0.00 O ATOM 16 N1 G A 1 4.674 -0.632 1.099 1.00 0.00 N ATOM 17 C2 G A 1 6.013 -0.957 1.150 1.00 0.00 C ATOM 18 N2 G A 1 6.882 0.027 0.897 1.00 0.00 N ATOM 19 N3 G A 1 6.466 -2.181 1.438 1.00 0.00 N ATOM 20 C4 G A 1 5.461 -3.061 1.678 1.00 0.00 C ATOM 0 H5' G A 1 6.369 -9.056 2.929 1.00 0.00 H new ATOM 0 H5'' G A 1 6.646 -8.727 4.628 1.00 0.00 H new ATOM 0 H4' G A 1 8.142 -7.438 3.293 1.00 0.00 H new ATOM 0 H3' G A 1 5.973 -5.803 4.718 1.00 0.00 H new ATOM 0 H2' G A 1 7.268 -3.811 3.907 1.00 0.00 H new ATOM 0 HO2' G A 1 9.249 -4.128 2.858 1.00 0.00 H new ATOM 0 HO5' G A 1 4.391 -8.707 4.087 1.00 0.00 H new ATOM 0 H1' G A 1 7.558 -4.754 1.331 1.00 0.00 H new ATOM 0 H8 G A 1 4.129 -5.902 2.408 1.00 0.00 H new ATOM 0 H1 G A 1 4.432 0.331 0.864 1.00 0.00 H new ATOM 0 H21 G A 1 7.885 -0.159 0.922 1.00 0.00 H new ATOM 0 H22 G A 1 6.542 0.964 0.679 1.00 0.00 H new ATOM 33 P G A 2 7.559 -5.181 6.784 1.00 0.00 P ATOM 34 OP1 G A 2 8.475 -5.653 7.846 1.00 0.00 O ATOM 35 OP2 G A 2 6.110 -5.076 7.060 1.00 0.00 O ATOM 36 O5' G A 2 8.078 -3.736 6.280 1.00 0.00 O ATOM 37 C5' G A 2 9.457 -3.469 6.136 1.00 0.00 C ATOM 38 C4' G A 2 9.671 -2.009 5.719 1.00 0.00 C ATOM 39 O4' G A 2 9.068 -1.700 4.461 1.00 0.00 O ATOM 40 C3' G A 2 9.070 -1.028 6.703 1.00 0.00 C ATOM 41 O3' G A 2 9.848 -0.871 7.873 1.00 0.00 O ATOM 42 C2' G A 2 9.077 0.211 5.854 1.00 0.00 C ATOM 43 O2' G A 2 10.398 0.688 5.703 1.00 0.00 O ATOM 44 C1' G A 2 8.603 -0.338 4.525 1.00 0.00 C ATOM 45 N9 G A 2 7.133 -0.330 4.444 1.00 0.00 N ATOM 46 C8 G A 2 6.273 -1.376 4.611 1.00 0.00 C ATOM 47 N7 G A 2 5.019 -1.070 4.419 1.00 0.00 N ATOM 48 C5 G A 2 5.053 0.284 4.094 1.00 0.00 C ATOM 49 C6 G A 2 3.989 1.174 3.758 1.00 0.00 C ATOM 50 O6 G A 2 2.785 0.934 3.693 1.00 0.00 O ATOM 51 N1 G A 2 4.459 2.453 3.482 1.00 0.00 N ATOM 52 C2 G A 2 5.784 2.833 3.511 1.00 0.00 C ATOM 53 N2 G A 2 6.051 4.109 3.215 1.00 0.00 N ATOM 54 N3 G A 2 6.786 2.000 3.820 1.00 0.00 N ATOM 55 C4 G A 2 6.347 0.745 4.101 1.00 0.00 C ATOM 0 H5' G A 2 9.888 -4.135 5.389 1.00 0.00 H new ATOM 0 H5'' G A 2 9.973 -3.666 7.075 1.00 0.00 H new ATOM 0 H4' G A 2 10.755 -1.910 5.672 1.00 0.00 H new ATOM 0 H3' G A 2 8.098 -1.322 7.099 1.00 0.00 H new ATOM 0 H2' G A 2 8.482 1.030 6.258 1.00 0.00 H new ATOM 0 HO2' G A 2 10.393 1.495 5.147 1.00 0.00 H new ATOM 0 H1' G A 2 8.985 0.270 3.705 1.00 0.00 H new ATOM 0 H8 G A 2 6.601 -2.370 4.878 1.00 0.00 H new ATOM 0 H1 G A 2 3.770 3.165 3.239 1.00 0.00 H new ATOM 0 H21 G A 2 7.015 4.443 3.222 1.00 0.00 H new ATOM 0 H22 G A 2 5.291 4.748 2.983 1.00 0.00 H new ATOM 67 P A A 3 9.243 -0.120 9.170 1.00 0.00 P ATOM 68 OP1 A A 3 10.315 -0.016 10.184 1.00 0.00 O ATOM 69 OP2 A A 3 7.965 -0.778 9.520 1.00 0.00 O ATOM 70 O5' A A 3 8.906 1.367 8.640 1.00 0.00 O ATOM 71 C5' A A 3 9.932 2.309 8.410 1.00 0.00 C ATOM 72 C4' A A 3 9.320 3.634 7.941 1.00 0.00 C ATOM 73 O4' A A 3 8.598 3.498 6.723 1.00 0.00 O ATOM 74 C3' A A 3 8.344 4.204 8.947 1.00 0.00 C ATOM 75 O3' A A 3 9.007 4.843 10.021 1.00 0.00 O ATOM 76 C2' A A 3 7.606 5.191 8.075 1.00 0.00 C ATOM 77 O2' A A 3 8.421 6.320 7.844 1.00 0.00 O ATOM 78 C1' A A 3 7.498 4.422 6.754 1.00 0.00 C ATOM 79 N9 A A 3 6.254 3.650 6.715 1.00 0.00 N ATOM 80 C8 A A 3 6.088 2.312 6.919 1.00 0.00 C ATOM 81 N7 A A 3 4.855 1.904 6.797 1.00 0.00 N ATOM 82 C5 A A 3 4.157 3.065 6.473 1.00 0.00 C ATOM 83 C6 A A 3 2.804 3.316 6.191 1.00 0.00 C ATOM 84 N6 A A 3 1.862 2.366 6.213 1.00 0.00 N ATOM 85 N1 A A 3 2.456 4.577 5.874 1.00 0.00 N ATOM 86 C2 A A 3 3.394 5.520 5.847 1.00 0.00 C ATOM 87 N3 A A 3 4.691 5.412 6.098 1.00 0.00 N ATOM 88 C4 A A 3 5.008 4.133 6.410 1.00 0.00 C ATOM 0 H5' A A 3 10.625 1.931 7.658 1.00 0.00 H new ATOM 0 H5'' A A 3 10.507 2.466 9.323 1.00 0.00 H new ATOM 0 H4' A A 3 10.176 4.296 7.811 1.00 0.00 H new ATOM 0 H3' A A 3 7.710 3.465 9.437 1.00 0.00 H new ATOM 0 H2' A A 3 6.661 5.529 8.500 1.00 0.00 H new ATOM 0 HO2' A A 3 9.191 6.297 8.450 1.00 0.00 H new ATOM 0 H1' A A 3 7.512 5.114 5.912 1.00 0.00 H new ATOM 0 H8 A A 3 6.905 1.649 7.160 1.00 0.00 H new ATOM 0 H61 A A 3 0.893 2.603 6.000 1.00 0.00 H new ATOM 0 H62 A A 3 2.113 1.404 6.443 1.00 0.00 H new ATOM 0 H2 A A 3 3.051 6.510 5.584 1.00 0.00 H new ATOM 100 P G A 4 8.222 5.205 11.379 1.00 0.00 P ATOM 101 OP1 G A 4 9.131 5.991 12.242 1.00 0.00 O ATOM 102 OP2 G A 4 7.613 3.960 11.897 1.00 0.00 O ATOM 103 O5' G A 4 7.033 6.172 10.890 1.00 0.00 O ATOM 104 C5' G A 4 7.284 7.508 10.506 1.00 0.00 C ATOM 105 C4' G A 4 5.974 8.166 10.139 1.00 0.00 C ATOM 106 O4' G A 4 5.388 7.536 9.013 1.00 0.00 O ATOM 107 C3' G A 4 4.958 8.034 11.225 1.00 0.00 C ATOM 108 O3' G A 4 5.217 8.909 12.309 1.00 0.00 O ATOM 109 C2' G A 4 3.748 8.447 10.438 1.00 0.00 C ATOM 110 O2' G A 4 3.787 9.839 10.196 1.00 0.00 O ATOM 111 C1' G A 4 3.983 7.728 9.121 1.00 0.00 C ATOM 112 N9 G A 4 3.280 6.430 9.095 1.00 0.00 N ATOM 113 C8 G A 4 3.787 5.168 9.259 1.00 0.00 C ATOM 114 N7 G A 4 2.896 4.220 9.141 1.00 0.00 N ATOM 115 C5 G A 4 1.709 4.905 8.883 1.00 0.00 C ATOM 116 C6 G A 4 0.385 4.412 8.661 1.00 0.00 C ATOM 117 O6 G A 4 -0.012 3.247 8.639 1.00 0.00 O ATOM 118 N1 G A 4 -0.513 5.448 8.457 1.00 0.00 N ATOM 119 C2 G A 4 -0.196 6.786 8.449 1.00 0.00 C ATOM 120 N2 G A 4 -1.204 7.638 8.230 1.00 0.00 N ATOM 121 N3 G A 4 1.039 7.254 8.645 1.00 0.00 N ATOM 122 C4 G A 4 1.939 6.260 8.858 1.00 0.00 C ATOM 0 H5' G A 4 7.969 7.534 9.659 1.00 0.00 H new ATOM 0 H5'' G A 4 7.763 8.051 11.321 1.00 0.00 H new ATOM 0 H4' G A 4 6.219 9.211 9.949 1.00 0.00 H new ATOM 0 H3' G A 4 4.901 7.059 11.709 1.00 0.00 H new ATOM 0 H2' G A 4 2.802 8.221 10.930 1.00 0.00 H new ATOM 0 HO2' G A 4 4.428 10.259 10.806 1.00 0.00 H new ATOM 0 H1' G A 4 3.597 8.312 8.285 1.00 0.00 H new ATOM 0 H8 G A 4 4.829 4.974 9.467 1.00 0.00 H new ATOM 0 H1 G A 4 -1.489 5.197 8.300 1.00 0.00 H new ATOM 0 H21 G A 4 -1.028 8.643 8.213 1.00 0.00 H new ATOM 0 H22 G A 4 -2.148 7.283 8.080 1.00 0.00 H new ATOM 134 P U A 5 4.488 8.707 13.733 1.00 0.00 P ATOM 135 OP1 U A 5 4.787 9.886 14.576 1.00 0.00 O ATOM 136 OP2 U A 5 4.819 7.352 14.224 1.00 0.00 O ATOM 137 O5' U A 5 2.923 8.733 13.369 1.00 0.00 O ATOM 138 C5' U A 5 2.264 9.932 13.023 1.00 0.00 C ATOM 139 C4' U A 5 0.801 9.612 12.703 1.00 0.00 C ATOM 140 O4' U A 5 0.684 8.700 11.614 1.00 0.00 O ATOM 141 C3' U A 5 0.122 8.944 13.886 1.00 0.00 C ATOM 142 O3' U A 5 -0.362 9.887 14.833 1.00 0.00 O ATOM 143 C2' U A 5 -0.988 8.196 13.225 1.00 0.00 C ATOM 144 O2' U A 5 -2.085 9.058 13.002 1.00 0.00 O ATOM 145 C1' U A 5 -0.394 7.796 11.890 1.00 0.00 C ATOM 146 N1 U A 5 0.099 6.399 11.908 1.00 0.00 N ATOM 147 C2 U A 5 -0.821 5.393 11.652 1.00 0.00 C ATOM 148 O2 U A 5 -2.009 5.633 11.451 1.00 0.00 O ATOM 149 N3 U A 5 -0.326 4.097 11.632 1.00 0.00 N ATOM 150 C4 U A 5 1.005 3.736 11.802 1.00 0.00 C ATOM 151 O4 U A 5 1.343 2.556 11.771 1.00 0.00 O ATOM 152 C5 U A 5 1.898 4.862 12.001 1.00 0.00 C ATOM 153 C6 U A 5 1.427 6.120 12.050 1.00 0.00 C ATOM 0 H5' U A 5 2.747 10.394 12.162 1.00 0.00 H new ATOM 0 H5'' U A 5 2.324 10.647 13.844 1.00 0.00 H new ATOM 0 H4' U A 5 0.334 10.566 12.458 1.00 0.00 H new ATOM 0 H3' U A 5 0.791 8.311 14.469 1.00 0.00 H new ATOM 0 H2' U A 5 -1.345 7.354 13.818 1.00 0.00 H new ATOM 0 HO2' U A 5 -1.911 9.925 13.425 1.00 0.00 H new ATOM 0 H1' U A 5 -1.159 7.849 11.116 1.00 0.00 H new ATOM 0 H3 U A 5 -0.997 3.344 11.479 1.00 0.00 H new ATOM 0 H5 U A 5 2.958 4.687 12.112 1.00 0.00 H new ATOM 0 H6 U A 5 2.120 6.934 12.206 1.00 0.00 H new ATOM 164 P U A 6 -0.936 9.411 16.273 1.00 0.00 P ATOM 165 OP1 U A 6 -1.097 10.614 17.118 1.00 0.00 O ATOM 166 OP2 U A 6 -0.090 8.294 16.746 1.00 0.00 O ATOM 167 O5' U A 6 -2.415 8.818 15.965 1.00 0.00 O ATOM 168 C5' U A 6 -3.540 9.674 15.822 1.00 0.00 C ATOM 169 C4' U A 6 -4.829 8.833 15.725 1.00 0.00 C ATOM 170 O4' U A 6 -4.855 8.045 14.541 1.00 0.00 O ATOM 171 C3' U A 6 -4.965 7.852 16.878 1.00 0.00 C ATOM 172 O3' U A 6 -5.475 8.448 18.055 1.00 0.00 O ATOM 173 C2' U A 6 -5.954 6.886 16.289 1.00 0.00 C ATOM 174 O2' U A 6 -7.251 7.446 16.316 1.00 0.00 O ATOM 175 C1' U A 6 -5.498 6.800 14.851 1.00 0.00 C ATOM 176 N1 U A 6 -4.541 5.690 14.669 1.00 0.00 N ATOM 177 C2 U A 6 -5.041 4.407 14.513 1.00 0.00 C ATOM 178 O2 U A 6 -6.241 4.153 14.595 1.00 0.00 O ATOM 179 N3 U A 6 -4.105 3.419 14.251 1.00 0.00 N ATOM 180 C4 U A 6 -2.737 3.606 14.121 1.00 0.00 C ATOM 181 O4 U A 6 -1.994 2.657 13.888 1.00 0.00 O ATOM 182 C5 U A 6 -2.316 4.978 14.282 1.00 0.00 C ATOM 183 C6 U A 6 -3.215 5.948 14.551 1.00 0.00 C ATOM 0 H5' U A 6 -3.429 10.290 14.929 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.602 10.353 16.672 1.00 0.00 H new ATOM 0 H4' U A 6 -5.640 9.561 15.737 1.00 0.00 H new ATOM 0 H3' U A 6 -4.018 7.420 17.202 1.00 0.00 H new ATOM 0 H2' U A 6 -5.995 5.932 16.814 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.266 8.207 16.933 1.00 0.00 H new ATOM 0 H1' U A 6 -6.349 6.615 14.195 1.00 0.00 H new ATOM 0 H3 U A 6 -4.454 2.467 14.144 1.00 0.00 H new ATOM 0 H5 U A 6 -1.270 5.231 14.186 1.00 0.00 H new ATOM 0 H6 U A 6 -2.867 6.963 14.676 1.00 0.00 H new ATOM 194 P C A 7 -5.426 7.660 19.466 1.00 0.00 P ATOM 195 OP1 C A 7 -6.128 8.483 20.476 1.00 0.00 O ATOM 196 OP2 C A 7 -4.026 7.248 19.703 1.00 0.00 O ATOM 197 O5' C A 7 -6.300 6.320 19.213 1.00 0.00 O ATOM 198 C5' C A 7 -7.716 6.349 19.231 1.00 0.00 C ATOM 199 C4' C A 7 -8.262 4.923 19.063 1.00 0.00 C ATOM 200 O4' C A 7 -7.884 4.340 17.810 1.00 0.00 O ATOM 201 C3' C A 7 -7.716 3.984 20.117 1.00 0.00 C ATOM 202 O3' C A 7 -8.365 4.135 21.368 1.00 0.00 O ATOM 203 C2' C A 7 -8.036 2.660 19.474 1.00 0.00 C ATOM 204 O2' C A 7 -9.416 2.391 19.601 1.00 0.00 O ATOM 205 C1' C A 7 -7.736 2.919 18.010 1.00 0.00 C ATOM 206 N1 C A 7 -6.358 2.483 17.662 1.00 0.00 N ATOM 207 C2 C A 7 -6.165 1.139 17.353 1.00 0.00 C ATOM 208 O2 C A 7 -7.101 0.345 17.420 1.00 0.00 O ATOM 209 N3 C A 7 -4.919 0.736 16.976 1.00 0.00 N ATOM 210 C4 C A 7 -3.905 1.610 16.904 1.00 0.00 C ATOM 211 N4 C A 7 -2.701 1.173 16.521 1.00 0.00 N ATOM 212 C5 C A 7 -4.094 2.997 17.215 1.00 0.00 C ATOM 213 C6 C A 7 -5.332 3.379 17.584 1.00 0.00 C ATOM 0 H5' C A 7 -8.087 6.988 18.430 1.00 0.00 H new ATOM 0 H5'' C A 7 -8.069 6.776 20.169 1.00 0.00 H new ATOM 0 H4' C A 7 -9.344 5.032 19.139 1.00 0.00 H new ATOM 0 H3' C A 7 -6.665 4.139 20.362 1.00 0.00 H new ATOM 0 H2' C A 7 -7.485 1.826 19.909 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.833 3.078 20.162 1.00 0.00 H new ATOM 0 H1' C A 7 -8.414 2.355 17.369 1.00 0.00 H new ATOM 0 H41 C A 7 -1.918 1.824 16.460 1.00 0.00 H new ATOM 0 H42 C A 7 -2.566 0.189 16.289 1.00 0.00 H new ATOM 0 H5 C A 7 -3.280 3.704 17.156 1.00 0.00 H new ATOM 0 H6 C A 7 -5.516 4.416 17.823 1.00 0.00 H new ATOM 225 P C A 8 -7.782 3.417 22.692 1.00 0.00 P ATOM 226 OP1 C A 8 -8.702 3.702 23.815 1.00 0.00 O ATOM 227 OP2 C A 8 -6.350 3.771 22.809 1.00 0.00 O ATOM 228 O5' C A 8 -7.878 1.846 22.352 1.00 0.00 O ATOM 229 C5' C A 8 -9.111 1.158 22.411 1.00 0.00 C ATOM 230 C4' C A 8 -8.888 -0.297 21.988 1.00 0.00 C ATOM 231 O4' C A 8 -8.368 -0.383 20.665 1.00 0.00 O ATOM 232 C3' C A 8 -7.857 -0.982 22.857 1.00 0.00 C ATOM 233 O3' C A 8 -8.392 -1.401 24.094 1.00 0.00 O ATOM 234 C2' C A 8 -7.492 -2.159 21.989 1.00 0.00 C ATOM 235 O2' C A 8 -8.448 -3.185 22.154 1.00 0.00 O ATOM 236 C1' C A 8 -7.591 -1.589 20.574 1.00 0.00 C ATOM 237 N1 C A 8 -6.220 -1.293 20.089 1.00 0.00 N ATOM 238 C2 C A 8 -5.499 -2.330 19.506 1.00 0.00 C ATOM 239 O2 C A 8 -6.018 -3.432 19.342 1.00 0.00 O ATOM 240 N3 C A 8 -4.210 -2.089 19.132 1.00 0.00 N ATOM 241 C4 C A 8 -3.651 -0.886 19.328 1.00 0.00 C ATOM 242 N4 C A 8 -2.386 -0.689 18.942 1.00 0.00 N ATOM 243 C5 C A 8 -4.377 0.182 19.945 1.00 0.00 C ATOM 244 C6 C A 8 -5.652 -0.075 20.304 1.00 0.00 C ATOM 0 H5' C A 8 -9.840 1.634 21.755 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.517 1.199 23.422 1.00 0.00 H new ATOM 0 H4' C A 8 -9.866 -0.771 22.073 1.00 0.00 H new ATOM 0 H3' C A 8 -7.020 -0.343 23.137 1.00 0.00 H new ATOM 0 H2' C A 8 -6.515 -2.583 22.220 1.00 0.00 H new ATOM 0 HO2' C A 8 -8.847 -3.120 23.047 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.692 -1.839 24.621 1.00 0.00 H new ATOM 0 H1' C A 8 -8.060 -2.286 19.880 1.00 0.00 H new ATOM 0 H41 C A 8 -1.945 0.220 19.084 1.00 0.00 H new ATOM 0 H42 C A 8 -1.862 -1.448 18.506 1.00 0.00 H new ATOM 0 H5 C A 8 -3.926 1.148 20.115 1.00 0.00 H new ATOM 0 H6 C A 8 -6.235 0.704 20.773 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.430 -8.796 15.803 1.00 0.00 O ATOM 259 C5' G B 9 2.883 -10.090 15.940 1.00 0.00 C ATOM 260 C4' G B 9 1.397 -10.005 16.303 1.00 0.00 C ATOM 261 O4' G B 9 1.201 -9.356 17.560 1.00 0.00 O ATOM 262 C3' G B 9 0.589 -9.192 15.310 1.00 0.00 C ATOM 263 O3' G B 9 0.296 -9.904 14.124 1.00 0.00 O ATOM 264 C2' G B 9 -0.646 -8.930 16.132 1.00 0.00 C ATOM 265 O2' G B 9 -1.435 -10.099 16.214 1.00 0.00 O ATOM 266 C1' G B 9 -0.049 -8.647 17.501 1.00 0.00 C ATOM 267 N9 G B 9 0.184 -7.196 17.654 1.00 0.00 N ATOM 268 C8 G B 9 1.351 -6.487 17.523 1.00 0.00 C ATOM 269 N7 G B 9 1.218 -5.206 17.728 1.00 0.00 N ATOM 270 C5 G B 9 -0.135 -5.052 18.015 1.00 0.00 C ATOM 271 C6 G B 9 -0.878 -3.875 18.325 1.00 0.00 C ATOM 272 O6 G B 9 -0.473 -2.718 18.405 1.00 0.00 O ATOM 273 N1 G B 9 -2.220 -4.161 18.553 1.00 0.00 N ATOM 274 C2 G B 9 -2.783 -5.417 18.487 1.00 0.00 C ATOM 275 N2 G B 9 -4.095 -5.502 18.725 1.00 0.00 N ATOM 276 N3 G B 9 -2.090 -6.523 18.197 1.00 0.00 N ATOM 277 C4 G B 9 -0.776 -6.267 17.973 1.00 0.00 C ATOM 0 H5' G B 9 3.422 -10.640 16.712 1.00 0.00 H new ATOM 0 H5'' G B 9 3.006 -10.644 15.009 1.00 0.00 H new ATOM 0 H4' G B 9 1.064 -11.043 16.316 1.00 0.00 H new ATOM 0 H3' G B 9 1.097 -8.302 14.938 1.00 0.00 H new ATOM 0 H2' G B 9 -1.280 -8.139 15.731 1.00 0.00 H new ATOM 0 HO2' G B 9 -2.234 -9.917 16.751 1.00 0.00 H new ATOM 0 HO5' G B 9 4.380 -8.865 15.573 1.00 0.00 H new ATOM 0 H1' G B 9 -0.719 -8.967 18.299 1.00 0.00 H new ATOM 0 H8 G B 9 2.295 -6.948 17.273 1.00 0.00 H new ATOM 0 H1 G B 9 -2.834 -3.381 18.787 1.00 0.00 H new ATOM 0 H21 G B 9 -4.562 -6.408 18.689 1.00 0.00 H new ATOM 0 H22 G B 9 -4.629 -4.661 18.943 1.00 0.00 H new ATOM 290 P G B 10 -0.336 -9.145 12.845 1.00 0.00 P ATOM 291 OP1 G B 10 -0.499 -10.135 11.758 1.00 0.00 O ATOM 292 OP2 G B 10 0.460 -7.920 12.607 1.00 0.00 O ATOM 293 O5' G B 10 -1.807 -8.696 13.340 1.00 0.00 O ATOM 294 C5' G B 10 -2.849 -9.641 13.465 1.00 0.00 C ATOM 295 C4' G B 10 -4.149 -8.944 13.883 1.00 0.00 C ATOM 296 O4' G B 10 -4.045 -8.291 15.151 1.00 0.00 O ATOM 297 C3' G B 10 -4.573 -7.865 12.909 1.00 0.00 C ATOM 298 O3' G B 10 -5.171 -8.383 11.737 1.00 0.00 O ATOM 299 C2' G B 10 -5.563 -7.122 13.762 1.00 0.00 C ATOM 300 O2' G B 10 -6.752 -7.873 13.904 1.00 0.00 O ATOM 301 C1' G B 10 -4.843 -7.091 15.093 1.00 0.00 C ATOM 302 N9 G B 10 -3.956 -5.919 15.187 1.00 0.00 N ATOM 303 C8 G B 10 -2.601 -5.870 15.028 1.00 0.00 C ATOM 304 N7 G B 10 -2.084 -4.689 15.231 1.00 0.00 N ATOM 305 C5 G B 10 -3.181 -3.896 15.557 1.00 0.00 C ATOM 306 C6 G B 10 -3.244 -2.513 15.903 1.00 0.00 C ATOM 307 O6 G B 10 -2.323 -1.702 15.979 1.00 0.00 O ATOM 308 N1 G B 10 -4.547 -2.112 16.178 1.00 0.00 N ATOM 309 C2 G B 10 -5.653 -2.934 16.136 1.00 0.00 C ATOM 310 N2 G B 10 -6.830 -2.374 16.432 1.00 0.00 N ATOM 311 N3 G B 10 -5.598 -4.233 15.817 1.00 0.00 N ATOM 312 C4 G B 10 -4.334 -4.645 15.538 1.00 0.00 C ATOM 0 H5' G B 10 -2.579 -10.396 14.204 1.00 0.00 H new ATOM 0 H5'' G B 10 -2.995 -10.160 12.518 1.00 0.00 H new ATOM 0 H4' G B 10 -4.876 -9.755 13.916 1.00 0.00 H new ATOM 0 H3' G B 10 -3.751 -7.265 12.517 1.00 0.00 H new ATOM 0 H2' G B 10 -5.847 -6.148 13.363 1.00 0.00 H new ATOM 0 HO2' G B 10 -7.387 -7.378 14.463 1.00 0.00 H new ATOM 0 H1' G B 10 -5.561 -7.031 15.911 1.00 0.00 H new ATOM 0 H8 G B 10 -2.009 -6.732 14.758 1.00 0.00 H new ATOM 0 H1 G B 10 -4.696 -1.135 16.430 1.00 0.00 H new ATOM 0 H21 G B 10 -7.681 -2.936 16.416 1.00 0.00 H new ATOM 0 H22 G B 10 -6.877 -1.384 16.674 1.00 0.00 H new ATOM 324 P A B 11 -5.401 -7.440 10.444 1.00 0.00 P ATOM 325 OP1 A B 11 -6.130 -8.227 9.425 1.00 0.00 O ATOM 326 OP2 A B 11 -4.103 -6.818 10.100 1.00 0.00 O ATOM 327 O5' A B 11 -6.383 -6.277 10.978 1.00 0.00 O ATOM 328 C5' A B 11 -7.755 -6.527 11.202 1.00 0.00 C ATOM 329 C4' A B 11 -8.442 -5.244 11.682 1.00 0.00 C ATOM 330 O4' A B 11 -7.900 -4.761 12.905 1.00 0.00 O ATOM 331 C3' A B 11 -8.307 -4.111 10.689 1.00 0.00 C ATOM 332 O3' A B 11 -9.210 -4.246 9.608 1.00 0.00 O ATOM 333 C2' A B 11 -8.658 -2.937 11.572 1.00 0.00 C ATOM 334 O2' A B 11 -10.050 -2.918 11.802 1.00 0.00 O ATOM 335 C1' A B 11 -7.979 -3.327 12.889 1.00 0.00 C ATOM 336 N9 A B 11 -6.615 -2.795 12.936 1.00 0.00 N ATOM 337 C8 A B 11 -5.445 -3.463 12.726 1.00 0.00 C ATOM 338 N7 A B 11 -4.379 -2.723 12.859 1.00 0.00 N ATOM 339 C5 A B 11 -4.889 -1.473 13.198 1.00 0.00 C ATOM 340 C6 A B 11 -4.278 -0.243 13.498 1.00 0.00 C ATOM 341 N6 A B 11 -2.954 -0.058 13.481 1.00 0.00 N ATOM 342 N1 A B 11 -5.080 0.787 13.828 1.00 0.00 N ATOM 343 C2 A B 11 -6.397 0.603 13.851 1.00 0.00 C ATOM 344 N3 A B 11 -7.089 -0.496 13.584 1.00 0.00 N ATOM 345 C4 A B 11 -6.255 -1.513 13.259 1.00 0.00 C ATOM 0 H5' A B 11 -7.874 -7.315 11.946 1.00 0.00 H new ATOM 0 H5'' A B 11 -8.225 -6.881 10.284 1.00 0.00 H new ATOM 0 H4' A B 11 -9.486 -5.530 11.807 1.00 0.00 H new ATOM 0 H3' A B 11 -7.333 -4.043 10.205 1.00 0.00 H new ATOM 0 H2' A B 11 -8.364 -1.973 11.157 1.00 0.00 H new ATOM 0 HO2' A B 11 -10.488 -3.565 11.210 1.00 0.00 H new ATOM 0 H1' A B 11 -8.542 -2.932 13.735 1.00 0.00 H new ATOM 0 H8 A B 11 -5.404 -4.512 12.472 1.00 0.00 H new ATOM 0 H61 A B 11 -2.564 0.857 13.707 1.00 0.00 H new ATOM 0 H62 A B 11 -2.334 -0.832 13.242 1.00 0.00 H new ATOM 0 H2 A B 11 -6.983 1.468 14.125 1.00 0.00 H new ATOM 357 P G B 12 -9.022 -3.383 8.262 1.00 0.00 P ATOM 358 OP1 G B 12 -10.191 -3.631 7.388 1.00 0.00 O ATOM 359 OP2 G B 12 -7.657 -3.631 7.749 1.00 0.00 O ATOM 360 O5' G B 12 -9.092 -1.859 8.771 1.00 0.00 O ATOM 361 C5' G B 12 -10.315 -1.269 9.161 1.00 0.00 C ATOM 362 C4' G B 12 -10.067 0.170 9.546 1.00 0.00 C ATOM 363 O4' G B 12 -9.209 0.253 10.671 1.00 0.00 O ATOM 364 C3' G B 12 -9.363 0.924 8.468 1.00 0.00 C ATOM 365 O3' G B 12 -10.229 1.260 7.398 1.00 0.00 O ATOM 366 C2' G B 12 -8.953 2.130 9.266 1.00 0.00 C ATOM 367 O2' G B 12 -10.073 2.959 9.515 1.00 0.00 O ATOM 368 C1' G B 12 -8.520 1.495 10.576 1.00 0.00 C ATOM 369 N9 G B 12 -7.059 1.281 10.600 1.00 0.00 N ATOM 370 C8 G B 12 -6.351 0.120 10.431 1.00 0.00 C ATOM 371 N7 G B 12 -5.058 0.266 10.549 1.00 0.00 N ATOM 372 C5 G B 12 -4.897 1.625 10.813 1.00 0.00 C ATOM 373 C6 G B 12 -3.709 2.390 11.035 1.00 0.00 C ATOM 374 O6 G B 12 -2.538 2.010 11.054 1.00 0.00 O ATOM 375 N1 G B 12 -4.001 3.729 11.243 1.00 0.00 N ATOM 376 C2 G B 12 -5.262 4.276 11.255 1.00 0.00 C ATOM 377 N2 G B 12 -5.341 5.593 11.478 1.00 0.00 N ATOM 378 N3 G B 12 -6.376 3.567 11.059 1.00 0.00 N ATOM 379 C4 G B 12 -6.120 2.253 10.841 1.00 0.00 C ATOM 0 H5' G B 12 -10.745 -1.815 10.001 1.00 0.00 H new ATOM 0 H5'' G B 12 -11.035 -1.321 8.345 1.00 0.00 H new ATOM 0 H4' G B 12 -11.053 0.590 9.744 1.00 0.00 H new ATOM 0 H3' G B 12 -8.553 0.390 7.970 1.00 0.00 H new ATOM 0 H2' G B 12 -8.199 2.745 8.775 1.00 0.00 H new ATOM 0 HO2' G B 12 -10.761 2.792 8.837 1.00 0.00 H new ATOM 0 H1' G B 12 -8.758 2.143 11.419 1.00 0.00 H new ATOM 0 H8 G B 12 -6.819 -0.830 10.219 1.00 0.00 H new ATOM 0 H1 G B 12 -3.215 4.360 11.400 1.00 0.00 H new ATOM 0 H21 G B 12 -6.251 6.053 11.498 1.00 0.00 H new ATOM 0 H22 G B 12 -4.491 6.137 11.628 1.00 0.00 H new ATOM 391 P U B 13 -9.644 1.730 5.972 1.00 0.00 P ATOM 392 OP1 U B 13 -10.771 2.221 5.149 1.00 0.00 O ATOM 393 OP2 U B 13 -8.777 0.647 5.457 1.00 0.00 O ATOM 394 O5' U B 13 -8.705 2.982 6.338 1.00 0.00 O ATOM 395 C5' U B 13 -9.249 4.235 6.697 1.00 0.00 C ATOM 396 C4' U B 13 -8.100 5.194 7.016 1.00 0.00 C ATOM 397 O4' U B 13 -7.301 4.718 8.096 1.00 0.00 O ATOM 398 C3' U B 13 -7.164 5.330 5.829 1.00 0.00 C ATOM 399 O3' U B 13 -7.628 6.285 4.881 1.00 0.00 O ATOM 400 C2' U B 13 -5.895 5.761 6.490 1.00 0.00 C ATOM 401 O2' U B 13 -5.925 7.152 6.727 1.00 0.00 O ATOM 402 C1' U B 13 -5.931 5.038 7.819 1.00 0.00 C ATOM 403 N1 U B 13 -5.113 3.803 7.792 1.00 0.00 N ATOM 404 C2 U B 13 -3.755 3.930 8.043 1.00 0.00 C ATOM 405 O2 U B 13 -3.230 5.022 8.244 1.00 0.00 O ATOM 406 N3 U B 13 -3.019 2.753 8.057 1.00 0.00 N ATOM 407 C4 U B 13 -3.535 1.475 7.886 1.00 0.00 C ATOM 408 O4 U B 13 -2.797 0.493 7.912 1.00 0.00 O ATOM 409 C5 U B 13 -4.972 1.442 7.692 1.00 0.00 C ATOM 410 C6 U B 13 -5.692 2.575 7.648 1.00 0.00 C ATOM 0 H5' U B 13 -9.904 4.129 7.562 1.00 0.00 H new ATOM 0 H5'' U B 13 -9.857 4.631 5.883 1.00 0.00 H new ATOM 0 H4' U B 13 -8.566 6.146 7.270 1.00 0.00 H new ATOM 0 H3' U B 13 -7.066 4.416 5.243 1.00 0.00 H new ATOM 0 H2' U B 13 -5.010 5.544 5.892 1.00 0.00 H new ATOM 0 HO2' U B 13 -6.638 7.560 6.192 1.00 0.00 H new ATOM 0 H1' U B 13 -5.512 5.678 8.596 1.00 0.00 H new ATOM 0 H3 U B 13 -2.013 2.834 8.206 1.00 0.00 H new ATOM 0 H5 U B 13 -5.471 0.491 7.581 1.00 0.00 H new ATOM 0 H6 U B 13 -6.759 2.513 7.494 1.00 0.00 H new ATOM 421 P U B 14 -6.913 6.446 3.433 1.00 0.00 P ATOM 422 OP1 U B 14 -7.794 7.275 2.581 1.00 0.00 O ATOM 423 OP2 U B 14 -6.514 5.097 2.976 1.00 0.00 O ATOM 424 O5' U B 14 -5.561 7.294 3.723 1.00 0.00 O ATOM 425 C5' U B 14 -5.578 8.713 3.798 1.00 0.00 C ATOM 426 C4' U B 14 -4.137 9.245 3.912 1.00 0.00 C ATOM 427 O4' U B 14 -3.505 8.801 5.107 1.00 0.00 O ATOM 428 C3' U B 14 -3.254 8.760 2.774 1.00 0.00 C ATOM 429 O3' U B 14 -3.418 9.513 1.588 1.00 0.00 O ATOM 430 C2' U B 14 -1.898 8.987 3.378 1.00 0.00 C ATOM 431 O2' U B 14 -1.580 10.363 3.349 1.00 0.00 O ATOM 432 C1' U B 14 -2.117 8.577 4.816 1.00 0.00 C ATOM 433 N1 U B 14 -1.789 7.150 5.012 1.00 0.00 N ATOM 434 C2 U B 14 -0.458 6.794 5.163 1.00 0.00 C ATOM 435 O2 U B 14 0.456 7.610 5.072 1.00 0.00 O ATOM 436 N3 U B 14 -0.214 5.455 5.429 1.00 0.00 N ATOM 437 C4 U B 14 -1.173 4.464 5.567 1.00 0.00 C ATOM 438 O4 U B 14 -0.847 3.304 5.801 1.00 0.00 O ATOM 439 C5 U B 14 -2.529 4.936 5.413 1.00 0.00 C ATOM 440 C6 U B 14 -2.781 6.234 5.142 1.00 0.00 C ATOM 0 H5' U B 14 -6.164 9.034 4.659 1.00 0.00 H new ATOM 0 H5'' U B 14 -6.060 9.128 2.913 1.00 0.00 H new ATOM 0 H4' U B 14 -4.237 10.330 3.893 1.00 0.00 H new ATOM 0 H3' U B 14 -3.464 7.739 2.456 1.00 0.00 H new ATOM 0 H2' U B 14 -1.099 8.452 2.865 1.00 0.00 H new ATOM 0 HO2' U B 14 -2.206 10.831 2.758 1.00 0.00 H new ATOM 0 H1' U B 14 -1.473 9.156 5.478 1.00 0.00 H new ATOM 0 H3 U B 14 0.761 5.174 5.533 1.00 0.00 H new ATOM 0 H5 U B 14 -3.351 4.243 5.516 1.00 0.00 H new ATOM 0 H6 U B 14 -3.806 6.554 5.025 1.00 0.00 H new ATOM 451 P C B 15 -2.791 8.995 0.190 1.00 0.00 P ATOM 452 OP1 C B 15 -3.031 10.036 -0.834 1.00 0.00 O ATOM 453 OP2 C B 15 -3.277 7.617 -0.039 1.00 0.00 O ATOM 454 O5' C B 15 -1.198 8.919 0.465 1.00 0.00 O ATOM 455 C5' C B 15 -0.392 10.083 0.458 1.00 0.00 C ATOM 456 C4' C B 15 1.080 9.693 0.658 1.00 0.00 C ATOM 457 O4' C B 15 1.306 9.040 1.914 1.00 0.00 O ATOM 458 C3' C B 15 1.547 8.705 -0.390 1.00 0.00 C ATOM 459 O3' C B 15 1.830 9.325 -1.633 1.00 0.00 O ATOM 460 C2' C B 15 2.797 8.198 0.279 1.00 0.00 C ATOM 461 O2' C B 15 3.802 9.185 0.194 1.00 0.00 O ATOM 462 C1' C B 15 2.373 8.084 1.731 1.00 0.00 C ATOM 463 N1 C B 15 1.902 6.711 2.051 1.00 0.00 N ATOM 464 C2 C B 15 2.862 5.757 2.378 1.00 0.00 C ATOM 465 O2 C B 15 4.057 6.037 2.336 1.00 0.00 O ATOM 466 N3 C B 15 2.437 4.514 2.745 1.00 0.00 N ATOM 467 C4 C B 15 1.130 4.219 2.791 1.00 0.00 C ATOM 468 N4 C B 15 0.758 2.991 3.168 1.00 0.00 N ATOM 469 C5 C B 15 0.134 5.194 2.459 1.00 0.00 C ATOM 470 C6 C B 15 0.571 6.418 2.101 1.00 0.00 C ATOM 0 H5' C B 15 -0.709 10.762 1.250 1.00 0.00 H new ATOM 0 H5'' C B 15 -0.513 10.615 -0.486 1.00 0.00 H new ATOM 0 H4' C B 15 1.624 10.636 0.599 1.00 0.00 H new ATOM 0 H3' C B 15 0.815 7.941 -0.653 1.00 0.00 H new ATOM 0 H2' C B 15 3.179 7.274 -0.156 1.00 0.00 H new ATOM 0 HO2' C B 15 3.550 9.851 -0.479 1.00 0.00 H new ATOM 0 H1' C B 15 3.212 8.286 2.396 1.00 0.00 H new ATOM 0 H41 C B 15 -0.232 2.748 3.209 1.00 0.00 H new ATOM 0 H42 C B 15 1.464 2.297 3.414 1.00 0.00 H new ATOM 0 H5 C B 15 -0.920 4.959 2.494 1.00 0.00 H new ATOM 0 H6 C B 15 -0.148 7.183 1.848 1.00 0.00 H new ATOM 482 P C B 16 2.034 8.441 -2.971 1.00 0.00 P ATOM 483 OP1 C B 16 2.382 9.356 -4.080 1.00 0.00 O ATOM 484 OP2 C B 16 0.869 7.539 -3.101 1.00 0.00 O ATOM 485 O5' C B 16 3.327 7.537 -2.644 1.00 0.00 O ATOM 486 C5' C B 16 4.637 8.054 -2.767 1.00 0.00 C ATOM 487 C4' C B 16 5.637 6.972 -2.358 1.00 0.00 C ATOM 488 O4' C B 16 5.415 6.536 -1.019 1.00 0.00 O ATOM 489 C3' C B 16 5.488 5.726 -3.198 1.00 0.00 C ATOM 490 O3' C B 16 6.093 5.854 -4.467 1.00 0.00 O ATOM 491 C2' C B 16 6.209 4.722 -2.339 1.00 0.00 C ATOM 492 O2' C B 16 7.601 4.830 -2.548 1.00 0.00 O ATOM 493 C1' C B 16 5.870 5.176 -0.920 1.00 0.00 C ATOM 494 N1 C B 16 4.797 4.293 -0.399 1.00 0.00 N ATOM 495 C2 C B 16 5.175 3.072 0.149 1.00 0.00 C ATOM 496 O2 C B 16 6.364 2.789 0.276 1.00 0.00 O ATOM 497 N3 C B 16 4.194 2.205 0.528 1.00 0.00 N ATOM 498 C4 C B 16 2.900 2.518 0.372 1.00 0.00 C ATOM 499 N4 C B 16 1.970 1.638 0.756 1.00 0.00 N ATOM 500 C5 C B 16 2.500 3.768 -0.203 1.00 0.00 C ATOM 501 C6 C B 16 3.485 4.615 -0.568 1.00 0.00 C ATOM 0 H5' C B 16 4.755 8.935 -2.136 1.00 0.00 H new ATOM 0 H5'' C B 16 4.823 8.370 -3.793 1.00 0.00 H new ATOM 0 H4' C B 16 6.618 7.429 -2.483 1.00 0.00 H new ATOM 0 H3' C B 16 4.455 5.470 -3.432 1.00 0.00 H new ATOM 0 H2' C B 16 5.926 3.690 -2.547 1.00 0.00 H new ATOM 0 HO2' C B 16 7.774 5.072 -3.482 1.00 0.00 H new ATOM 0 HO3' C B 16 5.972 5.023 -4.972 1.00 0.00 H new ATOM 0 H1' C B 16 6.724 5.120 -0.245 1.00 0.00 H new ATOM 0 H41 C B 16 0.981 1.860 0.644 1.00 0.00 H new ATOM 0 H42 C B 16 2.250 0.744 1.161 1.00 0.00 H new ATOM 0 H5 C B 16 1.459 4.021 -0.338 1.00 0.00 H new ATOM 0 H6 C B 16 3.227 5.569 -1.004 1.00 0.00 H new TER 514 C B 16