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 -16:sc= 0.0413 USER MOD Single : A 1 G O5' : rot 180:sc=-0.00631 USER MOD Single : A 2 G O2' : rot -77:sc= 0.262 USER MOD Single : A 3 A O2' : rot -23:sc= -0.302 USER MOD Single : A 4 G O2' : rot -17:sc= -0.553 USER MOD Single : A 5 U O2' : rot -8:sc= 0.127 USER MOD Single : A 6 U O2' : rot -15:sc= -0.491 USER MOD Single : A 7 C O2' : rot -7:sc= -0.443 USER MOD Single : A 8 C O2' : rot -27:sc= 0.183 USER MOD Single : A 8 C O3' : rot 180:sc= 0.201 USER MOD Single : B 9 G O2' : rot 180:sc= -0.47 USER MOD Single : B 9 G O5' : rot 180:sc=-0.00392 USER MOD Single : B 10 G O2' : rot 180:sc= -0.543 USER MOD Single : B 11 A O2' : rot 180:sc= -1.03 USER MOD Single : B 12 G O2' : rot -23:sc= -0.586 USER MOD Single : B 13 U O2' : rot -16:sc= 0.15 USER MOD Single : B 14 U O2' : rot -13:sc= -0.545 USER MOD Single : B 15 C O2' : rot -8:sc= -0.431 USER MOD Single : B 16 C O2' : rot -27:sc= 0.144 USER MOD Single : B 16 C O3' : rot 180:sc= 0.189 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 4.985 -7.999 3.342 1.00 0.00 O ATOM 2 C5' G A 1 6.292 -8.338 2.929 1.00 0.00 C ATOM 3 C4' G A 1 7.057 -7.080 2.504 1.00 0.00 C ATOM 4 O4' G A 1 6.436 -6.441 1.390 1.00 0.00 O ATOM 5 C3' G A 1 7.104 -6.020 3.587 1.00 0.00 C ATOM 6 O3' G A 1 8.047 -6.308 4.600 1.00 0.00 O ATOM 7 C2' G A 1 7.521 -4.836 2.760 1.00 0.00 C ATOM 8 O2' G A 1 8.883 -4.965 2.416 1.00 0.00 O ATOM 9 C1' G A 1 6.695 -5.031 1.498 1.00 0.00 C ATOM 10 N9 G A 1 5.423 -4.291 1.593 1.00 0.00 N ATOM 11 C8 G A 1 4.167 -4.758 1.887 1.00 0.00 C ATOM 12 N7 G A 1 3.240 -3.842 1.846 1.00 0.00 N ATOM 13 C5 G A 1 3.930 -2.683 1.503 1.00 0.00 C ATOM 14 C6 G A 1 3.450 -1.356 1.301 1.00 0.00 C ATOM 15 O6 G A 1 2.296 -0.942 1.384 1.00 0.00 O ATOM 16 N1 G A 1 4.482 -0.484 0.968 1.00 0.00 N ATOM 17 C2 G A 1 5.807 -0.839 0.842 1.00 0.00 C ATOM 18 N2 G A 1 6.665 0.136 0.529 1.00 0.00 N ATOM 19 N3 G A 1 6.259 -2.084 1.021 1.00 0.00 N ATOM 20 C4 G A 1 5.268 -2.950 1.351 1.00 0.00 C ATOM 0 H5' G A 1 6.247 -9.043 2.099 1.00 0.00 H new ATOM 0 H5'' G A 1 6.820 -8.836 3.742 1.00 0.00 H new ATOM 0 H4' G A 1 8.058 -7.442 2.270 1.00 0.00 H new ATOM 0 H3' G A 1 6.175 -5.903 4.144 1.00 0.00 H new ATOM 0 H2' G A 1 7.383 -3.877 3.259 1.00 0.00 H new ATOM 0 HO2' G A 1 9.304 -5.637 2.992 1.00 0.00 H new ATOM 0 HO5' G A 1 4.506 -8.811 3.609 1.00 0.00 H new ATOM 0 H1' G A 1 7.228 -4.657 0.624 1.00 0.00 H new ATOM 0 H8 G A 1 3.964 -5.791 2.130 1.00 0.00 H new ATOM 0 H1 G A 1 4.239 0.493 0.805 1.00 0.00 H new ATOM 0 H21 G A 1 7.658 -0.073 0.424 1.00 0.00 H new ATOM 0 H22 G A 1 6.327 1.089 0.395 1.00 0.00 H new ATOM 33 P G A 2 8.055 -5.464 5.978 1.00 0.00 P ATOM 34 OP1 G A 2 9.131 -6.003 6.838 1.00 0.00 O ATOM 35 OP2 G A 2 6.666 -5.418 6.485 1.00 0.00 O ATOM 36 O5' G A 2 8.473 -3.965 5.533 1.00 0.00 O ATOM 37 C5' G A 2 9.822 -3.627 5.273 1.00 0.00 C ATOM 38 C4' G A 2 9.947 -2.117 5.051 1.00 0.00 C ATOM 39 O4' G A 2 9.205 -1.655 3.927 1.00 0.00 O ATOM 40 C3' G A 2 9.438 -1.329 6.233 1.00 0.00 C ATOM 41 O3' G A 2 10.379 -1.304 7.288 1.00 0.00 O ATOM 42 C2' G A 2 9.242 0.024 5.618 1.00 0.00 C ATOM 43 O2' G A 2 10.491 0.669 5.474 1.00 0.00 O ATOM 44 C1' G A 2 8.714 -0.337 4.237 1.00 0.00 C ATOM 45 N9 G A 2 7.246 -0.371 4.207 1.00 0.00 N ATOM 46 C8 G A 2 6.425 -1.460 4.267 1.00 0.00 C ATOM 47 N7 G A 2 5.157 -1.177 4.133 1.00 0.00 N ATOM 48 C5 G A 2 5.141 0.205 3.952 1.00 0.00 C ATOM 49 C6 G A 2 4.046 1.091 3.715 1.00 0.00 C ATOM 50 O6 G A 2 2.847 0.827 3.659 1.00 0.00 O ATOM 51 N1 G A 2 4.476 2.400 3.526 1.00 0.00 N ATOM 52 C2 G A 2 5.791 2.814 3.569 1.00 0.00 C ATOM 53 N2 G A 2 6.018 4.117 3.371 1.00 0.00 N ATOM 54 N3 G A 2 6.819 1.989 3.798 1.00 0.00 N ATOM 55 C4 G A 2 6.421 0.703 3.977 1.00 0.00 C ATOM 0 H5' G A 2 10.177 -4.163 4.393 1.00 0.00 H new ATOM 0 H5'' G A 2 10.451 -3.934 6.109 1.00 0.00 H new ATOM 0 H4' G A 2 11.014 -1.959 4.893 1.00 0.00 H new ATOM 0 H3' G A 2 8.539 -1.739 6.694 1.00 0.00 H new ATOM 0 H2' G A 2 8.597 0.684 6.197 1.00 0.00 H new ATOM 0 HO2' G A 2 10.785 1.011 6.344 1.00 0.00 H new ATOM 0 H1' G A 2 9.047 0.412 3.519 1.00 0.00 H new ATOM 0 H8 G A 2 6.791 -2.466 4.412 1.00 0.00 H new ATOM 0 H1 G A 2 3.765 3.108 3.342 1.00 0.00 H new ATOM 0 H21 G A 2 6.972 4.477 3.392 1.00 0.00 H new ATOM 0 H22 G A 2 5.237 4.750 3.199 1.00 0.00 H new ATOM 67 P A A 3 10.020 -0.605 8.685 1.00 0.00 P ATOM 68 OP1 A A 3 11.170 -0.772 9.602 1.00 0.00 O ATOM 69 OP2 A A 3 8.675 -1.066 9.097 1.00 0.00 O ATOM 70 O5' A A 3 9.921 0.948 8.278 1.00 0.00 O ATOM 71 C5' A A 3 9.061 1.809 8.979 1.00 0.00 C ATOM 72 C4' A A 3 9.096 3.215 8.377 1.00 0.00 C ATOM 73 O4' A A 3 8.658 3.236 7.014 1.00 0.00 O ATOM 74 C3' A A 3 8.146 4.094 9.161 1.00 0.00 C ATOM 75 O3' A A 3 8.810 4.740 10.230 1.00 0.00 O ATOM 76 C2' A A 3 7.674 5.081 8.130 1.00 0.00 C ATOM 77 O2' A A 3 8.671 6.062 7.927 1.00 0.00 O ATOM 78 C1' A A 3 7.613 4.208 6.876 1.00 0.00 C ATOM 79 N9 A A 3 6.336 3.487 6.785 1.00 0.00 N ATOM 80 C8 A A 3 6.122 2.140 6.877 1.00 0.00 C ATOM 81 N7 A A 3 4.878 1.788 6.712 1.00 0.00 N ATOM 82 C5 A A 3 4.225 2.991 6.463 1.00 0.00 C ATOM 83 C6 A A 3 2.887 3.303 6.166 1.00 0.00 C ATOM 84 N6 A A 3 1.919 2.383 6.106 1.00 0.00 N ATOM 85 N1 A A 3 2.586 4.591 5.912 1.00 0.00 N ATOM 86 C2 A A 3 3.555 5.502 5.961 1.00 0.00 C ATOM 87 N3 A A 3 4.843 5.337 6.238 1.00 0.00 N ATOM 88 C4 A A 3 5.112 4.033 6.483 1.00 0.00 C ATOM 0 H5' A A 3 9.355 1.850 10.028 1.00 0.00 H new ATOM 0 H5'' A A 3 8.043 1.420 8.948 1.00 0.00 H new ATOM 0 H4' A A 3 10.128 3.564 8.421 1.00 0.00 H new ATOM 0 H3' A A 3 7.331 3.540 9.627 1.00 0.00 H new ATOM 0 H2' A A 3 6.745 5.587 8.394 1.00 0.00 H new ATOM 0 HO2' A A 3 9.248 6.110 8.718 1.00 0.00 H new ATOM 0 H1' A A 3 7.717 4.830 5.987 1.00 0.00 H new ATOM 0 H8 A A 3 6.913 1.431 7.069 1.00 0.00 H new ATOM 0 H61 A A 3 0.963 2.662 5.886 1.00 0.00 H new ATOM 0 H62 A A 3 2.137 1.402 6.280 1.00 0.00 H new ATOM 0 H2 A A 3 3.252 6.516 5.746 1.00 0.00 H new ATOM 100 P G A 4 7.994 5.281 11.502 1.00 0.00 P ATOM 101 OP1 G A 4 8.904 6.122 12.311 1.00 0.00 O ATOM 102 OP2 G A 4 7.313 4.126 12.126 1.00 0.00 O ATOM 103 O5' G A 4 6.869 6.230 10.858 1.00 0.00 O ATOM 104 C5' G A 4 7.163 7.542 10.415 1.00 0.00 C ATOM 105 C4' G A 4 5.870 8.193 9.990 1.00 0.00 C ATOM 106 O4' G A 4 5.299 7.512 8.887 1.00 0.00 O ATOM 107 C3' G A 4 4.843 8.104 11.067 1.00 0.00 C ATOM 108 O3' G A 4 5.084 9.032 12.110 1.00 0.00 O ATOM 109 C2' G A 4 3.628 8.456 10.259 1.00 0.00 C ATOM 110 O2' G A 4 3.622 9.838 9.954 1.00 0.00 O ATOM 111 C1' G A 4 3.889 7.678 8.981 1.00 0.00 C ATOM 112 N9 G A 4 3.211 6.365 9.019 1.00 0.00 N ATOM 113 C8 G A 4 3.745 5.117 9.213 1.00 0.00 C ATOM 114 N7 G A 4 2.870 4.149 9.139 1.00 0.00 N ATOM 115 C5 G A 4 1.668 4.804 8.884 1.00 0.00 C ATOM 116 C6 G A 4 0.350 4.280 8.703 1.00 0.00 C ATOM 117 O6 G A 4 -0.024 3.108 8.715 1.00 0.00 O ATOM 118 N1 G A 4 -0.572 5.293 8.497 1.00 0.00 N ATOM 119 C2 G A 4 -0.283 6.636 8.448 1.00 0.00 C ATOM 120 N2 G A 4 -1.314 7.462 8.236 1.00 0.00 N ATOM 121 N3 G A 4 0.946 7.132 8.599 1.00 0.00 N ATOM 122 C4 G A 4 1.869 6.163 8.818 1.00 0.00 C ATOM 0 H5' G A 4 7.867 7.514 9.583 1.00 0.00 H new ATOM 0 H5'' G A 4 7.634 8.116 11.212 1.00 0.00 H new ATOM 0 H4' G A 4 6.120 9.227 9.750 1.00 0.00 H new ATOM 0 H3' G A 4 4.793 7.151 11.594 1.00 0.00 H new ATOM 0 H2' G A 4 2.685 8.234 10.759 1.00 0.00 H new ATOM 0 HO2' G A 4 4.250 10.306 10.543 1.00 0.00 H new ATOM 0 H1' G A 4 3.499 8.211 8.114 1.00 0.00 H new ATOM 0 H8 G A 4 4.794 4.949 9.409 1.00 0.00 H new ATOM 0 H1 G A 4 -1.547 5.020 8.371 1.00 0.00 H new ATOM 0 H21 G A 4 -1.159 8.469 8.190 1.00 0.00 H new ATOM 0 H22 G A 4 -2.254 7.084 8.120 1.00 0.00 H new ATOM 134 P U A 5 4.371 8.872 13.546 1.00 0.00 P ATOM 135 OP1 U A 5 4.643 10.094 14.336 1.00 0.00 O ATOM 136 OP2 U A 5 4.741 7.548 14.092 1.00 0.00 O ATOM 137 O5' U A 5 2.804 8.840 13.193 1.00 0.00 O ATOM 138 C5' U A 5 2.112 10.005 12.797 1.00 0.00 C ATOM 139 C4' U A 5 0.657 9.632 12.505 1.00 0.00 C ATOM 140 O4' U A 5 0.559 8.670 11.458 1.00 0.00 O ATOM 141 C3' U A 5 0.004 9.000 13.721 1.00 0.00 C ATOM 142 O3' U A 5 -0.500 9.971 14.629 1.00 0.00 O ATOM 143 C2' U A 5 -1.089 8.192 13.103 1.00 0.00 C ATOM 144 O2' U A 5 -2.211 9.012 12.852 1.00 0.00 O ATOM 145 C1' U A 5 -0.493 7.752 11.782 1.00 0.00 C ATOM 146 N1 U A 5 0.037 6.371 11.853 1.00 0.00 N ATOM 147 C2 U A 5 -0.859 5.333 11.651 1.00 0.00 C ATOM 148 O2 U A 5 -2.054 5.535 11.453 1.00 0.00 O ATOM 149 N3 U A 5 -0.333 4.050 11.679 1.00 0.00 N ATOM 150 C4 U A 5 1.009 3.730 11.847 1.00 0.00 C ATOM 151 O4 U A 5 1.376 2.558 11.862 1.00 0.00 O ATOM 152 C5 U A 5 1.876 4.886 11.984 1.00 0.00 C ATOM 153 C6 U A 5 1.374 6.132 11.987 1.00 0.00 C ATOM 0 H5' U A 5 2.577 10.439 11.911 1.00 0.00 H new ATOM 0 H5'' U A 5 2.159 10.759 13.583 1.00 0.00 H new ATOM 0 H4' U A 5 0.162 10.561 12.223 1.00 0.00 H new ATOM 0 H3' U A 5 0.694 8.413 14.327 1.00 0.00 H new ATOM 0 H2' U A 5 -1.418 7.367 13.735 1.00 0.00 H new ATOM 0 HO2' U A 5 -2.065 9.896 13.248 1.00 0.00 H new ATOM 0 H1' U A 5 -1.266 7.754 11.014 1.00 0.00 H new ATOM 0 H3 U A 5 -0.987 3.275 11.567 1.00 0.00 H new ATOM 0 H5 U A 5 2.942 4.742 12.085 1.00 0.00 H new ATOM 0 H6 U A 5 2.048 6.969 12.099 1.00 0.00 H new ATOM 164 P U A 6 -1.053 9.543 16.092 1.00 0.00 P ATOM 165 OP1 U A 6 -1.243 10.777 16.885 1.00 0.00 O ATOM 166 OP2 U A 6 -0.173 8.472 16.609 1.00 0.00 O ATOM 167 O5' U A 6 -2.516 8.896 15.821 1.00 0.00 O ATOM 168 C5' U A 6 -3.667 9.713 15.657 1.00 0.00 C ATOM 169 C4' U A 6 -4.930 8.832 15.596 1.00 0.00 C ATOM 170 O4' U A 6 -4.938 8.003 14.440 1.00 0.00 O ATOM 171 C3' U A 6 -5.030 7.885 16.781 1.00 0.00 C ATOM 172 O3' U A 6 -5.534 8.504 17.949 1.00 0.00 O ATOM 173 C2' U A 6 -6.008 6.888 16.231 1.00 0.00 C ATOM 174 O2' U A 6 -7.309 7.436 16.240 1.00 0.00 O ATOM 175 C1' U A 6 -5.556 6.757 14.796 1.00 0.00 C ATOM 176 N1 U A 6 -4.577 5.661 14.652 1.00 0.00 N ATOM 177 C2 U A 6 -5.052 4.363 14.543 1.00 0.00 C ATOM 178 O2 U A 6 -6.247 4.091 14.636 1.00 0.00 O ATOM 179 N3 U A 6 -4.097 3.384 14.317 1.00 0.00 N ATOM 180 C4 U A 6 -2.733 3.593 14.180 1.00 0.00 C ATOM 181 O4 U A 6 -1.972 2.651 13.981 1.00 0.00 O ATOM 182 C5 U A 6 -2.339 4.978 14.291 1.00 0.00 C ATOM 183 C6 U A 6 -3.256 5.939 14.525 1.00 0.00 C ATOM 0 H5' U A 6 -3.579 10.302 14.744 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.744 10.418 16.485 1.00 0.00 H new ATOM 0 H4' U A 6 -5.762 9.537 15.589 1.00 0.00 H new ATOM 0 H3' U A 6 -4.071 7.482 17.107 1.00 0.00 H new ATOM 0 H2' U A 6 -6.036 5.953 16.790 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.324 8.234 16.808 1.00 0.00 H new ATOM 0 H1' U A 6 -6.404 6.530 14.150 1.00 0.00 H new ATOM 0 H3 U A 6 -4.428 2.422 14.245 1.00 0.00 H new ATOM 0 H5 U A 6 -1.298 5.247 14.185 1.00 0.00 H new ATOM 0 H6 U A 6 -2.927 6.964 14.614 1.00 0.00 H new ATOM 194 P C A 7 -5.476 7.742 19.376 1.00 0.00 P ATOM 195 OP1 C A 7 -6.160 8.590 20.377 1.00 0.00 O ATOM 196 OP2 C A 7 -4.076 7.323 19.606 1.00 0.00 O ATOM 197 O5' C A 7 -6.364 6.406 19.158 1.00 0.00 O ATOM 198 C5' C A 7 -7.778 6.451 19.176 1.00 0.00 C ATOM 199 C4' C A 7 -8.344 5.031 19.018 1.00 0.00 C ATOM 200 O4' C A 7 -7.958 4.424 17.778 1.00 0.00 O ATOM 201 C3' C A 7 -7.833 4.095 20.094 1.00 0.00 C ATOM 202 O3' C A 7 -8.508 4.268 21.327 1.00 0.00 O ATOM 203 C2' C A 7 -8.153 2.765 19.461 1.00 0.00 C ATOM 204 O2' C A 7 -9.538 2.507 19.565 1.00 0.00 O ATOM 205 C1' C A 7 -7.822 3.003 18.000 1.00 0.00 C ATOM 206 N1 C A 7 -6.439 2.554 17.686 1.00 0.00 N ATOM 207 C2 C A 7 -6.250 1.208 17.383 1.00 0.00 C ATOM 208 O2 C A 7 -7.194 0.421 17.428 1.00 0.00 O ATOM 209 N3 C A 7 -4.998 0.793 17.037 1.00 0.00 N ATOM 210 C4 C A 7 -3.975 1.658 16.988 1.00 0.00 C ATOM 211 N4 C A 7 -2.766 1.210 16.634 1.00 0.00 N ATOM 212 C5 C A 7 -4.158 3.047 17.294 1.00 0.00 C ATOM 213 C6 C A 7 -5.403 3.440 17.632 1.00 0.00 C ATOM 0 H5' C A 7 -8.141 7.089 18.371 1.00 0.00 H new ATOM 0 H5'' C A 7 -8.126 6.889 20.112 1.00 0.00 H new ATOM 0 H4' C A 7 -9.425 5.161 19.076 1.00 0.00 H new ATOM 0 H3' C A 7 -6.786 4.240 20.359 1.00 0.00 H new ATOM 0 H2' C A 7 -7.618 1.932 19.918 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.958 3.196 20.122 1.00 0.00 H new ATOM 0 H1' C A 7 -8.490 2.435 17.352 1.00 0.00 H new ATOM 0 H41 C A 7 -1.976 1.854 16.591 1.00 0.00 H new ATOM 0 H42 C A 7 -2.634 0.224 16.407 1.00 0.00 H new ATOM 0 H5 C A 7 -3.336 3.747 17.256 1.00 0.00 H new ATOM 0 H6 C A 7 -5.584 4.479 17.865 1.00 0.00 H new ATOM 225 P C A 8 -7.957 3.566 22.674 1.00 0.00 P ATOM 226 OP1 C A 8 -8.903 3.866 23.772 1.00 0.00 O ATOM 227 OP2 C A 8 -6.528 3.921 22.820 1.00 0.00 O ATOM 228 O5' C A 8 -8.046 1.991 22.352 1.00 0.00 O ATOM 229 C5' C A 8 -9.279 1.302 22.398 1.00 0.00 C ATOM 230 C4' C A 8 -9.051 -0.158 22.000 1.00 0.00 C ATOM 231 O4' C A 8 -8.513 -0.266 20.685 1.00 0.00 O ATOM 232 C3' C A 8 -8.032 -0.831 22.892 1.00 0.00 C ATOM 233 O3' C A 8 -8.577 -1.229 24.132 1.00 0.00 O ATOM 234 C2' C A 8 -7.658 -2.022 22.048 1.00 0.00 C ATOM 235 O2' C A 8 -8.622 -3.043 22.207 1.00 0.00 O ATOM 236 C1' C A 8 -7.731 -1.472 20.624 1.00 0.00 C ATOM 237 N1 C A 8 -6.352 -1.180 20.161 1.00 0.00 N ATOM 238 C2 C A 8 -5.621 -2.223 19.601 1.00 0.00 C ATOM 239 O2 C A 8 -6.137 -3.326 19.437 1.00 0.00 O ATOM 240 N3 C A 8 -4.325 -1.985 19.249 1.00 0.00 N ATOM 241 C4 C A 8 -3.769 -0.781 19.443 1.00 0.00 C ATOM 242 N4 C A 8 -2.496 -0.589 19.082 1.00 0.00 N ATOM 243 C5 C A 8 -4.507 0.294 20.034 1.00 0.00 C ATOM 244 C6 C A 8 -5.789 0.041 20.372 1.00 0.00 C ATOM 0 H5' C A 8 -9.996 1.768 21.722 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.703 1.357 23.401 1.00 0.00 H new ATOM 0 H4' C A 8 -10.031 -0.628 22.079 1.00 0.00 H new ATOM 0 H3' C A 8 -7.198 -0.187 23.171 1.00 0.00 H new ATOM 0 H2' C A 8 -6.688 -2.446 22.305 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.046 -2.959 23.087 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.882 -1.660 24.672 1.00 0.00 H new ATOM 0 H1' C A 8 -8.185 -2.179 19.930 1.00 0.00 H new ATOM 0 H41 C A 8 -2.058 0.321 19.223 1.00 0.00 H new ATOM 0 H42 C A 8 -1.963 -1.353 18.666 1.00 0.00 H new ATOM 0 H5 C A 8 -4.059 1.262 20.202 1.00 0.00 H new ATOM 0 H6 C A 8 -6.381 0.825 20.820 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.403 -8.900 16.256 1.00 0.00 O ATOM 259 C5' G B 9 2.799 -10.165 16.407 1.00 0.00 C ATOM 260 C4' G B 9 1.312 -10.002 16.729 1.00 0.00 C ATOM 261 O4' G B 9 1.114 -9.280 17.945 1.00 0.00 O ATOM 262 C3' G B 9 0.566 -9.205 15.676 1.00 0.00 C ATOM 263 O3' G B 9 0.281 -9.956 14.513 1.00 0.00 O ATOM 264 C2' G B 9 -0.683 -8.865 16.447 1.00 0.00 C ATOM 265 O2' G B 9 -1.520 -9.999 16.540 1.00 0.00 O ATOM 266 C1' G B 9 -0.127 -8.559 17.829 1.00 0.00 C ATOM 267 N9 G B 9 0.109 -7.106 17.960 1.00 0.00 N ATOM 268 C8 G B 9 1.279 -6.402 17.840 1.00 0.00 C ATOM 269 N7 G B 9 1.144 -5.117 18.016 1.00 0.00 N ATOM 270 C5 G B 9 -0.215 -4.955 18.271 1.00 0.00 C ATOM 271 C6 G B 9 -0.962 -3.771 18.540 1.00 0.00 C ATOM 272 O6 G B 9 -0.558 -2.613 18.606 1.00 0.00 O ATOM 273 N1 G B 9 -2.310 -4.051 18.744 1.00 0.00 N ATOM 274 C2 G B 9 -2.872 -5.308 18.690 1.00 0.00 C ATOM 275 N2 G B 9 -4.190 -5.387 18.901 1.00 0.00 N ATOM 276 N3 G B 9 -2.175 -6.420 18.439 1.00 0.00 N ATOM 277 C4 G B 9 -0.856 -6.169 18.239 1.00 0.00 C ATOM 0 H5' G B 9 3.293 -10.720 17.205 1.00 0.00 H new ATOM 0 H5'' G B 9 2.920 -10.746 15.493 1.00 0.00 H new ATOM 0 H4' G B 9 0.935 -11.023 16.788 1.00 0.00 H new ATOM 0 H3' G B 9 1.119 -8.352 15.283 1.00 0.00 H new ATOM 0 H2' G B 9 -1.267 -8.062 15.998 1.00 0.00 H new ATOM 0 HO2' G B 9 -2.328 -9.768 17.044 1.00 0.00 H new ATOM 0 HO5' G B 9 4.355 -9.014 16.052 1.00 0.00 H new ATOM 0 H1' G B 9 -0.823 -8.857 18.613 1.00 0.00 H new ATOM 0 H8 G B 9 2.227 -6.869 17.620 1.00 0.00 H new ATOM 0 H1 G B 9 -2.929 -3.266 18.949 1.00 0.00 H new ATOM 0 H21 G B 9 -4.658 -6.293 18.873 1.00 0.00 H new ATOM 0 H22 G B 9 -4.728 -4.541 19.090 1.00 0.00 H new ATOM 290 P G B 10 -0.306 -9.234 13.192 1.00 0.00 P ATOM 291 OP1 G B 10 -0.458 -10.260 12.137 1.00 0.00 O ATOM 292 OP2 G B 10 0.515 -8.031 12.931 1.00 0.00 O ATOM 293 O5' G B 10 -1.782 -8.745 13.632 1.00 0.00 O ATOM 294 C5' G B 10 -2.846 -9.667 13.750 1.00 0.00 C ATOM 295 C4' G B 10 -4.144 -8.934 14.111 1.00 0.00 C ATOM 296 O4' G B 10 -4.066 -8.254 15.366 1.00 0.00 O ATOM 297 C3' G B 10 -4.514 -7.869 13.103 1.00 0.00 C ATOM 298 O3' G B 10 -5.064 -8.399 11.912 1.00 0.00 O ATOM 299 C2' G B 10 -5.534 -7.113 13.906 1.00 0.00 C ATOM 300 O2' G B 10 -6.720 -7.871 14.021 1.00 0.00 O ATOM 301 C1' G B 10 -4.861 -7.056 15.260 1.00 0.00 C ATOM 302 N9 G B 10 -3.977 -5.884 15.360 1.00 0.00 N ATOM 303 C8 G B 10 -2.619 -5.836 15.230 1.00 0.00 C ATOM 304 N7 G B 10 -2.106 -4.653 15.427 1.00 0.00 N ATOM 305 C5 G B 10 -3.210 -3.855 15.716 1.00 0.00 C ATOM 306 C6 G B 10 -3.280 -2.467 16.039 1.00 0.00 C ATOM 307 O6 G B 10 -2.361 -1.655 16.123 1.00 0.00 O ATOM 308 N1 G B 10 -4.588 -2.062 16.280 1.00 0.00 N ATOM 309 C2 G B 10 -5.693 -2.884 16.226 1.00 0.00 C ATOM 310 N2 G B 10 -6.877 -2.319 16.488 1.00 0.00 N ATOM 311 N3 G B 10 -5.633 -4.188 15.927 1.00 0.00 N ATOM 312 C4 G B 10 -4.363 -4.604 15.683 1.00 0.00 C ATOM 0 H5' G B 10 -2.613 -10.407 14.516 1.00 0.00 H new ATOM 0 H5'' G B 10 -2.974 -10.208 12.812 1.00 0.00 H new ATOM 0 H4' G B 10 -4.888 -9.730 14.138 1.00 0.00 H new ATOM 0 H3' G B 10 -3.673 -7.281 12.736 1.00 0.00 H new ATOM 0 H2' G B 10 -5.808 -6.147 13.480 1.00 0.00 H new ATOM 0 HO2' G B 10 -7.378 -7.371 14.547 1.00 0.00 H new ATOM 0 H1' G B 10 -5.605 -6.980 16.053 1.00 0.00 H new ATOM 0 H8 G B 10 -2.022 -6.702 14.985 1.00 0.00 H new ATOM 0 H1 G B 10 -4.742 -1.081 16.515 1.00 0.00 H new ATOM 0 H21 G B 10 -7.727 -2.882 16.462 1.00 0.00 H new ATOM 0 H22 G B 10 -6.929 -1.326 16.714 1.00 0.00 H new ATOM 324 P A B 11 -5.253 -7.465 10.606 1.00 0.00 P ATOM 325 OP1 A B 11 -5.925 -8.268 9.560 1.00 0.00 O ATOM 326 OP2 A B 11 -3.953 -6.823 10.315 1.00 0.00 O ATOM 327 O5' A B 11 -6.277 -6.317 11.092 1.00 0.00 O ATOM 328 C5' A B 11 -7.650 -6.593 11.270 1.00 0.00 C ATOM 329 C4' A B 11 -8.382 -5.324 11.718 1.00 0.00 C ATOM 330 O4' A B 11 -7.888 -4.816 12.953 1.00 0.00 O ATOM 331 C3' A B 11 -8.250 -4.197 10.717 1.00 0.00 C ATOM 332 O3' A B 11 -9.128 -4.362 9.621 1.00 0.00 O ATOM 333 C2' A B 11 -8.642 -3.018 11.579 1.00 0.00 C ATOM 334 O2' A B 11 -10.040 -3.013 11.775 1.00 0.00 O ATOM 335 C1' A B 11 -7.988 -3.382 12.917 1.00 0.00 C ATOM 336 N9 A B 11 -6.633 -2.827 12.990 1.00 0.00 N ATOM 337 C8 A B 11 -5.448 -3.477 12.814 1.00 0.00 C ATOM 338 N7 A B 11 -4.397 -2.721 12.967 1.00 0.00 N ATOM 339 C5 A B 11 -4.933 -1.476 13.283 1.00 0.00 C ATOM 340 C6 A B 11 -4.347 -0.235 13.587 1.00 0.00 C ATOM 341 N6 A B 11 -3.025 -0.033 13.601 1.00 0.00 N ATOM 342 N1 A B 11 -5.171 0.787 13.888 1.00 0.00 N ATOM 343 C2 A B 11 -6.485 0.583 13.879 1.00 0.00 C ATOM 344 N3 A B 11 -7.155 -0.528 13.605 1.00 0.00 N ATOM 345 C4 A B 11 -6.299 -1.535 13.310 1.00 0.00 C ATOM 0 H5' A B 11 -7.779 -7.379 12.014 1.00 0.00 H new ATOM 0 H5'' A B 11 -8.080 -6.962 10.339 1.00 0.00 H new ATOM 0 H4' A B 11 -9.422 -5.636 11.817 1.00 0.00 H new ATOM 0 H3' A B 11 -7.267 -4.114 10.253 1.00 0.00 H new ATOM 0 H2' A B 11 -8.353 -2.055 11.159 1.00 0.00 H new ATOM 0 HO2' A B 11 -10.289 -2.248 12.335 1.00 0.00 H new ATOM 0 H1' A B 11 -8.576 -2.986 13.745 1.00 0.00 H new ATOM 0 H8 A B 11 -5.385 -4.527 12.569 1.00 0.00 H new ATOM 0 H61 A B 11 -2.652 0.889 13.829 1.00 0.00 H new ATOM 0 H62 A B 11 -2.389 -0.801 13.384 1.00 0.00 H new ATOM 0 H2 A B 11 -7.091 1.441 14.130 1.00 0.00 H new ATOM 357 P G B 12 -8.926 -3.515 8.265 1.00 0.00 P ATOM 358 OP1 G B 12 -10.068 -3.801 7.369 1.00 0.00 O ATOM 359 OP2 G B 12 -7.544 -3.744 7.788 1.00 0.00 O ATOM 360 O5' G B 12 -9.037 -1.985 8.748 1.00 0.00 O ATOM 361 C5' G B 12 -10.281 -1.417 9.103 1.00 0.00 C ATOM 362 C4' G B 12 -10.071 0.028 9.489 1.00 0.00 C ATOM 363 O4' G B 12 -9.241 0.130 10.634 1.00 0.00 O ATOM 364 C3' G B 12 -9.356 0.796 8.426 1.00 0.00 C ATOM 365 O3' G B 12 -10.201 1.117 7.336 1.00 0.00 O ATOM 366 C2' G B 12 -8.990 2.010 9.234 1.00 0.00 C ATOM 367 O2' G B 12 -10.133 2.816 9.454 1.00 0.00 O ATOM 368 C1' G B 12 -8.577 1.385 10.554 1.00 0.00 C ATOM 369 N9 G B 12 -7.113 1.203 10.614 1.00 0.00 N ATOM 370 C8 G B 12 -6.375 0.059 10.458 1.00 0.00 C ATOM 371 N7 G B 12 -5.088 0.234 10.605 1.00 0.00 N ATOM 372 C5 G B 12 -4.964 1.596 10.873 1.00 0.00 C ATOM 373 C6 G B 12 -3.799 2.388 11.121 1.00 0.00 C ATOM 374 O6 G B 12 -2.619 2.035 11.164 1.00 0.00 O ATOM 375 N1 G B 12 -4.127 3.720 11.327 1.00 0.00 N ATOM 376 C2 G B 12 -5.401 4.237 11.311 1.00 0.00 C ATOM 377 N2 G B 12 -5.517 5.551 11.532 1.00 0.00 N ATOM 378 N3 G B 12 -6.493 3.503 11.089 1.00 0.00 N ATOM 379 C4 G B 12 -6.201 2.195 10.876 1.00 0.00 C ATOM 0 H5' G B 12 -10.723 -1.968 9.933 1.00 0.00 H new ATOM 0 H5'' G B 12 -10.978 -1.486 8.268 1.00 0.00 H new ATOM 0 H4' G B 12 -11.070 0.428 9.661 1.00 0.00 H new ATOM 0 H3' G B 12 -8.525 0.277 7.948 1.00 0.00 H new ATOM 0 H2' G B 12 -8.236 2.639 8.762 1.00 0.00 H new ATOM 0 HO2' G B 12 -10.799 2.635 8.759 1.00 0.00 H new ATOM 0 H1' G B 12 -8.850 2.028 11.391 1.00 0.00 H new ATOM 0 H8 G B 12 -6.817 -0.901 10.234 1.00 0.00 H new ATOM 0 H1 G B 12 -3.360 4.369 11.505 1.00 0.00 H new ATOM 0 H21 G B 12 -6.438 5.989 11.532 1.00 0.00 H new ATOM 0 H22 G B 12 -4.684 6.115 11.701 1.00 0.00 H new ATOM 391 P U B 13 -9.590 1.601 5.923 1.00 0.00 P ATOM 392 OP1 U B 13 -10.705 2.078 5.076 1.00 0.00 O ATOM 393 OP2 U B 13 -8.697 0.532 5.426 1.00 0.00 O ATOM 394 O5' U B 13 -8.676 2.867 6.311 1.00 0.00 O ATOM 395 C5' U B 13 -9.244 4.113 6.657 1.00 0.00 C ATOM 396 C4' U B 13 -8.115 5.086 7.011 1.00 0.00 C ATOM 397 O4' U B 13 -7.341 4.614 8.111 1.00 0.00 O ATOM 398 C3' U B 13 -7.148 5.243 5.852 1.00 0.00 C ATOM 399 O3' U B 13 -7.592 6.205 4.902 1.00 0.00 O ATOM 400 C2' U B 13 -5.901 5.679 6.551 1.00 0.00 C ATOM 401 O2' U B 13 -5.951 7.066 6.804 1.00 0.00 O ATOM 402 C1' U B 13 -5.966 4.941 7.871 1.00 0.00 C ATOM 403 N1 U B 13 -5.142 3.710 7.849 1.00 0.00 N ATOM 404 C2 U B 13 -3.791 3.845 8.123 1.00 0.00 C ATOM 405 O2 U B 13 -3.279 4.940 8.339 1.00 0.00 O ATOM 406 N3 U B 13 -3.046 2.673 8.144 1.00 0.00 N ATOM 407 C4 U B 13 -3.551 1.392 7.957 1.00 0.00 C ATOM 408 O4 U B 13 -2.807 0.416 7.993 1.00 0.00 O ATOM 409 C5 U B 13 -4.984 1.351 7.736 1.00 0.00 C ATOM 410 C6 U B 13 -5.710 2.480 7.686 1.00 0.00 C ATOM 0 H5' U B 13 -9.922 3.997 7.502 1.00 0.00 H new ATOM 0 H5'' U B 13 -9.833 4.503 5.827 1.00 0.00 H new ATOM 0 H4' U B 13 -8.600 6.031 7.255 1.00 0.00 H new ATOM 0 H3' U B 13 -7.027 4.336 5.260 1.00 0.00 H new ATOM 0 H2' U B 13 -4.999 5.477 5.974 1.00 0.00 H new ATOM 0 HO2' U B 13 -6.653 7.474 6.255 1.00 0.00 H new ATOM 0 H1' U B 13 -5.568 5.572 8.666 1.00 0.00 H new ATOM 0 H3 U B 13 -2.043 2.760 8.311 1.00 0.00 H new ATOM 0 H5 U B 13 -5.475 0.397 7.610 1.00 0.00 H new ATOM 0 H6 U B 13 -6.774 2.412 7.512 1.00 0.00 H new ATOM 421 P U B 14 -6.836 6.391 3.477 1.00 0.00 P ATOM 422 OP1 U B 14 -7.697 7.226 2.611 1.00 0.00 O ATOM 423 OP2 U B 14 -6.415 5.050 3.014 1.00 0.00 O ATOM 424 O5' U B 14 -5.496 7.244 3.816 1.00 0.00 O ATOM 425 C5' U B 14 -5.525 8.662 3.915 1.00 0.00 C ATOM 426 C4' U B 14 -4.088 9.202 4.053 1.00 0.00 C ATOM 427 O4' U B 14 -3.461 8.734 5.240 1.00 0.00 O ATOM 428 C3' U B 14 -3.196 8.753 2.908 1.00 0.00 C ATOM 429 O3' U B 14 -3.355 9.543 1.746 1.00 0.00 O ATOM 430 C2' U B 14 -1.844 8.965 3.528 1.00 0.00 C ATOM 431 O2' U B 14 -1.528 10.342 3.539 1.00 0.00 O ATOM 432 C1' U B 14 -2.071 8.516 4.952 1.00 0.00 C ATOM 433 N1 U B 14 -1.745 7.083 5.113 1.00 0.00 N ATOM 434 C2 U B 14 -0.412 6.717 5.229 1.00 0.00 C ATOM 435 O2 U B 14 0.505 7.530 5.131 1.00 0.00 O ATOM 436 N3 U B 14 -0.169 5.373 5.470 1.00 0.00 N ATOM 437 C4 U B 14 -1.134 4.386 5.617 1.00 0.00 C ATOM 438 O4 U B 14 -0.812 3.220 5.826 1.00 0.00 O ATOM 439 C5 U B 14 -2.490 4.870 5.506 1.00 0.00 C ATOM 440 C6 U B 14 -2.739 6.172 5.258 1.00 0.00 C ATOM 0 H5' U B 14 -6.122 8.964 4.776 1.00 0.00 H new ATOM 0 H5'' U B 14 -6.001 9.088 3.032 1.00 0.00 H new ATOM 0 H4' U B 14 -4.195 10.287 4.062 1.00 0.00 H new ATOM 0 H3' U B 14 -3.400 7.741 2.558 1.00 0.00 H new ATOM 0 H2' U B 14 -1.041 8.444 3.006 1.00 0.00 H new ATOM 0 HO2' U B 14 -2.152 10.826 2.959 1.00 0.00 H new ATOM 0 H1' U B 14 -1.429 9.075 5.633 1.00 0.00 H new ATOM 0 H3 U B 14 0.806 5.084 5.546 1.00 0.00 H new ATOM 0 H5 U B 14 -3.314 4.182 5.623 1.00 0.00 H new ATOM 0 H6 U B 14 -3.764 6.500 5.172 1.00 0.00 H new ATOM 451 P C B 15 -2.714 9.075 0.336 1.00 0.00 P ATOM 452 OP1 C B 15 -2.956 10.146 -0.656 1.00 0.00 O ATOM 453 OP2 C B 15 -3.189 7.701 0.060 1.00 0.00 O ATOM 454 O5' C B 15 -1.123 9.002 0.619 1.00 0.00 O ATOM 455 C5' C B 15 -0.326 10.171 0.656 1.00 0.00 C ATOM 456 C4' C B 15 1.146 9.781 0.857 1.00 0.00 C ATOM 457 O4' C B 15 1.358 9.080 2.089 1.00 0.00 O ATOM 458 C3' C B 15 1.626 8.837 -0.224 1.00 0.00 C ATOM 459 O3' C B 15 1.928 9.509 -1.434 1.00 0.00 O ATOM 460 C2' C B 15 2.863 8.292 0.439 1.00 0.00 C ATOM 461 O2' C B 15 3.893 9.255 0.389 1.00 0.00 O ATOM 462 C1' C B 15 2.428 8.135 1.883 1.00 0.00 C ATOM 463 N1 C B 15 1.964 6.749 2.157 1.00 0.00 N ATOM 464 C2 C B 15 2.930 5.791 2.453 1.00 0.00 C ATOM 465 O2 C B 15 4.123 6.084 2.427 1.00 0.00 O ATOM 466 N3 C B 15 2.515 4.532 2.773 1.00 0.00 N ATOM 467 C4 C B 15 1.210 4.224 2.801 1.00 0.00 C ATOM 468 N4 C B 15 0.848 2.979 3.132 1.00 0.00 N ATOM 469 C5 C B 15 0.207 5.203 2.500 1.00 0.00 C ATOM 470 C6 C B 15 0.635 6.442 2.188 1.00 0.00 C ATOM 0 H5' C B 15 -0.655 10.823 1.466 1.00 0.00 H new ATOM 0 H5'' C B 15 -0.441 10.732 -0.271 1.00 0.00 H new ATOM 0 H4' C B 15 1.689 10.726 0.841 1.00 0.00 H new ATOM 0 H3' C B 15 0.896 8.088 -0.530 1.00 0.00 H new ATOM 0 H2' C B 15 3.231 7.377 -0.025 1.00 0.00 H new ATOM 0 HO2' C B 15 3.612 10.006 -0.175 1.00 0.00 H new ATOM 0 H1' C B 15 3.260 8.323 2.561 1.00 0.00 H new ATOM 0 H41 C B 15 -0.140 2.725 3.159 1.00 0.00 H new ATOM 0 H42 C B 15 1.560 2.284 3.357 1.00 0.00 H new ATOM 0 H5 C B 15 -0.845 4.958 2.522 1.00 0.00 H new ATOM 0 H6 C B 15 -0.090 7.209 1.957 1.00 0.00 H new ATOM 482 P C B 16 2.205 8.680 -2.792 1.00 0.00 P ATOM 483 OP1 C B 16 2.570 9.641 -3.856 1.00 0.00 O ATOM 484 OP2 C B 16 1.070 7.754 -2.999 1.00 0.00 O ATOM 485 O5' C B 16 3.507 7.798 -2.446 1.00 0.00 O ATOM 486 C5' C B 16 4.799 8.369 -2.437 1.00 0.00 C ATOM 487 C4' C B 16 5.813 7.295 -2.036 1.00 0.00 C ATOM 488 O4' C B 16 5.542 6.778 -0.734 1.00 0.00 O ATOM 489 C3' C B 16 5.749 6.094 -2.952 1.00 0.00 C ATOM 490 O3' C B 16 6.412 6.314 -4.179 1.00 0.00 O ATOM 491 C2' C B 16 6.452 5.060 -2.110 1.00 0.00 C ATOM 492 O2' C B 16 7.852 5.220 -2.217 1.00 0.00 O ATOM 493 C1' C B 16 6.009 5.418 -0.692 1.00 0.00 C ATOM 494 N1 C B 16 4.911 4.500 -0.298 1.00 0.00 N ATOM 495 C2 C B 16 5.259 3.269 0.245 1.00 0.00 C ATOM 496 O2 C B 16 6.439 2.990 0.446 1.00 0.00 O ATOM 497 N3 C B 16 4.261 2.386 0.535 1.00 0.00 N ATOM 498 C4 C B 16 2.978 2.696 0.297 1.00 0.00 C ATOM 499 N4 C B 16 2.029 1.804 0.599 1.00 0.00 N ATOM 500 C5 C B 16 2.610 3.953 -0.280 1.00 0.00 C ATOM 501 C6 C B 16 3.612 4.813 -0.557 1.00 0.00 C ATOM 0 H5' C B 16 4.837 9.204 -1.737 1.00 0.00 H new ATOM 0 H5'' C B 16 5.042 8.768 -3.422 1.00 0.00 H new ATOM 0 H4' C B 16 6.784 7.789 -2.084 1.00 0.00 H new ATOM 0 H3' C B 16 4.739 5.821 -3.257 1.00 0.00 H new ATOM 0 H2' C B 16 6.220 4.036 -2.401 1.00 0.00 H new ATOM 0 HO2' C B 16 8.070 5.627 -3.082 1.00 0.00 H new ATOM 0 HO3' C B 16 6.345 5.510 -4.736 1.00 0.00 H new ATOM 0 H1' C B 16 6.819 5.321 0.031 1.00 0.00 H new ATOM 0 H41 C B 16 1.048 2.024 0.424 1.00 0.00 H new ATOM 0 H42 C B 16 2.286 0.904 1.004 1.00 0.00 H new ATOM 0 H5 C B 16 1.579 4.201 -0.484 1.00 0.00 H new ATOM 0 H6 C B 16 3.378 5.772 -0.994 1.00 0.00 H new TER 514 C B 16