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= -0.25 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot 180:sc= -0.387 USER MOD Single : A 3 A O2' : rot -29:sc= 0.144 USER MOD Single : A 4 U O2' : rot 180:sc= -0.241 USER MOD Single : A 5 G O2' : rot -16:sc= 0.204 USER MOD Single : A 6 U O2' : rot -15:sc= -0.433 USER MOD Single : A 7 C O2' : rot 180:sc= -0.273 USER MOD Single : A 8 C O2' : rot -20:sc= 0.126 USER MOD Single : A 8 C O3' : rot 180:sc= 0.172 USER MOD Single : B 9 G O2' : rot 180:sc= -0.236 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 G O2' : rot 180:sc= -0.372 USER MOD Single : B 11 A O2' : rot -25:sc= 0.155 USER MOD Single : B 12 U O2' : rot 180:sc= -0.26 USER MOD Single : B 13 G O2' : rot -7:sc= 0.0926 USER MOD Single : B 14 U O2' : rot -15:sc= -0.425 USER MOD Single : B 15 C O2' : rot 180:sc= -0.292 USER MOD Single : B 16 C O2' : rot -28:sc= 0.117 USER MOD Single : B 16 C O3' : rot 180:sc= 0.144 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 5.383 -8.119 5.567 1.00 0.00 O ATOM 2 C5' G A 1 6.735 -8.516 5.647 1.00 0.00 C ATOM 3 C4' G A 1 7.643 -7.371 5.194 1.00 0.00 C ATOM 4 O4' G A 1 7.395 -7.017 3.834 1.00 0.00 O ATOM 5 C3' G A 1 7.415 -6.098 5.983 1.00 0.00 C ATOM 6 O3' G A 1 8.004 -6.141 7.270 1.00 0.00 O ATOM 7 C2' G A 1 8.098 -5.110 5.068 1.00 0.00 C ATOM 8 O2' G A 1 9.499 -5.248 5.174 1.00 0.00 O ATOM 9 C1' G A 1 7.657 -5.611 3.693 1.00 0.00 C ATOM 10 N9 G A 1 6.419 -4.909 3.292 1.00 0.00 N ATOM 11 C8 G A 1 5.125 -5.365 3.302 1.00 0.00 C ATOM 12 N7 G A 1 4.250 -4.485 2.901 1.00 0.00 N ATOM 13 C5 G A 1 5.016 -3.362 2.604 1.00 0.00 C ATOM 14 C6 G A 1 4.614 -2.081 2.124 1.00 0.00 C ATOM 15 O6 G A 1 3.480 -1.685 1.868 1.00 0.00 O ATOM 16 N1 G A 1 5.703 -1.233 1.953 1.00 0.00 N ATOM 17 C2 G A 1 7.015 -1.569 2.211 1.00 0.00 C ATOM 18 N2 G A 1 7.933 -0.622 1.993 1.00 0.00 N ATOM 19 N3 G A 1 7.396 -2.769 2.664 1.00 0.00 N ATOM 20 C4 G A 1 6.347 -3.614 2.837 1.00 0.00 C ATOM 0 H5' G A 1 6.903 -9.393 5.022 1.00 0.00 H new ATOM 0 H5'' G A 1 6.979 -8.802 6.670 1.00 0.00 H new ATOM 0 H4' G A 1 8.655 -7.746 5.344 1.00 0.00 H new ATOM 0 H3' G A 1 6.371 -5.876 6.206 1.00 0.00 H new ATOM 0 H2' G A 1 7.855 -4.068 5.279 1.00 0.00 H new ATOM 0 HO2' G A 1 9.937 -4.606 4.578 1.00 0.00 H new ATOM 0 HO5' G A 1 4.808 -8.857 5.857 1.00 0.00 H new ATOM 0 H1' G A 1 8.419 -5.428 2.936 1.00 0.00 H new ATOM 0 H8 G A 1 4.855 -6.363 3.614 1.00 0.00 H new ATOM 0 H1 G A 1 5.517 -0.290 1.611 1.00 0.00 H new ATOM 0 H21 G A 1 8.919 -0.817 2.168 1.00 0.00 H new ATOM 0 H22 G A 1 7.648 0.296 1.652 1.00 0.00 H new ATOM 33 P G A 2 7.629 -5.036 8.392 1.00 0.00 P ATOM 34 OP1 G A 2 8.383 -5.359 9.624 1.00 0.00 O ATOM 35 OP2 G A 2 6.155 -4.925 8.443 1.00 0.00 O ATOM 36 O5' G A 2 8.213 -3.658 7.795 1.00 0.00 O ATOM 37 C5' G A 2 9.601 -3.401 7.786 1.00 0.00 C ATOM 38 C4' G A 2 9.867 -2.040 7.137 1.00 0.00 C ATOM 39 O4' G A 2 9.356 -1.996 5.801 1.00 0.00 O ATOM 40 C3' G A 2 9.181 -0.895 7.858 1.00 0.00 C ATOM 41 O3' G A 2 9.849 -0.509 9.046 1.00 0.00 O ATOM 42 C2' G A 2 9.273 0.159 6.781 1.00 0.00 C ATOM 43 O2' G A 2 10.604 0.615 6.660 1.00 0.00 O ATOM 44 C1' G A 2 8.916 -0.652 5.542 1.00 0.00 C ATOM 45 N9 G A 2 7.446 -0.624 5.357 1.00 0.00 N ATOM 46 C8 G A 2 6.519 -1.591 5.653 1.00 0.00 C ATOM 47 N7 G A 2 5.290 -1.247 5.387 1.00 0.00 N ATOM 48 C5 G A 2 5.405 0.044 4.885 1.00 0.00 C ATOM 49 C6 G A 2 4.394 0.940 4.432 1.00 0.00 C ATOM 50 O6 G A 2 3.182 0.754 4.374 1.00 0.00 O ATOM 51 N1 G A 2 4.932 2.155 4.023 1.00 0.00 N ATOM 52 C2 G A 2 6.274 2.470 4.038 1.00 0.00 C ATOM 53 N2 G A 2 6.610 3.691 3.608 1.00 0.00 N ATOM 54 N3 G A 2 7.227 1.629 4.457 1.00 0.00 N ATOM 55 C4 G A 2 6.721 0.437 4.867 1.00 0.00 C ATOM 0 H5' G A 2 10.123 -4.185 7.237 1.00 0.00 H new ATOM 0 H5'' G A 2 9.990 -3.412 8.804 1.00 0.00 H new ATOM 0 H4' G A 2 10.950 -1.926 7.175 1.00 0.00 H new ATOM 0 H3' G A 2 8.175 -1.116 8.215 1.00 0.00 H new ATOM 0 H2' G A 2 8.649 1.034 6.960 1.00 0.00 H new ATOM 0 HO2' G A 2 10.654 1.297 5.958 1.00 0.00 H new ATOM 0 H1' G A 2 9.384 -0.254 4.641 1.00 0.00 H new ATOM 0 H8 G A 2 6.784 -2.552 6.069 1.00 0.00 H new ATOM 0 H1 G A 2 4.284 2.868 3.686 1.00 0.00 H new ATOM 0 H21 G A 2 7.589 3.977 3.598 1.00 0.00 H new ATOM 0 H22 G A 2 5.887 4.337 3.290 1.00 0.00 H new ATOM 67 P A A 3 9.115 0.427 10.149 1.00 0.00 P ATOM 68 OP1 A A 3 10.072 0.672 11.250 1.00 0.00 O ATOM 69 OP2 A A 3 7.795 -0.171 10.446 1.00 0.00 O ATOM 70 O5' A A 3 8.865 1.825 9.383 1.00 0.00 O ATOM 71 C5' A A 3 9.942 2.678 9.064 1.00 0.00 C ATOM 72 C4' A A 3 9.431 3.903 8.302 1.00 0.00 C ATOM 73 O4' A A 3 8.709 3.520 7.128 1.00 0.00 O ATOM 74 C3' A A 3 8.465 4.761 9.095 1.00 0.00 C ATOM 75 O3' A A 3 9.127 5.618 10.002 1.00 0.00 O ATOM 76 C2' A A 3 7.790 5.537 7.999 1.00 0.00 C ATOM 77 O2' A A 3 8.643 6.567 7.540 1.00 0.00 O ATOM 78 C1' A A 3 7.653 4.476 6.914 1.00 0.00 C ATOM 79 N9 A A 3 6.332 3.811 7.029 1.00 0.00 N ATOM 80 C8 A A 3 6.033 2.536 7.445 1.00 0.00 C ATOM 81 N7 A A 3 4.765 2.240 7.378 1.00 0.00 N ATOM 82 C5 A A 3 4.176 3.404 6.902 1.00 0.00 C ATOM 83 C6 A A 3 2.842 3.748 6.616 1.00 0.00 C ATOM 84 N6 A A 3 1.818 2.899 6.764 1.00 0.00 N ATOM 85 N1 A A 3 2.599 5.000 6.187 1.00 0.00 N ATOM 86 C2 A A 3 3.618 5.842 6.041 1.00 0.00 C ATOM 87 N3 A A 3 4.910 5.636 6.260 1.00 0.00 N ATOM 88 C4 A A 3 5.121 4.372 6.699 1.00 0.00 C ATOM 0 H5' A A 3 10.674 2.143 8.459 1.00 0.00 H new ATOM 0 H5'' A A 3 10.450 2.992 9.976 1.00 0.00 H new ATOM 0 H4' A A 3 10.337 4.466 8.077 1.00 0.00 H new ATOM 0 H3' A A 3 7.787 4.186 9.725 1.00 0.00 H new ATOM 0 H2' A A 3 6.854 6.008 8.298 1.00 0.00 H new ATOM 0 HO2' A A 3 9.231 6.854 8.269 1.00 0.00 H new ATOM 0 H1' A A 3 7.725 4.917 5.920 1.00 0.00 H new ATOM 0 H8 A A 3 6.781 1.841 7.796 1.00 0.00 H new ATOM 0 H61 A A 3 0.869 3.201 6.542 1.00 0.00 H new ATOM 0 H62 A A 3 1.986 1.950 7.099 1.00 0.00 H new ATOM 0 H2 A A 3 3.357 6.832 5.696 1.00 0.00 H new ATOM 100 P U A 4 8.722 5.639 11.555 1.00 0.00 P ATOM 101 OP1 U A 4 9.689 6.489 12.284 1.00 0.00 O ATOM 102 OP2 U A 4 8.473 4.250 11.996 1.00 0.00 O ATOM 103 O5' U A 4 7.317 6.416 11.477 1.00 0.00 O ATOM 104 C5' U A 4 7.279 7.788 11.135 1.00 0.00 C ATOM 105 C4' U A 4 5.841 8.218 10.844 1.00 0.00 C ATOM 106 O4' U A 4 5.318 7.518 9.718 1.00 0.00 O ATOM 107 C3' U A 4 4.890 7.916 11.983 1.00 0.00 C ATOM 108 O3' U A 4 4.992 8.868 13.027 1.00 0.00 O ATOM 109 C2' U A 4 3.567 7.998 11.257 1.00 0.00 C ATOM 110 O2' U A 4 3.217 9.350 11.052 1.00 0.00 O ATOM 111 C1' U A 4 3.903 7.374 9.900 1.00 0.00 C ATOM 112 N1 U A 4 3.524 5.940 9.888 1.00 0.00 N ATOM 113 C2 U A 4 2.192 5.644 9.647 1.00 0.00 C ATOM 114 O2 U A 4 1.358 6.525 9.447 1.00 0.00 O ATOM 115 N3 U A 4 1.848 4.301 9.640 1.00 0.00 N ATOM 116 C4 U A 4 2.715 3.242 9.861 1.00 0.00 C ATOM 117 O4 U A 4 2.303 2.085 9.845 1.00 0.00 O ATOM 118 C5 U A 4 4.089 3.640 10.091 1.00 0.00 C ATOM 119 C6 U A 4 4.447 4.946 10.095 1.00 0.00 C ATOM 0 H5' U A 4 7.905 7.970 10.262 1.00 0.00 H new ATOM 0 H5'' U A 4 7.687 8.385 11.950 1.00 0.00 H new ATOM 0 H4' U A 4 5.901 9.293 10.675 1.00 0.00 H new ATOM 0 H3' U A 4 5.070 6.968 12.490 1.00 0.00 H new ATOM 0 H2' U A 4 2.747 7.518 11.791 1.00 0.00 H new ATOM 0 HO2' U A 4 2.359 9.398 10.580 1.00 0.00 H new ATOM 0 H1' U A 4 3.355 7.865 9.096 1.00 0.00 H new ATOM 0 H3 U A 4 0.871 4.072 9.456 1.00 0.00 H new ATOM 0 H5 U A 4 4.840 2.883 10.262 1.00 0.00 H new ATOM 0 H6 U A 4 5.480 5.211 10.265 1.00 0.00 H new ATOM 130 P G A 5 4.220 8.646 14.426 1.00 0.00 P ATOM 131 OP1 G A 5 4.613 9.736 15.347 1.00 0.00 O ATOM 132 OP2 G A 5 4.410 7.236 14.834 1.00 0.00 O ATOM 133 O5' G A 5 2.670 8.851 14.042 1.00 0.00 O ATOM 134 C5' G A 5 2.139 10.143 13.821 1.00 0.00 C ATOM 135 C4' G A 5 0.653 10.024 13.475 1.00 0.00 C ATOM 136 O4' G A 5 0.457 9.238 12.306 1.00 0.00 O ATOM 137 C3' G A 5 -0.121 9.301 14.557 1.00 0.00 C ATOM 138 O3' G A 5 -0.407 10.136 15.670 1.00 0.00 O ATOM 139 C2' G A 5 -1.367 8.925 13.795 1.00 0.00 C ATOM 140 O2' G A 5 -2.256 10.020 13.771 1.00 0.00 O ATOM 141 C1' G A 5 -0.858 8.677 12.381 1.00 0.00 C ATOM 142 N9 G A 5 -0.826 7.226 12.124 1.00 0.00 N ATOM 143 C8 G A 5 0.224 6.359 12.228 1.00 0.00 C ATOM 144 N7 G A 5 -0.080 5.119 11.954 1.00 0.00 N ATOM 145 C5 G A 5 -1.439 5.169 11.653 1.00 0.00 C ATOM 146 C6 G A 5 -2.341 4.125 11.284 1.00 0.00 C ATOM 147 O6 G A 5 -2.112 2.927 11.125 1.00 0.00 O ATOM 148 N1 G A 5 -3.626 4.609 11.099 1.00 0.00 N ATOM 149 C2 G A 5 -4.010 5.922 11.233 1.00 0.00 C ATOM 150 N2 G A 5 -5.298 6.194 11.004 1.00 0.00 N ATOM 151 N3 G A 5 -3.170 6.906 11.568 1.00 0.00 N ATOM 152 C4 G A 5 -1.904 6.457 11.764 1.00 0.00 C ATOM 0 H5' G A 5 2.675 10.636 13.010 1.00 0.00 H new ATOM 0 H5'' G A 5 2.269 10.760 14.710 1.00 0.00 H new ATOM 0 H4' G A 5 0.306 11.049 13.347 1.00 0.00 H new ATOM 0 H3' G A 5 0.410 8.462 15.006 1.00 0.00 H new ATOM 0 H2' G A 5 -1.890 8.073 14.229 1.00 0.00 H new ATOM 0 HO2' G A 5 -1.993 10.670 14.455 1.00 0.00 H new ATOM 0 H1' G A 5 -1.504 9.135 11.633 1.00 0.00 H new ATOM 0 H8 G A 5 1.218 6.671 12.512 1.00 0.00 H new ATOM 0 H1 G A 5 -4.347 3.935 10.842 1.00 0.00 H new ATOM 0 H21 G A 5 -5.640 7.151 11.089 1.00 0.00 H new ATOM 0 H22 G A 5 -5.939 5.444 10.745 1.00 0.00 H new ATOM 164 P U A 6 -0.885 9.507 17.086 1.00 0.00 P ATOM 165 OP1 U A 6 -0.999 10.613 18.061 1.00 0.00 O ATOM 166 OP2 U A 6 -0.007 8.355 17.385 1.00 0.00 O ATOM 167 O5' U A 6 -2.372 8.938 16.803 1.00 0.00 O ATOM 168 C5' U A 6 -3.512 9.772 16.901 1.00 0.00 C ATOM 169 C4' U A 6 -4.785 8.940 16.675 1.00 0.00 C ATOM 170 O4' U A 6 -4.808 8.340 15.373 1.00 0.00 O ATOM 171 C3' U A 6 -4.906 7.778 17.647 1.00 0.00 C ATOM 172 O3' U A 6 -5.374 8.158 18.924 1.00 0.00 O ATOM 173 C2' U A 6 -5.922 6.937 16.922 1.00 0.00 C ATOM 174 O2' U A 6 -7.205 7.519 17.043 1.00 0.00 O ATOM 175 C1' U A 6 -5.470 7.062 15.480 1.00 0.00 C ATOM 176 N1 U A 6 -4.534 5.964 15.127 1.00 0.00 N ATOM 177 C2 U A 6 -5.077 4.803 14.592 1.00 0.00 C ATOM 178 O2 U A 6 -6.288 4.649 14.447 1.00 0.00 O ATOM 179 N3 U A 6 -4.175 3.818 14.227 1.00 0.00 N ATOM 180 C4 U A 6 -2.797 3.889 14.351 1.00 0.00 C ATOM 181 O4 U A 6 -2.091 2.941 14.018 1.00 0.00 O ATOM 182 C5 U A 6 -2.318 5.140 14.895 1.00 0.00 C ATOM 183 C6 U A 6 -3.182 6.112 15.264 1.00 0.00 C ATOM 0 H5' U A 6 -3.453 10.572 16.163 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.545 10.245 17.882 1.00 0.00 H new ATOM 0 H4' U A 6 -5.598 9.653 16.810 1.00 0.00 H new ATOM 0 H3' U A 6 -3.956 7.291 17.869 1.00 0.00 H new ATOM 0 H2' U A 6 -5.986 5.915 17.295 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.194 8.190 17.757 1.00 0.00 H new ATOM 0 H1' U A 6 -6.316 6.994 14.796 1.00 0.00 H new ATOM 0 H3 U A 6 -4.561 2.961 13.830 1.00 0.00 H new ATOM 0 H5 U A 6 -1.256 5.300 15.008 1.00 0.00 H new ATOM 0 H6 U A 6 -2.793 7.031 15.678 1.00 0.00 H new ATOM 194 P C A 7 -5.281 7.129 20.171 1.00 0.00 P ATOM 195 OP1 C A 7 -5.954 7.754 21.332 1.00 0.00 O ATOM 196 OP2 C A 7 -3.873 6.691 20.290 1.00 0.00 O ATOM 197 O5' C A 7 -6.162 5.852 19.707 1.00 0.00 O ATOM 198 C5' C A 7 -7.575 5.885 19.742 1.00 0.00 C ATOM 199 C4' C A 7 -8.144 4.527 19.307 1.00 0.00 C ATOM 200 O4' C A 7 -7.760 4.179 17.971 1.00 0.00 O ATOM 201 C3' C A 7 -7.630 3.389 20.161 1.00 0.00 C ATOM 202 O3' C A 7 -8.255 3.341 21.431 1.00 0.00 O ATOM 203 C2' C A 7 -8.015 2.215 19.291 1.00 0.00 C ATOM 204 O2' C A 7 -9.402 1.977 19.401 1.00 0.00 O ATOM 205 C1' C A 7 -7.722 2.738 17.884 1.00 0.00 C ATOM 206 N1 C A 7 -6.386 2.262 17.431 1.00 0.00 N ATOM 207 C2 C A 7 -6.282 0.928 17.044 1.00 0.00 C ATOM 208 O2 C A 7 -7.270 0.197 17.070 1.00 0.00 O ATOM 209 N3 C A 7 -5.067 0.464 16.641 1.00 0.00 N ATOM 210 C4 C A 7 -3.995 1.268 16.623 1.00 0.00 C ATOM 211 N4 C A 7 -2.822 0.774 16.217 1.00 0.00 N ATOM 212 C5 C A 7 -4.086 2.641 17.015 1.00 0.00 C ATOM 213 C6 C A 7 -5.298 3.092 17.403 1.00 0.00 C ATOM 0 H5' C A 7 -7.945 6.671 19.084 1.00 0.00 H new ATOM 0 H5'' C A 7 -7.916 6.126 20.749 1.00 0.00 H new ATOM 0 H4' C A 7 -9.223 4.649 19.400 1.00 0.00 H new ATOM 0 H3' C A 7 -6.571 3.449 20.410 1.00 0.00 H new ATOM 0 H2' C A 7 -7.495 1.293 19.549 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.649 1.216 18.835 1.00 0.00 H new ATOM 0 H1' C A 7 -8.451 2.377 17.159 1.00 0.00 H new ATOM 0 H41 C A 7 -1.996 1.372 16.197 1.00 0.00 H new ATOM 0 H42 C A 7 -2.752 -0.201 15.927 1.00 0.00 H new ATOM 0 H5 C A 7 -3.222 3.289 17.001 1.00 0.00 H new ATOM 0 H6 C A 7 -5.411 4.125 17.696 1.00 0.00 H new ATOM 225 P C A 8 -7.659 2.412 22.609 1.00 0.00 P ATOM 226 OP1 C A 8 -8.523 2.566 23.800 1.00 0.00 O ATOM 227 OP2 C A 8 -6.209 2.687 22.715 1.00 0.00 O ATOM 228 O5' C A 8 -7.838 0.911 22.052 1.00 0.00 O ATOM 229 C5' C A 8 -9.096 0.268 22.073 1.00 0.00 C ATOM 230 C4' C A 8 -8.940 -1.160 21.542 1.00 0.00 C ATOM 231 O4' C A 8 -8.480 -1.171 20.197 1.00 0.00 O ATOM 232 C3' C A 8 -7.889 -1.934 22.304 1.00 0.00 C ATOM 233 O3' C A 8 -8.344 -2.384 23.561 1.00 0.00 O ATOM 234 C2' C A 8 -7.617 -3.068 21.363 1.00 0.00 C ATOM 235 O2' C A 8 -8.627 -4.050 21.479 1.00 0.00 O ATOM 236 C1' C A 8 -7.721 -2.378 20.008 1.00 0.00 C ATOM 237 N1 C A 8 -6.354 -2.067 19.533 1.00 0.00 N ATOM 238 C2 C A 8 -5.660 -3.072 18.866 1.00 0.00 C ATOM 239 O2 C A 8 -6.207 -4.144 18.617 1.00 0.00 O ATOM 240 N3 C A 8 -4.368 -2.835 18.506 1.00 0.00 N ATOM 241 C4 C A 8 -3.777 -1.668 18.799 1.00 0.00 C ATOM 242 N4 C A 8 -2.508 -1.474 18.425 1.00 0.00 N ATOM 243 C5 C A 8 -4.475 -0.637 19.507 1.00 0.00 C ATOM 244 C6 C A 8 -5.754 -0.882 19.846 1.00 0.00 C ATOM 0 H5' C A 8 -9.810 0.820 21.462 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.492 0.250 23.088 1.00 0.00 H new ATOM 0 H4' C A 8 -9.930 -1.605 21.645 1.00 0.00 H new ATOM 0 H3' C A 8 -7.010 -1.342 22.557 1.00 0.00 H new ATOM 0 H2' C A 8 -6.668 -3.575 21.539 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.088 -3.945 22.337 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.627 -2.879 24.010 1.00 0.00 H new ATOM 0 H1' C A 8 -8.212 -3.009 19.268 1.00 0.00 H new ATOM 0 H41 C A 8 -2.042 -0.592 18.639 1.00 0.00 H new ATOM 0 H42 C A 8 -2.006 -2.208 17.925 1.00 0.00 H new ATOM 0 H5 C A 8 -3.995 0.297 19.758 1.00 0.00 H new ATOM 0 H6 C A 8 -6.316 -0.127 20.376 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 2.457 -9.427 13.666 1.00 0.00 O ATOM 259 C5' G B 9 1.844 -10.698 13.617 1.00 0.00 C ATOM 260 C4' G B 9 0.403 -10.612 14.132 1.00 0.00 C ATOM 261 O4' G B 9 0.360 -10.199 15.496 1.00 0.00 O ATOM 262 C3' G B 9 -0.433 -9.593 13.385 1.00 0.00 C ATOM 263 O3' G B 9 -0.837 -10.050 12.108 1.00 0.00 O ATOM 264 C2' G B 9 -1.588 -9.464 14.347 1.00 0.00 C ATOM 265 O2' G B 9 -2.412 -10.608 14.262 1.00 0.00 O ATOM 266 C1' G B 9 -0.866 -9.476 15.695 1.00 0.00 C ATOM 267 N9 G B 9 -0.565 -8.087 16.101 1.00 0.00 N ATOM 268 C8 G B 9 0.630 -7.414 16.059 1.00 0.00 C ATOM 269 N7 G B 9 0.559 -6.180 16.475 1.00 0.00 N ATOM 270 C5 G B 9 -0.780 -6.020 16.819 1.00 0.00 C ATOM 271 C6 G B 9 -1.463 -4.878 17.334 1.00 0.00 C ATOM 272 O6 G B 9 -1.005 -3.767 17.588 1.00 0.00 O ATOM 273 N1 G B 9 -2.811 -5.141 17.547 1.00 0.00 N ATOM 274 C2 G B 9 -3.432 -6.346 17.296 1.00 0.00 C ATOM 275 N2 G B 9 -4.742 -6.415 17.556 1.00 0.00 N ATOM 276 N3 G B 9 -2.796 -7.418 16.810 1.00 0.00 N ATOM 277 C4 G B 9 -1.476 -7.184 16.596 1.00 0.00 C ATOM 0 H5' G B 9 2.412 -11.407 14.220 1.00 0.00 H new ATOM 0 H5'' G B 9 1.850 -11.073 12.594 1.00 0.00 H new ATOM 0 H4' G B 9 0.006 -11.617 13.990 1.00 0.00 H new ATOM 0 H3' G B 9 0.079 -8.660 13.151 1.00 0.00 H new ATOM 0 H2' G B 9 -2.219 -8.593 14.170 1.00 0.00 H new ATOM 0 HO2' G B 9 -3.160 -10.520 14.889 1.00 0.00 H new ATOM 0 HO5' G B 9 3.377 -9.495 13.336 1.00 0.00 H new ATOM 0 H1' G B 9 -1.475 -9.939 16.471 1.00 0.00 H new ATOM 0 H8 G B 9 1.548 -7.866 15.712 1.00 0.00 H new ATOM 0 H1 G B 9 -3.385 -4.384 17.918 1.00 0.00 H new ATOM 0 H21 G B 9 -5.250 -7.283 17.388 1.00 0.00 H new ATOM 0 H22 G B 9 -5.233 -5.599 17.922 1.00 0.00 H new ATOM 290 P G B 10 -1.452 -9.024 11.019 1.00 0.00 P ATOM 291 OP1 G B 10 -1.753 -9.788 9.788 1.00 0.00 O ATOM 292 OP2 G B 10 -0.558 -7.847 10.951 1.00 0.00 O ATOM 293 O5' G B 10 -2.849 -8.553 11.670 1.00 0.00 O ATOM 294 C5' G B 10 -3.961 -9.423 11.709 1.00 0.00 C ATOM 295 C4' G B 10 -5.133 -8.724 12.402 1.00 0.00 C ATOM 296 O4' G B 10 -4.786 -8.325 13.731 1.00 0.00 O ATOM 297 C3' G B 10 -5.556 -7.446 11.705 1.00 0.00 C ATOM 298 O3' G B 10 -6.326 -7.681 10.539 1.00 0.00 O ATOM 299 C2' G B 10 -6.371 -6.823 12.812 1.00 0.00 C ATOM 300 O2' G B 10 -7.593 -7.515 12.963 1.00 0.00 O ATOM 301 C1' G B 10 -5.492 -7.107 14.024 1.00 0.00 C ATOM 302 N9 G B 10 -4.533 -5.991 14.195 1.00 0.00 N ATOM 303 C8 G B 10 -3.202 -5.936 13.865 1.00 0.00 C ATOM 304 N7 G B 10 -2.637 -4.792 14.131 1.00 0.00 N ATOM 305 C5 G B 10 -3.665 -4.027 14.669 1.00 0.00 C ATOM 306 C6 G B 10 -3.653 -2.682 15.139 1.00 0.00 C ATOM 307 O6 G B 10 -2.708 -1.899 15.182 1.00 0.00 O ATOM 308 N1 G B 10 -4.908 -2.283 15.585 1.00 0.00 N ATOM 309 C2 G B 10 -6.034 -3.078 15.589 1.00 0.00 C ATOM 310 N2 G B 10 -7.159 -2.524 16.055 1.00 0.00 N ATOM 311 N3 G B 10 -6.048 -4.344 15.154 1.00 0.00 N ATOM 312 C4 G B 10 -4.832 -4.751 14.708 1.00 0.00 C ATOM 0 H5' G B 10 -3.702 -10.337 12.243 1.00 0.00 H new ATOM 0 H5'' G B 10 -4.244 -9.714 10.697 1.00 0.00 H new ATOM 0 H4' G B 10 -5.938 -9.458 12.384 1.00 0.00 H new ATOM 0 H3' G B 10 -4.735 -6.837 11.327 1.00 0.00 H new ATOM 0 H2' G B 10 -6.614 -5.773 12.649 1.00 0.00 H new ATOM 0 HO2' G B 10 -8.114 -7.105 13.684 1.00 0.00 H new ATOM 0 H1' G B 10 -6.074 -7.203 14.940 1.00 0.00 H new ATOM 0 H8 G B 10 -2.670 -6.766 13.424 1.00 0.00 H new ATOM 0 H1 G B 10 -5.003 -1.330 15.936 1.00 0.00 H new ATOM 0 H21 G B 10 -8.022 -3.067 16.081 1.00 0.00 H new ATOM 0 H22 G B 10 -7.154 -1.559 16.384 1.00 0.00 H new ATOM 324 P A B 11 -6.567 -6.504 9.449 1.00 0.00 P ATOM 325 OP1 A B 11 -7.428 -7.046 8.374 1.00 0.00 O ATOM 326 OP2 A B 11 -5.250 -5.923 9.109 1.00 0.00 O ATOM 327 O5' A B 11 -7.411 -5.385 10.249 1.00 0.00 O ATOM 328 C5' A B 11 -8.757 -5.611 10.608 1.00 0.00 C ATOM 329 C4' A B 11 -9.297 -4.409 11.387 1.00 0.00 C ATOM 330 O4' A B 11 -8.494 -4.134 12.538 1.00 0.00 O ATOM 331 C3' A B 11 -9.301 -3.118 10.593 1.00 0.00 C ATOM 332 O3' A B 11 -10.397 -3.034 9.705 1.00 0.00 O ATOM 333 C2' A B 11 -9.407 -2.102 11.696 1.00 0.00 C ATOM 334 O2' A B 11 -10.734 -2.058 12.180 1.00 0.00 O ATOM 335 C1' A B 11 -8.505 -2.712 12.763 1.00 0.00 C ATOM 336 N9 A B 11 -7.132 -2.167 12.633 1.00 0.00 N ATOM 337 C8 A B 11 -5.984 -2.793 12.214 1.00 0.00 C ATOM 338 N7 A B 11 -4.919 -2.042 12.270 1.00 0.00 N ATOM 339 C5 A B 11 -5.395 -0.825 12.742 1.00 0.00 C ATOM 340 C6 A B 11 -4.764 0.401 13.017 1.00 0.00 C ATOM 341 N6 A B 11 -3.450 0.601 12.860 1.00 0.00 N ATOM 342 N1 A B 11 -5.536 1.418 13.445 1.00 0.00 N ATOM 343 C2 A B 11 -6.842 1.217 13.600 1.00 0.00 C ATOM 344 N3 A B 11 -7.547 0.113 13.391 1.00 0.00 N ATOM 345 C4 A B 11 -6.746 -0.887 12.953 1.00 0.00 C ATOM 0 H5' A B 11 -8.834 -6.513 11.215 1.00 0.00 H new ATOM 0 H5'' A B 11 -9.358 -5.776 9.714 1.00 0.00 H new ATOM 0 H4' A B 11 -10.316 -4.698 11.642 1.00 0.00 H new ATOM 0 H3' A B 11 -8.433 -2.998 9.945 1.00 0.00 H new ATOM 0 H2' A B 11 -9.139 -1.089 11.397 1.00 0.00 H new ATOM 0 HO2' A B 11 -11.348 -2.363 11.480 1.00 0.00 H new ATOM 0 H1' A B 11 -8.868 -2.479 13.764 1.00 0.00 H new ATOM 0 H8 A B 11 -5.965 -3.816 11.869 1.00 0.00 H new ATOM 0 H61 A B 11 -3.044 1.512 13.075 1.00 0.00 H new ATOM 0 H62 A B 11 -2.855 -0.157 12.526 1.00 0.00 H new ATOM 0 H2 A B 11 -7.406 2.071 13.944 1.00 0.00 H new ATOM 357 P U B 12 -10.167 -2.735 8.145 1.00 0.00 P ATOM 358 OP1 U B 12 -11.459 -2.884 7.440 1.00 0.00 O ATOM 359 OP2 U B 12 -8.980 -3.491 7.690 1.00 0.00 O ATOM 360 O5' U B 12 -9.793 -1.172 8.201 1.00 0.00 O ATOM 361 C5' U B 12 -10.777 -0.215 8.541 1.00 0.00 C ATOM 362 C4' U B 12 -10.118 1.137 8.814 1.00 0.00 C ATOM 363 O4' U B 12 -9.243 1.056 9.936 1.00 0.00 O ATOM 364 C3' U B 12 -9.257 1.619 7.667 1.00 0.00 C ATOM 365 O3' U B 12 -10.028 2.170 6.615 1.00 0.00 O ATOM 366 C2' U B 12 -8.428 2.661 8.378 1.00 0.00 C ATOM 367 O2' U B 12 -9.197 3.827 8.574 1.00 0.00 O ATOM 368 C1' U B 12 -8.187 2.006 9.742 1.00 0.00 C ATOM 369 N1 U B 12 -6.869 1.325 9.755 1.00 0.00 N ATOM 370 C2 U B 12 -5.757 2.117 9.983 1.00 0.00 C ATOM 371 O2 U B 12 -5.851 3.328 10.170 1.00 0.00 O ATOM 372 N3 U B 12 -4.530 1.471 9.990 1.00 0.00 N ATOM 373 C4 U B 12 -4.326 0.116 9.780 1.00 0.00 C ATOM 374 O4 U B 12 -3.192 -0.354 9.794 1.00 0.00 O ATOM 375 C5 U B 12 -5.544 -0.638 9.563 1.00 0.00 C ATOM 376 C6 U B 12 -6.753 -0.028 9.560 1.00 0.00 C ATOM 0 H5' U B 12 -11.328 -0.545 9.422 1.00 0.00 H new ATOM 0 H5'' U B 12 -11.499 -0.120 7.730 1.00 0.00 H new ATOM 0 H4' U B 12 -10.948 1.824 8.979 1.00 0.00 H new ATOM 0 H3' U B 12 -8.679 0.840 7.169 1.00 0.00 H new ATOM 0 H2' U B 12 -7.523 2.942 7.839 1.00 0.00 H new ATOM 0 HO2' U B 12 -8.657 4.501 9.036 1.00 0.00 H new ATOM 0 H1' U B 12 -8.181 2.748 10.540 1.00 0.00 H new ATOM 0 H3 U B 12 -3.704 2.044 10.165 1.00 0.00 H new ATOM 0 H5 U B 12 -5.487 -1.704 9.401 1.00 0.00 H new ATOM 0 H6 U B 12 -7.643 -0.618 9.401 1.00 0.00 H new ATOM 387 P G B 13 -9.341 2.582 5.214 1.00 0.00 P ATOM 388 OP1 G B 13 -10.409 3.012 4.285 1.00 0.00 O ATOM 389 OP2 G B 13 -8.421 1.492 4.820 1.00 0.00 O ATOM 390 O5' G B 13 -8.455 3.873 5.591 1.00 0.00 O ATOM 391 C5' G B 13 -9.059 5.135 5.801 1.00 0.00 C ATOM 392 C4' G B 13 -7.975 6.160 6.144 1.00 0.00 C ATOM 393 O4' G B 13 -7.263 5.785 7.318 1.00 0.00 O ATOM 394 C3' G B 13 -6.918 6.242 5.063 1.00 0.00 C ATOM 395 O3' G B 13 -7.340 7.009 3.946 1.00 0.00 O ATOM 396 C2' G B 13 -5.802 6.916 5.822 1.00 0.00 C ATOM 397 O2' G B 13 -6.003 8.314 5.833 1.00 0.00 O ATOM 398 C1' G B 13 -5.963 6.383 7.239 1.00 0.00 C ATOM 399 N9 G B 13 -4.909 5.388 7.504 1.00 0.00 N ATOM 400 C8 G B 13 -4.965 4.028 7.403 1.00 0.00 C ATOM 401 N7 G B 13 -3.840 3.426 7.680 1.00 0.00 N ATOM 402 C5 G B 13 -2.969 4.470 7.980 1.00 0.00 C ATOM 403 C6 G B 13 -1.590 4.445 8.350 1.00 0.00 C ATOM 404 O6 G B 13 -0.852 3.474 8.510 1.00 0.00 O ATOM 405 N1 G B 13 -1.092 5.724 8.536 1.00 0.00 N ATOM 406 C2 G B 13 -1.812 6.887 8.399 1.00 0.00 C ATOM 407 N2 G B 13 -1.154 8.028 8.629 1.00 0.00 N ATOM 408 N3 G B 13 -3.104 6.919 8.060 1.00 0.00 N ATOM 409 C4 G B 13 -3.616 5.677 7.865 1.00 0.00 C ATOM 0 H5' G B 13 -9.787 5.073 6.610 1.00 0.00 H new ATOM 0 H5'' G B 13 -9.601 5.446 4.908 1.00 0.00 H new ATOM 0 H4' G B 13 -8.503 7.106 6.266 1.00 0.00 H new ATOM 0 H3' G B 13 -6.655 5.281 4.620 1.00 0.00 H new ATOM 0 H2' G B 13 -4.820 6.724 5.389 1.00 0.00 H new ATOM 0 HO2' G B 13 -6.758 8.541 5.251 1.00 0.00 H new ATOM 0 H1' G B 13 -5.871 7.176 7.982 1.00 0.00 H new ATOM 0 H8 G B 13 -5.861 3.496 7.119 1.00 0.00 H new ATOM 0 H1 G B 13 -0.110 5.810 8.796 1.00 0.00 H new ATOM 0 H21 G B 13 -1.638 8.922 8.542 1.00 0.00 H new ATOM 0 H22 G B 13 -0.169 8.004 8.891 1.00 0.00 H new ATOM 421 P U B 14 -6.516 6.974 2.553 1.00 0.00 P ATOM 422 OP1 U B 14 -7.242 7.811 1.572 1.00 0.00 O ATOM 423 OP2 U B 14 -6.229 5.558 2.235 1.00 0.00 O ATOM 424 O5' U B 14 -5.110 7.702 2.886 1.00 0.00 O ATOM 425 C5' U B 14 -4.998 9.112 2.906 1.00 0.00 C ATOM 426 C4' U B 14 -3.532 9.517 3.144 1.00 0.00 C ATOM 427 O4' U B 14 -3.062 9.089 4.429 1.00 0.00 O ATOM 428 C3' U B 14 -2.578 8.886 2.143 1.00 0.00 C ATOM 429 O3' U B 14 -2.554 9.542 0.892 1.00 0.00 O ATOM 430 C2' U B 14 -1.274 9.067 2.874 1.00 0.00 C ATOM 431 O2' U B 14 -0.868 10.419 2.810 1.00 0.00 O ATOM 432 C1' U B 14 -1.664 8.749 4.304 1.00 0.00 C ATOM 433 N1 U B 14 -1.461 7.308 4.598 1.00 0.00 N ATOM 434 C2 U B 14 -0.238 6.925 5.132 1.00 0.00 C ATOM 435 O2 U B 14 0.680 7.723 5.312 1.00 0.00 O ATOM 436 N3 U B 14 -0.106 5.586 5.456 1.00 0.00 N ATOM 437 C4 U B 14 -1.074 4.609 5.296 1.00 0.00 C ATOM 438 O4 U B 14 -0.841 3.442 5.600 1.00 0.00 O ATOM 439 C5 U B 14 -2.321 5.100 4.754 1.00 0.00 C ATOM 440 C6 U B 14 -2.469 6.402 4.421 1.00 0.00 C ATOM 0 H5' U B 14 -5.631 9.525 3.692 1.00 0.00 H new ATOM 0 H5'' U B 14 -5.351 9.527 1.962 1.00 0.00 H new ATOM 0 H4' U B 14 -3.536 10.603 3.052 1.00 0.00 H new ATOM 0 H3' U B 14 -2.840 7.862 1.878 1.00 0.00 H new ATOM 0 H2' U B 14 -0.463 8.459 2.474 1.00 0.00 H new ATOM 0 HO2' U B 14 -1.381 10.882 2.115 1.00 0.00 H new ATOM 0 H1' U B 14 -1.050 9.311 5.008 1.00 0.00 H new ATOM 0 H3 U B 14 0.788 5.291 5.849 1.00 0.00 H new ATOM 0 H5 U B 14 -3.146 4.417 4.613 1.00 0.00 H new ATOM 0 H6 U B 14 -3.408 6.735 4.004 1.00 0.00 H new ATOM 451 P C B 15 -1.843 8.847 -0.386 1.00 0.00 P ATOM 452 OP1 C B 15 -1.860 9.816 -1.504 1.00 0.00 O ATOM 453 OP2 C B 15 -2.451 7.510 -0.568 1.00 0.00 O ATOM 454 O5' C B 15 -0.305 8.635 0.074 1.00 0.00 O ATOM 455 C5' C B 15 0.611 9.713 0.087 1.00 0.00 C ATOM 456 C4' C B 15 2.001 9.218 0.513 1.00 0.00 C ATOM 457 O4' C B 15 1.997 8.648 1.827 1.00 0.00 O ATOM 458 C3' C B 15 2.518 8.112 -0.381 1.00 0.00 C ATOM 459 O3' C B 15 2.977 8.595 -1.630 1.00 0.00 O ATOM 460 C2' C B 15 3.646 7.588 0.477 1.00 0.00 C ATOM 461 O2' C B 15 4.744 8.471 0.409 1.00 0.00 O ATOM 462 C1' C B 15 3.051 7.662 1.885 1.00 0.00 C ATOM 463 N1 C B 15 2.522 6.329 2.284 1.00 0.00 N ATOM 464 C2 C B 15 3.452 5.356 2.642 1.00 0.00 C ATOM 465 O2 C B 15 4.654 5.615 2.636 1.00 0.00 O ATOM 466 N3 C B 15 2.995 4.122 2.993 1.00 0.00 N ATOM 467 C4 C B 15 1.683 3.848 2.989 1.00 0.00 C ATOM 468 N4 C B 15 1.276 2.626 3.344 1.00 0.00 N ATOM 469 C5 C B 15 0.716 4.837 2.625 1.00 0.00 C ATOM 470 C6 C B 15 1.180 6.059 2.289 1.00 0.00 C ATOM 0 H5' C B 15 0.265 10.486 0.773 1.00 0.00 H new ATOM 0 H5'' C B 15 0.665 10.167 -0.903 1.00 0.00 H new ATOM 0 H4' C B 15 2.627 10.109 0.459 1.00 0.00 H new ATOM 0 H3' C B 15 1.772 7.370 -0.664 1.00 0.00 H new ATOM 0 H2' C B 15 3.992 6.597 0.182 1.00 0.00 H new ATOM 0 HO2' C B 15 5.474 8.129 0.967 1.00 0.00 H new ATOM 0 H1' C B 15 3.798 7.942 2.628 1.00 0.00 H new ATOM 0 H41 C B 15 0.281 2.400 3.347 1.00 0.00 H new ATOM 0 H42 C B 15 1.960 1.919 3.612 1.00 0.00 H new ATOM 0 H5 C B 15 -0.341 4.615 2.619 1.00 0.00 H new ATOM 0 H6 C B 15 0.481 6.837 2.020 1.00 0.00 H new ATOM 482 P C B 16 3.290 7.577 -2.844 1.00 0.00 P ATOM 483 OP1 C B 16 3.759 8.369 -4.002 1.00 0.00 O ATOM 484 OP2 C B 16 2.125 6.678 -2.994 1.00 0.00 O ATOM 485 O5' C B 16 4.529 6.697 -2.308 1.00 0.00 O ATOM 486 C5' C B 16 5.843 7.215 -2.297 1.00 0.00 C ATOM 487 C4' C B 16 6.806 6.132 -1.802 1.00 0.00 C ATOM 488 O4' C B 16 6.508 5.733 -0.471 1.00 0.00 O ATOM 489 C3' C B 16 6.690 4.859 -2.608 1.00 0.00 C ATOM 490 O3' C B 16 7.321 4.948 -3.867 1.00 0.00 O ATOM 491 C2' C B 16 7.366 3.875 -1.702 1.00 0.00 C ATOM 492 O2' C B 16 8.770 3.995 -1.809 1.00 0.00 O ATOM 493 C1' C B 16 6.911 4.360 -0.329 1.00 0.00 C ATOM 494 N1 C B 16 5.771 3.523 0.111 1.00 0.00 N ATOM 495 C2 C B 16 6.063 2.317 0.742 1.00 0.00 C ATOM 496 O2 C B 16 7.228 2.012 0.991 1.00 0.00 O ATOM 497 N3 C B 16 5.029 1.492 1.066 1.00 0.00 N ATOM 498 C4 C B 16 3.765 1.827 0.773 1.00 0.00 C ATOM 499 N4 C B 16 2.780 0.990 1.111 1.00 0.00 N ATOM 500 C5 C B 16 3.457 3.055 0.103 1.00 0.00 C ATOM 501 C6 C B 16 4.488 3.865 -0.201 1.00 0.00 C ATOM 0 H5' C B 16 5.897 8.090 -1.649 1.00 0.00 H new ATOM 0 H5'' C B 16 6.127 7.541 -3.298 1.00 0.00 H new ATOM 0 H4' C B 16 7.795 6.582 -1.888 1.00 0.00 H new ATOM 0 H3' C B 16 5.664 4.597 -2.867 1.00 0.00 H new ATOM 0 H2' C B 16 7.126 2.834 -1.918 1.00 0.00 H new ATOM 0 HO2' C B 16 9.003 4.323 -2.703 1.00 0.00 H new ATOM 0 HO3' C B 16 7.218 4.099 -4.345 1.00 0.00 H new ATOM 0 H1' C B 16 7.706 4.284 0.413 1.00 0.00 H new ATOM 0 H41 C B 16 1.812 1.228 0.896 1.00 0.00 H new ATOM 0 H42 C B 16 2.996 0.113 1.584 1.00 0.00 H new ATOM 0 H5 C B 16 2.440 3.320 -0.148 1.00 0.00 H new ATOM 0 H6 C B 16 4.296 4.803 -0.701 1.00 0.00 H new TER 514 C B 16