USER MOD reduce.3.24.130724 H: found=0, std=0, add=249, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 299 hydrogens (50 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 4 DT C7 :methyl -30:sc= 0 (180deg=-0.02) USER MOD Single : A 4 DT O5' : rot -80:sc= 0.996 USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl -30:sc= 0 (180deg=-0.00144) USER MOD Single : A 23 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 25 DA O3' : rot 180:sc= 0.609 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 4 6.919 -8.752 -12.950 1.00 1.22 O ATOM 2 C5' DT A 4 7.243 -9.940 -12.223 1.00 1.11 C ATOM 3 C4' DT A 4 8.698 -9.961 -11.812 1.00 0.94 C ATOM 4 O4' DT A 4 8.870 -10.921 -10.742 1.00 0.94 O ATOM 5 C3' DT A 4 9.678 -10.372 -12.922 1.00 0.87 C ATOM 6 O3' DT A 4 10.744 -9.421 -13.015 1.00 0.81 O ATOM 7 C2' DT A 4 10.210 -11.728 -12.478 1.00 0.87 C ATOM 8 C1' DT A 4 10.036 -11.686 -10.973 1.00 0.86 C ATOM 9 N1 DT A 4 9.850 -13.006 -10.339 1.00 0.99 N ATOM 10 C2 DT A 4 8.691 -13.702 -10.608 1.00 1.21 C ATOM 11 O2 DT A 4 7.815 -13.279 -11.344 1.00 1.30 O ATOM 12 N3 DT A 4 8.595 -14.917 -9.980 1.00 1.38 N ATOM 13 C4 DT A 4 9.519 -15.492 -9.131 1.00 1.36 C ATOM 14 O4 DT A 4 9.294 -16.595 -8.640 1.00 1.57 O ATOM 15 C5 DT A 4 10.710 -14.708 -8.893 1.00 1.16 C ATOM 16 C7 DT A 4 11.766 -15.255 -7.983 1.00 1.22 C ATOM 17 C6 DT A 4 10.819 -13.518 -9.500 1.00 0.98 C ATOM 0 H5' DT A 4 7.025 -10.814 -12.837 1.00 1.11 H new ATOM 0 H5'' DT A 4 6.613 -10.008 -11.336 1.00 1.11 H new ATOM 0 H4' DT A 4 8.928 -8.935 -11.526 1.00 0.94 H new ATOM 0 H3' DT A 4 9.206 -10.415 -13.904 1.00 0.87 H new ATOM 0 H2' DT A 4 9.649 -12.548 -12.926 1.00 0.87 H new ATOM 0 H2'' DT A 4 11.254 -11.864 -12.760 1.00 0.87 H new ATOM 0 HO5' DT A 4 6.779 -8.012 -12.322 1.00 1.22 H new ATOM 0 H1' DT A 4 10.945 -11.272 -10.538 1.00 0.86 H new ATOM 0 H3 DT A 4 7.747 -15.455 -10.160 1.00 1.38 H new ATOM 0 H71 DT A 4 11.303 -15.893 -7.230 1.00 1.22 H new ATOM 0 H72 DT A 4 12.480 -15.839 -8.564 1.00 1.22 H new ATOM 0 H73 DT A 4 12.285 -14.432 -7.492 1.00 1.22 H new ATOM 0 H6 DT A 4 11.708 -12.931 -9.324 1.00 0.98 H new ATOM 31 P DG A 5 11.450 -9.148 -14.433 1.00 0.89 P ATOM 32 OP1 DG A 5 10.430 -8.547 -15.329 1.00 1.27 O ATOM 33 OP2 DG A 5 12.154 -10.387 -14.850 1.00 1.28 O ATOM 34 O5' DG A 5 12.545 -8.035 -14.111 1.00 0.77 O ATOM 35 C5' DG A 5 12.164 -6.689 -13.824 1.00 0.65 C ATOM 36 C4' DG A 5 13.259 -5.992 -13.050 1.00 0.64 C ATOM 37 O4' DG A 5 13.633 -6.813 -11.915 1.00 0.67 O ATOM 38 C3' DG A 5 14.551 -5.753 -13.837 1.00 0.72 C ATOM 39 O3' DG A 5 15.159 -4.521 -13.433 1.00 0.77 O ATOM 40 C2' DG A 5 15.421 -6.932 -13.443 1.00 0.82 C ATOM 41 C1' DG A 5 15.001 -7.185 -12.005 1.00 0.78 C ATOM 42 N9 DG A 5 15.120 -8.577 -11.578 1.00 0.86 N ATOM 43 C8 DG A 5 14.102 -9.486 -11.422 1.00 0.88 C ATOM 44 N7 DG A 5 14.513 -10.659 -11.027 1.00 1.00 N ATOM 45 C5 DG A 5 15.890 -10.518 -10.914 1.00 1.06 C ATOM 46 C6 DG A 5 16.880 -11.456 -10.524 1.00 1.24 C ATOM 47 O6 DG A 5 16.729 -12.638 -10.190 1.00 1.33 O ATOM 48 N1 DG A 5 18.159 -10.902 -10.545 1.00 1.38 N ATOM 49 C2 DG A 5 18.437 -9.603 -10.900 1.00 1.37 C ATOM 50 N2 DG A 5 19.729 -9.245 -10.861 1.00 1.60 N ATOM 51 N3 DG A 5 17.523 -8.718 -11.265 1.00 1.18 N ATOM 52 C4 DG A 5 16.280 -9.240 -11.250 1.00 1.01 C ATOM 0 H5' DG A 5 11.239 -6.680 -13.248 1.00 0.65 H new ATOM 0 H5'' DG A 5 11.967 -6.153 -14.752 1.00 0.65 H new ATOM 0 H4' DG A 5 12.840 -5.023 -12.780 1.00 0.64 H new ATOM 0 H3' DG A 5 14.394 -5.679 -14.913 1.00 0.72 H new ATOM 0 H2' DG A 5 15.240 -7.800 -14.077 1.00 0.82 H new ATOM 0 H2'' DG A 5 16.482 -6.697 -13.520 1.00 0.82 H new ATOM 0 H1' DG A 5 15.664 -6.611 -11.358 1.00 0.78 H new ATOM 0 H8 DG A 5 13.064 -9.252 -11.608 1.00 0.88 H new ATOM 0 H1 DG A 5 18.941 -11.500 -10.279 1.00 1.38 H new ATOM 0 H21 DG A 5 20.003 -8.295 -11.113 1.00 1.60 H new ATOM 0 H22 DG A 5 20.438 -9.923 -10.580 1.00 1.60 H new ATOM 64 P DA A 6 14.887 -3.180 -14.277 1.00 0.70 P ATOM 65 OP1 DA A 6 15.255 -3.461 -15.689 1.00 0.80 O ATOM 66 OP2 DA A 6 15.527 -2.044 -13.566 1.00 0.77 O ATOM 67 O5' DA A 6 13.306 -2.991 -14.206 1.00 0.68 O ATOM 68 C5' DA A 6 12.719 -2.006 -13.355 1.00 0.62 C ATOM 69 C4' DA A 6 11.260 -1.822 -13.702 1.00 0.64 C ATOM 70 O4' DA A 6 10.545 -3.048 -13.401 1.00 0.66 O ATOM 71 C3' DA A 6 10.546 -0.714 -12.923 1.00 0.70 C ATOM 72 O3' DA A 6 9.618 -0.027 -13.771 1.00 0.83 O ATOM 73 C2' DA A 6 9.812 -1.465 -11.827 1.00 0.63 C ATOM 74 C1' DA A 6 9.480 -2.784 -12.501 1.00 0.58 C ATOM 75 N9 DA A 6 9.369 -3.923 -11.587 1.00 0.57 N ATOM 76 C8 DA A 6 10.307 -4.380 -10.695 1.00 0.57 C ATOM 77 N7 DA A 6 9.920 -5.431 -10.013 1.00 0.65 N ATOM 78 C5 DA A 6 8.640 -5.683 -10.487 1.00 0.70 C ATOM 79 C6 DA A 6 7.689 -6.667 -10.165 1.00 0.84 C ATOM 80 N6 DA A 6 7.889 -7.620 -9.251 1.00 0.95 N ATOM 81 N1 DA A 6 6.510 -6.639 -10.822 1.00 0.91 N ATOM 82 C2 DA A 6 6.309 -5.684 -11.739 1.00 0.84 C ATOM 83 N3 DA A 6 7.124 -4.707 -12.128 1.00 0.73 N ATOM 84 C4 DA A 6 8.287 -4.762 -11.457 1.00 0.65 C ATOM 0 H5' DA A 6 13.248 -1.059 -13.463 1.00 0.62 H new ATOM 0 H5'' DA A 6 12.817 -2.310 -12.313 1.00 0.62 H new ATOM 0 H4' DA A 6 11.253 -1.551 -14.758 1.00 0.64 H new ATOM 0 H3' DA A 6 11.227 0.043 -12.535 1.00 0.70 H new ATOM 0 H2' DA A 6 10.435 -1.606 -10.944 1.00 0.63 H new ATOM 0 H2'' DA A 6 8.915 -0.937 -11.504 1.00 0.63 H new ATOM 0 H1' DA A 6 8.504 -2.680 -12.975 1.00 0.58 H new ATOM 0 H8 DA A 6 11.274 -3.917 -10.567 1.00 0.57 H new ATOM 0 H61 DA A 6 7.159 -8.307 -9.062 1.00 0.95 H new ATOM 0 H62 DA A 6 8.772 -7.661 -8.742 1.00 0.95 H new ATOM 0 H2 DA A 6 5.349 -5.711 -12.233 1.00 0.84 H new ATOM 96 P DG A 7 9.264 1.515 -13.485 1.00 0.87 P ATOM 97 OP1 DG A 7 7.934 1.784 -14.090 1.00 1.02 O ATOM 98 OP2 DG A 7 10.431 2.343 -13.882 1.00 1.23 O ATOM 99 O5' DG A 7 9.113 1.589 -11.900 1.00 0.79 O ATOM 100 C5' DG A 7 8.415 2.668 -11.276 1.00 0.84 C ATOM 101 C4' DG A 7 6.946 2.335 -11.151 1.00 0.69 C ATOM 102 O4' DG A 7 6.803 0.922 -10.855 1.00 0.58 O ATOM 103 C3' DG A 7 6.212 3.075 -10.028 1.00 0.74 C ATOM 104 O3' DG A 7 4.875 3.392 -10.432 1.00 0.76 O ATOM 105 C2' DG A 7 6.203 2.066 -8.896 1.00 0.72 C ATOM 106 C1' DG A 7 6.088 0.750 -9.642 1.00 0.57 C ATOM 107 N9 DG A 7 6.658 -0.397 -8.938 1.00 0.51 N ATOM 108 C8 DG A 7 7.971 -0.581 -8.577 1.00 0.52 C ATOM 109 N7 DG A 7 8.181 -1.708 -7.952 1.00 0.49 N ATOM 110 C5 DG A 7 6.928 -2.306 -7.898 1.00 0.47 C ATOM 111 C6 DG A 7 6.528 -3.546 -7.339 1.00 0.47 C ATOM 112 O6 DG A 7 7.226 -4.386 -6.762 1.00 0.50 O ATOM 113 N1 DG A 7 5.162 -3.773 -7.500 1.00 0.48 N ATOM 114 C2 DG A 7 4.298 -2.902 -8.124 1.00 0.50 C ATOM 115 N2 DG A 7 3.012 -3.285 -8.187 1.00 0.56 N ATOM 116 N3 DG A 7 4.660 -1.743 -8.649 1.00 0.51 N ATOM 117 C4 DG A 7 5.979 -1.511 -8.501 1.00 0.48 C ATOM 0 H5' DG A 7 8.541 3.579 -11.861 1.00 0.84 H new ATOM 0 H5'' DG A 7 8.837 2.862 -10.290 1.00 0.84 H new ATOM 0 H4' DG A 7 6.507 2.636 -12.102 1.00 0.69 H new ATOM 0 H3' DG A 7 6.681 4.020 -9.754 1.00 0.74 H new ATOM 0 H2' DG A 7 7.113 2.117 -8.298 1.00 0.72 H new ATOM 0 H2'' DG A 7 5.365 2.224 -8.217 1.00 0.72 H new ATOM 0 H1' DG A 7 5.029 0.527 -9.771 1.00 0.57 H new ATOM 0 H8 DG A 7 8.751 0.135 -8.789 1.00 0.52 H new ATOM 0 H1 DG A 7 4.777 -4.642 -7.131 1.00 0.48 H new ATOM 0 H21 DG A 7 2.322 -2.683 -8.637 1.00 0.56 H new ATOM 0 H22 DG A 7 2.725 -4.178 -7.785 1.00 0.56 H new ATOM 129 P DG A 8 3.991 4.411 -9.555 1.00 0.83 P ATOM 130 OP1 DG A 8 3.559 5.511 -10.455 1.00 1.01 O ATOM 131 OP2 DG A 8 4.740 4.732 -8.314 1.00 0.97 O ATOM 132 O5' DG A 8 2.703 3.561 -9.157 1.00 0.74 O ATOM 133 C5' DG A 8 1.639 3.357 -10.087 1.00 0.71 C ATOM 134 C4' DG A 8 0.530 2.555 -9.445 1.00 0.60 C ATOM 135 O4' DG A 8 1.088 1.341 -8.884 1.00 0.62 O ATOM 136 C3' DG A 8 -0.194 3.263 -8.294 1.00 0.63 C ATOM 137 O3' DG A 8 -1.602 3.009 -8.364 1.00 0.62 O ATOM 138 C2' DG A 8 0.403 2.628 -7.050 1.00 0.65 C ATOM 139 C1' DG A 8 0.719 1.222 -7.522 1.00 0.58 C ATOM 140 N9 DG A 8 1.823 0.579 -6.811 1.00 0.59 N ATOM 141 C8 DG A 8 3.144 0.950 -6.832 1.00 0.64 C ATOM 142 N7 DG A 8 3.906 0.185 -6.102 1.00 0.65 N ATOM 143 C5 DG A 8 3.035 -0.751 -5.564 1.00 0.61 C ATOM 144 C6 DG A 8 3.287 -1.838 -4.690 1.00 0.61 C ATOM 145 O6 DG A 8 4.368 -2.194 -4.204 1.00 0.66 O ATOM 146 N1 DG A 8 2.123 -2.543 -4.386 1.00 0.59 N ATOM 147 C2 DG A 8 0.874 -2.225 -4.872 1.00 0.57 C ATOM 148 N2 DG A 8 -0.136 -3.012 -4.470 1.00 0.60 N ATOM 149 N3 DG A 8 0.628 -1.212 -5.688 1.00 0.56 N ATOM 150 C4 DG A 8 1.746 -0.523 -5.990 1.00 0.57 C ATOM 0 H5' DG A 8 2.012 2.835 -10.968 1.00 0.71 H new ATOM 0 H5'' DG A 8 1.253 4.319 -10.426 1.00 0.71 H new ATOM 0 H4' DG A 8 -0.193 2.382 -10.242 1.00 0.60 H new ATOM 0 H3' DG A 8 -0.073 4.346 -8.314 1.00 0.63 H new ATOM 0 H2' DG A 8 1.297 3.154 -6.714 1.00 0.65 H new ATOM 0 H2'' DG A 8 -0.299 2.629 -6.217 1.00 0.65 H new ATOM 0 H1' DG A 8 -0.159 0.601 -7.343 1.00 0.58 H new ATOM 0 H8 DG A 8 3.515 1.792 -7.397 1.00 0.64 H new ATOM 0 H1 DG A 8 2.202 -3.347 -3.763 1.00 0.59 H new ATOM 0 H21 DG A 8 -1.085 -2.829 -4.795 1.00 0.60 H new ATOM 0 H22 DG A 8 0.046 -3.793 -3.840 1.00 0.60 H new ATOM 162 P DG A 9 -2.604 3.755 -7.351 1.00 0.70 P ATOM 163 OP1 DG A 9 -3.824 4.116 -8.117 1.00 0.90 O ATOM 164 OP2 DG A 9 -1.846 4.815 -6.638 1.00 0.87 O ATOM 165 O5' DG A 9 -2.996 2.626 -6.297 1.00 0.69 O ATOM 166 C5' DG A 9 -3.543 1.379 -6.727 1.00 0.77 C ATOM 167 C4' DG A 9 -4.069 0.602 -5.543 1.00 0.72 C ATOM 168 O4' DG A 9 -2.962 -0.061 -4.881 1.00 0.73 O ATOM 169 C3' DG A 9 -4.757 1.453 -4.468 1.00 0.74 C ATOM 170 O3' DG A 9 -5.911 0.775 -3.958 1.00 0.77 O ATOM 171 C2' DG A 9 -3.698 1.586 -3.388 1.00 0.69 C ATOM 172 C1' DG A 9 -2.957 0.268 -3.503 1.00 0.67 C ATOM 173 N9 DG A 9 -1.567 0.308 -3.050 1.00 0.64 N ATOM 174 C8 DG A 9 -0.568 1.134 -3.504 1.00 0.67 C ATOM 175 N7 DG A 9 0.576 0.936 -2.909 1.00 0.66 N ATOM 176 C5 DG A 9 0.317 -0.085 -2.004 1.00 0.61 C ATOM 177 C6 DG A 9 1.175 -0.727 -1.076 1.00 0.60 C ATOM 178 O6 DG A 9 2.373 -0.510 -0.866 1.00 0.62 O ATOM 179 N1 DG A 9 0.511 -1.712 -0.348 1.00 0.58 N ATOM 180 C2 DG A 9 -0.819 -2.031 -0.505 1.00 0.60 C ATOM 181 N2 DG A 9 -1.291 -3.008 0.284 1.00 0.63 N ATOM 182 N3 DG A 9 -1.629 -1.439 -1.367 1.00 0.62 N ATOM 183 C4 DG A 9 -1.000 -0.483 -2.078 1.00 0.61 C ATOM 0 H5' DG A 9 -2.779 0.797 -7.242 1.00 0.77 H new ATOM 0 H5'' DG A 9 -4.347 1.554 -7.442 1.00 0.77 H new ATOM 0 H4' DG A 9 -4.809 -0.081 -5.960 1.00 0.72 H new ATOM 0 H3' DG A 9 -5.105 2.415 -4.843 1.00 0.74 H new ATOM 0 H2' DG A 9 -3.042 2.439 -3.564 1.00 0.69 H new ATOM 0 H2'' DG A 9 -4.138 1.721 -2.400 1.00 0.69 H new ATOM 0 H1' DG A 9 -3.457 -0.458 -2.862 1.00 0.67 H new ATOM 0 H8 DG A 9 -0.715 1.874 -4.277 1.00 0.67 H new ATOM 0 H1 DG A 9 1.046 -2.232 0.348 1.00 0.58 H new ATOM 0 H21 DG A 9 -2.269 -3.291 0.216 1.00 0.63 H new ATOM 0 H22 DG A 9 -0.672 -3.468 0.952 1.00 0.63 H new ATOM 195 P DT A 10 -7.341 0.986 -4.662 1.00 0.91 P ATOM 196 OP1 DT A 10 -7.520 2.444 -4.881 1.00 1.11 O ATOM 197 OP2 DT A 10 -8.358 0.232 -3.885 1.00 1.01 O ATOM 198 O5' DT A 10 -7.177 0.288 -6.086 1.00 1.24 O ATOM 199 C5' DT A 10 -7.850 -0.934 -6.392 1.00 0.94 C ATOM 200 C4' DT A 10 -7.103 -2.108 -5.797 1.00 0.99 C ATOM 201 O4' DT A 10 -8.033 -2.932 -5.049 1.00 1.68 O ATOM 202 C3' DT A 10 -6.452 -3.042 -6.817 1.00 0.73 C ATOM 203 O3' DT A 10 -5.254 -3.613 -6.278 1.00 0.77 O ATOM 204 C2' DT A 10 -7.508 -4.110 -7.026 1.00 1.52 C ATOM 205 C1' DT A 10 -8.149 -4.215 -5.651 1.00 1.93 C ATOM 206 N1 DT A 10 -9.579 -4.580 -5.674 1.00 2.57 N ATOM 207 C2 DT A 10 -9.910 -5.917 -5.656 1.00 3.39 C ATOM 208 O2 DT A 10 -9.078 -6.810 -5.623 1.00 3.66 O ATOM 209 N3 DT A 10 -11.257 -6.174 -5.680 1.00 3.99 N ATOM 210 C4 DT A 10 -12.281 -5.250 -5.719 1.00 3.88 C ATOM 211 O4 DT A 10 -13.448 -5.632 -5.737 1.00 4.51 O ATOM 212 C5 DT A 10 -11.863 -3.866 -5.736 1.00 3.14 C ATOM 213 C7 DT A 10 -12.908 -2.794 -5.779 1.00 3.27 C ATOM 214 C6 DT A 10 -10.549 -3.598 -5.712 1.00 2.54 C ATOM 0 H5' DT A 10 -7.928 -1.054 -7.473 1.00 0.94 H new ATOM 0 H5'' DT A 10 -8.867 -0.905 -6.001 1.00 0.94 H new ATOM 0 H4' DT A 10 -6.315 -1.660 -5.192 1.00 0.99 H new ATOM 0 H3' DT A 10 -6.161 -2.541 -7.740 1.00 0.73 H new ATOM 0 H2' DT A 10 -8.231 -3.822 -7.789 1.00 1.52 H new ATOM 0 H2'' DT A 10 -7.070 -5.057 -7.343 1.00 1.52 H new ATOM 0 H1' DT A 10 -7.638 -5.009 -5.107 1.00 1.93 H new ATOM 0 H3 DT A 10 -11.532 -7.156 -5.668 1.00 3.99 H new ATOM 0 H71 DT A 10 -12.536 -1.903 -5.274 1.00 3.27 H new ATOM 0 H72 DT A 10 -13.140 -2.553 -6.817 1.00 3.27 H new ATOM 0 H73 DT A 10 -13.810 -3.145 -5.278 1.00 3.27 H new ATOM 0 H6 DT A 10 -10.235 -2.565 -5.723 1.00 2.54 H new ATOM 227 P DG A 11 -3.823 -3.220 -6.902 1.00 0.69 P ATOM 228 OP1 DG A 11 -2.992 -2.674 -5.799 1.00 0.91 O ATOM 229 OP2 DG A 11 -4.049 -2.403 -8.122 1.00 0.93 O ATOM 230 O5' DG A 11 -3.193 -4.616 -7.343 1.00 0.59 O ATOM 231 C5' DG A 11 -3.965 -5.581 -8.059 1.00 0.71 C ATOM 232 C4' DG A 11 -3.772 -6.953 -7.454 1.00 0.70 C ATOM 233 O4' DG A 11 -2.405 -7.383 -7.681 1.00 0.66 O ATOM 234 C3' DG A 11 -3.985 -7.027 -5.942 1.00 0.65 C ATOM 235 O3' DG A 11 -4.537 -8.297 -5.578 1.00 0.81 O ATOM 236 C2' DG A 11 -2.582 -6.874 -5.385 1.00 0.59 C ATOM 237 C1' DG A 11 -1.734 -7.563 -6.441 1.00 0.59 C ATOM 238 N9 DG A 11 -0.381 -7.024 -6.581 1.00 0.55 N ATOM 239 C8 DG A 11 -0.001 -5.907 -7.286 1.00 0.61 C ATOM 240 N7 DG A 11 1.281 -5.676 -7.234 1.00 0.58 N ATOM 241 C5 DG A 11 1.781 -6.703 -6.446 1.00 0.49 C ATOM 242 C6 DG A 11 3.110 -6.979 -6.037 1.00 0.45 C ATOM 243 O6 DG A 11 4.138 -6.345 -6.301 1.00 0.48 O ATOM 244 N1 DG A 11 3.185 -8.120 -5.242 1.00 0.42 N ATOM 245 C2 DG A 11 2.102 -8.893 -4.889 1.00 0.43 C ATOM 246 N2 DG A 11 2.364 -9.959 -4.116 1.00 0.46 N ATOM 247 N3 DG A 11 0.857 -8.645 -5.263 1.00 0.45 N ATOM 248 C4 DG A 11 0.770 -7.543 -6.035 1.00 0.48 C ATOM 0 H5' DG A 11 -3.666 -5.592 -9.107 1.00 0.71 H new ATOM 0 H5'' DG A 11 -5.020 -5.308 -8.031 1.00 0.71 H new ATOM 0 H4' DG A 11 -4.523 -7.579 -7.935 1.00 0.70 H new ATOM 0 H3' DG A 11 -4.678 -6.274 -5.567 1.00 0.65 H new ATOM 0 H2' DG A 11 -2.306 -5.827 -5.262 1.00 0.59 H new ATOM 0 H2'' DG A 11 -2.479 -7.348 -4.409 1.00 0.59 H new ATOM 0 H1' DG A 11 -1.618 -8.605 -6.141 1.00 0.59 H new ATOM 0 H8 DG A 11 -0.695 -5.283 -7.829 1.00 0.61 H new ATOM 0 H1 DG A 11 4.103 -8.402 -4.899 1.00 0.42 H new ATOM 0 H21 DG A 11 1.605 -10.573 -3.819 1.00 0.46 H new ATOM 0 H22 DG A 11 3.322 -10.155 -3.825 1.00 0.46 H new ATOM 260 P DG A 12 -5.437 -8.428 -4.252 1.00 0.93 P ATOM 261 OP1 DG A 12 -5.334 -9.833 -3.783 1.00 1.50 O ATOM 262 OP2 DG A 12 -6.773 -7.845 -4.536 1.00 1.44 O ATOM 263 O5' DG A 12 -4.699 -7.496 -3.191 1.00 0.93 O ATOM 264 C5' DG A 12 -5.094 -7.486 -1.819 1.00 0.89 C ATOM 265 C4' DG A 12 -4.247 -8.456 -1.026 1.00 0.73 C ATOM 266 O4' DG A 12 -2.908 -8.481 -1.581 1.00 0.67 O ATOM 267 C3' DG A 12 -4.079 -8.102 0.451 1.00 0.64 C ATOM 268 O3' DG A 12 -3.996 -9.293 1.243 1.00 0.77 O ATOM 269 C2' DG A 12 -2.765 -7.346 0.481 1.00 0.58 C ATOM 270 C1' DG A 12 -1.967 -8.024 -0.620 1.00 0.58 C ATOM 271 N9 DG A 12 -1.019 -7.145 -1.300 1.00 0.51 N ATOM 272 C8 DG A 12 -1.309 -6.166 -2.218 1.00 0.54 C ATOM 273 N7 DG A 12 -0.254 -5.528 -2.643 1.00 0.52 N ATOM 274 C5 DG A 12 0.800 -6.124 -1.964 1.00 0.46 C ATOM 275 C6 DG A 12 2.191 -5.854 -2.014 1.00 0.48 C ATOM 276 O6 DG A 12 2.780 -5.000 -2.687 1.00 0.55 O ATOM 277 N1 DG A 12 2.915 -6.691 -1.166 1.00 0.45 N ATOM 278 C2 DG A 12 2.354 -7.665 -0.372 1.00 0.43 C ATOM 279 N2 DG A 12 3.207 -8.381 0.379 1.00 0.46 N ATOM 280 N3 DG A 12 1.058 -7.926 -0.317 1.00 0.44 N ATOM 281 C4 DG A 12 0.346 -7.123 -1.132 1.00 0.45 C ATOM 0 H5' DG A 12 -6.146 -7.757 -1.734 1.00 0.89 H new ATOM 0 H5'' DG A 12 -4.989 -6.481 -1.410 1.00 0.89 H new ATOM 0 H4' DG A 12 -4.774 -9.408 -1.092 1.00 0.73 H new ATOM 0 H3' DG A 12 -4.912 -7.525 0.854 1.00 0.64 H new ATOM 0 H2' DG A 12 -2.904 -6.283 0.285 1.00 0.58 H new ATOM 0 H2'' DG A 12 -2.272 -7.429 1.449 1.00 0.58 H new ATOM 0 H1' DG A 12 -1.377 -8.819 -0.163 1.00 0.58 H new ATOM 0 H8 DG A 12 -2.311 -5.946 -2.555 1.00 0.54 H new ATOM 0 H1 DG A 12 3.928 -6.574 -1.132 1.00 0.45 H new ATOM 0 H21 DG A 12 2.854 -9.118 0.989 1.00 0.46 H new ATOM 0 H22 DG A 12 4.208 -8.188 0.339 1.00 0.46 H new ATOM 293 P DG A 13 -4.389 -9.247 2.802 1.00 0.85 P ATOM 294 OP1 DG A 13 -4.142 -10.600 3.362 1.00 1.10 O ATOM 295 OP2 DG A 13 -5.736 -8.635 2.927 1.00 0.95 O ATOM 296 O5' DG A 13 -3.324 -8.246 3.439 1.00 1.15 O ATOM 297 C5' DG A 13 -3.101 -8.206 4.849 1.00 0.87 C ATOM 298 C4' DG A 13 -1.716 -8.716 5.172 1.00 0.59 C ATOM 299 O4' DG A 13 -0.787 -8.240 4.165 1.00 0.49 O ATOM 300 C3' DG A 13 -1.154 -8.245 6.516 1.00 0.42 C ATOM 301 O3' DG A 13 -0.368 -9.281 7.117 1.00 0.41 O ATOM 302 C2' DG A 13 -0.283 -7.062 6.138 1.00 0.44 C ATOM 303 C1' DG A 13 0.233 -7.456 4.766 1.00 0.43 C ATOM 304 N9 DG A 13 0.514 -6.328 3.880 1.00 0.43 N ATOM 305 C8 DG A 13 -0.393 -5.610 3.140 1.00 0.51 C ATOM 306 N7 DG A 13 0.152 -4.651 2.445 1.00 0.50 N ATOM 307 C5 DG A 13 1.504 -4.740 2.743 1.00 0.44 C ATOM 308 C6 DG A 13 2.595 -3.959 2.285 1.00 0.49 C ATOM 309 O6 DG A 13 2.575 -3.006 1.497 1.00 0.56 O ATOM 310 N1 DG A 13 3.805 -4.381 2.833 1.00 0.53 N ATOM 311 C2 DG A 13 3.934 -5.431 3.714 1.00 0.50 C ATOM 312 N2 DG A 13 5.181 -5.703 4.133 1.00 0.60 N ATOM 313 N3 DG A 13 2.923 -6.167 4.149 1.00 0.42 N ATOM 314 C4 DG A 13 1.746 -5.768 3.626 1.00 0.40 C ATOM 0 H5' DG A 13 -3.848 -8.813 5.360 1.00 0.87 H new ATOM 0 H5'' DG A 13 -3.215 -7.185 5.214 1.00 0.87 H new ATOM 0 H4' DG A 13 -1.817 -9.801 5.206 1.00 0.59 H new ATOM 0 H3' DG A 13 -1.927 -7.988 7.240 1.00 0.42 H new ATOM 0 H2' DG A 13 -0.853 -6.133 6.106 1.00 0.44 H new ATOM 0 H2'' DG A 13 0.529 -6.913 6.849 1.00 0.44 H new ATOM 0 H1' DG A 13 1.179 -7.980 4.903 1.00 0.43 H new ATOM 0 H8 DG A 13 -1.453 -5.819 3.134 1.00 0.51 H new ATOM 0 H1 DG A 13 4.651 -3.879 2.564 1.00 0.53 H new ATOM 0 H21 DG A 13 5.344 -6.469 4.787 1.00 0.60 H new ATOM 0 H22 DG A 13 5.965 -5.143 3.798 1.00 0.60 H new ATOM 326 P DT A 14 -0.024 -9.221 8.687 1.00 0.80 P ATOM 327 OP1 DT A 14 -1.148 -8.527 9.365 1.00 1.19 O ATOM 328 OP2 DT A 14 1.358 -8.702 8.840 1.00 1.07 O ATOM 329 O5' DT A 14 -0.038 -10.749 9.143 1.00 1.07 O ATOM 330 C5' DT A 14 -1.179 -11.576 8.909 1.00 1.37 C ATOM 331 C4' DT A 14 -0.742 -12.958 8.482 1.00 0.90 C ATOM 332 O4' DT A 14 -1.187 -13.924 9.465 1.00 0.90 O ATOM 333 C3' DT A 14 -1.326 -13.437 7.155 1.00 0.96 C ATOM 334 O3' DT A 14 -0.454 -13.090 6.073 1.00 0.99 O ATOM 335 C2' DT A 14 -1.385 -14.941 7.336 1.00 1.24 C ATOM 336 C1' DT A 14 -1.693 -15.088 8.820 1.00 1.18 C ATOM 337 N1 DT A 14 -3.132 -15.194 9.136 1.00 1.62 N ATOM 338 C2 DT A 14 -3.722 -16.437 9.068 1.00 2.24 C ATOM 339 O2 DT A 14 -3.112 -17.449 8.761 1.00 2.55 O ATOM 340 N3 DT A 14 -5.058 -16.454 9.374 1.00 2.74 N ATOM 341 C4 DT A 14 -5.845 -15.377 9.733 1.00 2.84 C ATOM 342 O4 DT A 14 -7.036 -15.546 9.980 1.00 3.44 O ATOM 343 C5 DT A 14 -5.162 -14.104 9.784 1.00 2.44 C ATOM 344 C7 DT A 14 -5.937 -12.880 10.164 1.00 2.99 C ATOM 345 C6 DT A 14 -3.854 -14.072 9.487 1.00 1.83 C ATOM 0 H5' DT A 14 -1.808 -11.131 8.138 1.00 1.37 H new ATOM 0 H5'' DT A 14 -1.782 -11.641 9.814 1.00 1.37 H new ATOM 0 H4' DT A 14 0.341 -12.885 8.380 1.00 0.90 H new ATOM 0 H3' DT A 14 -2.293 -12.994 6.918 1.00 0.96 H new ATOM 0 H2' DT A 14 -2.158 -15.393 6.715 1.00 1.24 H new ATOM 0 H2'' DT A 14 -0.442 -15.418 7.069 1.00 1.24 H new ATOM 0 H1' DT A 14 -1.234 -16.017 9.159 1.00 1.18 H new ATOM 0 H3 DT A 14 -5.522 -17.361 9.332 1.00 2.74 H new ATOM 0 H71 DT A 14 -5.276 -12.171 10.662 1.00 2.99 H new ATOM 0 H72 DT A 14 -6.354 -12.420 9.268 1.00 2.99 H new ATOM 0 H73 DT A 14 -6.746 -13.157 10.840 1.00 2.99 H new ATOM 0 H6 DT A 14 -3.342 -13.122 9.525 1.00 1.83 H new ATOM 358 P DA A 15 -1.021 -13.045 4.569 1.00 1.03 P ATOM 359 OP1 DA A 15 -2.245 -12.205 4.579 1.00 1.24 O ATOM 360 OP2 DA A 15 -1.090 -14.436 4.055 1.00 1.39 O ATOM 361 O5' DA A 15 0.108 -12.266 3.757 1.00 0.97 O ATOM 362 C5' DA A 15 0.029 -12.122 2.339 1.00 1.21 C ATOM 363 C4' DA A 15 1.417 -12.029 1.748 1.00 0.87 C ATOM 364 O4' DA A 15 2.110 -10.901 2.338 1.00 0.71 O ATOM 365 C3' DA A 15 2.308 -13.242 2.007 1.00 0.76 C ATOM 366 O3' DA A 15 3.219 -13.436 0.919 1.00 0.72 O ATOM 367 C2' DA A 15 3.056 -12.857 3.269 1.00 0.73 C ATOM 368 C1' DA A 15 3.206 -11.350 3.126 1.00 0.61 C ATOM 369 N9 DA A 15 3.177 -10.617 4.394 1.00 0.64 N ATOM 370 C8 DA A 15 2.151 -10.555 5.305 1.00 0.75 C ATOM 371 N7 DA A 15 2.416 -9.809 6.349 1.00 0.83 N ATOM 372 C5 DA A 15 3.703 -9.348 6.112 1.00 0.80 C ATOM 373 C6 DA A 15 4.557 -8.509 6.848 1.00 0.96 C ATOM 374 N6 DA A 15 4.226 -7.963 8.021 1.00 1.06 N ATOM 375 N1 DA A 15 5.776 -8.246 6.332 1.00 1.12 N ATOM 376 C2 DA A 15 6.106 -8.793 5.155 1.00 1.13 C ATOM 377 N3 DA A 15 5.391 -9.596 4.370 1.00 0.95 N ATOM 378 C4 DA A 15 4.185 -9.838 4.912 1.00 0.75 C ATOM 0 H5' DA A 15 -0.542 -11.228 2.088 1.00 1.21 H new ATOM 0 H5'' DA A 15 -0.502 -12.971 1.908 1.00 1.21 H new ATOM 0 H4' DA A 15 1.258 -11.943 0.673 1.00 0.87 H new ATOM 0 H3' DA A 15 1.751 -14.174 2.106 1.00 0.76 H new ATOM 0 H2' DA A 15 2.499 -13.125 4.167 1.00 0.73 H new ATOM 0 H2'' DA A 15 4.023 -13.355 3.334 1.00 0.73 H new ATOM 0 H1' DA A 15 4.182 -11.158 2.680 1.00 0.61 H new ATOM 0 H8 DA A 15 1.213 -11.073 5.173 1.00 0.75 H new ATOM 0 H61 DA A 15 4.890 -7.361 8.509 1.00 1.06 H new ATOM 0 H62 DA A 15 3.310 -8.148 8.429 1.00 1.06 H new ATOM 0 H2 DA A 15 7.093 -8.548 4.791 1.00 1.13 H new ATOM 390 P DG A 16 2.767 -14.304 -0.357 1.00 0.95 P ATOM 391 OP1 DG A 16 2.029 -13.398 -1.273 1.00 1.52 O ATOM 392 OP2 DG A 16 2.114 -15.546 0.130 1.00 1.39 O ATOM 393 O5' DG A 16 4.142 -14.703 -1.057 1.00 0.58 O ATOM 394 C5' DG A 16 4.948 -15.766 -0.548 1.00 0.41 C ATOM 395 C4' DG A 16 6.382 -15.310 -0.401 1.00 0.44 C ATOM 396 O4' DG A 16 6.707 -14.413 -1.495 1.00 0.51 O ATOM 397 C3' DG A 16 6.682 -14.531 0.883 1.00 0.50 C ATOM 398 O3' DG A 16 7.998 -14.842 1.356 1.00 0.59 O ATOM 399 C2' DG A 16 6.600 -13.083 0.439 1.00 0.54 C ATOM 400 C1' DG A 16 7.115 -13.152 -0.987 1.00 0.51 C ATOM 401 N9 DG A 16 6.586 -12.115 -1.870 1.00 0.50 N ATOM 402 C8 DG A 16 5.298 -11.996 -2.334 1.00 0.53 C ATOM 403 N7 DG A 16 5.122 -10.961 -3.107 1.00 0.54 N ATOM 404 C5 DG A 16 6.371 -10.358 -3.159 1.00 0.51 C ATOM 405 C6 DG A 16 6.798 -9.194 -3.845 1.00 0.52 C ATOM 406 O6 DG A 16 6.131 -8.441 -4.564 1.00 0.57 O ATOM 407 N1 DG A 16 8.150 -8.929 -3.631 1.00 0.50 N ATOM 408 C2 DG A 16 8.978 -9.700 -2.848 1.00 0.49 C ATOM 409 N2 DG A 16 10.254 -9.293 -2.753 1.00 0.51 N ATOM 410 N3 DG A 16 8.591 -10.789 -2.204 1.00 0.49 N ATOM 411 C4 DG A 16 7.285 -11.057 -2.402 1.00 0.49 C ATOM 0 H5' DG A 16 4.898 -16.623 -1.219 1.00 0.41 H new ATOM 0 H5'' DG A 16 4.562 -16.094 0.417 1.00 0.41 H new ATOM 0 H4' DG A 16 6.970 -16.228 -0.387 1.00 0.44 H new ATOM 0 H3' DG A 16 6.000 -14.765 1.700 1.00 0.50 H new ATOM 0 H2' DG A 16 5.580 -12.701 0.485 1.00 0.54 H new ATOM 0 H2'' DG A 16 7.213 -12.431 1.062 1.00 0.54 H new ATOM 0 H1' DG A 16 8.195 -13.006 -0.962 1.00 0.51 H new ATOM 0 H8 DG A 16 4.510 -12.691 -2.083 1.00 0.53 H new ATOM 0 H1 DG A 16 8.552 -8.109 -4.085 1.00 0.50 H new ATOM 0 H21 DG A 16 10.917 -9.822 -2.187 1.00 0.51 H new ATOM 0 H22 DG A 16 10.560 -8.454 -3.247 1.00 0.51 H new ATOM 423 P DG A 17 8.436 -14.422 2.845 1.00 0.69 P ATOM 424 OP1 DG A 17 9.571 -15.296 3.237 1.00 0.91 O ATOM 425 OP2 DG A 17 7.220 -14.375 3.696 1.00 0.85 O ATOM 426 O5' DG A 17 8.991 -12.937 2.680 1.00 0.73 O ATOM 427 C5' DG A 17 9.188 -12.097 3.817 1.00 0.61 C ATOM 428 C4' DG A 17 9.845 -10.801 3.402 1.00 0.54 C ATOM 429 O4' DG A 17 9.239 -10.329 2.187 1.00 0.51 O ATOM 430 C3' DG A 17 9.689 -9.650 4.396 1.00 0.53 C ATOM 431 O3' DG A 17 10.863 -9.538 5.209 1.00 0.55 O ATOM 432 C2' DG A 17 9.522 -8.405 3.522 1.00 0.51 C ATOM 433 C1' DG A 17 9.439 -8.934 2.094 1.00 0.47 C ATOM 434 N9 DG A 17 8.341 -8.374 1.309 1.00 0.47 N ATOM 435 C8 DG A 17 7.057 -8.852 1.222 1.00 0.50 C ATOM 436 N7 DG A 17 6.291 -8.135 0.448 1.00 0.50 N ATOM 437 C5 DG A 17 7.121 -7.118 -0.006 1.00 0.46 C ATOM 438 C6 DG A 17 6.849 -6.034 -0.878 1.00 0.48 C ATOM 439 O6 DG A 17 5.784 -5.750 -1.437 1.00 0.51 O ATOM 440 N1 DG A 17 7.972 -5.232 -1.078 1.00 0.48 N ATOM 441 C2 DG A 17 9.201 -5.459 -0.503 1.00 0.48 C ATOM 442 N2 DG A 17 10.171 -4.583 -0.811 1.00 0.52 N ATOM 443 N3 DG A 17 9.466 -6.467 0.313 1.00 0.46 N ATOM 444 C4 DG A 17 8.389 -7.251 0.516 1.00 0.45 C ATOM 0 H5' DG A 17 9.809 -12.608 4.553 1.00 0.61 H new ATOM 0 H5'' DG A 17 8.231 -11.891 4.296 1.00 0.61 H new ATOM 0 H4' DG A 17 10.903 -11.048 3.314 1.00 0.54 H new ATOM 0 H3' DG A 17 8.847 -9.794 5.073 1.00 0.53 H new ATOM 0 H2' DG A 17 8.622 -7.852 3.791 1.00 0.51 H new ATOM 0 H2'' DG A 17 10.364 -7.723 3.642 1.00 0.51 H new ATOM 0 H1' DG A 17 10.360 -8.651 1.584 1.00 0.47 H new ATOM 0 H8 DG A 17 6.715 -9.734 1.743 1.00 0.50 H new ATOM 0 H1 DG A 17 7.876 -4.423 -1.692 1.00 0.48 H new ATOM 0 H21 DG A 17 11.105 -4.697 -0.417 1.00 0.52 H new ATOM 0 H22 DG A 17 9.974 -3.804 -1.439 1.00 0.52 H new ATOM 456 P DG A 18 10.906 -8.474 6.414 1.00 0.61 P ATOM 457 OP1 DG A 18 11.863 -8.989 7.426 1.00 0.85 O ATOM 458 OP2 DG A 18 9.510 -8.165 6.817 1.00 0.84 O ATOM 459 O5' DG A 18 11.538 -7.168 5.754 1.00 0.82 O ATOM 460 C5' DG A 18 12.783 -7.227 5.059 1.00 0.93 C ATOM 461 C4' DG A 18 13.152 -5.860 4.531 1.00 0.82 C ATOM 462 O4' DG A 18 12.118 -5.411 3.617 1.00 0.79 O ATOM 463 C3' DG A 18 13.278 -4.768 5.600 1.00 0.80 C ATOM 464 O3' DG A 18 14.400 -3.924 5.317 1.00 0.84 O ATOM 465 C2' DG A 18 11.979 -3.990 5.475 1.00 0.75 C ATOM 466 C1' DG A 18 11.657 -4.127 4.000 1.00 0.72 C ATOM 467 N9 DG A 18 10.233 -4.043 3.678 1.00 0.68 N ATOM 468 C8 DG A 18 9.226 -4.844 4.159 1.00 0.65 C ATOM 469 N7 DG A 18 8.049 -4.531 3.690 1.00 0.65 N ATOM 470 C5 DG A 18 8.294 -3.456 2.847 1.00 0.66 C ATOM 471 C6 DG A 18 7.400 -2.691 2.056 1.00 0.68 C ATOM 472 O6 DG A 18 6.176 -2.819 1.943 1.00 0.69 O ATOM 473 N1 DG A 18 8.059 -1.688 1.346 1.00 0.71 N ATOM 474 C2 DG A 18 9.416 -1.461 1.401 1.00 0.73 C ATOM 475 N2 DG A 18 9.878 -0.450 0.649 1.00 0.79 N ATOM 476 N3 DG A 18 10.259 -2.168 2.136 1.00 0.72 N ATOM 477 C4 DG A 18 9.635 -3.142 2.828 1.00 0.68 C ATOM 0 H5' DG A 18 12.714 -7.937 4.235 1.00 0.93 H new ATOM 0 H5'' DG A 18 13.564 -7.590 5.727 1.00 0.93 H new ATOM 0 H4' DG A 18 14.129 -5.991 4.065 1.00 0.82 H new ATOM 0 H3' DG A 18 13.436 -5.167 6.602 1.00 0.80 H new ATOM 0 H2' DG A 18 11.193 -4.409 6.103 1.00 0.75 H new ATOM 0 H2'' DG A 18 12.100 -2.947 5.769 1.00 0.75 H new ATOM 0 H1' DG A 18 12.133 -3.300 3.474 1.00 0.72 H new ATOM 0 H8 DG A 18 9.392 -5.652 4.856 1.00 0.65 H new ATOM 0 H1 DG A 18 7.499 -1.082 0.746 1.00 0.71 H new ATOM 0 H21 DG A 18 10.874 -0.231 0.646 1.00 0.79 H new ATOM 0 H22 DG A 18 9.233 0.099 0.081 1.00 0.79 H new ATOM 489 P DT A 19 15.114 -3.113 6.509 1.00 1.12 P ATOM 490 OP1 DT A 19 15.169 -4.012 7.690 1.00 1.52 O ATOM 491 OP2 DT A 19 14.459 -1.786 6.628 1.00 1.97 O ATOM 492 O5' DT A 19 16.603 -2.892 5.986 1.00 0.85 O ATOM 493 C5' DT A 19 16.866 -2.099 4.829 1.00 0.74 C ATOM 494 C4' DT A 19 18.241 -2.411 4.285 1.00 0.67 C ATOM 495 O4' DT A 19 19.204 -2.353 5.358 1.00 0.60 O ATOM 496 C3' DT A 19 18.397 -3.805 3.693 1.00 0.84 C ATOM 497 O3' DT A 19 18.053 -3.798 2.303 1.00 0.99 O ATOM 498 C2' DT A 19 19.877 -4.090 3.878 1.00 1.28 C ATOM 499 C1' DT A 19 20.247 -3.294 5.128 1.00 0.91 C ATOM 500 N1 DT A 19 20.397 -4.115 6.346 1.00 1.09 N ATOM 501 C2 DT A 19 21.547 -4.859 6.490 1.00 1.51 C ATOM 502 O2 DT A 19 22.442 -4.870 5.661 1.00 1.79 O ATOM 503 N3 DT A 19 21.612 -5.595 7.645 1.00 1.82 N ATOM 504 C4 DT A 19 20.665 -5.659 8.647 1.00 1.92 C ATOM 505 O4 DT A 19 20.863 -6.366 9.631 1.00 2.35 O ATOM 506 C5 DT A 19 19.483 -4.853 8.432 1.00 1.69 C ATOM 507 C7 DT A 19 18.403 -4.861 9.469 1.00 2.17 C ATOM 508 C6 DT A 19 19.405 -4.129 7.306 1.00 1.25 C ATOM 0 H5' DT A 19 16.798 -1.041 5.081 1.00 0.74 H new ATOM 0 H5'' DT A 19 16.112 -2.294 4.066 1.00 0.74 H new ATOM 0 H4' DT A 19 18.395 -1.674 3.497 1.00 0.67 H new ATOM 0 H3' DT A 19 17.754 -4.550 4.161 1.00 0.84 H new ATOM 0 H2' DT A 19 20.066 -5.155 4.011 1.00 1.28 H new ATOM 0 H2'' DT A 19 20.457 -3.769 3.013 1.00 1.28 H new ATOM 0 H1' DT A 19 21.216 -2.832 4.941 1.00 0.91 H new ATOM 0 H3 DT A 19 22.453 -6.157 7.778 1.00 1.82 H new ATOM 0 H71 DT A 19 18.391 -5.827 9.974 1.00 2.17 H new ATOM 0 H72 DT A 19 18.592 -4.073 10.198 1.00 2.17 H new ATOM 0 H73 DT A 19 17.439 -4.689 8.991 1.00 2.17 H new ATOM 0 H6 DT A 19 18.523 -3.527 7.142 1.00 1.25 H new ATOM 521 P DG A 20 17.416 -5.111 1.630 1.00 1.09 P ATOM 522 OP1 DG A 20 16.017 -5.226 2.115 1.00 1.62 O ATOM 523 OP2 DG A 20 18.358 -6.242 1.830 1.00 1.62 O ATOM 524 O5' DG A 20 17.375 -4.764 0.075 1.00 0.66 O ATOM 525 C5' DG A 20 16.537 -5.494 -0.821 1.00 0.55 C ATOM 526 C4' DG A 20 16.534 -4.837 -2.181 1.00 0.43 C ATOM 527 O4' DG A 20 15.633 -5.564 -3.056 1.00 0.43 O ATOM 528 C3' DG A 20 16.051 -3.381 -2.190 1.00 0.55 C ATOM 529 O3' DG A 20 16.854 -2.596 -3.079 1.00 0.66 O ATOM 530 C2' DG A 20 14.627 -3.480 -2.705 1.00 0.50 C ATOM 531 C1' DG A 20 14.704 -4.669 -3.642 1.00 0.44 C ATOM 532 N9 DG A 20 13.439 -5.377 -3.826 1.00 0.44 N ATOM 533 C8 DG A 20 13.113 -6.628 -3.364 1.00 0.50 C ATOM 534 N7 DG A 20 11.906 -7.000 -3.691 1.00 0.50 N ATOM 535 C5 DG A 20 11.403 -5.927 -4.414 1.00 0.43 C ATOM 536 C6 DG A 20 10.138 -5.749 -5.029 1.00 0.43 C ATOM 537 O6 DG A 20 9.181 -6.531 -5.049 1.00 0.49 O ATOM 538 N1 DG A 20 10.035 -4.513 -5.663 1.00 0.41 N ATOM 539 C2 DG A 20 11.037 -3.570 -5.693 1.00 0.41 C ATOM 540 N2 DG A 20 10.757 -2.427 -6.337 1.00 0.47 N ATOM 541 N3 DG A 20 12.222 -3.725 -5.123 1.00 0.40 N ATOM 542 C4 DG A 20 12.335 -4.918 -4.506 1.00 0.41 C ATOM 0 H5' DG A 20 15.521 -5.538 -0.427 1.00 0.55 H new ATOM 0 H5'' DG A 20 16.890 -6.522 -0.906 1.00 0.55 H new ATOM 0 H4' DG A 20 17.574 -4.852 -2.506 1.00 0.43 H new ATOM 0 H3' DG A 20 16.115 -2.903 -1.212 1.00 0.55 H new ATOM 0 H2' DG A 20 13.913 -3.644 -1.898 1.00 0.50 H new ATOM 0 H2'' DG A 20 14.318 -2.573 -3.224 1.00 0.50 H new ATOM 0 H1' DG A 20 14.988 -4.307 -4.630 1.00 0.44 H new ATOM 0 H8 DG A 20 13.788 -7.243 -2.787 1.00 0.50 H new ATOM 0 H1 DG A 20 9.159 -4.292 -6.136 1.00 0.41 H new ATOM 0 H21 DG A 20 11.459 -1.689 -6.394 1.00 0.47 H new ATOM 0 H22 DG A 20 9.843 -2.296 -6.769 1.00 0.47 H new ATOM 554 P DG A 21 16.898 -0.996 -2.919 1.00 0.87 P ATOM 555 OP1 DG A 21 17.989 -0.492 -3.790 1.00 1.14 O ATOM 556 OP2 DG A 21 16.909 -0.671 -1.469 1.00 1.07 O ATOM 557 O5' DG A 21 15.508 -0.507 -3.530 1.00 0.78 O ATOM 558 C5' DG A 21 15.270 -0.543 -4.938 1.00 0.82 C ATOM 559 C4' DG A 21 14.238 0.494 -5.323 1.00 0.70 C ATOM 560 O4' DG A 21 12.929 -0.132 -5.368 1.00 0.65 O ATOM 561 C3' DG A 21 14.109 1.671 -4.350 1.00 0.64 C ATOM 562 O3' DG A 21 13.893 2.889 -5.073 1.00 0.72 O ATOM 563 C2' DG A 21 12.887 1.315 -3.524 1.00 0.59 C ATOM 564 C1' DG A 21 12.028 0.569 -4.527 1.00 0.58 C ATOM 565 N9 DG A 21 11.108 -0.402 -3.937 1.00 0.51 N ATOM 566 C8 DG A 21 11.413 -1.400 -3.045 1.00 0.53 C ATOM 567 N7 DG A 21 10.380 -2.119 -2.700 1.00 0.49 N ATOM 568 C5 DG A 21 9.325 -1.559 -3.409 1.00 0.44 C ATOM 569 C6 DG A 21 7.953 -1.915 -3.442 1.00 0.44 C ATOM 570 O6 DG A 21 7.384 -2.827 -2.833 1.00 0.46 O ATOM 571 N1 DG A 21 7.222 -1.088 -4.294 1.00 0.48 N ATOM 572 C2 DG A 21 7.760 -0.049 -5.018 1.00 0.51 C ATOM 573 N2 DG A 21 6.906 0.644 -5.785 1.00 0.60 N ATOM 574 N3 DG A 21 9.038 0.291 -4.995 1.00 0.50 N ATOM 575 C4 DG A 21 9.757 -0.500 -4.176 1.00 0.47 C ATOM 0 H5' DG A 21 14.925 -1.535 -5.230 1.00 0.82 H new ATOM 0 H5'' DG A 21 16.200 -0.358 -5.476 1.00 0.82 H new ATOM 0 H4' DG A 21 14.578 0.884 -6.283 1.00 0.70 H new ATOM 0 H3' DG A 21 15.000 1.827 -3.742 1.00 0.64 H new ATOM 0 H2' DG A 21 13.143 0.694 -2.666 1.00 0.59 H new ATOM 0 H2'' DG A 21 12.384 2.202 -3.138 1.00 0.59 H new ATOM 0 H1' DG A 21 11.402 1.298 -5.043 1.00 0.58 H new ATOM 0 H8 DG A 21 12.409 -1.573 -2.666 1.00 0.53 H new ATOM 0 H1 DG A 21 6.222 -1.265 -4.387 1.00 0.48 H new ATOM 0 H21 DG A 21 7.244 1.426 -6.346 1.00 0.60 H new ATOM 0 H22 DG A 21 5.919 0.389 -5.808 1.00 0.60 H new ATOM 587 P DG A 22 13.964 4.302 -4.308 1.00 0.88 P ATOM 588 OP1 DG A 22 14.975 5.135 -5.009 1.00 1.04 O ATOM 589 OP2 DG A 22 14.110 4.042 -2.853 1.00 1.01 O ATOM 590 O5' DG A 22 12.529 4.949 -4.562 1.00 1.14 O ATOM 591 C5' DG A 22 11.675 5.303 -3.474 1.00 1.03 C ATOM 592 C4' DG A 22 10.243 5.397 -3.947 1.00 0.96 C ATOM 593 O4' DG A 22 9.699 4.069 -4.084 1.00 0.93 O ATOM 594 C3' DG A 22 9.296 6.111 -2.992 1.00 0.91 C ATOM 595 O3' DG A 22 9.279 7.516 -3.268 1.00 1.04 O ATOM 596 C2' DG A 22 7.948 5.484 -3.311 1.00 0.82 C ATOM 597 C1' DG A 22 8.303 4.083 -3.807 1.00 0.85 C ATOM 598 N9 DG A 22 8.026 3.016 -2.847 1.00 0.80 N ATOM 599 C8 DG A 22 8.929 2.377 -2.033 1.00 0.86 C ATOM 600 N7 DG A 22 8.386 1.461 -1.279 1.00 0.83 N ATOM 601 C5 DG A 22 7.039 1.497 -1.615 1.00 0.75 C ATOM 602 C6 DG A 22 5.953 0.730 -1.125 1.00 0.71 C ATOM 603 O6 DG A 22 5.971 -0.161 -0.268 1.00 0.75 O ATOM 604 N1 DG A 22 4.749 1.082 -1.733 1.00 0.68 N ATOM 605 C2 DG A 22 4.622 2.058 -2.696 1.00 0.69 C ATOM 606 N2 DG A 22 3.384 2.261 -3.174 1.00 0.72 N ATOM 607 N3 DG A 22 5.629 2.781 -3.160 1.00 0.72 N ATOM 608 C4 DG A 22 6.800 2.450 -2.580 1.00 0.74 C ATOM 0 H5' DG A 22 11.989 6.257 -3.050 1.00 1.03 H new ATOM 0 H5'' DG A 22 11.756 4.560 -2.681 1.00 1.03 H new ATOM 0 H4' DG A 22 10.300 5.963 -4.877 1.00 0.96 H new ATOM 0 H3' DG A 22 9.577 6.009 -1.944 1.00 0.91 H new ATOM 0 H2' DG A 22 7.307 5.446 -2.430 1.00 0.82 H new ATOM 0 H2'' DG A 22 7.412 6.053 -4.071 1.00 0.82 H new ATOM 0 H1' DG A 22 7.682 3.886 -4.681 1.00 0.85 H new ATOM 0 H8 DG A 22 9.984 2.610 -2.018 1.00 0.86 H new ATOM 0 H1 DG A 22 3.907 0.584 -1.446 1.00 0.68 H new ATOM 0 H21 DG A 22 3.223 2.970 -3.889 1.00 0.72 H new ATOM 0 H22 DG A 22 2.604 1.706 -2.822 1.00 0.72 H new ATOM 620 P DT A 23 8.789 8.548 -2.136 1.00 1.22 P ATOM 621 OP1 DT A 23 8.808 9.906 -2.735 1.00 1.60 O ATOM 622 OP2 DT A 23 9.561 8.282 -0.896 1.00 1.62 O ATOM 623 O5' DT A 23 7.270 8.142 -1.878 1.00 1.11 O ATOM 624 C5' DT A 23 6.578 8.589 -0.713 1.00 1.03 C ATOM 625 C4' DT A 23 5.214 7.944 -0.639 1.00 0.88 C ATOM 626 O4' DT A 23 5.364 6.505 -0.705 1.00 0.81 O ATOM 627 C3' DT A 23 4.447 8.210 0.652 1.00 0.78 C ATOM 628 O3' DT A 23 3.625 9.375 0.514 1.00 0.93 O ATOM 629 C2' DT A 23 3.595 6.965 0.799 1.00 0.70 C ATOM 630 C1' DT A 23 4.494 5.875 0.230 1.00 0.71 C ATOM 631 N1 DT A 23 5.326 5.184 1.235 1.00 0.66 N ATOM 632 C2 DT A 23 4.691 4.432 2.199 1.00 0.63 C ATOM 633 O2 DT A 23 3.478 4.309 2.257 1.00 0.63 O ATOM 634 N3 DT A 23 5.531 3.823 3.095 1.00 0.71 N ATOM 635 C4 DT A 23 6.909 3.889 3.124 1.00 0.84 C ATOM 636 O4 DT A 23 7.532 3.285 3.994 1.00 1.00 O ATOM 637 C5 DT A 23 7.510 4.695 2.085 1.00 0.85 C ATOM 638 C7 DT A 23 9.002 4.822 2.039 1.00 1.02 C ATOM 639 C6 DT A 23 6.702 5.297 1.201 1.00 0.76 C ATOM 0 H5' DT A 23 6.475 9.674 -0.736 1.00 1.03 H new ATOM 0 H5'' DT A 23 7.154 8.342 0.179 1.00 1.03 H new ATOM 0 H4' DT A 23 4.658 8.377 -1.470 1.00 0.88 H new ATOM 0 H3' DT A 23 5.091 8.396 1.512 1.00 0.78 H new ATOM 0 H2' DT A 23 3.335 6.773 1.840 1.00 0.70 H new ATOM 0 H2'' DT A 23 2.659 7.047 0.247 1.00 0.70 H new ATOM 0 H1' DT A 23 3.849 5.114 -0.209 1.00 0.71 H new ATOM 0 H3 DT A 23 5.088 3.259 3.820 1.00 0.71 H new ATOM 0 H71 DT A 23 9.323 4.965 1.007 1.00 1.02 H new ATOM 0 H72 DT A 23 9.313 5.678 2.638 1.00 1.02 H new ATOM 0 H73 DT A 23 9.457 3.915 2.438 1.00 1.02 H new ATOM 0 H6 DT A 23 7.149 5.900 0.424 1.00 0.76 H new ATOM 652 P DA A 24 3.028 10.095 1.822 1.00 1.27 P ATOM 653 OP1 DA A 24 2.123 9.125 2.490 1.00 1.69 O ATOM 654 OP2 DA A 24 2.509 11.428 1.424 1.00 1.82 O ATOM 655 O5' DA A 24 4.299 10.311 2.759 1.00 1.16 O ATOM 656 C5' DA A 24 4.322 11.347 3.743 1.00 1.32 C ATOM 657 C4' DA A 24 4.794 10.796 5.068 1.00 1.23 C ATOM 658 O4' DA A 24 5.140 11.898 5.944 1.00 1.46 O ATOM 659 C3' DA A 24 3.754 9.980 5.832 1.00 1.04 C ATOM 660 O3' DA A 24 3.885 8.588 5.522 1.00 0.99 O ATOM 661 C2' DA A 24 4.114 10.243 7.281 1.00 1.40 C ATOM 662 C1' DA A 24 4.605 11.682 7.244 1.00 1.48 C ATOM 663 N9 DA A 24 3.560 12.683 7.473 1.00 1.44 N ATOM 664 C8 DA A 24 2.744 13.276 6.541 1.00 1.49 C ATOM 665 N7 DA A 24 1.899 14.139 7.052 1.00 1.56 N ATOM 666 C5 DA A 24 2.176 14.112 8.412 1.00 1.54 C ATOM 667 C6 DA A 24 1.623 14.804 9.503 1.00 1.69 C ATOM 668 N6 DA A 24 0.634 15.694 9.393 1.00 1.76 N ATOM 669 N1 DA A 24 2.126 14.546 10.730 1.00 1.92 N ATOM 670 C2 DA A 24 3.118 13.653 10.842 1.00 2.03 C ATOM 671 N3 DA A 24 3.720 12.940 9.892 1.00 1.87 N ATOM 672 C4 DA A 24 3.197 13.220 8.686 1.00 1.57 C ATOM 0 H5' DA A 24 3.326 11.776 3.853 1.00 1.32 H new ATOM 0 H5'' DA A 24 4.982 12.152 3.419 1.00 1.32 H new ATOM 0 H4' DA A 24 5.629 10.143 4.816 1.00 1.23 H new ATOM 0 H3' DA A 24 2.726 10.249 5.589 1.00 1.04 H new ATOM 0 H2' DA A 24 3.254 10.125 7.940 1.00 1.40 H new ATOM 0 H2'' DA A 24 4.885 9.560 7.638 1.00 1.40 H new ATOM 0 H1' DA A 24 5.330 11.804 8.049 1.00 1.48 H new ATOM 0 H8 DA A 24 2.794 13.052 5.486 1.00 1.49 H new ATOM 0 H61 DA A 24 0.276 16.163 10.225 1.00 1.76 H new ATOM 0 H62 DA A 24 0.237 15.904 8.477 1.00 1.76 H new ATOM 0 H2 DA A 24 3.481 13.488 11.846 1.00 2.03 H new ATOM 684 P DA A 25 2.669 7.583 5.830 1.00 1.09 P ATOM 685 OP1 DA A 25 1.534 7.979 4.957 1.00 1.33 O ATOM 686 OP2 DA A 25 2.475 7.522 7.301 1.00 1.63 O ATOM 687 O5' DA A 25 3.203 6.166 5.335 1.00 1.06 O ATOM 688 C5' DA A 25 4.285 5.513 6.001 1.00 1.02 C ATOM 689 C4' DA A 25 3.795 4.260 6.688 1.00 0.91 C ATOM 690 O4' DA A 25 2.731 4.603 7.604 1.00 1.13 O ATOM 691 C3' DA A 25 3.197 3.209 5.761 1.00 0.56 C ATOM 692 O3' DA A 25 4.207 2.319 5.276 1.00 0.77 O ATOM 693 C2' DA A 25 2.223 2.480 6.669 1.00 0.69 C ATOM 694 C1' DA A 25 1.745 3.575 7.617 1.00 1.04 C ATOM 695 N9 DA A 25 0.463 4.177 7.244 1.00 1.26 N ATOM 696 C8 DA A 25 0.216 5.077 6.236 1.00 1.49 C ATOM 697 N7 DA A 25 -1.041 5.437 6.145 1.00 1.86 N ATOM 698 C5 DA A 25 -1.666 4.728 7.161 1.00 1.89 C ATOM 699 C6 DA A 25 -3.003 4.670 7.591 1.00 2.31 C ATOM 700 N6 DA A 25 -3.993 5.366 7.027 1.00 2.74 N ATOM 701 N1 DA A 25 -3.293 3.863 8.635 1.00 2.34 N ATOM 702 C2 DA A 25 -2.300 3.165 9.201 1.00 2.00 C ATOM 703 N3 DA A 25 -1.007 3.135 8.887 1.00 1.61 N ATOM 704 C4 DA A 25 -0.752 3.948 7.847 1.00 1.54 C ATOM 0 H5' DA A 25 4.731 6.187 6.733 1.00 1.02 H new ATOM 0 H5'' DA A 25 5.065 5.261 5.282 1.00 1.02 H new ATOM 0 H4' DA A 25 4.684 3.844 7.162 1.00 0.91 H new ATOM 0 H3' DA A 25 2.729 3.632 4.872 1.00 0.56 H new ATOM 0 H2' DA A 25 1.397 2.045 6.107 1.00 0.69 H new ATOM 0 H2'' DA A 25 2.707 1.665 7.207 1.00 0.69 H new ATOM 0 HO3' DA A 25 3.799 1.653 4.684 1.00 0.77 H new ATOM 0 H1' DA A 25 1.601 3.117 8.595 1.00 1.04 H new ATOM 0 H8 DA A 25 0.986 5.453 5.579 1.00 1.49 H new ATOM 0 H61 DA A 25 -4.944 5.281 7.385 1.00 2.74 H new ATOM 0 H62 DA A 25 -3.798 5.983 6.238 1.00 2.74 H new ATOM 0 H2 DA A 25 -2.590 2.537 10.030 1.00 2.00 H new TER 717 DA A 25 HETATM 718 C17 BO6 A 101 14.137 -7.677 -6.630 1.00 0.50 C HETATM 719 C18 BO6 A 101 15.012 -6.653 -6.980 1.00 0.52 C HETATM 720 N19 BO6 A 101 14.554 -5.566 -7.722 1.00 0.53 N HETATM 721 C31 BO6 A 101 15.485 -4.475 -8.095 1.00 0.65 C HETATM 722 C20 BO6 A 101 13.217 -5.508 -8.114 1.00 0.52 C HETATM 723 C21 BO6 A 101 12.343 -6.532 -7.764 1.00 0.49 C HETATM 724 C16 BO6 A 101 12.792 -7.629 -7.018 1.00 0.47 C HETATM 725 C15 BO6 A 101 11.951 -8.673 -6.642 1.00 0.54 C HETATM 726 C14 BO6 A 101 12.369 -10.146 -6.669 1.00 0.59 C HETATM 727 C7 BO6 A 101 11.576 -11.178 -6.176 1.00 0.60 C HETATM 728 C6 BO6 A 101 10.258 -11.276 -6.602 1.00 0.56 C HETATM 729 C8 BO6 A 101 12.049 -12.110 -5.281 1.00 0.67 C HETATM 730 C9 BO6 A 101 11.207 -13.112 -4.832 1.00 0.70 C HETATM 731 C2 BO6 A 101 9.941 -13.172 -5.266 1.00 0.66 C HETATM 732 N1 BO6 A 101 8.957 -14.022 -4.988 1.00 0.69 N HETATM 733 C3 BO6 A 101 9.469 -12.263 -6.144 1.00 0.60 C HETATM 734 C4 BO6 A 101 8.196 -12.563 -6.397 1.00 0.59 C HETATM 735 C10 BO6 A 101 7.285 -11.976 -7.192 1.00 0.55 C HETATM 736 C5 BO6 A 101 7.879 -13.658 -5.676 1.00 0.65 C HETATM 737 C13 BO6 A 101 6.649 -14.185 -5.739 1.00 0.67 C HETATM 738 C12 BO6 A 101 5.686 -13.609 -6.547 1.00 0.64 C HETATM 739 C11 BO6 A 101 5.999 -12.493 -7.283 1.00 0.59 C HETATM 740 C22 BO6 A 101 5.069 -11.876 -8.110 1.00 0.58 C HETATM 741 C23 BO6 A 101 4.796 -10.368 -8.097 1.00 0.56 C HETATM 742 C24 BO6 A 101 3.648 -9.792 -8.633 1.00 0.54 C HETATM 743 C25 BO6 A 101 2.399 -10.307 -8.258 1.00 0.56 C HETATM 744 C26 BO6 A 101 1.225 -9.762 -8.770 1.00 0.62 C HETATM 745 N27 BO6 A 101 1.283 -8.694 -9.664 1.00 0.66 N HETATM 746 C30 BO6 A 101 0.034 -8.114 -10.210 1.00 0.78 C HETATM 747 C28 BO6 A 101 2.519 -8.173 -10.044 1.00 0.64 C HETATM 748 C29 BO6 A 101 3.693 -8.718 -9.532 1.00 0.60 C HETATM 774 C17 BO6 A 102 -0.855 2.017 0.592 1.00 0.66 C HETATM 775 C18 BO6 A 102 -1.086 2.900 -0.458 1.00 0.69 C HETATM 776 N19 BO6 A 102 -0.019 3.574 -1.051 1.00 0.69 N HETATM 777 C31 BO6 A 102 -0.265 4.515 -2.168 1.00 0.75 C HETATM 778 C20 BO6 A 102 1.279 3.361 -0.589 1.00 0.67 C HETATM 779 C21 BO6 A 102 1.509 2.478 0.462 1.00 0.63 C HETATM 780 C16 BO6 A 102 0.446 1.795 1.065 1.00 0.62 C HETATM 781 C15 BO6 A 102 0.629 0.903 2.117 1.00 0.64 C HETATM 782 C14 BO6 A 102 -0.101 1.018 3.458 1.00 0.59 C HETATM 783 C7 BO6 A 102 -0.238 -0.039 4.348 1.00 0.58 C HETATM 784 C6 BO6 A 102 0.901 -0.596 4.912 1.00 0.52 C HETATM 785 C8 BO6 A 102 -1.464 -0.553 4.696 1.00 0.67 C HETATM 786 C9 BO6 A 102 -1.532 -1.605 5.592 1.00 0.70 C HETATM 787 C2 BO6 A 102 -0.410 -2.116 6.115 1.00 0.60 C HETATM 788 N1 BO6 A 102 -0.217 -3.108 6.980 1.00 0.62 N HETATM 789 C3 BO6 A 102 0.797 -1.617 5.779 1.00 0.51 C HETATM 790 C4 BO6 A 102 1.723 -2.308 6.442 1.00 0.48 C HETATM 791 C10 BO6 A 102 3.063 -2.209 6.459 1.00 0.49 C HETATM 792 C5 BO6 A 102 1.090 -3.236 7.189 1.00 0.52 C HETATM 793 C13 BO6 A 102 1.784 -4.079 7.965 1.00 0.51 C HETATM 794 C12 BO6 A 102 3.165 -4.007 8.009 1.00 0.48 C HETATM 795 C11 BO6 A 102 3.818 -3.065 7.250 1.00 0.51 C HETATM 796 C22 BO6 A 102 5.204 -2.944 7.257 1.00 0.61 C HETATM 797 C23 BO6 A 102 6.036 -2.722 5.991 1.00 0.73 C HETATM 798 C24 BO6 A 102 7.243 -2.029 5.978 1.00 0.82 C HETATM 799 C25 BO6 A 102 8.294 -2.495 6.780 1.00 0.82 C HETATM 800 C26 BO6 A 102 9.518 -1.834 6.798 1.00 0.98 C HETATM 801 N27 BO6 A 102 9.709 -0.697 6.014 1.00 1.11 N HETATM 802 C30 BO6 A 102 11.013 0.006 6.033 1.00 1.31 C HETATM 803 C28 BO6 A 102 8.671 -0.225 5.212 1.00 1.12 C HETATM 804 C29 BO6 A 102 7.447 -0.886 5.195 1.00 0.99 C