USER MOD reduce.3.24.130724 H: found=0, std=0, add=196, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 196 hydrogens (14 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 DG O5' : rot -34:sc= 0.061 USER MOD Single : A 4 DT C7 :methyl -30:sc= -1.64! (180deg=-4.27!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : A 9 PSO O14 : rot -113:sc= 0.397 USER MOD Single : B 9 DG O5' : rot -26:sc= 0.0808 USER MOD Single : B 12 DT C7 :methyl 150:sc= -2.9! (180deg=-2.9!) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.397 -13.969 9.608 1.00 0.00 O ATOM 2 C5' DG A 1 -2.207 -12.582 9.782 1.00 0.00 C ATOM 3 C4' DG A 1 -0.704 -12.286 9.802 1.00 0.00 C ATOM 4 O4' DG A 1 -0.033 -12.868 8.682 1.00 0.00 O ATOM 5 C3' DG A 1 -0.425 -10.800 9.756 1.00 0.00 C ATOM 6 O3' DG A 1 0.762 -10.524 10.478 1.00 0.00 O ATOM 7 C2' DG A 1 -0.317 -10.585 8.269 1.00 0.00 C ATOM 8 C1' DG A 1 0.244 -11.873 7.698 1.00 0.00 C ATOM 9 N9 DG A 1 -0.402 -12.196 6.399 1.00 0.00 N ATOM 10 C8 DG A 1 -1.695 -12.610 6.195 1.00 0.00 C ATOM 11 N7 DG A 1 -2.027 -12.767 4.950 1.00 0.00 N ATOM 12 C5 DG A 1 -0.863 -12.458 4.262 1.00 0.00 C ATOM 13 C6 DG A 1 -0.609 -12.484 2.862 1.00 0.00 C ATOM 14 O6 DG A 1 -1.401 -12.733 1.958 1.00 0.00 O ATOM 15 N1 DG A 1 0.703 -12.184 2.549 1.00 0.00 N ATOM 16 C2 DG A 1 1.662 -11.855 3.475 1.00 0.00 C ATOM 17 N2 DG A 1 2.887 -11.611 3.019 1.00 0.00 N ATOM 18 N3 DG A 1 1.429 -11.790 4.797 1.00 0.00 N ATOM 19 C4 DG A 1 0.147 -12.118 5.131 1.00 0.00 C ATOM 0 H5' DG A 1 -2.669 -12.252 10.713 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.689 -12.031 8.974 1.00 0.00 H new ATOM 0 H4' DG A 1 -0.336 -12.716 10.733 1.00 0.00 H new ATOM 0 H3' DG A 1 -1.165 -10.142 10.212 1.00 0.00 H new ATOM 0 H2' DG A 1 -1.291 -10.359 7.836 1.00 0.00 H new ATOM 0 H2'' DG A 1 0.336 -9.742 8.043 1.00 0.00 H new ATOM 0 HO5' DG A 1 -1.688 -14.327 9.034 1.00 0.00 H new ATOM 0 H1' DG A 1 1.312 -11.803 7.492 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.383 -12.791 7.008 1.00 0.00 H new ATOM 0 H1 DG A 1 0.977 -12.209 1.567 1.00 0.00 H new ATOM 0 H21 DG A 1 3.633 -11.363 3.669 1.00 0.00 H new ATOM 0 H22 DG A 1 3.081 -11.672 2.019 1.00 0.00 H new ATOM 32 P DC A 2 1.304 -9.025 10.717 1.00 0.00 P ATOM 33 OP1 DC A 2 1.988 -8.987 12.027 1.00 0.00 O ATOM 34 OP2 DC A 2 0.204 -8.078 10.431 1.00 0.00 O ATOM 35 O5' DC A 2 2.416 -8.879 9.564 1.00 0.00 O ATOM 36 C5' DC A 2 3.502 -9.776 9.503 1.00 0.00 C ATOM 37 C4' DC A 2 4.545 -9.339 8.472 1.00 0.00 C ATOM 38 O4' DC A 2 4.095 -9.486 7.128 1.00 0.00 O ATOM 39 C3' DC A 2 4.954 -7.877 8.633 1.00 0.00 C ATOM 40 O3' DC A 2 6.344 -7.892 8.381 1.00 0.00 O ATOM 41 C2' DC A 2 4.064 -7.194 7.592 1.00 0.00 C ATOM 42 C1' DC A 2 3.978 -8.230 6.462 1.00 0.00 C ATOM 43 N1 DC A 2 2.671 -8.270 5.721 1.00 0.00 N ATOM 44 C2 DC A 2 2.674 -8.626 4.375 1.00 0.00 C ATOM 45 O2 DC A 2 3.731 -8.819 3.780 1.00 0.00 O ATOM 46 N3 DC A 2 1.491 -8.765 3.698 1.00 0.00 N ATOM 47 C4 DC A 2 0.328 -8.571 4.336 1.00 0.00 C ATOM 48 N4 DC A 2 -0.809 -8.808 3.690 1.00 0.00 N ATOM 49 C5 DC A 2 0.278 -8.240 5.722 1.00 0.00 C ATOM 50 C6 DC A 2 1.464 -8.127 6.362 1.00 0.00 C ATOM 0 H5' DC A 2 3.137 -10.772 9.251 1.00 0.00 H new ATOM 0 H5'' DC A 2 3.970 -9.847 10.485 1.00 0.00 H new ATOM 0 H4' DC A 2 5.391 -9.999 8.662 1.00 0.00 H new ATOM 0 H3' DC A 2 4.821 -7.362 9.584 1.00 0.00 H new ATOM 0 H2' DC A 2 3.080 -6.959 7.997 1.00 0.00 H new ATOM 0 H2'' DC A 2 4.498 -6.256 7.245 1.00 0.00 H new ATOM 0 H1' DC A 2 4.741 -7.988 5.722 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.702 -8.665 4.161 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.788 -9.132 2.723 1.00 0.00 H new ATOM 0 H5 DC A 2 -0.660 -8.087 6.235 1.00 0.00 H new ATOM 0 H6 DC A 2 1.462 -7.916 7.421 1.00 0.00 H new ATOM 62 P DG A 3 7.221 -6.564 8.266 1.00 0.00 P ATOM 63 OP1 DG A 3 8.626 -6.893 8.589 1.00 0.00 O ATOM 64 OP2 DG A 3 6.529 -5.468 8.977 1.00 0.00 O ATOM 65 O5' DG A 3 7.088 -6.344 6.686 1.00 0.00 O ATOM 66 C5' DG A 3 7.607 -7.289 5.773 1.00 0.00 C ATOM 67 C4' DG A 3 7.722 -6.659 4.386 1.00 0.00 C ATOM 68 O4' DG A 3 6.436 -6.693 3.806 1.00 0.00 O ATOM 69 C3' DG A 3 8.190 -5.200 4.486 1.00 0.00 C ATOM 70 O3' DG A 3 9.085 -4.894 3.437 1.00 0.00 O ATOM 71 C2' DG A 3 6.845 -4.484 4.405 1.00 0.00 C ATOM 72 C1' DG A 3 6.030 -5.384 3.495 1.00 0.00 C ATOM 73 N9 DG A 3 4.572 -5.282 3.700 1.00 0.00 N ATOM 74 C8 DG A 3 3.861 -4.987 4.835 1.00 0.00 C ATOM 75 N7 DG A 3 2.582 -5.215 4.733 1.00 0.00 N ATOM 76 C5 DG A 3 2.418 -5.615 3.408 1.00 0.00 C ATOM 77 C6 DG A 3 1.239 -5.907 2.655 1.00 0.00 C ATOM 78 O6 DG A 3 0.077 -5.967 3.052 1.00 0.00 O ATOM 79 N1 DG A 3 1.511 -6.143 1.317 1.00 0.00 N ATOM 80 C2 DG A 3 2.772 -6.138 0.764 1.00 0.00 C ATOM 81 N2 DG A 3 2.923 -6.346 -0.537 1.00 0.00 N ATOM 82 N3 DG A 3 3.880 -5.886 1.462 1.00 0.00 N ATOM 83 C4 DG A 3 3.631 -5.627 2.768 1.00 0.00 C ATOM 0 H5' DG A 3 6.958 -8.164 5.733 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.585 -7.633 6.108 1.00 0.00 H new ATOM 0 H4' DG A 3 8.449 -7.207 3.787 1.00 0.00 H new ATOM 0 H3' DG A 3 8.760 -4.927 5.374 1.00 0.00 H new ATOM 0 H2' DG A 3 6.384 -4.380 5.387 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.947 -3.480 3.993 1.00 0.00 H new ATOM 0 H1' DG A 3 6.205 -5.094 2.459 1.00 0.00 H new ATOM 0 H8 DG A 3 4.320 -4.600 5.733 1.00 0.00 H new ATOM 0 H1 DG A 3 0.722 -6.334 0.699 1.00 0.00 H new ATOM 0 H21 DG A 3 3.856 -6.343 -0.949 1.00 0.00 H new ATOM 0 H22 DG A 3 2.106 -6.509 -1.126 1.00 0.00 H new ATOM 95 P DT A 4 9.801 -3.449 3.316 1.00 0.00 P ATOM 96 OP1 DT A 4 11.164 -3.654 2.783 1.00 0.00 O ATOM 97 OP2 DT A 4 9.605 -2.719 4.588 1.00 0.00 O ATOM 98 O5' DT A 4 8.908 -2.761 2.175 1.00 0.00 O ATOM 99 C5' DT A 4 8.918 -3.298 0.871 1.00 0.00 C ATOM 100 C4' DT A 4 7.598 -3.013 0.165 1.00 0.00 C ATOM 101 O4' DT A 4 6.482 -3.207 1.005 1.00 0.00 O ATOM 102 C3' DT A 4 7.451 -1.576 -0.350 1.00 0.00 C ATOM 103 O3' DT A 4 7.957 -1.471 -1.675 1.00 0.00 O ATOM 104 C2' DT A 4 5.940 -1.360 -0.266 1.00 0.00 C ATOM 105 C1' DT A 4 5.385 -2.621 0.333 1.00 0.00 C ATOM 106 N1 DT A 4 4.261 -2.379 1.264 1.00 0.00 N ATOM 107 C2 DT A 4 3.002 -2.889 1.014 1.00 0.00 C ATOM 108 O2 DT A 4 2.675 -3.334 -0.081 1.00 0.00 O ATOM 109 N3 DT A 4 2.112 -2.881 2.057 1.00 0.00 N ATOM 110 C4 DT A 4 2.267 -2.291 3.284 1.00 0.00 C ATOM 111 O4 DT A 4 1.459 -2.518 4.181 1.00 0.00 O ATOM 112 C5 DT A 4 3.453 -1.351 3.490 1.00 0.00 C ATOM 113 C7 DT A 4 4.135 -1.489 4.850 1.00 0.00 C ATOM 114 C6 DT A 4 4.502 -1.426 2.375 1.00 0.00 C ATOM 0 H5' DT A 4 9.088 -4.374 0.916 1.00 0.00 H new ATOM 0 H5'' DT A 4 9.742 -2.869 0.301 1.00 0.00 H new ATOM 0 H4' DT A 4 7.622 -3.717 -0.667 1.00 0.00 H new ATOM 0 H3' DT A 4 8.008 -0.826 0.212 1.00 0.00 H new ATOM 0 H2' DT A 4 5.701 -0.494 0.352 1.00 0.00 H new ATOM 0 H2'' DT A 4 5.515 -1.174 -1.252 1.00 0.00 H new ATOM 0 H1' DT A 4 4.963 -3.265 -0.439 1.00 0.00 H new ATOM 0 H3 DT A 4 1.231 -3.372 1.901 1.00 0.00 H new ATOM 0 H71 DT A 4 3.403 -1.803 5.594 1.00 0.00 H new ATOM 0 H72 DT A 4 4.929 -2.233 4.785 1.00 0.00 H new ATOM 0 H73 DT A 4 4.561 -0.529 5.143 1.00 0.00 H new ATOM 0 H6 DT A 4 5.386 -0.806 2.397 1.00 0.00 H new ATOM 127 P DA A 5 7.190 -2.053 -3.002 1.00 0.00 P ATOM 128 OP1 DA A 5 6.489 -3.312 -2.675 1.00 0.00 O ATOM 129 OP2 DA A 5 8.165 -2.036 -4.114 1.00 0.00 O ATOM 130 O5' DA A 5 6.088 -0.907 -3.283 1.00 0.00 O ATOM 131 C5' DA A 5 6.498 0.440 -3.320 1.00 0.00 C ATOM 132 C4' DA A 5 5.573 1.297 -4.169 1.00 0.00 C ATOM 133 O4' DA A 5 4.344 1.324 -3.431 1.00 0.00 O ATOM 134 C3' DA A 5 6.104 2.738 -4.317 1.00 0.00 C ATOM 135 O3' DA A 5 6.046 3.366 -5.593 1.00 0.00 O ATOM 136 C2' DA A 5 5.311 3.420 -3.227 1.00 0.00 C ATOM 137 C1' DA A 5 4.012 2.645 -3.039 1.00 0.00 C ATOM 138 N9 DA A 5 3.451 2.815 -1.660 1.00 0.00 N ATOM 139 C8 DA A 5 4.095 2.970 -0.447 1.00 0.00 C ATOM 140 N7 DA A 5 3.316 3.190 0.571 1.00 0.00 N ATOM 141 C5 DA A 5 2.053 3.175 0.005 1.00 0.00 C ATOM 142 C6 DA A 5 0.774 3.315 0.562 1.00 0.00 C ATOM 143 N6 DA A 5 0.632 3.411 1.878 1.00 0.00 N ATOM 144 N1 DA A 5 -0.306 3.283 -0.244 1.00 0.00 N ATOM 145 C2 DA A 5 -0.097 3.103 -1.547 1.00 0.00 C ATOM 146 N3 DA A 5 1.056 2.954 -2.193 1.00 0.00 N ATOM 147 C4 DA A 5 2.115 2.990 -1.348 1.00 0.00 C ATOM 0 H5' DA A 5 7.512 0.499 -3.717 1.00 0.00 H new ATOM 0 H5'' DA A 5 6.529 0.837 -2.305 1.00 0.00 H new ATOM 0 H4' DA A 5 5.474 0.895 -5.178 1.00 0.00 H new ATOM 0 H3' DA A 5 7.189 2.787 -4.223 1.00 0.00 H new ATOM 0 H2' DA A 5 5.880 3.442 -2.298 1.00 0.00 H new ATOM 0 H2'' DA A 5 5.102 4.455 -3.498 1.00 0.00 H new ATOM 0 H1' DA A 5 3.182 3.007 -3.646 1.00 0.00 H new ATOM 0 H8 DA A 5 5.169 2.913 -0.351 1.00 0.00 H new ATOM 0 H61 DA A 5 -0.298 3.513 2.285 1.00 0.00 H new ATOM 0 H62 DA A 5 1.453 3.383 2.483 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.984 3.074 -2.162 1.00 0.00 H new ATOM 159 P DC A 6 4.801 3.391 -6.615 1.00 0.00 P ATOM 160 OP1 DC A 6 4.314 2.007 -6.797 1.00 0.00 O ATOM 161 OP2 DC A 6 5.231 4.156 -7.804 1.00 0.00 O ATOM 162 O5' DC A 6 3.631 4.241 -5.907 1.00 0.00 O ATOM 163 C5' DC A 6 2.307 3.915 -6.251 1.00 0.00 C ATOM 164 C4' DC A 6 1.226 4.935 -5.902 1.00 0.00 C ATOM 165 O4' DC A 6 0.896 4.954 -4.508 1.00 0.00 O ATOM 166 C3' DC A 6 1.485 6.391 -6.327 1.00 0.00 C ATOM 167 O3' DC A 6 0.428 6.788 -7.191 1.00 0.00 O ATOM 168 C2' DC A 6 1.475 7.152 -4.999 1.00 0.00 C ATOM 169 C1' DC A 6 0.721 6.283 -4.003 1.00 0.00 C ATOM 170 N1 DC A 6 1.198 6.390 -2.598 1.00 0.00 N ATOM 171 C2 DC A 6 0.256 6.597 -1.593 1.00 0.00 C ATOM 172 O2 DC A 6 -0.924 6.821 -1.834 1.00 0.00 O ATOM 173 N3 DC A 6 0.634 6.553 -0.294 1.00 0.00 N ATOM 174 C4 DC A 6 1.914 6.380 0.029 1.00 0.00 C ATOM 175 N4 DC A 6 2.189 6.201 1.314 1.00 0.00 N ATOM 176 C5 DC A 6 2.918 6.194 -0.976 1.00 0.00 C ATOM 177 C6 DC A 6 2.511 6.203 -2.266 1.00 0.00 C ATOM 0 H5' DC A 6 2.053 2.973 -5.764 1.00 0.00 H new ATOM 0 H5'' DC A 6 2.271 3.738 -7.326 1.00 0.00 H new ATOM 0 H4' DC A 6 0.397 4.561 -6.503 1.00 0.00 H new ATOM 0 H3' DC A 6 2.415 6.563 -6.870 1.00 0.00 H new ATOM 0 H2' DC A 6 2.491 7.343 -4.655 1.00 0.00 H new ATOM 0 H2'' DC A 6 0.990 8.121 -5.112 1.00 0.00 H new ATOM 0 H1' DC A 6 -0.320 6.599 -3.934 1.00 0.00 H new ATOM 0 H41 DC A 6 3.154 6.064 1.615 1.00 0.00 H new ATOM 0 H42 DC A 6 1.436 6.200 2.001 1.00 0.00 H new ATOM 0 H5 DC A 6 3.956 6.053 -0.715 1.00 0.00 H new ATOM 0 H6 DC A 6 3.239 6.059 -3.051 1.00 0.00 H new ATOM 189 P DG A 7 0.259 8.300 -7.750 1.00 0.00 P ATOM 190 OP1 DG A 7 -0.462 8.230 -9.038 1.00 0.00 O ATOM 191 OP2 DG A 7 1.580 8.963 -7.684 1.00 0.00 O ATOM 192 O5' DG A 7 -0.721 8.993 -6.659 1.00 0.00 O ATOM 193 C5' DG A 7 -2.051 8.540 -6.511 1.00 0.00 C ATOM 194 C4' DG A 7 -2.895 9.362 -5.528 1.00 0.00 C ATOM 195 O4' DG A 7 -2.409 9.230 -4.205 1.00 0.00 O ATOM 196 C3' DG A 7 -2.916 10.855 -5.860 1.00 0.00 C ATOM 197 O3' DG A 7 -4.249 11.300 -5.657 1.00 0.00 O ATOM 198 C2' DG A 7 -1.888 11.404 -4.884 1.00 0.00 C ATOM 199 C1' DG A 7 -2.094 10.506 -3.673 1.00 0.00 C ATOM 200 N9 DG A 7 -0.951 10.326 -2.756 1.00 0.00 N ATOM 201 C8 DG A 7 0.383 10.213 -3.048 1.00 0.00 C ATOM 202 N7 DG A 7 1.125 9.891 -2.025 1.00 0.00 N ATOM 203 C5 DG A 7 0.219 9.789 -0.969 1.00 0.00 C ATOM 204 C6 DG A 7 0.420 9.502 0.418 1.00 0.00 C ATOM 205 O6 DG A 7 1.477 9.290 1.003 1.00 0.00 O ATOM 206 N1 DG A 7 -0.762 9.474 1.144 1.00 0.00 N ATOM 207 C2 DG A 7 -1.999 9.720 0.607 1.00 0.00 C ATOM 208 N2 DG A 7 -3.049 9.684 1.420 1.00 0.00 N ATOM 209 N3 DG A 7 -2.200 10.021 -0.681 1.00 0.00 N ATOM 210 C4 DG A 7 -1.055 10.032 -1.415 1.00 0.00 C ATOM 0 H5' DG A 7 -2.034 7.503 -6.177 1.00 0.00 H new ATOM 0 H5'' DG A 7 -2.537 8.552 -7.487 1.00 0.00 H new ATOM 0 H4' DG A 7 -3.906 8.963 -5.616 1.00 0.00 H new ATOM 0 H3' DG A 7 -2.664 11.161 -6.875 1.00 0.00 H new ATOM 0 H2' DG A 7 -0.874 11.334 -5.277 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.067 12.453 -4.650 1.00 0.00 H new ATOM 0 H1' DG A 7 -2.858 10.986 -3.062 1.00 0.00 H new ATOM 0 H8 DG A 7 0.784 10.376 -4.037 1.00 0.00 H new ATOM 0 H1 DG A 7 -0.707 9.257 2.139 1.00 0.00 H new ATOM 0 H21 DG A 7 -3.984 9.862 1.054 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.920 9.478 2.411 1.00 0.00 H new ATOM 222 P DC A 8 -4.736 12.798 -5.984 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.165 12.747 -6.363 1.00 0.00 O ATOM 224 OP2 DC A 8 -3.751 13.411 -6.901 1.00 0.00 O ATOM 225 O5' DC A 8 -4.618 13.513 -4.550 1.00 0.00 O ATOM 226 C5' DC A 8 -5.618 13.375 -3.558 1.00 0.00 C ATOM 227 C4' DC A 8 -5.115 13.963 -2.232 1.00 0.00 C ATOM 228 O4' DC A 8 -4.080 13.126 -1.725 1.00 0.00 O ATOM 229 C3' DC A 8 -4.513 15.373 -2.413 1.00 0.00 C ATOM 230 O3' DC A 8 -4.836 16.230 -1.337 1.00 0.00 O ATOM 231 C2' DC A 8 -3.026 15.045 -2.418 1.00 0.00 C ATOM 232 C1' DC A 8 -3.026 13.975 -1.325 1.00 0.00 C ATOM 233 N1 DC A 8 -1.728 13.317 -1.068 1.00 0.00 N ATOM 234 C2 DC A 8 -1.392 12.947 0.233 1.00 0.00 C ATOM 235 O2 DC A 8 -2.247 12.852 1.110 1.00 0.00 O ATOM 236 N3 DC A 8 -0.084 12.686 0.537 1.00 0.00 N ATOM 237 C4 DC A 8 0.866 12.839 -0.395 1.00 0.00 C ATOM 238 N4 DC A 8 2.122 12.549 -0.086 1.00 0.00 N ATOM 239 C5 DC A 8 0.537 13.248 -1.724 1.00 0.00 C ATOM 240 C6 DC A 8 -0.757 13.445 -1.998 1.00 0.00 C ATOM 0 H5' DC A 8 -5.872 12.323 -3.428 1.00 0.00 H new ATOM 0 H5'' DC A 8 -6.528 13.886 -3.872 1.00 0.00 H new ATOM 0 H4' DC A 8 -5.968 14.025 -1.556 1.00 0.00 H new ATOM 0 H3' DC A 8 -4.874 15.900 -3.296 1.00 0.00 H new ATOM 0 H2' DC A 8 -2.679 14.667 -3.380 1.00 0.00 H new ATOM 0 H2'' DC A 8 -2.402 15.904 -2.169 1.00 0.00 H new ATOM 0 HO3' DC A 8 -4.435 17.111 -1.489 1.00 0.00 H new ATOM 0 H1' DC A 8 -3.185 14.394 -0.331 1.00 0.00 H new ATOM 0 H41 DC A 8 2.858 12.660 -0.784 1.00 0.00 H new ATOM 0 H42 DC A 8 2.353 12.215 0.850 1.00 0.00 H new ATOM 0 H5 DC A 8 1.300 13.392 -2.475 1.00 0.00 H new ATOM 0 H6 DC A 8 -1.037 13.718 -3.005 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 4.073 12.298 9.479 1.00 0.00 O ATOM 255 C5' DG B 9 3.449 11.183 10.078 1.00 0.00 C ATOM 256 C4' DG B 9 1.946 11.449 10.208 1.00 0.00 C ATOM 257 O4' DG B 9 1.384 11.979 9.014 1.00 0.00 O ATOM 258 C3' DG B 9 1.178 10.182 10.512 1.00 0.00 C ATOM 259 O3' DG B 9 0.075 10.522 11.337 1.00 0.00 O ATOM 260 C2' DG B 9 0.787 9.689 9.122 1.00 0.00 C ATOM 261 C1' DG B 9 0.782 10.941 8.250 1.00 0.00 C ATOM 262 N9 DG B 9 1.475 10.821 6.940 1.00 0.00 N ATOM 263 C8 DG B 9 2.786 10.511 6.667 1.00 0.00 C ATOM 264 N7 DG B 9 3.132 10.671 5.423 1.00 0.00 N ATOM 265 C5 DG B 9 1.970 11.127 4.813 1.00 0.00 C ATOM 266 C6 DG B 9 1.734 11.522 3.463 1.00 0.00 C ATOM 267 O6 DG B 9 2.541 11.578 2.540 1.00 0.00 O ATOM 268 N1 DG B 9 0.415 11.875 3.228 1.00 0.00 N ATOM 269 C2 DG B 9 -0.561 11.885 4.193 1.00 0.00 C ATOM 270 N2 DG B 9 -1.798 12.209 3.835 1.00 0.00 N ATOM 271 N3 DG B 9 -0.341 11.564 5.474 1.00 0.00 N ATOM 272 C4 DG B 9 0.945 11.196 5.723 1.00 0.00 C ATOM 0 H5' DG B 9 3.882 10.994 11.060 1.00 0.00 H new ATOM 0 H5'' DG B 9 3.621 10.290 9.477 1.00 0.00 H new ATOM 0 H4' DG B 9 1.858 12.168 11.022 1.00 0.00 H new ATOM 0 H3' DG B 9 1.718 9.408 11.057 1.00 0.00 H new ATOM 0 H2' DG B 9 1.498 8.951 8.750 1.00 0.00 H new ATOM 0 H2'' DG B 9 -0.193 9.211 9.133 1.00 0.00 H new ATOM 0 HO5' DG B 9 3.422 12.779 8.926 1.00 0.00 H new ATOM 0 H1' DG B 9 -0.256 11.141 7.985 1.00 0.00 H new ATOM 0 H8 DG B 9 3.473 10.163 7.424 1.00 0.00 H new ATOM 0 H1 DG B 9 0.153 12.144 2.280 1.00 0.00 H new ATOM 0 H21 DG B 9 -2.543 12.224 4.532 1.00 0.00 H new ATOM 0 H22 DG B 9 -2.003 12.442 2.863 1.00 0.00 H new ATOM 285 P DC B 10 -0.922 9.422 11.966 1.00 0.00 P ATOM 286 OP1 DC B 10 -1.623 10.038 13.113 1.00 0.00 O ATOM 287 OP2 DC B 10 -0.166 8.165 12.151 1.00 0.00 O ATOM 288 O5' DC B 10 -1.985 9.221 10.777 1.00 0.00 O ATOM 289 C5' DC B 10 -2.831 10.280 10.380 1.00 0.00 C ATOM 290 C4' DC B 10 -3.464 9.971 9.022 1.00 0.00 C ATOM 291 O4' DC B 10 -2.487 9.965 7.992 1.00 0.00 O ATOM 292 C3' DC B 10 -4.157 8.601 8.983 1.00 0.00 C ATOM 293 O3' DC B 10 -5.503 8.830 8.616 1.00 0.00 O ATOM 294 C2' DC B 10 -3.333 7.851 7.923 1.00 0.00 C ATOM 295 C1' DC B 10 -2.867 8.992 7.040 1.00 0.00 C ATOM 296 N1 DC B 10 -1.770 8.650 6.095 1.00 0.00 N ATOM 297 C2 DC B 10 -1.892 8.934 4.733 1.00 0.00 C ATOM 298 O2 DC B 10 -2.948 9.347 4.257 1.00 0.00 O ATOM 299 N3 DC B 10 -0.816 8.751 3.907 1.00 0.00 N ATOM 300 C4 DC B 10 0.315 8.225 4.396 1.00 0.00 C ATOM 301 N4 DC B 10 1.392 8.188 3.620 1.00 0.00 N ATOM 302 C5 DC B 10 0.440 7.863 5.773 1.00 0.00 C ATOM 303 C6 DC B 10 -0.617 8.108 6.571 1.00 0.00 C ATOM 0 H5' DC B 10 -2.261 11.207 10.321 1.00 0.00 H new ATOM 0 H5'' DC B 10 -3.611 10.432 11.127 1.00 0.00 H new ATOM 0 H4' DC B 10 -4.202 10.758 8.867 1.00 0.00 H new ATOM 0 H3' DC B 10 -4.192 8.031 9.912 1.00 0.00 H new ATOM 0 H2' DC B 10 -2.498 7.305 8.363 1.00 0.00 H new ATOM 0 H2'' DC B 10 -3.934 7.126 7.374 1.00 0.00 H new ATOM 0 H1' DC B 10 -3.644 9.319 6.349 1.00 0.00 H new ATOM 0 H41 DC B 10 2.262 7.791 3.974 1.00 0.00 H new ATOM 0 H42 DC B 10 1.349 8.556 2.670 1.00 0.00 H new ATOM 0 H5 DC B 10 1.343 7.412 6.157 1.00 0.00 H new ATOM 0 H6 DC B 10 -0.547 7.867 7.621 1.00 0.00 H new ATOM 315 P DG B 11 -6.553 7.633 8.417 1.00 0.00 P ATOM 316 OP1 DG B 11 -7.900 8.133 8.767 1.00 0.00 O ATOM 317 OP2 DG B 11 -6.021 6.426 9.083 1.00 0.00 O ATOM 318 O5' DG B 11 -6.489 7.414 6.822 1.00 0.00 O ATOM 319 C5' DG B 11 -6.956 8.399 5.920 1.00 0.00 C ATOM 320 C4' DG B 11 -7.570 7.757 4.665 1.00 0.00 C ATOM 321 O4' DG B 11 -6.561 7.544 3.703 1.00 0.00 O ATOM 322 C3' DG B 11 -8.225 6.398 4.937 1.00 0.00 C ATOM 323 O3' DG B 11 -9.335 6.249 4.071 1.00 0.00 O ATOM 324 C2' DG B 11 -7.071 5.440 4.663 1.00 0.00 C ATOM 325 C1' DG B 11 -6.295 6.164 3.563 1.00 0.00 C ATOM 326 N9 DG B 11 -4.834 5.991 3.644 1.00 0.00 N ATOM 327 C8 DG B 11 -4.058 5.737 4.738 1.00 0.00 C ATOM 328 N7 DG B 11 -2.775 5.792 4.518 1.00 0.00 N ATOM 329 C5 DG B 11 -2.693 6.083 3.157 1.00 0.00 C ATOM 330 C6 DG B 11 -1.563 6.170 2.289 1.00 0.00 C ATOM 331 O6 DG B 11 -0.376 6.033 2.573 1.00 0.00 O ATOM 332 N1 DG B 11 -1.918 6.444 0.978 1.00 0.00 N ATOM 333 C2 DG B 11 -3.215 6.575 0.535 1.00 0.00 C ATOM 334 N2 DG B 11 -3.444 6.824 -0.747 1.00 0.00 N ATOM 335 N3 DG B 11 -4.280 6.439 1.326 1.00 0.00 N ATOM 336 C4 DG B 11 -3.950 6.204 2.619 1.00 0.00 C ATOM 0 H5' DG B 11 -6.132 9.052 5.632 1.00 0.00 H new ATOM 0 H5'' DG B 11 -7.700 9.024 6.413 1.00 0.00 H new ATOM 0 H4' DG B 11 -8.337 8.449 4.317 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.637 6.241 5.934 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.460 5.276 5.551 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.424 4.462 4.335 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.617 5.743 2.611 1.00 0.00 H new ATOM 0 H8 DG B 11 -4.474 5.509 5.708 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.168 6.556 0.295 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.402 6.923 -1.084 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.663 6.917 -1.396 1.00 0.00 H new ATOM 348 P DT B 12 -10.296 4.959 4.135 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.626 5.346 3.618 1.00 0.00 O ATOM 350 OP2 DT B 12 -10.173 4.359 5.481 1.00 0.00 O ATOM 351 O5' DT B 12 -9.597 3.982 3.067 1.00 0.00 O ATOM 352 C5' DT B 12 -9.949 4.029 1.701 1.00 0.00 C ATOM 353 C4' DT B 12 -8.987 3.180 0.870 1.00 0.00 C ATOM 354 O4' DT B 12 -7.760 3.839 0.602 1.00 0.00 O ATOM 355 C3' DT B 12 -8.672 1.806 1.458 1.00 0.00 C ATOM 356 O3' DT B 12 -9.643 0.828 1.126 1.00 0.00 O ATOM 357 C2' DT B 12 -7.379 1.582 0.687 1.00 0.00 C ATOM 358 C1' DT B 12 -6.862 2.881 0.057 1.00 0.00 C ATOM 359 N1 DT B 12 -5.525 3.114 0.612 1.00 0.00 N ATOM 360 C2 DT B 12 -4.359 3.360 -0.116 1.00 0.00 C ATOM 361 O2 DT B 12 -4.357 3.567 -1.324 1.00 0.00 O ATOM 362 N3 DT B 12 -3.179 3.355 0.631 1.00 0.00 N ATOM 363 C4 DT B 12 -3.099 3.145 2.001 1.00 0.00 C ATOM 364 O4 DT B 12 -2.028 3.204 2.586 1.00 0.00 O ATOM 365 C5 DT B 12 -4.370 2.861 2.633 1.00 0.00 C ATOM 366 C7 DT B 12 -4.564 2.511 4.067 1.00 0.00 C ATOM 367 C6 DT B 12 -5.491 2.862 1.926 1.00 0.00 C ATOM 0 H5' DT B 12 -9.929 5.061 1.350 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.969 3.667 1.570 1.00 0.00 H new ATOM 0 H4' DT B 12 -9.541 3.029 -0.057 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.632 1.746 2.546 1.00 0.00 H new ATOM 0 H2' DT B 12 -6.621 1.176 1.357 1.00 0.00 H new ATOM 0 H2'' DT B 12 -7.545 0.840 -0.094 1.00 0.00 H new ATOM 0 H1' DT B 12 -6.809 2.894 -1.032 1.00 0.00 H new ATOM 0 H3 DT B 12 -2.306 3.519 0.130 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.543 2.858 4.397 1.00 0.00 H new ATOM 0 H72 DT B 12 -4.502 1.430 4.189 1.00 0.00 H new ATOM 0 H73 DT B 12 -3.789 2.989 4.666 1.00 0.00 H new ATOM 0 H6 DT B 12 -6.420 2.650 2.434 1.00 0.00 H new ATOM 380 P DA B 13 -9.401 -0.740 1.450 1.00 0.00 P ATOM 381 OP1 DA B 13 -10.522 -1.506 0.863 1.00 0.00 O ATOM 382 OP2 DA B 13 -9.100 -0.860 2.892 1.00 0.00 O ATOM 383 O5' DA B 13 -8.059 -1.087 0.614 1.00 0.00 O ATOM 384 C5' DA B 13 -8.034 -1.002 -0.799 1.00 0.00 C ATOM 385 C4' DA B 13 -6.617 -0.761 -1.386 1.00 0.00 C ATOM 386 O4' DA B 13 -5.523 -0.978 -0.534 1.00 0.00 O ATOM 387 C3' DA B 13 -6.520 -1.775 -2.519 1.00 0.00 C ATOM 388 O3' DA B 13 -5.742 -1.249 -3.584 1.00 0.00 O ATOM 389 C2' DA B 13 -5.871 -2.899 -1.680 1.00 0.00 C ATOM 390 C1' DA B 13 -4.788 -2.094 -0.987 1.00 0.00 C ATOM 391 N9 DA B 13 -4.247 -2.666 0.245 1.00 0.00 N ATOM 392 C8 DA B 13 -4.865 -2.662 1.462 1.00 0.00 C ATOM 393 N7 DA B 13 -4.081 -2.942 2.468 1.00 0.00 N ATOM 394 C5 DA B 13 -2.835 -3.090 1.860 1.00 0.00 C ATOM 395 C6 DA B 13 -1.533 -3.295 2.351 1.00 0.00 C ATOM 396 N6 DA B 13 -1.252 -3.413 3.647 1.00 0.00 N ATOM 397 N1 DA B 13 -0.512 -3.286 1.484 1.00 0.00 N ATOM 398 C2 DA B 13 -0.746 -3.084 0.194 1.00 0.00 C ATOM 399 N3 DA B 13 -1.912 -2.882 -0.395 1.00 0.00 N ATOM 400 C4 DA B 13 -2.924 -2.893 0.508 1.00 0.00 C ATOM 0 H5' DA B 13 -8.691 -0.193 -1.117 1.00 0.00 H new ATOM 0 H5'' DA B 13 -8.438 -1.924 -1.217 1.00 0.00 H new ATOM 0 H4' DA B 13 -6.542 0.295 -1.647 1.00 0.00 H new ATOM 0 H3' DA B 13 -7.419 -2.082 -3.053 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.569 -3.355 -0.978 1.00 0.00 H new ATOM 0 H2'' DA B 13 -5.467 -3.703 -2.296 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.950 -1.967 -1.672 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.916 -2.445 1.583 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.289 -3.561 3.949 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.000 -3.356 4.338 1.00 0.00 H new ATOM 0 H2 DA B 13 0.119 -3.085 -0.452 1.00 0.00 H new ATOM 412 P DC B 14 -5.862 -1.815 -5.099 1.00 0.00 P ATOM 413 OP1 DC B 14 -6.076 -0.663 -5.999 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.833 -2.931 -5.095 1.00 0.00 O ATOM 415 O5' DC B 14 -4.406 -2.437 -5.389 1.00 0.00 O ATOM 416 C5' DC B 14 -3.873 -3.382 -4.495 1.00 0.00 C ATOM 417 C4' DC B 14 -2.425 -3.747 -4.798 1.00 0.00 C ATOM 418 O4' DC B 14 -1.769 -3.844 -3.542 1.00 0.00 O ATOM 419 C3' DC B 14 -2.327 -5.102 -5.499 1.00 0.00 C ATOM 420 O3' DC B 14 -1.233 -5.106 -6.404 1.00 0.00 O ATOM 421 C2' DC B 14 -2.117 -6.029 -4.319 1.00 0.00 C ATOM 422 C1' DC B 14 -1.408 -5.183 -3.279 1.00 0.00 C ATOM 423 N1 DC B 14 -1.787 -5.652 -1.933 1.00 0.00 N ATOM 424 C2 DC B 14 -0.806 -6.111 -1.072 1.00 0.00 C ATOM 425 O2 DC B 14 0.342 -6.316 -1.452 1.00 0.00 O ATOM 426 N3 DC B 14 -1.120 -6.339 0.227 1.00 0.00 N ATOM 427 C4 DC B 14 -2.379 -6.194 0.648 1.00 0.00 C ATOM 428 N4 DC B 14 -2.572 -6.275 1.958 1.00 0.00 N ATOM 429 C5 DC B 14 -3.441 -5.821 -0.252 1.00 0.00 C ATOM 430 C6 DC B 14 -3.082 -5.580 -1.530 1.00 0.00 C ATOM 0 H5' DC B 14 -4.482 -4.285 -4.526 1.00 0.00 H new ATOM 0 H5'' DC B 14 -3.937 -2.989 -3.480 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.980 -2.998 -5.453 1.00 0.00 H new ATOM 0 H3' DC B 14 -3.187 -5.378 -6.109 1.00 0.00 H new ATOM 0 H2' DC B 14 -3.066 -6.407 -3.940 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.518 -6.895 -4.599 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.322 -5.264 -3.324 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.511 -6.173 2.342 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.781 -6.440 2.581 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.466 -5.739 0.078 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.844 -5.323 -2.251 1.00 0.00 H new ATOM 442 P DG B 15 -0.827 -6.413 -7.270 1.00 0.00 P ATOM 443 OP1 DG B 15 -0.263 -5.947 -8.555 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.982 -7.337 -7.273 1.00 0.00 O ATOM 445 O5' DG B 15 0.362 -7.102 -6.410 1.00 0.00 O ATOM 446 C5' DG B 15 1.627 -6.478 -6.318 1.00 0.00 C ATOM 447 C4' DG B 15 2.691 -7.321 -5.602 1.00 0.00 C ATOM 448 O4' DG B 15 2.307 -7.585 -4.266 1.00 0.00 O ATOM 449 C3' DG B 15 2.954 -8.673 -6.274 1.00 0.00 C ATOM 450 O3' DG B 15 4.357 -8.884 -6.221 1.00 0.00 O ATOM 451 C2' DG B 15 2.123 -9.615 -5.419 1.00 0.00 C ATOM 452 C1' DG B 15 2.273 -8.985 -4.043 1.00 0.00 C ATOM 453 N9 DG B 15 1.190 -9.250 -3.075 1.00 0.00 N ATOM 454 C8 DG B 15 -0.166 -9.252 -3.268 1.00 0.00 C ATOM 455 N7 DG B 15 -0.862 -9.312 -2.166 1.00 0.00 N ATOM 456 C5 DG B 15 0.105 -9.340 -1.160 1.00 0.00 C ATOM 457 C6 DG B 15 -0.013 -9.380 0.265 1.00 0.00 C ATOM 458 O6 DG B 15 -1.033 -9.470 0.943 1.00 0.00 O ATOM 459 N1 DG B 15 1.215 -9.303 0.911 1.00 0.00 N ATOM 460 C2 DG B 15 2.423 -9.292 0.264 1.00 0.00 C ATOM 461 N2 DG B 15 3.531 -9.267 0.993 1.00 0.00 N ATOM 462 N3 DG B 15 2.550 -9.304 -1.065 1.00 0.00 N ATOM 463 C4 DG B 15 1.358 -9.298 -1.714 1.00 0.00 C ATOM 0 H5' DG B 15 1.515 -5.530 -5.792 1.00 0.00 H new ATOM 0 H5'' DG B 15 1.979 -6.245 -7.323 1.00 0.00 H new ATOM 0 H4' DG B 15 3.602 -6.724 -5.647 1.00 0.00 H new ATOM 0 H3' DG B 15 2.682 -8.788 -7.323 1.00 0.00 H new ATOM 0 H2' DG B 15 1.083 -9.653 -5.742 1.00 0.00 H new ATOM 0 H2'' DG B 15 2.502 -10.637 -5.446 1.00 0.00 H new ATOM 0 H1' DG B 15 3.166 -9.420 -3.594 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.620 -9.208 -4.247 1.00 0.00 H new ATOM 0 H1 DG B 15 1.217 -9.251 1.930 1.00 0.00 H new ATOM 0 H21 DG B 15 4.443 -9.258 0.535 1.00 0.00 H new ATOM 0 H22 DG B 15 3.471 -9.256 2.011 1.00 0.00 H new ATOM 475 P DC B 16 5.079 -10.188 -6.829 1.00 0.00 P ATOM 476 OP1 DC B 16 6.442 -9.804 -7.256 1.00 0.00 O ATOM 477 OP2 DC B 16 4.153 -10.813 -7.797 1.00 0.00 O ATOM 478 O5' DC B 16 5.203 -11.145 -5.542 1.00 0.00 O ATOM 479 C5' DC B 16 6.236 -10.990 -4.587 1.00 0.00 C ATOM 480 C4' DC B 16 5.990 -11.922 -3.390 1.00 0.00 C ATOM 481 O4' DC B 16 4.846 -11.462 -2.677 1.00 0.00 O ATOM 482 C3' DC B 16 5.699 -13.373 -3.830 1.00 0.00 C ATOM 483 O3' DC B 16 6.292 -14.322 -2.967 1.00 0.00 O ATOM 484 C2' DC B 16 4.183 -13.402 -3.713 1.00 0.00 C ATOM 485 C1' DC B 16 4.042 -12.592 -2.422 1.00 0.00 C ATOM 486 N1 DC B 16 2.656 -12.322 -1.987 1.00 0.00 N ATOM 487 C2 DC B 16 2.323 -12.352 -0.631 1.00 0.00 C ATOM 488 O2 DC B 16 3.179 -12.302 0.250 1.00 0.00 O ATOM 489 N3 DC B 16 1.007 -12.439 -0.276 1.00 0.00 N ATOM 490 C4 DC B 16 0.058 -12.553 -1.216 1.00 0.00 C ATOM 491 N4 DC B 16 -1.212 -12.614 -0.843 1.00 0.00 N ATOM 492 C5 DC B 16 0.392 -12.549 -2.605 1.00 0.00 C ATOM 493 C6 DC B 16 1.683 -12.408 -2.916 1.00 0.00 C ATOM 0 H5' DC B 16 6.278 -9.954 -4.249 1.00 0.00 H new ATOM 0 H5'' DC B 16 7.200 -11.216 -5.042 1.00 0.00 H new ATOM 0 H4' DC B 16 6.892 -11.911 -2.779 1.00 0.00 H new ATOM 0 H3' DC B 16 6.093 -13.625 -4.815 1.00 0.00 H new ATOM 0 H2' DC B 16 3.684 -12.936 -4.562 1.00 0.00 H new ATOM 0 H2'' DC B 16 3.784 -14.413 -3.625 1.00 0.00 H new ATOM 0 HO3' DC B 16 6.081 -15.226 -3.281 1.00 0.00 H new ATOM 0 H1' DC B 16 4.375 -13.141 -1.541 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.946 -12.701 -1.546 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.455 -12.574 0.147 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.365 -12.655 -3.368 1.00 0.00 H new ATOM 0 H6 DC B 16 1.960 -12.361 -3.959 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO A 9 -0.955 0.194 -0.682 1.00 0.00 O HETATM 508 C2 PSO A 9 -2.200 0.297 -0.387 1.00 0.00 C HETATM 509 C3 PSO A 9 -2.689 0.266 0.928 1.00 0.00 C HETATM 510 C4 PSO A 9 -1.773 0.134 1.964 1.00 0.00 C HETATM 511 C5 PSO A 9 0.585 0.192 2.611 1.00 0.00 C HETATM 512 C6 PSO A 9 1.930 0.253 2.220 1.00 0.00 C HETATM 513 C7 PSO A 9 2.283 0.176 0.919 1.00 0.00 C HETATM 514 C8 PSO A 9 1.286 0.061 -0.079 1.00 0.00 C HETATM 515 C9 PSO A 9 -0.086 0.147 0.273 1.00 0.00 C HETATM 516 C10 PSO A 9 -0.418 0.161 1.622 1.00 0.00 C HETATM 517 C4' PSO A 9 3.124 0.113 3.119 1.00 0.00 C HETATM 518 C5' PSO A 9 4.178 0.029 2.027 1.00 0.00 C HETATM 519 O6' PSO A 9 3.533 0.174 0.733 1.00 0.00 O HETATM 520 O11 PSO A 9 -3.006 0.430 -1.305 1.00 0.00 O HETATM 521 C12 PSO A 9 -2.224 -0.032 3.395 1.00 0.00 C HETATM 522 C13 PSO A 9 3.213 1.208 4.201 1.00 0.00 C HETATM 523 O14 PSO A 9 2.343 2.301 3.966 1.00 0.00 O HETATM 524 C15 PSO A 9 5.384 0.878 2.402 1.00 0.00 C HETATM 525 C16 PSO A 9 1.667 -0.158 -1.532 1.00 0.00 C HETATM 0 H163 PSO A 9 2.280 0.675 -1.877 1.00 0.00 H new HETATM 0 H162 PSO A 9 2.231 -1.086 -1.624 1.00 0.00 H new HETATM 0 H161 PSO A 9 0.764 -0.220 -2.140 1.00 0.00 H new HETATM 0 H153 PSO A 9 5.075 1.916 2.523 1.00 0.00 H new HETATM 0 H152 PSO A 9 5.808 0.515 3.338 1.00 0.00 H new HETATM 0 H151 PSO A 9 6.134 0.812 1.614 1.00 0.00 H new HETATM 0 H132 PSO A 9 2.980 0.770 5.171 1.00 0.00 H new HETATM 0 H131 PSO A 9 4.238 1.574 4.254 1.00 0.00 H new HETATM 0 H123 PSO A 9 -2.815 0.834 3.693 1.00 0.00 H new HETATM 0 H122 PSO A 9 -2.831 -0.933 3.483 1.00 0.00 H new HETATM 0 H121 PSO A 9 -1.352 -0.118 4.044 1.00 0.00 H new HETATM 0 H5 PSO A 9 0.318 0.169 3.668 1.00 0.00 H new HETATM 0 H3 PSO A 9 -3.757 0.343 1.131 1.00 0.00 H new HETATM 0 H14 PSO A 9 2.871 3.103 3.770 1.00 0.00 H new