USER MOD reduce.3.24.130724 H: found=0, std=0, add=294, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 301 hydrogens (51 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 G O2' : rot -94:sc= 0.335 USER MOD Single : A 4 G O5' : rot 32:sc= 0.0176 USER MOD Single : A 5 G O2' : rot 30:sc= 0.894 USER MOD Single : A 6 A O2' : rot 115:sc= 1.19 USER MOD Single : A 7 C O2' : rot -17:sc= 0.0743 USER MOD Single : A 8 U O2' : rot 180:sc= 0 USER MOD Single : A 9 G O2' : rot -13:sc= 0.701 USER MOD Single : A 10 G O2' : rot -7:sc= 0.106 USER MOD Single : A 11 G O2' : rot -17:sc= 0.124 USER MOD Single : A 12 C O2' : rot -25:sc= 0.111 USER MOD Single : A 13 G O2' : rot -21:sc= 0.0035 USER MOD Single : A 14 A O2' : rot -14:sc= 0.0948 USER MOD Single : A 15 G O2' : rot -108:sc= 1.33 USER MOD Single : A 16 A O2' : rot 14:sc= 0.0589 USER MOD Single : A 17 A O2' : rot -18:sc= 0.0871 USER MOD Single : A 18 G O2' : rot -17:sc= 0.0221 USER MOD Single : A 19 U O2' : rot -15:sc= 0.0919 USER MOD Single : A 20 U O2' : rot -24:sc= 0.0501 USER MOD Single : A 21 U O2' : rot -29:sc= 0.0417 USER MOD Single : A 22 A O2' : rot -28:sc= 0.0294 USER MOD Single : A 23 G O2' : rot -28:sc= 0.0587 USER MOD Single : A 24 U O2' : rot -23:sc= 0.0349 USER MOD Single : A 25 C O2' : rot -82:sc= 0.26 USER MOD Single : A 26 C O2' : rot -16:sc= 0.0677 USER MOD Single : A 26 C O3' : rot 180:sc= 0.0734 USER MOD Single : A 27 BDG O3 : rot 33:sc= 0.725 USER MOD Single : A 27 BDG O4 : rot 151:sc= 0.00168 USER MOD Single : A 28 NEB N1 :NH3+ 147:sc= 0.909 (180deg=0.158) USER MOD Single : A 28 NEB O6 : rot 140:sc= 0 USER MOD Single : A 29 BDR O2 : rot -136:sc= 0.00758 USER MOD Single : A 29 BDR O5 : rot 5:sc= 0.955 USER MOD Single : A 30 IDG O3 : rot -54:sc= 0.65 USER MOD Single : A 30 IDG O4 : rot 180:sc= -0.0909 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 4 7.990 8.076 -8.144 1.00 0.70 O ATOM 2 C5' G A 4 7.343 9.288 -7.756 1.00 0.58 C ATOM 3 C4' G A 4 7.745 9.721 -6.334 1.00 0.43 C ATOM 4 O4' G A 4 7.231 11.058 -6.044 1.00 0.45 O ATOM 5 C3' G A 4 7.122 8.892 -5.213 1.00 0.34 C ATOM 6 O3' G A 4 7.761 7.624 -5.054 1.00 0.37 O ATOM 7 C2' G A 4 7.264 9.822 -3.999 1.00 0.28 C ATOM 8 O2' G A 4 8.522 9.704 -3.325 1.00 0.31 O ATOM 9 C1' G A 4 7.093 11.221 -4.618 1.00 0.35 C ATOM 10 N9 G A 4 5.818 11.949 -4.293 1.00 0.32 N ATOM 11 C8 G A 4 4.802 12.295 -5.137 1.00 0.38 C ATOM 12 N7 G A 4 3.814 12.952 -4.580 1.00 0.37 N ATOM 13 C5 G A 4 4.174 13.061 -3.263 1.00 0.30 C ATOM 14 C6 G A 4 3.473 13.678 -2.209 1.00 0.29 C ATOM 15 O6 G A 4 2.372 14.237 -2.297 1.00 0.33 O ATOM 16 N1 G A 4 4.186 13.580 -0.990 1.00 0.26 N ATOM 17 C2 G A 4 5.424 12.958 -0.808 1.00 0.26 C ATOM 18 N2 G A 4 5.872 13.020 0.466 1.00 0.31 N ATOM 19 N3 G A 4 6.074 12.379 -1.846 1.00 0.27 N ATOM 20 C4 G A 4 5.414 12.455 -3.034 1.00 0.29 C ATOM 0 H5' G A 4 6.262 9.154 -7.803 1.00 0.58 H new ATOM 0 H5'' G A 4 7.598 10.078 -8.462 1.00 0.58 H new ATOM 0 H4' G A 4 8.831 9.624 -6.344 1.00 0.43 H new ATOM 0 H3' G A 4 6.086 8.607 -5.396 1.00 0.34 H new ATOM 0 H2' G A 4 6.538 9.584 -3.222 1.00 0.28 H new ATOM 0 HO2' G A 4 8.438 9.066 -2.585 1.00 0.31 H new ATOM 0 HO5' G A 4 8.133 7.514 -7.354 1.00 0.70 H new ATOM 0 H1' G A 4 7.857 11.861 -4.176 1.00 0.35 H new ATOM 0 H8 G A 4 4.812 12.045 -6.188 1.00 0.38 H new ATOM 0 H1 G A 4 3.756 14.003 -0.168 1.00 0.26 H new ATOM 0 H21 G A 4 6.767 12.598 0.713 1.00 0.31 H new ATOM 0 H22 G A 4 5.315 13.489 1.180 1.00 0.31 H new ATOM 33 P G A 5 7.012 6.220 -5.099 1.00 0.32 P ATOM 34 OP1 G A 5 7.855 5.266 -5.853 1.00 0.34 O ATOM 35 OP2 G A 5 5.635 6.428 -5.599 1.00 0.34 O ATOM 36 O5' G A 5 6.905 5.770 -3.580 1.00 0.37 O ATOM 37 C5' G A 5 8.025 5.766 -2.690 1.00 0.34 C ATOM 38 C4' G A 5 7.750 6.565 -1.384 1.00 0.26 C ATOM 39 O4' G A 5 7.033 7.825 -1.676 1.00 0.27 O ATOM 40 C3' G A 5 6.870 5.837 -0.353 1.00 0.23 C ATOM 41 O3' G A 5 7.369 6.164 0.955 1.00 0.23 O ATOM 42 C2' G A 5 5.478 6.408 -0.668 1.00 0.21 C ATOM 43 O2' G A 5 4.517 6.236 0.362 1.00 0.23 O ATOM 44 C1' G A 5 5.816 7.879 -0.932 1.00 0.21 C ATOM 45 N9 G A 5 4.736 8.658 -1.615 1.00 0.21 N ATOM 46 C8 G A 5 4.331 8.653 -2.920 1.00 0.25 C ATOM 47 N7 G A 5 3.327 9.455 -3.188 1.00 0.26 N ATOM 48 C5 G A 5 3.022 10.031 -1.981 1.00 0.23 C ATOM 49 C6 G A 5 2.020 10.969 -1.678 1.00 0.25 C ATOM 50 O6 G A 5 1.212 11.449 -2.482 1.00 0.30 O ATOM 51 N1 G A 5 2.039 11.316 -0.305 1.00 0.25 N ATOM 52 C2 G A 5 2.919 10.806 0.655 1.00 0.23 C ATOM 53 N2 G A 5 2.718 11.301 1.888 1.00 0.26 N ATOM 54 N3 G A 5 3.860 9.906 0.331 1.00 0.20 N ATOM 55 C4 G A 5 3.871 9.559 -0.980 1.00 0.21 C ATOM 0 H5' G A 5 8.890 6.192 -3.198 1.00 0.34 H new ATOM 0 H5'' G A 5 8.280 4.737 -2.436 1.00 0.34 H new ATOM 0 H4' G A 5 8.746 6.718 -0.969 1.00 0.26 H new ATOM 0 H3' G A 5 6.856 4.748 -0.388 1.00 0.23 H new ATOM 0 H2' G A 5 4.987 5.897 -1.497 1.00 0.21 H new ATOM 0 HO2' G A 5 4.967 6.233 1.232 1.00 0.23 H new ATOM 0 H1' G A 5 5.920 8.432 0.001 1.00 0.21 H new ATOM 0 H8 G A 5 4.801 8.037 -3.673 1.00 0.25 H new ATOM 0 H1 G A 5 1.350 11.998 0.012 1.00 0.25 H new ATOM 0 H21 G A 5 3.306 10.995 2.663 1.00 0.26 H new ATOM 0 H22 G A 5 1.977 11.983 2.049 1.00 0.26 H new ATOM 67 P A A 6 7.132 5.292 2.248 1.00 0.25 P ATOM 68 OP1 A A 6 8.232 5.542 3.208 1.00 0.31 O ATOM 69 OP2 A A 6 6.870 3.882 1.874 1.00 0.30 O ATOM 70 O5' A A 6 5.768 5.867 2.800 1.00 0.25 O ATOM 71 C5' A A 6 5.636 6.878 3.789 1.00 0.25 C ATOM 72 C4' A A 6 4.154 7.160 4.150 1.00 0.23 C ATOM 73 O4' A A 6 3.470 7.840 3.033 1.00 0.23 O ATOM 74 C3' A A 6 3.295 5.899 4.450 1.00 0.22 C ATOM 75 O3' A A 6 2.573 6.074 5.670 1.00 0.30 O ATOM 76 C2' A A 6 2.343 5.831 3.247 1.00 0.22 C ATOM 77 O2' A A 6 1.182 5.026 3.447 1.00 0.26 O ATOM 78 C1' A A 6 2.142 7.341 2.971 1.00 0.21 C ATOM 79 N9 A A 6 1.465 7.728 1.695 1.00 0.19 N ATOM 80 C8 A A 6 1.525 7.162 0.447 1.00 0.21 C ATOM 81 N7 A A 6 0.751 7.725 -0.451 1.00 0.21 N ATOM 82 C5 A A 6 0.137 8.744 0.230 1.00 0.18 C ATOM 83 C6 A A 6 -0.802 9.697 -0.208 1.00 0.18 C ATOM 84 N6 A A 6 -1.241 9.724 -1.497 1.00 0.22 N ATOM 85 N1 A A 6 -1.234 10.571 0.742 1.00 0.19 N ATOM 86 C2 A A 6 -0.771 10.504 1.991 1.00 0.18 C ATOM 87 N3 A A 6 0.109 9.656 2.502 1.00 0.17 N ATOM 88 C4 A A 6 0.543 8.781 1.556 1.00 0.17 C ATOM 0 H5' A A 6 6.101 7.796 3.431 1.00 0.25 H new ATOM 0 H5'' A A 6 6.175 6.577 4.687 1.00 0.25 H new ATOM 0 H4' A A 6 4.223 7.764 5.055 1.00 0.23 H new ATOM 0 H3' A A 6 3.882 4.989 4.575 1.00 0.22 H new ATOM 0 H2' A A 6 2.722 5.298 2.375 1.00 0.22 H new ATOM 0 HO2' A A 6 0.382 5.592 3.416 1.00 0.26 H new ATOM 0 H1' A A 6 1.441 7.759 3.694 1.00 0.21 H new ATOM 0 H8 A A 6 2.160 6.318 0.221 1.00 0.21 H new ATOM 0 H61 A A 6 -1.922 10.425 -1.789 1.00 0.22 H new ATOM 0 H62 A A 6 -0.889 9.043 -2.170 1.00 0.22 H new ATOM 0 H2 A A 6 -1.166 11.239 2.677 1.00 0.18 H new ATOM 100 P C A 7 2.504 4.983 6.814 1.00 0.19 P ATOM 101 OP1 C A 7 3.704 5.065 7.680 1.00 0.31 O ATOM 102 OP2 C A 7 2.182 3.647 6.248 1.00 0.26 O ATOM 103 O5' C A 7 1.223 5.460 7.595 1.00 0.28 O ATOM 104 C5' C A 7 1.186 6.648 8.386 1.00 0.25 C ATOM 105 C4' C A 7 -0.037 7.537 8.075 1.00 0.22 C ATOM 106 O4' C A 7 -0.017 8.012 6.699 1.00 0.27 O ATOM 107 C3' C A 7 -1.396 6.848 8.146 1.00 0.23 C ATOM 108 O3' C A 7 -1.805 6.580 9.494 1.00 0.25 O ATOM 109 C2' C A 7 -2.305 7.840 7.413 1.00 0.27 C ATOM 110 O2' C A 7 -2.762 8.885 8.278 1.00 0.35 O ATOM 111 C1' C A 7 -1.350 8.414 6.325 1.00 0.24 C ATOM 112 N1 C A 7 -1.665 8.061 4.888 1.00 0.22 N ATOM 113 C2 C A 7 -2.761 8.752 4.248 1.00 0.22 C ATOM 114 O2 C A 7 -3.468 9.584 4.847 1.00 0.26 O ATOM 115 N3 C A 7 -3.040 8.461 2.933 1.00 0.23 N ATOM 116 C4 C A 7 -2.325 7.564 2.235 1.00 0.20 C ATOM 117 N4 C A 7 -2.601 7.293 0.937 1.00 0.21 N ATOM 118 C5 C A 7 -1.242 6.865 2.855 1.00 0.20 C ATOM 119 C6 C A 7 -0.943 7.129 4.136 1.00 0.22 C ATOM 0 H5' C A 7 2.098 7.220 8.216 1.00 0.25 H new ATOM 0 H5'' C A 7 1.172 6.376 9.441 1.00 0.25 H new ATOM 0 H4' C A 7 0.056 8.307 8.841 1.00 0.22 H new ATOM 0 H3' C A 7 -1.410 5.856 7.695 1.00 0.23 H new ATOM 0 H2' C A 7 -3.211 7.379 7.021 1.00 0.27 H new ATOM 0 HO2' C A 7 -2.631 8.618 9.212 1.00 0.35 H new ATOM 0 H1' C A 7 -1.477 9.497 6.315 1.00 0.24 H new ATOM 0 H41 C A 7 -2.042 6.607 0.429 1.00 0.21 H new ATOM 0 H42 C A 7 -3.367 7.775 0.467 1.00 0.21 H new ATOM 0 H5 C A 7 -0.673 6.135 2.299 1.00 0.20 H new ATOM 0 H6 C A 7 -0.120 6.606 4.600 1.00 0.22 H new ATOM 131 P U A 8 -2.401 5.163 9.896 1.00 0.26 P ATOM 132 OP1 U A 8 -2.520 5.113 11.370 1.00 0.36 O ATOM 133 OP2 U A 8 -1.608 4.084 9.251 1.00 0.34 O ATOM 134 O5' U A 8 -3.864 5.266 9.280 1.00 0.27 O ATOM 135 C5' U A 8 -4.368 4.269 8.402 1.00 0.28 C ATOM 136 C4' U A 8 -5.744 4.674 7.851 1.00 0.25 C ATOM 137 O4' U A 8 -5.630 5.801 6.911 1.00 0.26 O ATOM 138 C3' U A 8 -6.392 3.579 7.002 1.00 0.25 C ATOM 139 O3' U A 8 -6.981 2.526 7.773 1.00 0.27 O ATOM 140 C2' U A 8 -7.382 4.380 6.149 1.00 0.25 C ATOM 141 O2' U A 8 -8.558 4.788 6.849 1.00 0.32 O ATOM 142 C1' U A 8 -6.490 5.586 5.769 1.00 0.23 C ATOM 143 N1 U A 8 -5.680 5.346 4.507 1.00 0.20 N ATOM 144 C2 U A 8 -6.383 5.396 3.258 1.00 0.22 C ATOM 145 O2 U A 8 -7.587 5.636 3.121 1.00 0.28 O ATOM 146 N3 U A 8 -5.582 5.142 2.136 1.00 0.21 N ATOM 147 C4 U A 8 -4.204 4.845 2.110 1.00 0.19 C ATOM 148 O4 U A 8 -3.612 4.650 1.045 1.00 0.21 O ATOM 149 C5 U A 8 -3.576 4.806 3.414 1.00 0.20 C ATOM 150 C6 U A 8 -4.308 5.049 4.519 1.00 0.21 C ATOM 0 H5' U A 8 -4.448 3.319 8.930 1.00 0.28 H new ATOM 0 H5'' U A 8 -3.671 4.118 7.578 1.00 0.28 H new ATOM 0 H4' U A 8 -6.330 4.902 8.741 1.00 0.25 H new ATOM 0 H3' U A 8 -5.681 3.014 6.399 1.00 0.25 H new ATOM 0 H2' U A 8 -7.797 3.815 5.315 1.00 0.25 H new ATOM 0 HO2' U A 8 -9.140 5.293 6.244 1.00 0.32 H new ATOM 0 H1' U A 8 -7.101 6.460 5.542 1.00 0.23 H new ATOM 0 H3 U A 8 -6.052 5.176 1.231 1.00 0.21 H new ATOM 0 H5 U A 8 -2.523 4.583 3.501 1.00 0.20 H new ATOM 0 H6 U A 8 -3.807 5.013 5.475 1.00 0.21 H new ATOM 161 P G A 9 -6.991 1.023 7.234 1.00 0.23 P ATOM 162 OP1 G A 9 -7.341 0.102 8.340 1.00 0.33 O ATOM 163 OP2 G A 9 -5.726 0.751 6.511 1.00 0.29 O ATOM 164 O5' G A 9 -8.163 1.040 6.154 1.00 0.27 O ATOM 165 C5' G A 9 -9.521 1.098 6.614 1.00 0.29 C ATOM 166 C4' G A 9 -10.541 1.491 5.523 1.00 0.27 C ATOM 167 O4' G A 9 -10.092 2.670 4.767 1.00 0.26 O ATOM 168 C3' G A 9 -10.843 0.456 4.434 1.00 0.29 C ATOM 169 O3' G A 9 -11.534 -0.702 4.896 1.00 0.39 O ATOM 170 C2' G A 9 -11.477 1.355 3.339 1.00 0.29 C ATOM 171 O2' G A 9 -12.806 1.829 3.637 1.00 0.36 O ATOM 172 C1' G A 9 -10.480 2.540 3.388 1.00 0.25 C ATOM 173 N9 G A 9 -9.256 2.432 2.527 1.00 0.23 N ATOM 174 C8 G A 9 -7.942 2.325 2.895 1.00 0.24 C ATOM 175 N7 G A 9 -7.097 2.262 1.895 1.00 0.24 N ATOM 176 C5 G A 9 -7.887 2.340 0.773 1.00 0.21 C ATOM 177 C6 G A 9 -7.510 2.325 -0.584 1.00 0.21 C ATOM 178 O6 G A 9 -6.359 2.233 -1.017 1.00 0.24 O ATOM 179 N1 G A 9 -8.632 2.427 -1.438 1.00 0.21 N ATOM 180 C2 G A 9 -9.962 2.531 -1.038 1.00 0.22 C ATOM 181 N2 G A 9 -10.825 2.609 -2.076 1.00 0.26 N ATOM 182 N3 G A 9 -10.290 2.542 0.271 1.00 0.22 N ATOM 183 C4 G A 9 -9.233 2.446 1.120 1.00 0.22 C ATOM 0 H5' G A 9 -9.586 1.816 7.432 1.00 0.29 H new ATOM 0 H5'' G A 9 -9.797 0.125 7.021 1.00 0.29 H new ATOM 0 H4' G A 9 -11.436 1.640 6.127 1.00 0.27 H new ATOM 0 H3' G A 9 -9.989 -0.087 4.030 1.00 0.29 H new ATOM 0 H2' G A 9 -11.608 0.837 2.389 1.00 0.29 H new ATOM 0 HO2' G A 9 -13.168 1.330 4.398 1.00 0.36 H new ATOM 0 H1' G A 9 -10.994 3.409 2.977 1.00 0.25 H new ATOM 0 H8 G A 9 -7.626 2.295 3.927 1.00 0.24 H new ATOM 0 H1 G A 9 -8.450 2.424 -2.442 1.00 0.21 H new ATOM 0 H21 G A 9 -11.827 2.688 -1.901 1.00 0.26 H new ATOM 0 H22 G A 9 -10.474 2.588 -3.034 1.00 0.26 H new ATOM 195 P G A 10 -13.036 -1.171 4.783 1.00 0.45 P ATOM 196 OP1 G A 10 -13.900 -0.087 5.304 1.00 0.53 O ATOM 197 OP2 G A 10 -13.174 -2.506 5.409 1.00 0.56 O ATOM 198 O5' G A 10 -13.271 -1.272 3.216 1.00 0.38 O ATOM 199 C5' G A 10 -12.729 -2.295 2.391 1.00 0.32 C ATOM 200 C4' G A 10 -12.579 -1.800 0.934 1.00 0.26 C ATOM 201 O4' G A 10 -11.320 -1.082 0.745 1.00 0.27 O ATOM 202 C3' G A 10 -12.458 -2.930 -0.084 1.00 0.22 C ATOM 203 O3' G A 10 -13.745 -3.463 -0.429 1.00 0.26 O ATOM 204 C2' G A 10 -11.702 -2.290 -1.269 1.00 0.22 C ATOM 205 O2' G A 10 -12.543 -1.924 -2.366 1.00 0.31 O ATOM 206 C1' G A 10 -11.021 -1.039 -0.658 1.00 0.20 C ATOM 207 N9 G A 10 -9.543 -0.945 -0.869 1.00 0.17 N ATOM 208 C8 G A 10 -8.561 -0.759 0.065 1.00 0.19 C ATOM 209 N7 G A 10 -7.346 -0.722 -0.432 1.00 0.19 N ATOM 210 C5 G A 10 -7.511 -0.878 -1.791 1.00 0.16 C ATOM 211 C6 G A 10 -6.537 -0.915 -2.814 1.00 0.19 C ATOM 212 O6 G A 10 -5.319 -0.793 -2.655 1.00 0.24 O ATOM 213 N1 G A 10 -7.127 -1.104 -4.093 1.00 0.18 N ATOM 214 C2 G A 10 -8.485 -1.235 -4.360 1.00 0.19 C ATOM 215 N2 G A 10 -8.750 -1.402 -5.677 1.00 0.25 N ATOM 216 N3 G A 10 -9.388 -1.193 -3.356 1.00 0.17 N ATOM 217 C4 G A 10 -8.860 -1.019 -2.110 1.00 0.15 C ATOM 0 H5' G A 10 -13.376 -3.172 2.418 1.00 0.32 H new ATOM 0 H5'' G A 10 -11.758 -2.604 2.777 1.00 0.32 H new ATOM 0 H4' G A 10 -13.473 -1.196 0.779 1.00 0.26 H new ATOM 0 H3' G A 10 -11.919 -3.799 0.293 1.00 0.22 H new ATOM 0 H2' G A 10 -11.001 -3.003 -1.702 1.00 0.22 H new ATOM 0 HO2' G A 10 -13.450 -2.261 -2.209 1.00 0.31 H new ATOM 0 H1' G A 10 -11.410 -0.155 -1.163 1.00 0.20 H new ATOM 0 H8 G A 10 -8.767 -0.652 1.120 1.00 0.19 H new ATOM 0 H1 G A 10 -6.494 -1.148 -4.891 1.00 0.18 H new ATOM 0 H21 G A 10 -9.714 -1.509 -5.994 1.00 0.25 H new ATOM 0 H22 G A 10 -7.986 -1.421 -6.353 1.00 0.25 H new ATOM 229 P G A 11 -13.974 -5.005 -0.723 1.00 0.31 P ATOM 230 OP1 G A 11 -15.424 -5.233 -0.913 1.00 0.43 O ATOM 231 OP2 G A 11 -13.287 -5.803 0.323 1.00 0.37 O ATOM 232 O5' G A 11 -13.236 -5.158 -2.130 1.00 0.30 O ATOM 233 C5' G A 11 -12.193 -6.105 -2.358 1.00 0.27 C ATOM 234 C4' G A 11 -11.348 -5.717 -3.590 1.00 0.27 C ATOM 235 O4' G A 11 -10.325 -4.731 -3.248 1.00 0.27 O ATOM 236 C3' G A 11 -10.531 -6.862 -4.182 1.00 0.25 C ATOM 237 O3' G A 11 -11.368 -7.735 -4.956 1.00 0.30 O ATOM 238 C2' G A 11 -9.475 -6.101 -5.012 1.00 0.26 C ATOM 239 O2' G A 11 -9.943 -5.837 -6.339 1.00 0.39 O ATOM 240 C1' G A 11 -9.284 -4.763 -4.235 1.00 0.24 C ATOM 241 N9 G A 11 -7.958 -4.495 -3.596 1.00 0.20 N ATOM 242 C8 G A 11 -7.676 -4.141 -2.299 1.00 0.21 C ATOM 243 N7 G A 11 -6.399 -3.946 -2.059 1.00 0.21 N ATOM 244 C5 G A 11 -5.779 -4.155 -3.264 1.00 0.18 C ATOM 245 C6 G A 11 -4.410 -4.075 -3.574 1.00 0.19 C ATOM 246 O6 G A 11 -3.510 -3.794 -2.780 1.00 0.20 O ATOM 247 N1 G A 11 -4.165 -4.374 -4.937 1.00 0.20 N ATOM 248 C2 G A 11 -5.130 -4.707 -5.883 1.00 0.21 C ATOM 249 N2 G A 11 -4.609 -4.945 -7.106 1.00 0.26 N ATOM 250 N3 G A 11 -6.438 -4.766 -5.557 1.00 0.21 N ATOM 251 C4 G A 11 -6.705 -4.493 -4.249 1.00 0.19 C ATOM 0 H5' G A 11 -12.623 -7.096 -2.506 1.00 0.27 H new ATOM 0 H5'' G A 11 -11.552 -6.164 -1.478 1.00 0.27 H new ATOM 0 H4' G A 11 -12.100 -5.360 -4.294 1.00 0.27 H new ATOM 0 H3' G A 11 -10.073 -7.532 -3.455 1.00 0.25 H new ATOM 0 H2' G A 11 -8.553 -6.671 -5.125 1.00 0.26 H new ATOM 0 HO2' G A 11 -10.710 -6.414 -6.536 1.00 0.39 H new ATOM 0 H1' G A 11 -9.330 -3.969 -4.980 1.00 0.24 H new ATOM 0 H8 G A 11 -8.438 -4.032 -1.542 1.00 0.21 H new ATOM 0 H1 G A 11 -3.196 -4.342 -5.253 1.00 0.20 H new ATOM 0 H21 G A 11 -5.222 -5.198 -7.881 1.00 0.26 H new ATOM 0 H22 G A 11 -3.603 -4.871 -7.255 1.00 0.26 H new ATOM 263 P C A 12 -11.163 -9.303 -5.066 1.00 0.28 P ATOM 264 OP1 C A 12 -12.352 -9.869 -5.739 1.00 0.36 O ATOM 265 OP2 C A 12 -10.812 -9.849 -3.732 1.00 0.32 O ATOM 266 O5' C A 12 -9.934 -9.370 -6.065 1.00 0.28 O ATOM 267 C5' C A 12 -8.855 -10.288 -5.957 1.00 0.27 C ATOM 268 C4' C A 12 -7.600 -9.719 -6.652 1.00 0.21 C ATOM 269 O4' C A 12 -7.144 -8.530 -5.946 1.00 0.21 O ATOM 270 C3' C A 12 -6.377 -10.634 -6.615 1.00 0.21 C ATOM 271 O3' C A 12 -6.401 -11.621 -7.650 1.00 0.23 O ATOM 272 C2' C A 12 -5.199 -9.645 -6.766 1.00 0.22 C ATOM 273 O2' C A 12 -4.891 -9.378 -8.136 1.00 0.29 O ATOM 274 C1' C A 12 -5.724 -8.357 -6.076 1.00 0.18 C ATOM 275 N1 C A 12 -5.097 -7.907 -4.760 1.00 0.15 N ATOM 276 C2 C A 12 -3.651 -7.735 -4.640 1.00 0.16 C ATOM 277 O2 C A 12 -2.849 -7.962 -5.567 1.00 0.20 O ATOM 278 N3 C A 12 -3.145 -7.289 -3.439 1.00 0.16 N ATOM 279 C4 C A 12 -3.946 -7.005 -2.394 1.00 0.15 C ATOM 280 N4 C A 12 -3.421 -6.572 -1.224 1.00 0.18 N ATOM 281 C5 C A 12 -5.370 -7.153 -2.501 1.00 0.16 C ATOM 282 C6 C A 12 -5.889 -7.583 -3.655 1.00 0.16 C ATOM 0 H5' C A 12 -9.131 -11.240 -6.411 1.00 0.27 H new ATOM 0 H5'' C A 12 -8.640 -10.486 -4.907 1.00 0.27 H new ATOM 0 H4' C A 12 -7.922 -9.557 -7.681 1.00 0.21 H new ATOM 0 H3' C A 12 -6.318 -11.227 -5.702 1.00 0.21 H new ATOM 0 H2' C A 12 -4.279 -10.037 -6.333 1.00 0.22 H new ATOM 0 HO2' C A 12 -5.190 -10.129 -8.691 1.00 0.29 H new ATOM 0 H1' C A 12 -5.422 -7.530 -6.718 1.00 0.18 H new ATOM 0 H41 C A 12 -4.035 -6.359 -0.437 1.00 0.18 H new ATOM 0 H42 C A 12 -2.412 -6.459 -1.129 1.00 0.18 H new ATOM 0 H5 C A 12 -6.011 -6.921 -1.663 1.00 0.16 H new ATOM 0 H6 C A 12 -6.961 -7.684 -3.737 1.00 0.16 H new ATOM 294 P G A 13 -6.655 -13.171 -7.423 1.00 0.30 P ATOM 295 OP1 G A 13 -6.739 -13.811 -8.755 1.00 0.41 O ATOM 296 OP2 G A 13 -7.814 -13.360 -6.516 1.00 0.36 O ATOM 297 O5' G A 13 -5.308 -13.648 -6.724 1.00 0.33 O ATOM 298 C5' G A 13 -5.192 -13.893 -5.324 1.00 0.34 C ATOM 299 C4' G A 13 -3.860 -13.350 -4.779 1.00 0.27 C ATOM 300 O4' G A 13 -3.900 -11.885 -4.677 1.00 0.23 O ATOM 301 C3' G A 13 -3.553 -13.782 -3.343 1.00 0.25 C ATOM 302 O3' G A 13 -3.073 -15.131 -3.232 1.00 0.29 O ATOM 303 C2' G A 13 -2.525 -12.723 -2.908 1.00 0.26 C ATOM 304 O2' G A 13 -1.215 -12.938 -3.445 1.00 0.32 O ATOM 305 C1' G A 13 -3.195 -11.449 -3.499 1.00 0.22 C ATOM 306 N9 G A 13 -4.152 -10.821 -2.536 1.00 0.17 N ATOM 307 C8 G A 13 -5.519 -10.807 -2.538 1.00 0.18 C ATOM 308 N7 G A 13 -6.060 -10.189 -1.515 1.00 0.19 N ATOM 309 C5 G A 13 -4.990 -9.772 -0.762 1.00 0.15 C ATOM 310 C6 G A 13 -4.979 -9.059 0.453 1.00 0.17 C ATOM 311 O6 G A 13 -5.974 -8.663 1.069 1.00 0.22 O ATOM 312 N1 G A 13 -3.653 -8.822 0.898 1.00 0.17 N ATOM 313 C2 G A 13 -2.488 -9.227 0.250 1.00 0.17 C ATOM 314 N2 G A 13 -1.368 -8.865 0.891 1.00 0.21 N ATOM 315 N3 G A 13 -2.530 -9.903 -0.909 1.00 0.16 N ATOM 316 C4 G A 13 -3.787 -10.148 -1.363 1.00 0.14 C ATOM 0 H5' G A 13 -5.258 -14.964 -5.132 1.00 0.34 H new ATOM 0 H5'' G A 13 -6.023 -13.423 -4.799 1.00 0.34 H new ATOM 0 H4' G A 13 -3.119 -13.737 -5.478 1.00 0.27 H new ATOM 0 H3' G A 13 -4.437 -13.816 -2.706 1.00 0.25 H new ATOM 0 H2' G A 13 -2.335 -12.703 -1.835 1.00 0.26 H new ATOM 0 HO2' G A 13 -1.118 -13.878 -3.704 1.00 0.32 H new ATOM 0 H1' G A 13 -2.442 -10.693 -3.721 1.00 0.22 H new ATOM 0 H8 G A 13 -6.106 -11.268 -3.319 1.00 0.18 H new ATOM 0 H1 G A 13 -3.542 -8.308 1.772 1.00 0.17 H new ATOM 0 H21 G A 13 -0.457 -9.111 0.504 1.00 0.21 H new ATOM 0 H22 G A 13 -1.427 -8.344 1.766 1.00 0.21 H new ATOM 328 P A A 14 -3.821 -16.190 -2.300 1.00 0.32 P ATOM 329 OP1 A A 14 -3.171 -17.511 -2.466 1.00 0.43 O ATOM 330 OP2 A A 14 -5.279 -16.117 -2.543 1.00 0.37 O ATOM 331 O5' A A 14 -3.481 -15.648 -0.843 1.00 0.32 O ATOM 332 C5' A A 14 -4.195 -16.143 0.295 1.00 0.36 C ATOM 333 C4' A A 14 -3.357 -16.108 1.596 1.00 0.32 C ATOM 334 O4' A A 14 -2.149 -16.924 1.459 1.00 0.35 O ATOM 335 C3' A A 14 -2.861 -14.716 2.008 1.00 0.28 C ATOM 336 O3' A A 14 -3.832 -14.046 2.824 1.00 0.29 O ATOM 337 C2' A A 14 -1.543 -14.999 2.743 1.00 0.29 C ATOM 338 O2' A A 14 -1.737 -15.293 4.128 1.00 0.33 O ATOM 339 C1' A A 14 -1.007 -16.243 1.999 1.00 0.30 C ATOM 340 N9 A A 14 -0.005 -16.001 0.906 1.00 0.30 N ATOM 341 C8 A A 14 -0.150 -16.154 -0.450 1.00 0.34 C ATOM 342 N7 A A 14 0.921 -15.887 -1.158 1.00 0.35 N ATOM 343 C5 A A 14 1.857 -15.526 -0.216 1.00 0.32 C ATOM 344 C6 A A 14 3.205 -15.135 -0.376 1.00 0.36 C ATOM 345 N6 A A 14 3.760 -15.071 -1.618 1.00 0.41 N ATOM 346 N1 A A 14 3.880 -14.838 0.777 1.00 0.37 N ATOM 347 C2 A A 14 3.254 -14.933 1.953 1.00 0.34 C ATOM 348 N3 A A 14 2.000 -15.296 2.216 1.00 0.30 N ATOM 349 C4 A A 14 1.334 -15.584 1.068 1.00 0.29 C ATOM 0 H5' A A 14 -4.512 -17.168 0.101 1.00 0.36 H new ATOM 0 H5'' A A 14 -5.099 -15.551 0.436 1.00 0.36 H new ATOM 0 H4' A A 14 -4.047 -16.480 2.353 1.00 0.32 H new ATOM 0 H3' A A 14 -2.708 -14.041 1.166 1.00 0.28 H new ATOM 0 H2' A A 14 -0.871 -14.141 2.734 1.00 0.29 H new ATOM 0 HO2' A A 14 -2.649 -15.047 4.390 1.00 0.33 H new ATOM 0 H1' A A 14 -0.446 -16.822 2.733 1.00 0.30 H new ATOM 0 H8 A A 14 -1.079 -16.471 -0.901 1.00 0.34 H new ATOM 0 H61 A A 14 4.734 -14.788 -1.727 1.00 0.41 H new ATOM 0 H62 A A 14 3.202 -15.306 -2.439 1.00 0.41 H new ATOM 0 H2 A A 14 3.852 -14.678 2.816 1.00 0.34 H new ATOM 361 P G A 15 -4.222 -12.518 2.610 1.00 0.25 P ATOM 362 OP1 G A 15 -5.344 -12.192 3.524 1.00 0.34 O ATOM 363 OP2 G A 15 -4.430 -12.263 1.167 1.00 0.29 O ATOM 364 O5' G A 15 -2.897 -11.765 3.082 1.00 0.24 O ATOM 365 C5' G A 15 -2.552 -11.712 4.472 1.00 0.23 C ATOM 366 C4' G A 15 -1.100 -11.236 4.730 1.00 0.20 C ATOM 367 O4' G A 15 -0.123 -12.135 4.109 1.00 0.21 O ATOM 368 C3' G A 15 -0.770 -9.878 4.122 1.00 0.19 C ATOM 369 O3' G A 15 -1.323 -8.787 4.867 1.00 0.22 O ATOM 370 C2' G A 15 0.767 -9.904 4.014 1.00 0.20 C ATOM 371 O2' G A 15 1.449 -9.594 5.235 1.00 0.25 O ATOM 372 C1' G A 15 1.004 -11.387 3.613 1.00 0.20 C ATOM 373 N9 G A 15 1.142 -11.645 2.138 1.00 0.22 N ATOM 374 C8 G A 15 0.171 -11.945 1.219 1.00 0.25 C ATOM 375 N7 G A 15 0.605 -12.118 -0.004 1.00 0.31 N ATOM 376 C5 G A 15 1.957 -11.921 0.080 1.00 0.32 C ATOM 377 C6 G A 15 2.919 -11.985 -0.940 1.00 0.40 C ATOM 378 O6 G A 15 2.698 -12.238 -2.128 1.00 0.47 O ATOM 379 N1 G A 15 4.218 -11.719 -0.449 1.00 0.43 N ATOM 380 C2 G A 15 4.549 -11.429 0.876 1.00 0.39 C ATOM 381 N2 G A 15 5.874 -11.221 1.051 1.00 0.48 N ATOM 382 N3 G A 15 3.598 -11.374 1.838 1.00 0.32 N ATOM 383 C4 G A 15 2.337 -11.624 1.392 1.00 0.27 C ATOM 0 H5' G A 15 -2.685 -12.702 4.909 1.00 0.23 H new ATOM 0 H5'' G A 15 -3.242 -11.042 4.984 1.00 0.23 H new ATOM 0 H4' G A 15 -1.041 -11.204 5.818 1.00 0.20 H new ATOM 0 H3' G A 15 -1.224 -9.710 3.145 1.00 0.19 H new ATOM 0 H2' G A 15 1.151 -9.154 3.323 1.00 0.20 H new ATOM 0 HO2' G A 15 1.851 -8.703 5.168 1.00 0.25 H new ATOM 0 H1' G A 15 1.960 -11.686 4.043 1.00 0.20 H new ATOM 0 H8 G A 15 -0.873 -12.032 1.483 1.00 0.25 H new ATOM 0 H1 G A 15 4.982 -11.741 -1.124 1.00 0.43 H new ATOM 0 H21 G A 15 6.238 -11.001 1.978 1.00 0.48 H new ATOM 0 H22 G A 15 6.510 -11.285 0.256 1.00 0.48 H new ATOM 395 P A A 16 -1.964 -7.543 4.113 1.00 0.17 P ATOM 396 OP1 A A 16 -3.310 -7.912 3.625 1.00 0.24 O ATOM 397 OP2 A A 16 -1.035 -7.051 3.066 1.00 0.26 O ATOM 398 O5' A A 16 -2.100 -6.420 5.235 1.00 0.19 O ATOM 399 C5' A A 16 -1.037 -6.102 6.145 1.00 0.21 C ATOM 400 C4' A A 16 0.098 -5.233 5.539 1.00 0.18 C ATOM 401 O4' A A 16 -0.427 -3.912 5.185 1.00 0.19 O ATOM 402 C3' A A 16 1.255 -4.968 6.535 1.00 0.18 C ATOM 403 O3' A A 16 2.539 -4.951 5.874 1.00 0.20 O ATOM 404 C2' A A 16 0.888 -3.591 7.115 1.00 0.21 C ATOM 405 O2' A A 16 2.004 -2.900 7.671 1.00 0.27 O ATOM 406 C1' A A 16 0.298 -2.897 5.868 1.00 0.19 C ATOM 407 N9 A A 16 -0.650 -1.762 6.058 1.00 0.18 N ATOM 408 C8 A A 16 -1.633 -1.567 6.996 1.00 0.22 C ATOM 409 N7 A A 16 -2.306 -0.450 6.854 1.00 0.23 N ATOM 410 C5 A A 16 -1.747 0.135 5.742 1.00 0.19 C ATOM 411 C6 A A 16 -2.054 1.348 5.103 1.00 0.21 C ATOM 412 N6 A A 16 -3.048 2.138 5.580 1.00 0.27 N ATOM 413 N1 A A 16 -1.307 1.649 3.999 1.00 0.21 N ATOM 414 C2 A A 16 -0.348 0.811 3.601 1.00 0.18 C ATOM 415 N3 A A 16 0.021 -0.351 4.127 1.00 0.15 N ATOM 416 C4 A A 16 -0.731 -0.643 5.218 1.00 0.16 C ATOM 0 H5' A A 16 -0.605 -7.031 6.517 1.00 0.21 H new ATOM 0 H5'' A A 16 -1.457 -5.579 7.004 1.00 0.21 H new ATOM 0 H4' A A 16 0.470 -5.790 4.679 1.00 0.18 H new ATOM 0 H3' A A 16 1.356 -5.742 7.296 1.00 0.18 H new ATOM 0 H2' A A 16 0.205 -3.633 7.964 1.00 0.21 H new ATOM 0 HO2' A A 16 2.834 -3.339 7.389 1.00 0.27 H new ATOM 0 H1' A A 16 1.151 -2.448 5.360 1.00 0.19 H new ATOM 0 H8 A A 16 -1.836 -2.275 7.786 1.00 0.22 H new ATOM 0 H61 A A 16 -3.268 3.018 5.114 1.00 0.27 H new ATOM 0 H62 A A 16 -3.575 1.852 6.405 1.00 0.27 H new ATOM 0 H2 A A 16 0.206 1.122 2.728 1.00 0.18 H new ATOM 428 P A A 17 3.391 -6.296 5.726 1.00 0.18 P ATOM 429 OP1 A A 17 2.678 -7.218 4.809 1.00 0.21 O ATOM 430 OP2 A A 17 3.686 -6.805 7.083 1.00 0.25 O ATOM 431 O5' A A 17 4.761 -5.805 5.078 1.00 0.20 O ATOM 432 C5' A A 17 4.837 -5.200 3.788 1.00 0.18 C ATOM 433 C4' A A 17 5.455 -6.126 2.719 1.00 0.17 C ATOM 434 O4' A A 17 4.512 -7.198 2.388 1.00 0.20 O ATOM 435 C3' A A 17 5.649 -5.439 1.358 1.00 0.18 C ATOM 436 O3' A A 17 6.820 -4.606 1.254 1.00 0.21 O ATOM 437 C2' A A 17 5.690 -6.634 0.393 1.00 0.22 C ATOM 438 O2' A A 17 7.013 -7.143 0.213 1.00 0.33 O ATOM 439 C1' A A 17 4.780 -7.689 1.070 1.00 0.20 C ATOM 440 N9 A A 17 3.503 -8.054 0.364 1.00 0.20 N ATOM 441 C8 A A 17 2.196 -8.075 0.813 1.00 0.21 C ATOM 442 N7 A A 17 1.326 -8.474 -0.076 1.00 0.24 N ATOM 443 C5 A A 17 2.068 -8.762 -1.186 1.00 0.23 C ATOM 444 C6 A A 17 1.665 -9.238 -2.449 1.00 0.27 C ATOM 445 N6 A A 17 0.359 -9.487 -2.727 1.00 0.31 N ATOM 446 N1 A A 17 2.665 -9.419 -3.358 1.00 0.29 N ATOM 447 C2 A A 17 3.924 -9.157 -3.025 1.00 0.29 C ATOM 448 N3 A A 17 4.413 -8.715 -1.869 1.00 0.26 N ATOM 449 C4 A A 17 3.414 -8.525 -0.966 1.00 0.21 C ATOM 0 H5' A A 17 5.430 -4.288 3.856 1.00 0.18 H new ATOM 0 H5'' A A 17 3.836 -4.907 3.471 1.00 0.18 H new ATOM 0 H4' A A 17 6.401 -6.451 3.151 1.00 0.17 H new ATOM 0 H3' A A 17 4.856 -4.720 1.152 1.00 0.18 H new ATOM 0 H2' A A 17 5.358 -6.357 -0.608 1.00 0.22 H new ATOM 0 HO2' A A 17 7.664 -6.471 0.503 1.00 0.33 H new ATOM 0 H1' A A 17 5.323 -8.634 1.053 1.00 0.20 H new ATOM 0 H8 A A 17 1.917 -7.786 1.815 1.00 0.21 H new ATOM 0 H61 A A 17 0.090 -9.831 -3.649 1.00 0.31 H new ATOM 0 H62 A A 17 -0.353 -9.330 -2.014 1.00 0.31 H new ATOM 0 H2 A A 17 4.654 -9.327 -3.803 1.00 0.29 H new ATOM 461 P G A 18 6.757 -3.036 1.003 1.00 0.19 P ATOM 462 OP1 G A 18 8.112 -2.471 1.189 1.00 0.22 O ATOM 463 OP2 G A 18 5.719 -2.482 1.894 1.00 0.22 O ATOM 464 O5' G A 18 6.282 -2.884 -0.524 1.00 0.23 O ATOM 465 C5' G A 18 7.200 -2.988 -1.622 1.00 0.27 C ATOM 466 C4' G A 18 6.700 -3.826 -2.836 1.00 0.24 C ATOM 467 O4' G A 18 6.033 -5.048 -2.397 1.00 0.24 O ATOM 468 C3' G A 18 5.683 -3.183 -3.784 1.00 0.24 C ATOM 469 O3' G A 18 6.292 -2.276 -4.709 1.00 0.23 O ATOM 470 C2' G A 18 5.033 -4.407 -4.461 1.00 0.25 C ATOM 471 O2' G A 18 5.818 -4.948 -5.530 1.00 0.29 O ATOM 472 C1' G A 18 4.936 -5.375 -3.270 1.00 0.23 C ATOM 473 N9 G A 18 3.624 -5.309 -2.540 1.00 0.22 N ATOM 474 C8 G A 18 3.358 -4.812 -1.300 1.00 0.26 C ATOM 475 N7 G A 18 2.109 -4.913 -0.915 1.00 0.25 N ATOM 476 C5 G A 18 1.480 -5.513 -1.973 1.00 0.19 C ATOM 477 C6 G A 18 0.127 -5.865 -2.109 1.00 0.19 C ATOM 478 O6 G A 18 -0.753 -5.683 -1.269 1.00 0.23 O ATOM 479 N1 G A 18 -0.138 -6.457 -3.358 1.00 0.21 N ATOM 480 C2 G A 18 0.799 -6.697 -4.358 1.00 0.22 C ATOM 481 N2 G A 18 0.238 -7.293 -5.434 1.00 0.30 N ATOM 482 N3 G A 18 2.097 -6.347 -4.207 1.00 0.20 N ATOM 483 C4 G A 18 2.379 -5.772 -3.008 1.00 0.17 C ATOM 0 H5' G A 18 8.128 -3.428 -1.257 1.00 0.27 H new ATOM 0 H5'' G A 18 7.439 -1.983 -1.970 1.00 0.27 H new ATOM 0 H4' G A 18 7.636 -3.967 -3.376 1.00 0.24 H new ATOM 0 H3' G A 18 4.955 -2.551 -3.276 1.00 0.24 H new ATOM 0 H2' G A 18 4.085 -4.184 -4.950 1.00 0.25 H new ATOM 0 HO2' G A 18 6.482 -4.286 -5.816 1.00 0.29 H new ATOM 0 H1' G A 18 4.991 -6.402 -3.632 1.00 0.23 H new ATOM 0 H8 G A 18 4.121 -4.367 -0.679 1.00 0.26 H new ATOM 0 H1 G A 18 -1.101 -6.734 -3.547 1.00 0.21 H new ATOM 0 H21 G A 18 0.812 -7.527 -6.244 1.00 0.30 H new ATOM 0 H22 G A 18 -0.759 -7.508 -5.436 1.00 0.30 H new ATOM 495 P U A 19 5.442 -1.149 -5.447 1.00 0.22 P ATOM 496 OP1 U A 19 6.372 -0.094 -5.907 1.00 0.29 O ATOM 497 OP2 U A 19 4.335 -0.720 -4.560 1.00 0.26 O ATOM 498 O5' U A 19 4.848 -1.939 -6.705 1.00 0.25 O ATOM 499 C5' U A 19 3.698 -1.434 -7.399 1.00 0.26 C ATOM 500 C4' U A 19 2.880 -2.543 -8.125 1.00 0.22 C ATOM 501 O4' U A 19 2.564 -3.669 -7.228 1.00 0.21 O ATOM 502 C3' U A 19 1.509 -2.039 -8.616 1.00 0.22 C ATOM 503 O3' U A 19 1.553 -1.611 -9.987 1.00 0.25 O ATOM 504 C2' U A 19 0.552 -3.217 -8.392 1.00 0.24 C ATOM 505 O2' U A 19 0.566 -4.133 -9.493 1.00 0.33 O ATOM 506 C1' U A 19 1.145 -3.864 -7.119 1.00 0.21 C ATOM 507 N1 U A 19 0.643 -3.442 -5.743 1.00 0.18 N ATOM 508 C2 U A 19 -0.684 -3.833 -5.352 1.00 0.20 C ATOM 509 O2 U A 19 -1.487 -4.455 -6.054 1.00 0.25 O ATOM 510 N3 U A 19 -1.049 -3.434 -4.047 1.00 0.18 N ATOM 511 C4 U A 19 -0.263 -2.728 -3.115 1.00 0.17 C ATOM 512 O4 U A 19 -0.703 -2.445 -1.996 1.00 0.18 O ATOM 513 C5 U A 19 1.062 -2.391 -3.585 1.00 0.19 C ATOM 514 C6 U A 19 1.449 -2.747 -4.824 1.00 0.19 C ATOM 0 H5' U A 19 4.020 -0.693 -8.130 1.00 0.26 H new ATOM 0 H5'' U A 19 3.050 -0.921 -6.689 1.00 0.26 H new ATOM 0 H4' U A 19 3.517 -2.846 -8.956 1.00 0.22 H new ATOM 0 H3' U A 19 1.180 -1.154 -8.072 1.00 0.22 H new ATOM 0 H2' U A 19 -0.492 -2.919 -8.298 1.00 0.24 H new ATOM 0 HO2' U A 19 1.000 -3.711 -10.264 1.00 0.33 H new ATOM 0 H1' U A 19 0.803 -4.899 -7.123 1.00 0.21 H new ATOM 0 H3 U A 19 -1.990 -3.686 -3.745 1.00 0.18 H new ATOM 0 H5 U A 19 1.742 -1.853 -2.941 1.00 0.19 H new ATOM 0 H6 U A 19 2.449 -2.480 -5.134 1.00 0.19 H new ATOM 525 P U A 20 0.894 -0.238 -10.447 1.00 0.27 P ATOM 526 OP1 U A 20 1.220 -0.020 -11.877 1.00 0.34 O ATOM 527 OP2 U A 20 1.273 0.826 -9.490 1.00 0.35 O ATOM 528 O5' U A 20 -0.659 -0.516 -10.276 1.00 0.24 O ATOM 529 C5' U A 20 -1.397 -1.230 -11.268 1.00 0.25 C ATOM 530 C4' U A 20 -2.866 -1.477 -10.863 1.00 0.22 C ATOM 531 O4' U A 20 -2.944 -2.287 -9.640 1.00 0.21 O ATOM 532 C3' U A 20 -3.681 -0.216 -10.547 1.00 0.24 C ATOM 533 O3' U A 20 -4.152 0.443 -11.736 1.00 0.31 O ATOM 534 C2' U A 20 -4.798 -0.770 -9.652 1.00 0.24 C ATOM 535 O2' U A 20 -5.863 -1.346 -10.418 1.00 0.33 O ATOM 536 C1' U A 20 -4.042 -1.847 -8.821 1.00 0.21 C ATOM 537 N1 U A 20 -3.563 -1.407 -7.449 1.00 0.18 N ATOM 538 C2 U A 20 -4.543 -1.337 -6.402 1.00 0.20 C ATOM 539 O2 U A 20 -5.741 -1.609 -6.526 1.00 0.25 O ATOM 540 N3 U A 20 -4.036 -0.925 -5.154 1.00 0.20 N ATOM 541 C4 U A 20 -2.704 -0.583 -4.842 1.00 0.22 C ATOM 542 O4 U A 20 -2.390 -0.234 -3.701 1.00 0.25 O ATOM 543 C5 U A 20 -1.784 -0.679 -5.955 1.00 0.23 C ATOM 544 C6 U A 20 -2.228 -1.068 -7.167 1.00 0.20 C ATOM 0 H5' U A 20 -0.911 -2.188 -11.456 1.00 0.25 H new ATOM 0 H5'' U A 20 -1.372 -0.672 -12.204 1.00 0.25 H new ATOM 0 H4' U A 20 -3.283 -1.965 -11.744 1.00 0.22 H new ATOM 0 H3' U A 20 -3.110 0.573 -10.058 1.00 0.24 H new ATOM 0 H2' U A 20 -5.287 -0.008 -9.045 1.00 0.24 H new ATOM 0 HO2' U A 20 -5.866 -0.957 -11.318 1.00 0.33 H new ATOM 0 H1' U A 20 -4.744 -2.647 -8.585 1.00 0.21 H new ATOM 0 H3 U A 20 -4.709 -0.868 -4.389 1.00 0.20 H new ATOM 0 H5 U A 20 -0.740 -0.439 -5.814 1.00 0.23 H new ATOM 0 H6 U A 20 -1.512 -1.123 -7.974 1.00 0.20 H new ATOM 555 P U A 21 -4.494 1.997 -11.763 1.00 0.40 P ATOM 556 OP1 U A 21 -4.729 2.396 -13.170 1.00 0.59 O ATOM 557 OP2 U A 21 -3.460 2.741 -11.003 1.00 0.50 O ATOM 558 O5' U A 21 -5.888 2.032 -10.991 1.00 0.35 O ATOM 559 C5' U A 21 -6.318 3.178 -10.255 1.00 0.33 C ATOM 560 C4' U A 21 -7.530 2.848 -9.350 1.00 0.29 C ATOM 561 O4' U A 21 -7.183 1.813 -8.356 1.00 0.32 O ATOM 562 C3' U A 21 -8.030 4.034 -8.501 1.00 0.28 C ATOM 563 O3' U A 21 -8.917 4.910 -9.216 1.00 0.33 O ATOM 564 C2' U A 21 -8.705 3.321 -7.319 1.00 0.28 C ATOM 565 O2' U A 21 -10.017 2.852 -7.645 1.00 0.34 O ATOM 566 C1' U A 21 -7.729 2.142 -7.063 1.00 0.26 C ATOM 567 N1 U A 21 -6.608 2.422 -6.072 1.00 0.24 N ATOM 568 C2 U A 21 -6.865 2.242 -4.667 1.00 0.23 C ATOM 569 O2 U A 21 -7.935 1.871 -4.173 1.00 0.26 O ATOM 570 N3 U A 21 -5.762 2.529 -3.837 1.00 0.27 N ATOM 571 C4 U A 21 -4.489 2.977 -4.228 1.00 0.33 C ATOM 572 O4 U A 21 -3.619 3.207 -3.387 1.00 0.41 O ATOM 573 C5 U A 21 -4.317 3.134 -5.652 1.00 0.36 C ATOM 574 C6 U A 21 -5.340 2.866 -6.485 1.00 0.31 C ATOM 0 H5' U A 21 -6.586 3.977 -10.947 1.00 0.33 H new ATOM 0 H5'' U A 21 -5.496 3.549 -9.643 1.00 0.33 H new ATOM 0 H4' U A 21 -8.298 2.537 -10.058 1.00 0.29 H new ATOM 0 H3' U A 21 -7.233 4.713 -8.197 1.00 0.28 H new ATOM 0 H2' U A 21 -8.862 3.968 -6.456 1.00 0.28 H new ATOM 0 HO2' U A 21 -10.411 3.432 -8.330 1.00 0.34 H new ATOM 0 H1' U A 21 -8.282 1.328 -6.595 1.00 0.26 H new ATOM 0 H3 U A 21 -5.905 2.396 -2.836 1.00 0.27 H new ATOM 0 H5 U A 21 -3.369 3.466 -6.049 1.00 0.36 H new ATOM 0 H6 U A 21 -5.175 3.002 -7.544 1.00 0.31 H new ATOM 585 P A A 22 -8.895 6.498 -9.044 1.00 0.35 P ATOM 586 OP1 A A 22 -9.689 7.094 -10.144 1.00 0.46 O ATOM 587 OP2 A A 22 -7.495 6.962 -8.898 1.00 0.44 O ATOM 588 O5' A A 22 -9.627 6.737 -7.646 1.00 0.30 O ATOM 589 C5' A A 22 -11.051 6.661 -7.534 1.00 0.29 C ATOM 590 C4' A A 22 -11.550 6.535 -6.073 1.00 0.25 C ATOM 591 O4' A A 22 -10.852 5.451 -5.375 1.00 0.26 O ATOM 592 C3' A A 22 -11.338 7.766 -5.179 1.00 0.23 C ATOM 593 O3' A A 22 -12.343 8.771 -5.387 1.00 0.28 O ATOM 594 C2' A A 22 -11.349 7.153 -3.767 1.00 0.22 C ATOM 595 O2' A A 22 -12.663 6.977 -3.229 1.00 0.30 O ATOM 596 C1' A A 22 -10.674 5.786 -3.992 1.00 0.23 C ATOM 597 N9 A A 22 -9.225 5.702 -3.620 1.00 0.23 N ATOM 598 C8 A A 22 -8.102 5.665 -4.411 1.00 0.27 C ATOM 599 N7 A A 22 -6.969 5.573 -3.750 1.00 0.31 N ATOM 600 C5 A A 22 -7.353 5.556 -2.431 1.00 0.28 C ATOM 601 C6 A A 22 -6.582 5.473 -1.254 1.00 0.31 C ATOM 602 N6 A A 22 -5.223 5.384 -1.290 1.00 0.35 N ATOM 603 N1 A A 22 -7.288 5.479 -0.094 1.00 0.32 N ATOM 604 C2 A A 22 -8.616 5.557 -0.103 1.00 0.29 C ATOM 605 N3 A A 22 -9.435 5.634 -1.145 1.00 0.27 N ATOM 606 C4 A A 22 -8.732 5.631 -2.308 1.00 0.25 C ATOM 0 H5' A A 22 -11.407 5.805 -8.106 1.00 0.29 H new ATOM 0 H5'' A A 22 -11.491 7.551 -7.984 1.00 0.29 H new ATOM 0 H4' A A 22 -12.620 6.371 -6.204 1.00 0.25 H new ATOM 0 H3' A A 22 -10.417 8.311 -5.387 1.00 0.23 H new ATOM 0 H2' A A 22 -10.850 7.798 -3.043 1.00 0.22 H new ATOM 0 HO2' A A 22 -13.268 7.642 -3.619 1.00 0.30 H new ATOM 0 H1' A A 22 -11.154 5.078 -3.316 1.00 0.23 H new ATOM 0 H8 A A 22 -8.146 5.708 -5.489 1.00 0.27 H new ATOM 0 H61 A A 22 -4.693 5.325 -0.421 1.00 0.35 H new ATOM 0 H62 A A 22 -4.736 5.376 -2.186 1.00 0.35 H new ATOM 0 H2 A A 22 -9.091 5.558 0.867 1.00 0.29 H new ATOM 618 P G A 23 -12.164 10.276 -4.892 1.00 0.28 P ATOM 619 OP1 G A 23 -13.261 11.087 -5.462 1.00 0.36 O ATOM 620 OP2 G A 23 -10.772 10.717 -5.163 1.00 0.29 O ATOM 621 O5' G A 23 -12.405 10.120 -3.319 1.00 0.28 O ATOM 622 C5' G A 23 -11.783 11.003 -2.385 1.00 0.28 C ATOM 623 C4' G A 23 -12.011 10.556 -0.918 1.00 0.26 C ATOM 624 O4' G A 23 -11.469 9.203 -0.682 1.00 0.24 O ATOM 625 C3' G A 23 -11.286 11.459 0.101 1.00 0.26 C ATOM 626 O3' G A 23 -12.116 12.546 0.555 1.00 0.29 O ATOM 627 C2' G A 23 -10.873 10.491 1.225 1.00 0.25 C ATOM 628 O2' G A 23 -11.928 10.268 2.163 1.00 0.30 O ATOM 629 C1' G A 23 -10.562 9.199 0.435 1.00 0.22 C ATOM 630 N9 G A 23 -9.164 9.029 -0.072 1.00 0.20 N ATOM 631 C8 G A 23 -8.725 8.950 -1.367 1.00 0.20 C ATOM 632 N7 G A 23 -7.437 8.780 -1.499 1.00 0.21 N ATOM 633 C5 G A 23 -6.966 8.731 -0.217 1.00 0.20 C ATOM 634 C6 G A 23 -5.652 8.559 0.217 1.00 0.23 C ATOM 635 O6 G A 23 -4.671 8.424 -0.521 1.00 0.25 O ATOM 636 N1 G A 23 -5.566 8.557 1.623 1.00 0.25 N ATOM 637 C2 G A 23 -6.622 8.706 2.516 1.00 0.25 C ATOM 638 N2 G A 23 -6.217 8.662 3.806 1.00 0.30 N ATOM 639 N3 G A 23 -7.887 8.868 2.067 1.00 0.23 N ATOM 640 C4 G A 23 -8.001 8.875 0.708 1.00 0.20 C ATOM 0 H5' G A 23 -12.177 12.010 -2.522 1.00 0.28 H new ATOM 0 H5'' G A 23 -10.713 11.049 -2.587 1.00 0.28 H new ATOM 0 H4' G A 23 -13.091 10.603 -0.780 1.00 0.26 H new ATOM 0 H3' G A 23 -10.423 11.969 -0.326 1.00 0.26 H new ATOM 0 H2' G A 23 -10.044 10.865 1.827 1.00 0.25 H new ATOM 0 HO2' G A 23 -12.510 11.056 2.195 1.00 0.30 H new ATOM 0 H1' G A 23 -10.680 8.366 1.129 1.00 0.22 H new ATOM 0 H8 G A 23 -9.392 9.023 -2.213 1.00 0.20 H new ATOM 0 H1 G A 23 -4.637 8.434 2.026 1.00 0.25 H new ATOM 0 H21 G A 23 -6.899 8.760 4.558 1.00 0.30 H new ATOM 0 H22 G A 23 -5.230 8.531 4.026 1.00 0.30 H new ATOM 652 P U A 24 -11.547 14.022 0.755 1.00 0.29 P ATOM 653 OP1 U A 24 -12.669 14.900 1.157 1.00 0.39 O ATOM 654 OP2 U A 24 -10.778 14.414 -0.451 1.00 0.34 O ATOM 655 O5' U A 24 -10.588 13.827 2.006 1.00 0.27 O ATOM 656 C5' U A 24 -9.373 14.548 2.186 1.00 0.31 C ATOM 657 C4' U A 24 -8.504 13.860 3.258 1.00 0.23 C ATOM 658 O4' U A 24 -8.143 12.508 2.820 1.00 0.23 O ATOM 659 C3' U A 24 -7.161 14.553 3.532 1.00 0.24 C ATOM 660 O3' U A 24 -7.293 15.584 4.521 1.00 0.28 O ATOM 661 C2' U A 24 -6.250 13.389 3.961 1.00 0.23 C ATOM 662 O2' U A 24 -6.384 13.054 5.346 1.00 0.29 O ATOM 663 C1' U A 24 -6.756 12.233 3.055 1.00 0.21 C ATOM 664 N1 U A 24 -6.012 11.995 1.744 1.00 0.18 N ATOM 665 C2 U A 24 -4.604 11.694 1.805 1.00 0.20 C ATOM 666 O2 U A 24 -3.923 11.625 2.830 1.00 0.23 O ATOM 667 N3 U A 24 -4.004 11.471 0.550 1.00 0.21 N ATOM 668 C4 U A 24 -4.612 11.503 -0.720 1.00 0.22 C ATOM 669 O4 U A 24 -3.948 11.286 -1.741 1.00 0.26 O ATOM 670 C5 U A 24 -6.029 11.807 -0.691 1.00 0.23 C ATOM 671 C6 U A 24 -6.651 12.028 0.488 1.00 0.20 C ATOM 0 H5' U A 24 -9.590 15.573 2.485 1.00 0.31 H new ATOM 0 H5'' U A 24 -8.828 14.600 1.243 1.00 0.31 H new ATOM 0 H4' U A 24 -9.119 13.887 4.158 1.00 0.23 H new ATOM 0 H3' U A 24 -6.753 15.085 2.672 1.00 0.24 H new ATOM 0 H2' U A 24 -5.191 13.621 3.850 1.00 0.23 H new ATOM 0 HO2' U A 24 -6.736 13.826 5.837 1.00 0.29 H new ATOM 0 H1' U A 24 -6.571 11.297 3.583 1.00 0.21 H new ATOM 0 H3 U A 24 -3.006 11.260 0.563 1.00 0.21 H new ATOM 0 H5 U A 24 -6.589 11.857 -1.613 1.00 0.23 H new ATOM 0 H6 U A 24 -7.709 12.244 0.467 1.00 0.20 H new ATOM 682 P C A 25 -6.400 16.899 4.544 1.00 0.30 P ATOM 683 OP1 C A 25 -6.999 17.857 5.500 1.00 0.41 O ATOM 684 OP2 C A 25 -6.184 17.378 3.155 1.00 0.36 O ATOM 685 O5' C A 25 -5.044 16.347 5.166 1.00 0.28 O ATOM 686 C5' C A 25 -3.773 16.930 4.876 1.00 0.30 C ATOM 687 C4' C A 25 -2.665 15.854 4.857 1.00 0.27 C ATOM 688 O4' C A 25 -2.873 14.925 3.752 1.00 0.30 O ATOM 689 C3' C A 25 -1.272 16.406 4.558 1.00 0.29 C ATOM 690 O3' C A 25 -0.664 17.019 5.696 1.00 0.35 O ATOM 691 C2' C A 25 -0.513 15.166 4.057 1.00 0.30 C ATOM 692 O2' C A 25 0.136 14.428 5.099 1.00 0.37 O ATOM 693 C1' C A 25 -1.628 14.309 3.386 1.00 0.27 C ATOM 694 N1 C A 25 -1.516 14.122 1.881 1.00 0.27 N ATOM 695 C2 C A 25 -0.302 13.549 1.341 1.00 0.27 C ATOM 696 O2 C A 25 0.656 13.206 2.060 1.00 0.31 O ATOM 697 N3 C A 25 -0.208 13.372 -0.019 1.00 0.30 N ATOM 698 C4 C A 25 -1.211 13.702 -0.852 1.00 0.30 C ATOM 699 N4 C A 25 -1.071 13.503 -2.187 1.00 0.35 N ATOM 700 C5 C A 25 -2.429 14.268 -0.337 1.00 0.32 C ATOM 701 C6 C A 25 -2.541 14.454 0.988 1.00 0.31 C ATOM 0 H5' C A 25 -3.537 17.688 5.623 1.00 0.30 H new ATOM 0 H5'' C A 25 -3.812 17.435 3.911 1.00 0.30 H new ATOM 0 H4' C A 25 -2.720 15.409 5.851 1.00 0.27 H new ATOM 0 H3' C A 25 -1.280 17.215 3.828 1.00 0.29 H new ATOM 0 H2' C A 25 0.300 15.445 3.387 1.00 0.30 H new ATOM 0 HO2' C A 25 0.996 14.848 5.310 1.00 0.37 H new ATOM 0 H1' C A 25 -1.535 13.286 3.750 1.00 0.27 H new ATOM 0 H41 C A 25 -1.829 13.752 -2.822 1.00 0.35 H new ATOM 0 H42 C A 25 -0.207 13.104 -2.555 1.00 0.35 H new ATOM 0 H5 C A 25 -3.236 14.538 -1.002 1.00 0.32 H new ATOM 0 H6 C A 25 -3.455 14.875 1.379 1.00 0.31 H new ATOM 713 P C A 26 -0.296 18.562 5.808 1.00 0.36 P ATOM 714 OP1 C A 26 -0.869 19.088 7.065 1.00 0.47 O ATOM 715 OP2 C A 26 -0.649 19.272 4.554 1.00 0.44 O ATOM 716 O5' C A 26 1.287 18.547 5.911 1.00 0.39 O ATOM 717 C5' C A 26 2.004 17.920 6.976 1.00 0.44 C ATOM 718 C4' C A 26 3.196 17.077 6.462 1.00 0.44 C ATOM 719 O4' C A 26 2.738 16.044 5.532 1.00 0.40 O ATOM 720 C3' C A 26 4.239 17.861 5.664 1.00 0.48 C ATOM 721 O3' C A 26 5.179 18.535 6.504 1.00 0.60 O ATOM 722 C2' C A 26 4.880 16.812 4.752 1.00 0.45 C ATOM 723 O2' C A 26 5.955 16.114 5.382 1.00 0.54 O ATOM 724 C1' C A 26 3.692 15.854 4.471 1.00 0.36 C ATOM 725 N1 C A 26 3.010 16.046 3.134 1.00 0.32 N ATOM 726 C2 C A 26 3.227 15.071 2.094 1.00 0.33 C ATOM 727 O2 C A 26 3.954 14.072 2.255 1.00 0.37 O ATOM 728 N3 C A 26 2.607 15.267 0.881 1.00 0.37 N ATOM 729 C4 C A 26 1.810 16.328 0.644 1.00 0.36 C ATOM 730 N4 C A 26 1.218 16.477 -0.567 1.00 0.41 N ATOM 731 C5 C A 26 1.587 17.309 1.670 1.00 0.35 C ATOM 732 C6 C A 26 2.188 17.140 2.859 1.00 0.35 C ATOM 0 H5' C A 26 1.326 17.280 7.541 1.00 0.44 H new ATOM 0 H5'' C A 26 2.370 18.682 7.663 1.00 0.44 H new ATOM 0 H4' C A 26 3.641 16.687 7.377 1.00 0.44 H new ATOM 0 H3' C A 26 3.797 18.675 5.089 1.00 0.48 H new ATOM 0 H2' C A 26 5.329 17.250 3.861 1.00 0.45 H new ATOM 0 HO2' C A 26 6.238 16.604 6.182 1.00 0.54 H new ATOM 0 HO3' C A 26 5.825 19.020 5.949 1.00 0.60 H new ATOM 0 H1' C A 26 4.094 14.842 4.431 1.00 0.36 H new ATOM 0 H41 C A 26 0.615 17.280 -0.745 1.00 0.41 H new ATOM 0 H42 C A 26 1.376 15.786 -1.300 1.00 0.41 H new ATOM 0 H5 C A 26 0.951 18.163 1.489 1.00 0.35 H new ATOM 0 H6 C A 26 2.029 17.878 3.631 1.00 0.35 H new TER 745 C A 26 HETATM 746 C4 BDR A 29 2.545 -2.125 1.168 1.00 0.20 C HETATM 747 O BDR A 29 1.364 -2.047 0.382 1.00 0.19 O HETATM 748 C1 BDR A 29 1.287 -0.726 -0.153 1.00 0.20 C HETATM 749 C2 BDR A 29 2.632 -0.077 0.148 1.00 0.21 C HETATM 750 O2 BDR A 29 3.627 -0.521 -0.784 1.00 0.29 O HETATM 751 C3 BDR A 29 2.812 -0.675 1.521 1.00 0.18 C HETATM 752 O3 BDR A 29 4.131 -0.403 1.997 1.00 0.19 O HETATM 753 C5 BDR A 29 2.303 -3.033 2.363 1.00 0.22 C HETATM 754 O5 BDR A 29 1.976 -4.379 1.995 1.00 0.30 O HETATM 0 HO2 BDR A 29 4.457 -0.723 -0.304 1.00 0.29 H new HETATM 0 H52 BDR A 29 3.194 -3.042 2.990 1.00 0.22 H new HETATM 0 H51 BDR A 29 1.493 -2.621 2.965 1.00 0.22 H new HETATM 0 H5 BDR A 29 2.041 -4.477 1.022 1.00 0.30 H new HETATM 0 H4 BDR A 29 3.411 -2.565 0.673 1.00 0.20 H new HETATM 0 H3 BDR A 29 2.184 -0.305 2.331 1.00 0.18 H new HETATM 0 H2 BDR A 29 2.699 1.009 0.088 1.00 0.21 H new HETATM 763 C5 IDG A 30 3.505 0.970 5.302 1.00 0.19 C HETATM 764 O5 IDG A 30 3.533 0.026 4.215 1.00 0.17 O HETATM 765 C1 IDG A 30 4.212 0.499 3.060 1.00 0.17 C HETATM 766 C2 IDG A 30 5.676 0.773 3.389 1.00 0.21 C HETATM 767 N2 IDG A 30 6.371 -0.500 3.711 1.00 0.23 N HETATM 768 C3 IDG A 30 5.759 1.782 4.537 1.00 0.25 C HETATM 769 O3 IDG A 30 5.282 3.045 4.096 1.00 0.29 O HETATM 770 C4 IDG A 30 4.931 1.317 5.738 1.00 0.23 C HETATM 771 O4 IDG A 30 5.542 0.191 6.354 1.00 0.27 O HETATM 772 C6 IDG A 30 2.668 0.355 6.410 1.00 0.22 C HETATM 773 N6 IDG A 30 2.554 1.251 7.586 1.00 0.25 N HETATM 0 HN62 IDG A 30 2.017 0.956 8.402 1.00 0.25 H new HETATM 0 HN61 IDG A 30 3.013 2.162 7.579 1.00 0.25 H new HETATM 0 HN22 IDG A 30 7.361 -0.493 3.955 1.00 0.23 H new HETATM 0 HN21 IDG A 30 5.858 -1.381 3.688 1.00 0.23 H new HETATM 0 HO4 IDG A 30 6.454 0.423 6.628 1.00 0.27 H new HETATM 0 HO3 IDG A 30 5.764 3.312 3.286 1.00 0.29 H new HETATM 0 H62 IDG A 30 1.672 0.130 6.029 1.00 0.22 H new HETATM 0 H61 IDG A 30 3.113 -0.591 6.718 1.00 0.22 H new HETATM 0 H5 IDG A 30 3.051 1.916 5.008 1.00 0.19 H new HETATM 0 H4 IDG A 30 4.886 2.131 6.462 1.00 0.23 H new HETATM 0 H3 IDG A 30 6.801 1.864 4.846 1.00 0.25 H new HETATM 0 H2 IDG A 30 6.180 1.207 2.525 1.00 0.21 H new HETATM 789 C5 BDG A 27 -3.940 -2.184 2.940 1.00 0.22 C HETATM 790 O5 BDG A 27 -2.610 -1.633 3.021 1.00 0.20 O HETATM 791 C1 BDG A 27 -1.777 -1.942 1.912 1.00 0.19 C HETATM 792 C2 BDG A 27 -1.614 -3.451 1.780 1.00 0.20 C HETATM 793 N2 BDG A 27 -0.721 -3.763 0.640 1.00 0.21 N HETATM 794 C3 BDG A 27 -2.991 -4.089 1.615 1.00 0.21 C HETATM 795 O3 BDG A 27 -2.864 -5.502 1.536 1.00 0.24 O HETATM 796 C4 BDG A 27 -3.876 -3.706 2.802 1.00 0.24 C HETATM 797 O4 BDG A 27 -5.186 -4.222 2.609 1.00 0.30 O HETATM 798 C6 BDG A 27 -4.683 -1.744 4.188 1.00 0.27 C HETATM 799 N6 BDG A 27 -4.865 -0.274 4.213 1.00 0.31 N HETATM 0 HN62 BDG A 27 -5.349 0.167 4.995 1.00 0.31 H new HETATM 0 HN61 BDG A 27 -4.506 0.297 3.448 1.00 0.31 H new HETATM 0 HN22 BDG A 27 -0.505 -4.733 0.412 1.00 0.21 H new HETATM 0 HN21 BDG A 27 -0.322 -3.007 0.083 1.00 0.21 H new HETATM 0 HO4 BDG A 27 -5.138 -5.050 2.087 1.00 0.30 H new HETATM 0 HO3 BDG A 27 -2.106 -5.793 2.084 1.00 0.24 H new HETATM 0 H62 BDG A 27 -5.656 -2.234 4.227 1.00 0.27 H new HETATM 0 H61 BDG A 27 -4.131 -2.060 5.073 1.00 0.27 H new HETATM 0 H5 BDG A 27 -4.471 -1.823 2.059 1.00 0.22 H new HETATM 0 H4 BDG A 27 -3.450 -4.128 3.712 1.00 0.24 H new HETATM 0 H3 BDG A 27 -3.449 -3.727 0.695 1.00 0.21 H new HETATM 0 H2 BDG A 27 -1.153 -3.862 2.678 1.00 0.20 H new HETATM 815 C1 NEB A 28 -2.001 2.396 -1.120 1.00 0.18 C HETATM 816 N1 NEB A 28 -1.882 3.865 -1.242 1.00 0.22 N HETATM 817 C2 NEB A 28 -3.258 2.058 -0.326 1.00 0.18 C HETATM 818 C3 NEB A 28 -3.390 0.550 -0.168 1.00 0.20 C HETATM 819 N3 NEB A 28 -4.606 0.277 0.581 1.00 0.28 N HETATM 820 C4 NEB A 28 -2.172 0.010 0.574 1.00 0.18 C HETATM 821 O4 NEB A 28 -2.280 -1.420 0.714 1.00 0.20 O HETATM 822 C5 NEB A 28 -0.888 0.346 -0.184 1.00 0.18 C HETATM 823 O5 NEB A 28 0.243 -0.098 0.587 1.00 0.20 O HETATM 824 C6 NEB A 28 -0.761 1.849 -0.424 1.00 0.19 C HETATM 825 O6 NEB A 28 0.382 2.108 -1.228 1.00 0.24 O HETATM 0 HO6 NEB A 28 1.131 2.376 -0.655 1.00 0.24 H new HETATM 0 H6 NEB A 28 -0.657 2.343 0.542 1.00 0.19 H new HETATM 0 H5 NEB A 28 -0.920 -0.157 -1.150 1.00 0.18 H new HETATM 0 H4 NEB A 28 -2.135 0.476 1.559 1.00 0.18 H new HETATM 0 H32 NEB A 28 -4.871 -0.686 0.791 1.00 0.28 H new HETATM 0 H31 NEB A 28 -5.195 1.048 0.897 1.00 0.28 H new HETATM 0 H3 NEB A 28 -3.443 0.063 -1.142 1.00 0.20 H new HETATM 0 H22 NEB A 28 -3.216 2.531 0.655 1.00 0.18 H new HETATM 0 H21 NEB A 28 -4.136 2.456 -0.834 1.00 0.18 H new HETATM 0 H13 NEB A 28 -0.896 4.127 -1.247 1.00 0.22 H new HETATM 0 H12 NEB A 28 -2.319 4.171 -2.111 1.00 0.22 H new HETATM 0 H11 NEB A 28 -2.348 4.311 -0.452 1.00 0.22 H new HETATM 0 H1 NEB A 28 -2.078 1.941 -2.107 1.00 0.18 H new