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 -16:sc= 0.0615 USER MOD Single : A 4 G O5' : rot 180:sc= 0 USER MOD Single : A 5 G O2' : rot 57:sc= 0.536 USER MOD Single : A 6 A O2' : rot -1:sc= 0.87 USER MOD Single : A 7 C O2' : rot -15:sc= 0.0944 USER MOD Single : A 8 U O2' : rot -62:sc= 0.13 USER MOD Single : A 9 G O2' : rot -21:sc= 0.00461 USER MOD Single : A 10 G O2' : rot -19:sc= 0.00516 USER MOD Single : A 11 G O2' : rot -11:sc= 0.124 USER MOD Single : A 12 C O2' : rot -19:sc= 0.0875 USER MOD Single : A 13 G O2' : rot -20:sc= 0.00263 USER MOD Single : A 14 A O2' : rot -19:sc= 0.0677 USER MOD Single : A 15 G O2' : rot -22:sc= 0.0805 USER MOD Single : A 16 A O2' : rot 26:sc= 0.0711 USER MOD Single : A 17 A O2' : rot -15:sc= 0.0722 USER MOD Single : A 18 G O2' : rot -26:sc= 0.0348 USER MOD Single : A 19 U O2' : rot -17:sc= 0.0455 USER MOD Single : A 20 U O2' : rot -19:sc= 0.039 USER MOD Single : A 21 U O2' : rot -15:sc= 0.0992 USER MOD Single : A 22 A O2' : rot -12:sc= 0.067 USER MOD Single : A 23 G O2' : rot -18:sc= 0.0188 USER MOD Single : A 24 U O2' : rot -64:sc= 0.212 USER MOD Single : A 25 C O2' : rot -20:sc= 0.0938 USER MOD Single : A 26 C O2' : rot -15:sc= 0.049 USER MOD Single : A 26 C O3' : rot 180:sc= 0.0534 USER MOD Single : A 27 BDG O3 : rot 82:sc= 0.00276 USER MOD Single : A 27 BDG O4 : rot -158:sc= -0.0316 USER MOD Single : A 28 NEB N1 :NH3+ -178:sc= 1.32 (180deg=1.17) USER MOD Single : A 28 NEB O6 : rot 170:sc= 0 USER MOD Single : A 29 BDR O2 : rot -144:sc= 0.0424 USER MOD Single : A 29 BDR O5 : rot -1:sc= 1.25 USER MOD Single : A 30 IDG O3 : rot 180:sc= 0 USER MOD Single : A 30 IDG O4 : rot 180:sc= -0.422 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 4 3.063 16.357 -11.273 1.00 0.85 O ATOM 2 C5' G A 4 3.081 15.334 -10.281 1.00 0.71 C ATOM 3 C4' G A 4 3.848 15.789 -9.026 1.00 0.56 C ATOM 4 O4' G A 4 3.130 16.871 -8.343 1.00 0.58 O ATOM 5 C3' G A 4 3.949 14.711 -7.946 1.00 0.48 C ATOM 6 O3' G A 4 4.978 13.753 -8.222 1.00 0.52 O ATOM 7 C2' G A 4 4.209 15.538 -6.680 1.00 0.42 C ATOM 8 O2' G A 4 5.592 15.839 -6.487 1.00 0.45 O ATOM 9 C1' G A 4 3.402 16.825 -6.929 1.00 0.47 C ATOM 10 N9 G A 4 2.126 16.945 -6.146 1.00 0.43 N ATOM 11 C8 G A 4 0.843 16.935 -6.613 1.00 0.45 C ATOM 12 N7 G A 4 -0.080 17.070 -5.696 1.00 0.43 N ATOM 13 C5 G A 4 0.612 17.176 -4.522 1.00 0.38 C ATOM 14 C6 G A 4 0.108 17.337 -3.222 1.00 0.36 C ATOM 15 O6 G A 4 -1.087 17.411 -2.917 1.00 0.38 O ATOM 16 N1 G A 4 1.143 17.407 -2.268 1.00 0.34 N ATOM 17 C2 G A 4 2.510 17.330 -2.534 1.00 0.34 C ATOM 18 N2 G A 4 3.257 17.433 -1.411 1.00 0.35 N ATOM 19 N3 G A 4 2.969 17.179 -3.801 1.00 0.36 N ATOM 20 C4 G A 4 1.989 17.104 -4.746 1.00 0.38 C ATOM 0 H5' G A 4 3.546 14.436 -10.689 1.00 0.71 H new ATOM 0 H5'' G A 4 2.059 15.069 -10.010 1.00 0.71 H new ATOM 0 H4' G A 4 4.830 16.069 -9.406 1.00 0.56 H new ATOM 0 H3' G A 4 3.059 14.088 -7.866 1.00 0.48 H new ATOM 0 H2' G A 4 3.918 15.000 -5.778 1.00 0.42 H new ATOM 0 HO2' G A 4 6.137 15.250 -7.050 1.00 0.45 H new ATOM 0 HO5' G A 4 2.571 16.041 -12.060 1.00 0.85 H new ATOM 0 H1' G A 4 4.000 17.668 -6.582 1.00 0.47 H new ATOM 0 H8 G A 4 0.608 16.824 -7.661 1.00 0.45 H new ATOM 0 H1 G A 4 0.867 17.525 -1.293 1.00 0.34 H new ATOM 0 H21 G A 4 4.274 17.392 -1.470 1.00 0.35 H new ATOM 0 H22 G A 4 2.803 17.552 -0.506 1.00 0.35 H new ATOM 33 P G A 5 4.773 12.175 -8.111 1.00 0.54 P ATOM 34 OP1 G A 5 5.808 11.509 -8.933 1.00 0.66 O ATOM 35 OP2 G A 5 3.360 11.850 -8.411 1.00 0.60 O ATOM 36 O5' G A 5 5.031 11.856 -6.576 1.00 0.47 O ATOM 37 C5' G A 5 6.283 12.092 -5.920 1.00 0.49 C ATOM 38 C4' G A 5 6.132 12.643 -4.468 1.00 0.39 C ATOM 39 O4' G A 5 5.003 13.589 -4.390 1.00 0.36 O ATOM 40 C3' G A 5 5.851 11.608 -3.352 1.00 0.39 C ATOM 41 O3' G A 5 6.483 12.091 -2.158 1.00 0.36 O ATOM 42 C2' G A 5 4.314 11.603 -3.361 1.00 0.34 C ATOM 43 O2' G A 5 3.694 10.992 -2.244 1.00 0.34 O ATOM 44 C1' G A 5 4.023 13.104 -3.475 1.00 0.31 C ATOM 45 N9 G A 5 2.625 13.419 -3.881 1.00 0.29 N ATOM 46 C8 G A 5 2.036 13.374 -5.106 1.00 0.33 C ATOM 47 N7 G A 5 0.762 13.690 -5.116 1.00 0.34 N ATOM 48 C5 G A 5 0.469 13.956 -3.799 1.00 0.29 C ATOM 49 C6 G A 5 -0.754 14.344 -3.214 1.00 0.30 C ATOM 50 O6 G A 5 -1.822 14.526 -3.810 1.00 0.35 O ATOM 51 N1 G A 5 -0.622 14.517 -1.813 1.00 0.28 N ATOM 52 C2 G A 5 0.551 14.334 -1.078 1.00 0.26 C ATOM 53 N2 G A 5 0.405 14.568 0.239 1.00 0.28 N ATOM 54 N3 G A 5 1.696 13.963 -1.667 1.00 0.25 N ATOM 55 C4 G A 5 1.604 13.791 -3.005 1.00 0.27 C ATOM 0 H5' G A 5 6.865 12.800 -6.510 1.00 0.49 H new ATOM 0 H5'' G A 5 6.849 11.161 -5.890 1.00 0.49 H new ATOM 0 H4' G A 5 7.113 13.082 -4.287 1.00 0.39 H new ATOM 0 H3' G A 5 6.234 10.593 -3.459 1.00 0.39 H new ATOM 0 H2' G A 5 3.900 10.991 -4.162 1.00 0.34 H new ATOM 0 HO2' G A 5 3.996 11.431 -1.422 1.00 0.34 H new ATOM 0 H1' G A 5 4.094 13.597 -2.506 1.00 0.31 H new ATOM 0 H8 G A 5 2.575 13.100 -6.001 1.00 0.33 H new ATOM 0 H1 G A 5 -1.456 14.799 -1.298 1.00 0.28 H new ATOM 0 H21 G A 5 1.202 14.463 0.867 1.00 0.28 H new ATOM 0 H22 G A 5 -0.503 14.850 0.609 1.00 0.28 H new ATOM 67 P A A 6 6.455 11.542 -0.679 1.00 0.46 P ATOM 68 OP1 A A 6 7.603 12.142 0.039 1.00 0.55 O ATOM 69 OP2 A A 6 6.377 10.063 -0.697 1.00 0.60 O ATOM 70 O5' A A 6 5.092 12.128 -0.106 1.00 0.45 O ATOM 71 C5' A A 6 4.901 12.394 1.289 1.00 0.38 C ATOM 72 C4' A A 6 3.703 11.641 1.926 1.00 0.30 C ATOM 73 O4' A A 6 2.455 11.948 1.205 1.00 0.26 O ATOM 74 C3' A A 6 3.822 10.094 1.925 1.00 0.27 C ATOM 75 O3' A A 6 3.466 9.597 3.227 1.00 0.29 O ATOM 76 C2' A A 6 2.814 9.691 0.831 1.00 0.25 C ATOM 77 O2' A A 6 2.430 8.323 0.841 1.00 0.27 O ATOM 78 C1' A A 6 1.709 10.746 1.062 1.00 0.22 C ATOM 79 N9 A A 6 0.654 10.948 0.019 1.00 0.21 N ATOM 80 C8 A A 6 0.657 10.702 -1.334 1.00 0.24 C ATOM 81 N7 A A 6 -0.468 10.994 -1.945 1.00 0.24 N ATOM 82 C5 A A 6 -1.276 11.476 -0.945 1.00 0.20 C ATOM 83 C6 A A 6 -2.599 11.950 -1.000 1.00 0.22 C ATOM 84 N6 A A 6 -3.267 11.985 -2.183 1.00 0.26 N ATOM 85 N1 A A 6 -3.130 12.366 0.186 1.00 0.22 N ATOM 86 C2 A A 6 -2.405 12.305 1.302 1.00 0.21 C ATOM 87 N3 A A 6 -1.155 11.881 1.459 1.00 0.19 N ATOM 88 C4 A A 6 -0.630 11.469 0.277 1.00 0.19 C ATOM 0 H5' A A 6 4.755 13.466 1.426 1.00 0.38 H new ATOM 0 H5'' A A 6 5.811 12.125 1.826 1.00 0.38 H new ATOM 0 H4' A A 6 3.701 11.989 2.959 1.00 0.30 H new ATOM 0 H3' A A 6 4.817 9.697 1.726 1.00 0.27 H new ATOM 0 H2' A A 6 3.203 9.713 -0.187 1.00 0.25 H new ATOM 0 HO2' A A 6 2.907 7.855 1.557 1.00 0.27 H new ATOM 0 H1' A A 6 1.104 10.410 1.904 1.00 0.22 H new ATOM 0 H8 A A 6 1.515 10.301 -1.852 1.00 0.24 H new ATOM 0 H61 A A 6 -4.226 12.330 -2.217 1.00 0.26 H new ATOM 0 H62 A A 6 -2.809 11.667 -3.037 1.00 0.26 H new ATOM 0 H2 A A 6 -2.899 12.646 2.200 1.00 0.21 H new ATOM 100 P C A 7 4.103 8.294 3.856 1.00 0.29 P ATOM 101 OP1 C A 7 5.521 8.542 4.207 1.00 0.33 O ATOM 102 OP2 C A 7 3.821 7.157 2.943 1.00 0.35 O ATOM 103 O5' C A 7 3.272 8.138 5.202 1.00 0.34 O ATOM 104 C5' C A 7 2.034 7.434 5.290 1.00 0.37 C ATOM 105 C4' C A 7 0.836 8.372 5.554 1.00 0.26 C ATOM 106 O4' C A 7 0.541 9.172 4.373 1.00 0.25 O ATOM 107 C3' C A 7 -0.461 7.605 5.798 1.00 0.25 C ATOM 108 O3' C A 7 -0.566 7.189 7.164 1.00 0.32 O ATOM 109 C2' C A 7 -1.559 8.588 5.375 1.00 0.24 C ATOM 110 O2' C A 7 -1.952 9.469 6.431 1.00 0.33 O ATOM 111 C1' C A 7 -0.876 9.362 4.215 1.00 0.23 C ATOM 112 N1 C A 7 -1.317 8.999 2.808 1.00 0.22 N ATOM 113 C2 C A 7 -2.685 9.258 2.424 1.00 0.22 C ATOM 114 O2 C A 7 -3.522 9.744 3.208 1.00 0.27 O ATOM 115 N3 C A 7 -3.064 8.952 1.137 1.00 0.23 N ATOM 116 C4 C A 7 -2.210 8.434 0.235 1.00 0.23 C ATOM 117 N4 C A 7 -2.632 8.152 -1.024 1.00 0.26 N ATOM 118 C5 C A 7 -0.848 8.175 0.598 1.00 0.24 C ATOM 119 C6 C A 7 -0.454 8.463 1.848 1.00 0.23 C ATOM 0 H5' C A 7 2.096 6.696 6.090 1.00 0.37 H new ATOM 0 H5'' C A 7 1.865 6.886 4.363 1.00 0.37 H new ATOM 0 H4' C A 7 1.128 8.964 6.422 1.00 0.26 H new ATOM 0 H3' C A 7 -0.527 6.675 5.233 1.00 0.25 H new ATOM 0 H2' C A 7 -2.487 8.090 5.094 1.00 0.24 H new ATOM 0 HO2' C A 7 -1.625 9.120 7.287 1.00 0.33 H new ATOM 0 H1' C A 7 -1.182 10.405 4.299 1.00 0.23 H new ATOM 0 H41 C A 7 -1.981 7.760 -1.704 1.00 0.26 H new ATOM 0 H42 C A 7 -3.600 8.333 -1.290 1.00 0.26 H new ATOM 0 H5 C A 7 -0.155 7.758 -0.118 1.00 0.24 H new ATOM 0 H6 C A 7 0.573 8.273 2.124 1.00 0.23 H new ATOM 131 P U A 8 -0.891 5.688 7.562 1.00 0.37 P ATOM 132 OP1 U A 8 -0.674 5.548 9.021 1.00 0.53 O ATOM 133 OP2 U A 8 -0.147 4.761 6.675 1.00 0.48 O ATOM 134 O5' U A 8 -2.440 5.571 7.224 1.00 0.27 O ATOM 135 C5' U A 8 -3.429 6.179 8.065 1.00 0.26 C ATOM 136 C4' U A 8 -4.844 6.190 7.437 1.00 0.18 C ATOM 137 O4' U A 8 -4.876 7.016 6.230 1.00 0.18 O ATOM 138 C3' U A 8 -5.348 4.823 6.976 1.00 0.16 C ATOM 139 O3' U A 8 -5.869 4.058 8.068 1.00 0.19 O ATOM 140 C2' U A 8 -6.359 5.167 5.875 1.00 0.17 C ATOM 141 O2' U A 8 -7.685 5.394 6.354 1.00 0.21 O ATOM 142 C1' U A 8 -5.778 6.455 5.260 1.00 0.17 C ATOM 143 N1 U A 8 -5.067 6.251 3.948 1.00 0.17 N ATOM 144 C2 U A 8 -5.841 6.427 2.761 1.00 0.19 C ATOM 145 O2 U A 8 -7.037 6.732 2.719 1.00 0.22 O ATOM 146 N3 U A 8 -5.131 6.220 1.577 1.00 0.20 N ATOM 147 C4 U A 8 -3.781 5.860 1.434 1.00 0.19 C ATOM 148 O4 U A 8 -3.292 5.692 0.314 1.00 0.20 O ATOM 149 C5 U A 8 -3.068 5.691 2.686 1.00 0.19 C ATOM 150 C6 U A 8 -3.715 5.884 3.854 1.00 0.19 C ATOM 0 H5' U A 8 -3.129 7.203 8.285 1.00 0.26 H new ATOM 0 H5'' U A 8 -3.465 5.646 9.015 1.00 0.26 H new ATOM 0 H4' U A 8 -5.473 6.567 8.244 1.00 0.18 H new ATOM 0 H3' U A 8 -4.570 4.167 6.587 1.00 0.16 H new ATOM 0 H2' U A 8 -6.474 4.341 5.174 1.00 0.17 H new ATOM 0 HO2' U A 8 -8.024 4.578 6.779 1.00 0.21 H new ATOM 0 H1' U A 8 -6.608 7.123 5.028 1.00 0.17 H new ATOM 0 H3 U A 8 -5.656 6.345 0.711 1.00 0.20 H new ATOM 0 H5 U A 8 -2.025 5.412 2.683 1.00 0.19 H new ATOM 0 H6 U A 8 -3.160 5.748 4.771 1.00 0.19 H new ATOM 161 P G A 9 -6.111 2.493 7.956 1.00 0.21 P ATOM 162 OP1 G A 9 -6.323 1.956 9.319 1.00 0.32 O ATOM 163 OP2 G A 9 -5.033 1.869 7.143 1.00 0.23 O ATOM 164 O5' G A 9 -7.501 2.476 7.171 1.00 0.21 O ATOM 165 C5' G A 9 -7.700 1.612 6.057 1.00 0.28 C ATOM 166 C4' G A 9 -9.080 1.838 5.405 1.00 0.25 C ATOM 167 O4' G A 9 -9.126 3.086 4.626 1.00 0.26 O ATOM 168 C3' G A 9 -9.402 0.771 4.362 1.00 0.27 C ATOM 169 O3' G A 9 -9.868 -0.438 4.954 1.00 0.34 O ATOM 170 C2' G A 9 -10.421 1.457 3.450 1.00 0.25 C ATOM 171 O2' G A 9 -11.733 1.530 4.020 1.00 0.27 O ATOM 172 C1' G A 9 -9.735 2.846 3.336 1.00 0.24 C ATOM 173 N9 G A 9 -8.683 2.929 2.262 1.00 0.21 N ATOM 174 C8 G A 9 -7.345 3.183 2.391 1.00 0.23 C ATOM 175 N7 G A 9 -6.673 3.180 1.267 1.00 0.21 N ATOM 176 C5 G A 9 -7.617 2.902 0.309 1.00 0.19 C ATOM 177 C6 G A 9 -7.452 2.777 -1.079 1.00 0.19 C ATOM 178 O6 G A 9 -6.387 2.905 -1.687 1.00 0.21 O ATOM 179 N1 G A 9 -8.670 2.487 -1.732 1.00 0.21 N ATOM 180 C2 G A 9 -9.911 2.332 -1.122 1.00 0.22 C ATOM 181 N2 G A 9 -10.901 2.055 -2.004 1.00 0.27 N ATOM 182 N3 G A 9 -10.040 2.457 0.220 1.00 0.21 N ATOM 183 C4 G A 9 -8.879 2.739 0.878 1.00 0.19 C ATOM 0 H5' G A 9 -7.615 0.575 6.380 1.00 0.28 H new ATOM 0 H5'' G A 9 -6.916 1.781 5.319 1.00 0.28 H new ATOM 0 H4' G A 9 -9.774 1.835 6.246 1.00 0.25 H new ATOM 0 H3' G A 9 -8.529 0.438 3.801 1.00 0.27 H new ATOM 0 H2' G A 9 -10.617 0.948 2.506 1.00 0.25 H new ATOM 0 HO2' G A 9 -11.823 0.851 4.721 1.00 0.27 H new ATOM 0 H1' G A 9 -10.483 3.589 3.058 1.00 0.24 H new ATOM 0 H8 G A 9 -6.879 3.372 3.347 1.00 0.23 H new ATOM 0 H1 G A 9 -8.637 2.381 -2.746 1.00 0.21 H new ATOM 0 H21 G A 9 -11.856 1.920 -1.673 1.00 0.27 H new ATOM 0 H22 G A 9 -10.691 1.981 -2.999 1.00 0.27 H new ATOM 195 P G A 10 -9.267 -1.847 4.550 1.00 0.44 P ATOM 196 OP1 G A 10 -8.914 -2.575 5.787 1.00 0.78 O ATOM 197 OP2 G A 10 -8.163 -1.702 3.555 1.00 0.63 O ATOM 198 O5' G A 10 -10.550 -2.501 3.884 1.00 0.40 O ATOM 199 C5' G A 10 -10.468 -3.326 2.729 1.00 0.33 C ATOM 200 C4' G A 10 -11.331 -2.779 1.570 1.00 0.24 C ATOM 201 O4' G A 10 -10.948 -1.410 1.193 1.00 0.24 O ATOM 202 C3' G A 10 -11.106 -3.568 0.287 1.00 0.20 C ATOM 203 O3' G A 10 -11.831 -4.801 0.268 1.00 0.22 O ATOM 204 C2' G A 10 -11.490 -2.582 -0.816 1.00 0.19 C ATOM 205 O2' G A 10 -12.898 -2.452 -1.005 1.00 0.23 O ATOM 206 C1' G A 10 -10.880 -1.282 -0.243 1.00 0.21 C ATOM 207 N9 G A 10 -9.475 -0.991 -0.638 1.00 0.19 N ATOM 208 C8 G A 10 -8.419 -0.652 0.155 1.00 0.17 C ATOM 209 N7 G A 10 -7.310 -0.436 -0.501 1.00 0.16 N ATOM 210 C5 G A 10 -7.626 -0.642 -1.813 1.00 0.15 C ATOM 211 C6 G A 10 -6.799 -0.550 -2.941 1.00 0.17 C ATOM 212 O6 G A 10 -5.603 -0.251 -2.927 1.00 0.22 O ATOM 213 N1 G A 10 -7.510 -0.837 -4.131 1.00 0.20 N ATOM 214 C2 G A 10 -8.864 -1.162 -4.215 1.00 0.21 C ATOM 215 N2 G A 10 -9.281 -1.372 -5.481 1.00 0.26 N ATOM 216 N3 G A 10 -9.628 -1.240 -3.108 1.00 0.20 N ATOM 217 C4 G A 10 -8.967 -0.978 -1.949 1.00 0.17 C ATOM 0 H5' G A 10 -10.794 -4.335 2.980 1.00 0.33 H new ATOM 0 H5'' G A 10 -9.429 -3.397 2.406 1.00 0.33 H new ATOM 0 H4' G A 10 -12.355 -2.841 1.939 1.00 0.24 H new ATOM 0 H3' G A 10 -10.078 -3.910 0.165 1.00 0.20 H new ATOM 0 H2' G A 10 -11.139 -2.877 -1.805 1.00 0.19 H new ATOM 0 HO2' G A 10 -13.353 -3.230 -0.620 1.00 0.23 H new ATOM 0 H1' G A 10 -11.451 -0.448 -0.651 1.00 0.21 H new ATOM 0 H8 G A 10 -8.493 -0.569 1.229 1.00 0.17 H new ATOM 0 H1 G A 10 -6.985 -0.803 -5.005 1.00 0.20 H new ATOM 0 H21 G A 10 -10.254 -1.616 -5.663 1.00 0.26 H new ATOM 0 H22 G A 10 -8.623 -1.286 -6.256 1.00 0.26 H new ATOM 229 P G A 11 -11.173 -6.103 -0.364 1.00 0.24 P ATOM 230 OP1 G A 11 -11.790 -7.296 0.257 1.00 0.40 O ATOM 231 OP2 G A 11 -9.689 -6.005 -0.337 1.00 0.33 O ATOM 232 O5' G A 11 -11.687 -5.979 -1.861 1.00 0.25 O ATOM 233 C5' G A 11 -11.150 -6.883 -2.829 1.00 0.25 C ATOM 234 C4' G A 11 -11.064 -6.231 -4.220 1.00 0.20 C ATOM 235 O4' G A 11 -10.383 -4.932 -4.148 1.00 0.22 O ATOM 236 C3' G A 11 -10.238 -7.088 -5.186 1.00 0.21 C ATOM 237 O3' G A 11 -11.097 -7.937 -5.963 1.00 0.24 O ATOM 238 C2' G A 11 -9.438 -6.083 -6.019 1.00 0.23 C ATOM 239 O2' G A 11 -10.138 -5.695 -7.204 1.00 0.31 O ATOM 240 C1' G A 11 -9.296 -4.865 -5.066 1.00 0.20 C ATOM 241 N9 G A 11 -8.032 -4.619 -4.303 1.00 0.17 N ATOM 242 C8 G A 11 -7.854 -4.289 -2.971 1.00 0.18 C ATOM 243 N7 G A 11 -6.600 -4.086 -2.636 1.00 0.16 N ATOM 244 C5 G A 11 -5.892 -4.273 -3.799 1.00 0.15 C ATOM 245 C6 G A 11 -4.508 -4.184 -4.008 1.00 0.17 C ATOM 246 O6 G A 11 -3.674 -3.919 -3.140 1.00 0.20 O ATOM 247 N1 G A 11 -4.160 -4.446 -5.359 1.00 0.18 N ATOM 248 C2 G A 11 -5.052 -4.763 -6.382 1.00 0.18 C ATOM 249 N2 G A 11 -4.435 -4.969 -7.566 1.00 0.24 N ATOM 250 N3 G A 11 -6.378 -4.837 -6.147 1.00 0.17 N ATOM 251 C4 G A 11 -6.739 -4.592 -4.858 1.00 0.15 C ATOM 0 H5' G A 11 -11.774 -7.775 -2.882 1.00 0.25 H new ATOM 0 H5'' G A 11 -10.158 -7.207 -2.515 1.00 0.25 H new ATOM 0 H4' G A 11 -12.091 -6.124 -4.570 1.00 0.20 H new ATOM 0 H3' G A 11 -9.559 -7.777 -4.684 1.00 0.21 H new ATOM 0 H2' G A 11 -8.488 -6.495 -6.359 1.00 0.23 H new ATOM 0 HO2' G A 11 -10.907 -6.288 -7.339 1.00 0.31 H new ATOM 0 H1' G A 11 -9.283 -4.018 -5.752 1.00 0.20 H new ATOM 0 H8 G A 11 -8.672 -4.206 -2.270 1.00 0.18 H new ATOM 0 H1 G A 11 -3.171 -4.398 -5.602 1.00 0.18 H new ATOM 0 H21 G A 11 -4.983 -5.208 -8.392 1.00 0.24 H new ATOM 0 H22 G A 11 -3.421 -4.885 -7.634 1.00 0.24 H new ATOM 263 P C A 12 -10.916 -9.508 -6.052 1.00 0.25 P ATOM 264 OP1 C A 12 -12.133 -10.068 -6.681 1.00 0.38 O ATOM 265 OP2 C A 12 -10.534 -10.036 -4.718 1.00 0.36 O ATOM 266 O5' C A 12 -9.719 -9.610 -7.089 1.00 0.29 O ATOM 267 C5' C A 12 -8.600 -10.468 -6.915 1.00 0.34 C ATOM 268 C4' C A 12 -7.324 -9.829 -7.496 1.00 0.25 C ATOM 269 O4' C A 12 -6.992 -8.619 -6.755 1.00 0.28 O ATOM 270 C3' C A 12 -6.073 -10.691 -7.334 1.00 0.24 C ATOM 271 O3' C A 12 -5.969 -11.699 -8.350 1.00 0.27 O ATOM 272 C2' C A 12 -4.927 -9.660 -7.383 1.00 0.24 C ATOM 273 O2' C A 12 -4.493 -9.391 -8.720 1.00 0.32 O ATOM 274 C1' C A 12 -5.570 -8.392 -6.743 1.00 0.22 C ATOM 275 N1 C A 12 -5.093 -7.961 -5.364 1.00 0.19 N ATOM 276 C2 C A 12 -3.683 -7.677 -5.117 1.00 0.21 C ATOM 277 O2 C A 12 -2.795 -7.779 -5.990 1.00 0.26 O ATOM 278 N3 C A 12 -3.316 -7.263 -3.854 1.00 0.22 N ATOM 279 C4 C A 12 -4.221 -7.109 -2.860 1.00 0.19 C ATOM 280 N4 C A 12 -3.844 -6.707 -1.619 1.00 0.22 N ATOM 281 C5 C A 12 -5.609 -7.368 -3.098 1.00 0.18 C ATOM 282 C6 C A 12 -5.991 -7.773 -4.312 1.00 0.18 C ATOM 0 H5' C A 12 -8.789 -11.423 -7.405 1.00 0.34 H new ATOM 0 H5'' C A 12 -8.457 -10.676 -5.855 1.00 0.34 H new ATOM 0 H4' C A 12 -7.556 -9.671 -8.549 1.00 0.25 H new ATOM 0 H3' C A 12 -6.069 -11.270 -6.410 1.00 0.24 H new ATOM 0 H2' C A 12 -4.033 -10.009 -6.867 1.00 0.24 H new ATOM 0 HO2' C A 12 -4.791 -10.113 -9.312 1.00 0.32 H new ATOM 0 H1' C A 12 -5.247 -7.543 -7.345 1.00 0.22 H new ATOM 0 H41 C A 12 -4.543 -6.597 -0.884 1.00 0.22 H new ATOM 0 H42 C A 12 -2.862 -6.515 -1.422 1.00 0.22 H new ATOM 0 H5 C A 12 -6.335 -7.238 -2.309 1.00 0.18 H new ATOM 0 H6 C A 12 -7.040 -7.963 -4.487 1.00 0.18 H new ATOM 294 P G A 13 -6.165 -13.254 -8.078 1.00 0.30 P ATOM 295 OP1 G A 13 -6.098 -13.951 -9.382 1.00 0.38 O ATOM 296 OP2 G A 13 -7.388 -13.470 -7.267 1.00 0.37 O ATOM 297 O5' G A 13 -4.861 -13.623 -7.249 1.00 0.30 O ATOM 298 C5' G A 13 -4.888 -13.864 -5.845 1.00 0.32 C ATOM 299 C4' G A 13 -3.599 -13.365 -5.174 1.00 0.29 C ATOM 300 O4' G A 13 -3.597 -11.899 -5.049 1.00 0.28 O ATOM 301 C3' G A 13 -3.463 -13.840 -3.727 1.00 0.30 C ATOM 302 O3' G A 13 -3.028 -15.203 -3.615 1.00 0.35 O ATOM 303 C2' G A 13 -2.475 -12.814 -3.142 1.00 0.30 C ATOM 304 O2' G A 13 -1.115 -13.045 -3.524 1.00 0.34 O ATOM 305 C1' G A 13 -3.047 -11.511 -3.772 1.00 0.26 C ATOM 306 N9 G A 13 -4.107 -10.900 -2.910 1.00 0.23 N ATOM 307 C8 G A 13 -5.459 -10.859 -3.086 1.00 0.24 C ATOM 308 N7 G A 13 -6.121 -10.278 -2.113 1.00 0.24 N ATOM 309 C5 G A 13 -5.151 -9.910 -1.210 1.00 0.21 C ATOM 310 C6 G A 13 -5.293 -9.248 0.026 1.00 0.22 C ATOM 311 O6 G A 13 -6.357 -8.862 0.520 1.00 0.28 O ATOM 312 N1 G A 13 -4.035 -9.052 0.653 1.00 0.21 N ATOM 313 C2 G A 13 -2.804 -9.456 0.147 1.00 0.21 C ATOM 314 N2 G A 13 -1.776 -9.147 0.955 1.00 0.24 N ATOM 315 N3 G A 13 -2.697 -10.080 -1.041 1.00 0.21 N ATOM 316 C4 G A 13 -3.887 -10.282 -1.667 1.00 0.20 C ATOM 0 H5' G A 13 -5.010 -14.931 -5.658 1.00 0.32 H new ATOM 0 H5'' G A 13 -5.749 -13.363 -5.403 1.00 0.32 H new ATOM 0 H4' G A 13 -2.800 -13.750 -5.808 1.00 0.29 H new ATOM 0 H3' G A 13 -4.409 -13.870 -3.187 1.00 0.30 H new ATOM 0 H2' G A 13 -2.414 -12.824 -2.054 1.00 0.30 H new ATOM 0 HO2' G A 13 -1.011 -13.974 -3.817 1.00 0.34 H new ATOM 0 H1' G A 13 -2.267 -10.757 -3.876 1.00 0.26 H new ATOM 0 H8 G A 13 -5.946 -11.272 -3.957 1.00 0.24 H new ATOM 0 H1 G A 13 -4.033 -8.573 1.554 1.00 0.21 H new ATOM 0 H21 G A 13 -0.824 -9.395 0.686 1.00 0.24 H new ATOM 0 H22 G A 13 -1.948 -8.664 1.837 1.00 0.24 H new ATOM 328 P A A 14 -3.833 -16.261 -2.737 1.00 0.35 P ATOM 329 OP1 A A 14 -3.141 -17.568 -2.822 1.00 0.42 O ATOM 330 OP2 A A 14 -5.268 -16.223 -3.096 1.00 0.41 O ATOM 331 O5' A A 14 -3.620 -15.666 -1.281 1.00 0.34 O ATOM 332 C5' A A 14 -4.306 -16.194 -0.148 1.00 0.34 C ATOM 333 C4' A A 14 -3.405 -16.265 1.104 1.00 0.30 C ATOM 334 O4' A A 14 -2.252 -17.141 0.870 1.00 0.32 O ATOM 335 C3' A A 14 -2.801 -14.923 1.542 1.00 0.27 C ATOM 336 O3' A A 14 -3.704 -14.192 2.377 1.00 0.30 O ATOM 337 C2' A A 14 -1.508 -15.346 2.256 1.00 0.28 C ATOM 338 O2' A A 14 -1.731 -15.736 3.612 1.00 0.32 O ATOM 339 C1' A A 14 -1.054 -16.555 1.405 1.00 0.31 C ATOM 340 N9 A A 14 -0.087 -16.262 0.287 1.00 0.31 N ATOM 341 C8 A A 14 -0.267 -16.381 -1.069 1.00 0.33 C ATOM 342 N7 A A 14 0.778 -16.065 -1.800 1.00 0.34 N ATOM 343 C5 A A 14 1.731 -15.705 -0.876 1.00 0.34 C ATOM 344 C6 A A 14 3.062 -15.272 -1.063 1.00 0.38 C ATOM 345 N6 A A 14 3.581 -15.155 -2.317 1.00 0.41 N ATOM 346 N1 A A 14 3.762 -14.992 0.076 1.00 0.40 N ATOM 347 C2 A A 14 3.174 -15.133 1.268 1.00 0.38 C ATOM 348 N3 A A 14 1.938 -15.539 1.555 1.00 0.35 N ATOM 349 C4 A A 14 1.245 -15.812 0.420 1.00 0.32 C ATOM 0 H5' A A 14 -4.676 -17.192 -0.383 1.00 0.34 H new ATOM 0 H5'' A A 14 -5.176 -15.574 0.068 1.00 0.34 H new ATOM 0 H4' A A 14 -4.079 -16.630 1.879 1.00 0.30 H new ATOM 0 H3' A A 14 -2.604 -14.235 0.720 1.00 0.27 H new ATOM 0 H2' A A 14 -0.779 -14.539 2.324 1.00 0.28 H new ATOM 0 HO2' A A 14 -2.591 -15.380 3.918 1.00 0.32 H new ATOM 0 H1' A A 14 -0.489 -17.217 2.061 1.00 0.31 H new ATOM 0 H8 A A 14 -1.200 -16.710 -1.503 1.00 0.33 H new ATOM 0 H61 A A 14 4.543 -14.842 -2.443 1.00 0.41 H new ATOM 0 H62 A A 14 3.007 -15.381 -3.129 1.00 0.41 H new ATOM 0 H2 A A 14 3.788 -14.882 2.120 1.00 0.38 H new ATOM 361 P G A 15 -4.027 -12.647 2.189 1.00 0.27 P ATOM 362 OP1 G A 15 -5.188 -12.320 3.048 1.00 0.31 O ATOM 363 OP2 G A 15 -4.143 -12.327 0.750 1.00 0.30 O ATOM 364 O5' G A 15 -2.717 -11.947 2.770 1.00 0.28 O ATOM 365 C5' G A 15 -2.426 -11.992 4.173 1.00 0.29 C ATOM 366 C4' G A 15 -0.938 -11.718 4.496 1.00 0.25 C ATOM 367 O4' G A 15 -0.076 -12.656 3.779 1.00 0.25 O ATOM 368 C3' G A 15 -0.428 -10.331 4.084 1.00 0.22 C ATOM 369 O3' G A 15 -0.670 -9.345 5.084 1.00 0.28 O ATOM 370 C2' G A 15 1.067 -10.550 3.824 1.00 0.19 C ATOM 371 O2' G A 15 1.858 -10.464 5.013 1.00 0.22 O ATOM 372 C1' G A 15 1.080 -11.987 3.256 1.00 0.21 C ATOM 373 N9 G A 15 1.088 -12.100 1.759 1.00 0.21 N ATOM 374 C8 G A 15 0.060 -12.367 0.895 1.00 0.24 C ATOM 375 N7 G A 15 0.397 -12.418 -0.368 1.00 0.26 N ATOM 376 C5 G A 15 1.742 -12.166 -0.369 1.00 0.25 C ATOM 377 C6 G A 15 2.622 -12.100 -1.459 1.00 0.28 C ATOM 378 O6 G A 15 2.316 -12.263 -2.646 1.00 0.32 O ATOM 379 N1 G A 15 3.948 -11.819 -1.037 1.00 0.31 N ATOM 380 C2 G A 15 4.363 -11.624 0.284 1.00 0.31 C ATOM 381 N2 G A 15 5.683 -11.366 0.407 1.00 0.38 N ATOM 382 N3 G A 15 3.490 -11.693 1.307 1.00 0.27 N ATOM 383 C4 G A 15 2.213 -11.962 0.932 1.00 0.22 C ATOM 0 H5' G A 15 -2.701 -12.972 4.563 1.00 0.29 H new ATOM 0 H5'' G A 15 -3.044 -11.258 4.689 1.00 0.29 H new ATOM 0 H4' G A 15 -0.894 -11.814 5.581 1.00 0.25 H new ATOM 0 H3' G A 15 -0.946 -9.942 3.207 1.00 0.22 H new ATOM 0 H2' G A 15 1.497 -9.795 3.166 1.00 0.19 H new ATOM 0 HO2' G A 15 1.372 -9.952 5.693 1.00 0.22 H new ATOM 0 H1' G A 15 2.022 -12.439 3.565 1.00 0.21 H new ATOM 0 H8 G A 15 -0.954 -12.524 1.231 1.00 0.24 H new ATOM 0 H1 G A 15 4.662 -11.753 -1.762 1.00 0.31 H new ATOM 0 H21 G A 15 6.088 -11.208 1.330 1.00 0.38 H new ATOM 0 H22 G A 15 6.275 -11.329 -0.423 1.00 0.38 H new ATOM 395 P A A 16 -1.877 -8.319 5.061 1.00 0.19 P ATOM 396 OP1 A A 16 -2.544 -8.382 6.380 1.00 0.27 O ATOM 397 OP2 A A 16 -2.737 -8.511 3.864 1.00 0.26 O ATOM 398 O5' A A 16 -1.106 -6.928 4.905 1.00 0.33 O ATOM 399 C5' A A 16 -0.459 -6.348 6.042 1.00 0.31 C ATOM 400 C4' A A 16 0.586 -5.285 5.637 1.00 0.24 C ATOM 401 O4' A A 16 -0.079 -4.056 5.161 1.00 0.23 O ATOM 402 C3' A A 16 1.471 -4.836 6.822 1.00 0.22 C ATOM 403 O3' A A 16 2.810 -4.591 6.385 1.00 0.24 O ATOM 404 C2' A A 16 0.797 -3.536 7.285 1.00 0.22 C ATOM 405 O2' A A 16 1.663 -2.682 8.028 1.00 0.31 O ATOM 406 C1' A A 16 0.362 -2.935 5.931 1.00 0.20 C ATOM 407 N9 A A 16 -0.683 -1.866 5.943 1.00 0.22 N ATOM 408 C8 A A 16 -1.756 -1.685 6.780 1.00 0.24 C ATOM 409 N7 A A 16 -2.488 -0.630 6.513 1.00 0.24 N ATOM 410 C5 A A 16 -1.873 -0.056 5.425 1.00 0.23 C ATOM 411 C6 A A 16 -2.202 1.106 4.688 1.00 0.24 C ATOM 412 N6 A A 16 -3.283 1.874 4.991 1.00 0.27 N ATOM 413 N1 A A 16 -1.369 1.400 3.646 1.00 0.24 N ATOM 414 C2 A A 16 -0.325 0.615 3.392 1.00 0.24 C ATOM 415 N3 A A 16 0.080 -0.488 4.007 1.00 0.22 N ATOM 416 C4 A A 16 -0.754 -0.786 5.041 1.00 0.22 C ATOM 0 H5' A A 16 0.028 -7.133 6.621 1.00 0.31 H new ATOM 0 H5'' A A 16 -1.207 -5.892 6.690 1.00 0.31 H new ATOM 0 H4' A A 16 1.192 -5.760 4.865 1.00 0.24 H new ATOM 0 H3' A A 16 1.548 -5.582 7.613 1.00 0.22 H new ATOM 0 H2' A A 16 -0.022 -3.688 7.988 1.00 0.22 H new ATOM 0 HO2' A A 16 2.593 -2.860 7.776 1.00 0.31 H new ATOM 0 H1' A A 16 1.217 -2.395 5.523 1.00 0.20 H new ATOM 0 H8 A A 16 -1.980 -2.358 7.594 1.00 0.24 H new ATOM 0 H61 A A 16 -3.489 2.705 4.437 1.00 0.27 H new ATOM 0 H62 A A 16 -3.887 1.619 5.772 1.00 0.27 H new ATOM 0 H2 A A 16 0.286 0.923 2.557 1.00 0.24 H new ATOM 428 P A A 17 4.091 -5.456 6.728 1.00 0.24 P ATOM 429 OP1 A A 17 3.811 -6.380 7.849 1.00 0.33 O ATOM 430 OP2 A A 17 5.205 -4.494 6.896 1.00 0.34 O ATOM 431 O5' A A 17 4.299 -6.288 5.384 1.00 0.24 O ATOM 432 C5' A A 17 4.565 -5.599 4.155 1.00 0.24 C ATOM 433 C4' A A 17 5.046 -6.536 3.031 1.00 0.22 C ATOM 434 O4' A A 17 3.980 -7.444 2.590 1.00 0.25 O ATOM 435 C3' A A 17 5.369 -5.797 1.725 1.00 0.24 C ATOM 436 O3' A A 17 6.593 -5.037 1.723 1.00 0.25 O ATOM 437 C2' A A 17 5.373 -6.960 0.716 1.00 0.28 C ATOM 438 O2' A A 17 6.658 -7.574 0.592 1.00 0.35 O ATOM 439 C1' A A 17 4.331 -7.960 1.293 1.00 0.25 C ATOM 440 N9 A A 17 3.114 -8.251 0.453 1.00 0.22 N ATOM 441 C8 A A 17 1.776 -8.279 0.796 1.00 0.22 C ATOM 442 N7 A A 17 0.970 -8.600 -0.183 1.00 0.23 N ATOM 443 C5 A A 17 1.794 -8.820 -1.257 1.00 0.23 C ATOM 444 C6 A A 17 1.486 -9.192 -2.585 1.00 0.25 C ATOM 445 N6 A A 17 0.202 -9.394 -2.989 1.00 0.28 N ATOM 446 N1 A A 17 2.555 -9.325 -3.428 1.00 0.27 N ATOM 447 C2 A A 17 3.787 -9.110 -2.983 1.00 0.28 C ATOM 448 N3 A A 17 4.184 -8.766 -1.757 1.00 0.26 N ATOM 449 C4 A A 17 3.121 -8.624 -0.917 1.00 0.23 C ATOM 0 H5' A A 17 5.321 -4.833 4.330 1.00 0.24 H new ATOM 0 H5'' A A 17 3.660 -5.085 3.830 1.00 0.24 H new ATOM 0 H4' A A 17 5.912 -7.029 3.472 1.00 0.22 H new ATOM 0 H3' A A 17 4.652 -5.005 1.508 1.00 0.24 H new ATOM 0 H2' A A 17 5.131 -6.620 -0.291 1.00 0.28 H new ATOM 0 HO2' A A 17 7.339 -6.990 0.986 1.00 0.35 H new ATOM 0 H1' A A 17 4.796 -8.945 1.326 1.00 0.25 H new ATOM 0 H8 A A 17 1.424 -8.054 1.792 1.00 0.22 H new ATOM 0 H61 A A 17 0.007 -9.662 -3.954 1.00 0.28 H new ATOM 0 H62 A A 17 -0.565 -9.277 -2.327 1.00 0.28 H new ATOM 0 H2 A A 17 4.574 -9.230 -3.712 1.00 0.28 H new ATOM 461 P G A 18 6.609 -3.441 1.604 1.00 0.24 P ATOM 462 OP1 G A 18 8.004 -2.950 1.687 1.00 0.34 O ATOM 463 OP2 G A 18 5.694 -2.875 2.625 1.00 0.33 O ATOM 464 O5' G A 18 6.008 -3.142 0.144 1.00 0.40 O ATOM 465 C5' G A 18 6.851 -3.091 -1.023 1.00 0.63 C ATOM 466 C4' G A 18 6.381 -3.915 -2.264 1.00 0.38 C ATOM 467 O4' G A 18 5.621 -5.093 -1.877 1.00 0.30 O ATOM 468 C3' G A 18 5.455 -3.241 -3.276 1.00 0.30 C ATOM 469 O3' G A 18 6.139 -2.320 -4.132 1.00 0.32 O ATOM 470 C2' G A 18 4.892 -4.454 -4.048 1.00 0.29 C ATOM 471 O2' G A 18 5.791 -4.967 -5.036 1.00 0.38 O ATOM 472 C1' G A 18 4.694 -5.471 -2.911 1.00 0.26 C ATOM 473 N9 G A 18 3.297 -5.530 -2.369 1.00 0.21 N ATOM 474 C8 G A 18 2.879 -5.278 -1.100 1.00 0.24 C ATOM 475 N7 G A 18 1.600 -5.434 -0.893 1.00 0.22 N ATOM 476 C5 G A 18 1.104 -5.808 -2.100 1.00 0.19 C ATOM 477 C6 G A 18 -0.218 -6.097 -2.420 1.00 0.21 C ATOM 478 O6 G A 18 -1.156 -6.034 -1.616 1.00 0.24 O ATOM 479 N1 G A 18 -0.354 -6.450 -3.779 1.00 0.19 N ATOM 480 C2 G A 18 0.686 -6.523 -4.713 1.00 0.19 C ATOM 481 N2 G A 18 0.242 -6.902 -5.931 1.00 0.22 N ATOM 482 N3 G A 18 1.967 -6.233 -4.371 1.00 0.19 N ATOM 483 C4 G A 18 2.116 -5.888 -3.062 1.00 0.19 C ATOM 0 H5' G A 18 7.845 -3.438 -0.740 1.00 0.63 H new ATOM 0 H5'' G A 18 6.952 -2.048 -1.325 1.00 0.63 H new ATOM 0 H4' G A 18 7.349 -4.100 -2.730 1.00 0.38 H new ATOM 0 H3' G A 18 4.689 -2.620 -2.812 1.00 0.30 H new ATOM 0 H2' G A 18 3.995 -4.211 -4.618 1.00 0.29 H new ATOM 0 HO2' G A 18 6.393 -4.253 -5.333 1.00 0.38 H new ATOM 0 H1' G A 18 4.874 -6.474 -3.297 1.00 0.26 H new ATOM 0 H8 G A 18 3.558 -4.970 -0.318 1.00 0.24 H new ATOM 0 H1 G A 18 -1.293 -6.672 -4.110 1.00 0.19 H new ATOM 0 H21 G A 18 0.898 -6.995 -6.707 1.00 0.22 H new ATOM 0 H22 G A 18 -0.749 -7.095 -6.075 1.00 0.22 H new ATOM 495 P U A 19 5.442 -0.982 -4.643 1.00 0.34 P ATOM 496 OP1 U A 19 6.455 -0.173 -5.359 1.00 0.43 O ATOM 497 OP2 U A 19 4.742 -0.335 -3.509 1.00 0.39 O ATOM 498 O5' U A 19 4.333 -1.485 -5.668 1.00 0.34 O ATOM 499 C5' U A 19 4.650 -1.997 -6.962 1.00 0.35 C ATOM 500 C4' U A 19 3.435 -2.620 -7.704 1.00 0.31 C ATOM 501 O4' U A 19 2.785 -3.671 -6.901 1.00 0.27 O ATOM 502 C3' U A 19 2.305 -1.644 -8.065 1.00 0.31 C ATOM 503 O3' U A 19 2.579 -0.922 -9.277 1.00 0.34 O ATOM 504 C2' U A 19 1.084 -2.576 -8.153 1.00 0.29 C ATOM 505 O2' U A 19 0.994 -3.240 -9.420 1.00 0.40 O ATOM 506 C1' U A 19 1.349 -3.578 -7.012 1.00 0.24 C ATOM 507 N1 U A 19 0.704 -3.292 -5.666 1.00 0.22 N ATOM 508 C2 U A 19 -0.675 -3.658 -5.479 1.00 0.22 C ATOM 509 O2 U A 19 -1.406 -4.178 -6.331 1.00 0.25 O ATOM 510 N3 U A 19 -1.180 -3.369 -4.196 1.00 0.21 N ATOM 511 C4 U A 19 -0.497 -2.787 -3.110 1.00 0.20 C ATOM 512 O4 U A 19 -1.065 -2.597 -2.031 1.00 0.22 O ATOM 513 C5 U A 19 0.881 -2.459 -3.383 1.00 0.23 C ATOM 514 C6 U A 19 1.405 -2.713 -4.598 1.00 0.23 C ATOM 0 H5' U A 19 5.430 -2.752 -6.863 1.00 0.35 H new ATOM 0 H5'' U A 19 5.062 -1.192 -7.570 1.00 0.35 H new ATOM 0 H4' U A 19 3.894 -2.995 -8.619 1.00 0.31 H new ATOM 0 H3' U A 19 2.161 -0.841 -7.342 1.00 0.31 H new ATOM 0 H2' U A 19 0.137 -2.044 -8.062 1.00 0.29 H new ATOM 0 HO2' U A 19 1.555 -2.773 -10.074 1.00 0.40 H new ATOM 0 H1' U A 19 0.865 -4.517 -7.282 1.00 0.24 H new ATOM 0 H3 U A 19 -2.158 -3.610 -4.034 1.00 0.21 H new ATOM 0 H5 U A 19 1.492 -2.010 -2.614 1.00 0.23 H new ATOM 0 H6 U A 19 2.440 -2.452 -4.761 1.00 0.23 H new ATOM 525 P U A 20 1.763 0.386 -9.683 1.00 0.34 P ATOM 526 OP1 U A 20 2.426 1.002 -10.853 1.00 0.42 O ATOM 527 OP2 U A 20 1.570 1.237 -8.482 1.00 0.35 O ATOM 528 O5' U A 20 0.364 -0.235 -10.155 1.00 0.34 O ATOM 529 C5' U A 20 -0.814 0.570 -10.079 1.00 0.32 C ATOM 530 C4' U A 20 -2.109 -0.209 -10.431 1.00 0.27 C ATOM 531 O4' U A 20 -2.282 -1.411 -9.593 1.00 0.27 O ATOM 532 C3' U A 20 -3.361 0.640 -10.165 1.00 0.27 C ATOM 533 O3' U A 20 -3.739 1.384 -11.334 1.00 0.30 O ATOM 534 C2' U A 20 -4.412 -0.363 -9.666 1.00 0.26 C ATOM 535 O2' U A 20 -5.105 -1.013 -10.733 1.00 0.35 O ATOM 536 C1' U A 20 -3.534 -1.373 -8.878 1.00 0.26 C ATOM 537 N1 U A 20 -3.303 -1.101 -7.395 1.00 0.22 N ATOM 538 C2 U A 20 -4.408 -1.243 -6.478 1.00 0.22 C ATOM 539 O2 U A 20 -5.564 -1.559 -6.778 1.00 0.25 O ATOM 540 N3 U A 20 -4.074 -0.987 -5.133 1.00 0.22 N ATOM 541 C4 U A 20 -2.815 -0.614 -4.611 1.00 0.23 C ATOM 542 O4 U A 20 -2.658 -0.411 -3.405 1.00 0.26 O ATOM 543 C5 U A 20 -1.768 -0.502 -5.600 1.00 0.24 C ATOM 544 C6 U A 20 -2.039 -0.739 -6.895 1.00 0.24 C ATOM 0 H5' U A 20 -0.712 1.418 -10.757 1.00 0.32 H new ATOM 0 H5'' U A 20 -0.904 0.976 -9.072 1.00 0.32 H new ATOM 0 H4' U A 20 -2.003 -0.470 -11.484 1.00 0.27 H new ATOM 0 H3' U A 20 -3.211 1.418 -9.416 1.00 0.27 H new ATOM 0 H2' U A 20 -5.204 0.106 -9.082 1.00 0.26 H new ATOM 0 HO2' U A 20 -5.008 -0.487 -11.554 1.00 0.35 H new ATOM 0 H1' U A 20 -4.071 -2.321 -8.842 1.00 0.26 H new ATOM 0 H3 U A 20 -4.831 -1.082 -4.456 1.00 0.22 H new ATOM 0 H5 U A 20 -0.768 -0.228 -5.299 1.00 0.24 H new ATOM 0 H6 U A 20 -1.228 -0.645 -7.602 1.00 0.24 H new ATOM 555 P U A 21 -4.232 2.896 -11.265 1.00 0.33 P ATOM 556 OP1 U A 21 -4.099 3.514 -12.604 1.00 0.45 O ATOM 557 OP2 U A 21 -3.569 3.581 -10.124 1.00 0.37 O ATOM 558 O5' U A 21 -5.767 2.662 -10.950 1.00 0.35 O ATOM 559 C5' U A 21 -6.528 3.574 -10.168 1.00 0.34 C ATOM 560 C4' U A 21 -7.816 2.906 -9.642 1.00 0.31 C ATOM 561 O4' U A 21 -7.523 1.697 -8.859 1.00 0.33 O ATOM 562 C3' U A 21 -8.617 3.820 -8.714 1.00 0.29 C ATOM 563 O3' U A 21 -9.652 4.461 -9.471 1.00 0.32 O ATOM 564 C2' U A 21 -9.128 2.892 -7.601 1.00 0.29 C ATOM 565 O2' U A 21 -10.372 2.275 -7.939 1.00 0.36 O ATOM 566 C1' U A 21 -7.999 1.833 -7.516 1.00 0.30 C ATOM 567 N1 U A 21 -6.843 2.077 -6.554 1.00 0.26 N ATOM 568 C2 U A 21 -7.128 2.142 -5.148 1.00 0.25 C ATOM 569 O2 U A 21 -8.241 2.028 -4.622 1.00 0.27 O ATOM 570 N3 U A 21 -5.995 2.342 -4.343 1.00 0.25 N ATOM 571 C4 U A 21 -4.649 2.484 -4.744 1.00 0.27 C ATOM 572 O4 U A 21 -3.748 2.663 -3.918 1.00 0.30 O ATOM 573 C5 U A 21 -4.452 2.403 -6.172 1.00 0.29 C ATOM 574 C6 U A 21 -5.506 2.209 -6.988 1.00 0.28 C ATOM 0 H5' U A 21 -6.785 4.447 -10.768 1.00 0.34 H new ATOM 0 H5'' U A 21 -5.929 3.929 -9.329 1.00 0.34 H new ATOM 0 H4' U A 21 -8.389 2.672 -10.539 1.00 0.31 H new ATOM 0 H3' U A 21 -8.044 4.635 -8.271 1.00 0.29 H new ATOM 0 H2' U A 21 -9.324 3.419 -6.667 1.00 0.29 H new ATOM 0 HO2' U A 21 -10.773 2.743 -8.701 1.00 0.36 H new ATOM 0 H1' U A 21 -8.435 0.934 -7.081 1.00 0.30 H new ATOM 0 H3 U A 21 -6.167 2.391 -3.339 1.00 0.25 H new ATOM 0 H5 U A 21 -3.459 2.498 -6.586 1.00 0.29 H new ATOM 0 H6 U A 21 -5.315 2.150 -8.049 1.00 0.28 H new ATOM 585 P A A 22 -10.151 5.933 -9.196 1.00 0.32 P ATOM 586 OP1 A A 22 -11.053 6.335 -10.297 1.00 0.43 O ATOM 587 OP2 A A 22 -8.989 6.807 -8.903 1.00 0.34 O ATOM 588 O5' A A 22 -11.022 5.686 -7.895 1.00 0.32 O ATOM 589 C5' A A 22 -11.253 6.738 -6.972 1.00 0.29 C ATOM 590 C4' A A 22 -12.041 6.233 -5.746 1.00 0.24 C ATOM 591 O4' A A 22 -11.357 5.101 -5.098 1.00 0.24 O ATOM 592 C3' A A 22 -12.165 7.322 -4.669 1.00 0.24 C ATOM 593 O3' A A 22 -13.424 8.004 -4.798 1.00 0.26 O ATOM 594 C2' A A 22 -11.968 6.582 -3.338 1.00 0.23 C ATOM 595 O2' A A 22 -13.200 6.094 -2.800 1.00 0.27 O ATOM 596 C1' A A 22 -11.038 5.407 -3.738 1.00 0.22 C ATOM 597 N9 A A 22 -9.545 5.567 -3.630 1.00 0.19 N ATOM 598 C8 A A 22 -8.591 5.547 -4.626 1.00 0.21 C ATOM 599 N7 A A 22 -7.354 5.682 -4.207 1.00 0.19 N ATOM 600 C5 A A 22 -7.475 5.799 -2.843 1.00 0.16 C ATOM 601 C6 A A 22 -6.483 5.973 -1.859 1.00 0.15 C ATOM 602 N6 A A 22 -5.165 6.048 -2.202 1.00 0.18 N ATOM 603 N1 A A 22 -6.938 6.051 -0.577 1.00 0.17 N ATOM 604 C2 A A 22 -8.244 5.964 -0.317 1.00 0.18 C ATOM 605 N3 A A 22 -9.255 5.795 -1.165 1.00 0.18 N ATOM 606 C4 A A 22 -8.803 5.726 -2.442 1.00 0.16 C ATOM 0 H5' A A 22 -11.807 7.540 -7.460 1.00 0.29 H new ATOM 0 H5'' A A 22 -10.301 7.159 -6.649 1.00 0.29 H new ATOM 0 H4' A A 22 -13.020 5.940 -6.125 1.00 0.24 H new ATOM 0 H3' A A 22 -11.425 8.117 -4.754 1.00 0.24 H new ATOM 0 H2' A A 22 -11.561 7.225 -2.558 1.00 0.23 H new ATOM 0 HO2' A A 22 -13.951 6.490 -3.290 1.00 0.27 H new ATOM 0 H1' A A 22 -11.239 4.633 -2.998 1.00 0.22 H new ATOM 0 H8 A A 22 -8.842 5.429 -5.670 1.00 0.21 H new ATOM 0 H61 A A 22 -4.456 6.174 -1.479 1.00 0.18 H new ATOM 0 H62 A A 22 -4.888 5.978 -3.181 1.00 0.18 H new ATOM 0 H2 A A 22 -8.518 6.041 0.725 1.00 0.18 H new ATOM 618 P G A 23 -13.600 9.564 -4.566 1.00 0.28 P ATOM 619 OP1 G A 23 -14.935 9.963 -5.061 1.00 0.38 O ATOM 620 OP2 G A 23 -12.421 10.279 -5.120 1.00 0.31 O ATOM 621 O5' G A 23 -13.605 9.616 -2.976 1.00 0.31 O ATOM 622 C5' G A 23 -12.896 10.598 -2.232 1.00 0.26 C ATOM 623 C4' G A 23 -12.804 10.198 -0.744 1.00 0.24 C ATOM 624 O4' G A 23 -12.036 8.947 -0.584 1.00 0.23 O ATOM 625 C3' G A 23 -12.051 11.231 0.114 1.00 0.21 C ATOM 626 O3' G A 23 -12.908 12.275 0.611 1.00 0.21 O ATOM 627 C2' G A 23 -11.413 10.362 1.213 1.00 0.21 C ATOM 628 O2' G A 23 -12.327 10.037 2.261 1.00 0.26 O ATOM 629 C1' G A 23 -11.011 9.102 0.407 1.00 0.20 C ATOM 630 N9 G A 23 -9.680 9.159 -0.278 1.00 0.20 N ATOM 631 C8 G A 23 -9.394 9.053 -1.611 1.00 0.21 C ATOM 632 N7 G A 23 -8.123 9.128 -1.908 1.00 0.21 N ATOM 633 C5 G A 23 -7.504 9.296 -0.699 1.00 0.19 C ATOM 634 C6 G A 23 -6.139 9.433 -0.432 1.00 0.20 C ATOM 635 O6 G A 23 -5.243 9.427 -1.286 1.00 0.22 O ATOM 636 N1 G A 23 -5.898 9.586 0.956 1.00 0.21 N ATOM 637 C2 G A 23 -6.860 9.600 1.967 1.00 0.21 C ATOM 638 N2 G A 23 -6.349 9.764 3.207 1.00 0.24 N ATOM 639 N3 G A 23 -8.167 9.457 1.670 1.00 0.21 N ATOM 640 C4 G A 23 -8.431 9.315 0.344 1.00 0.19 C ATOM 0 H5' G A 23 -13.397 11.562 -2.324 1.00 0.26 H new ATOM 0 H5'' G A 23 -11.894 10.719 -2.643 1.00 0.26 H new ATOM 0 H4' G A 23 -13.840 10.108 -0.418 1.00 0.24 H new ATOM 0 H3' G A 23 -11.306 11.798 -0.444 1.00 0.21 H new ATOM 0 H2' G A 23 -10.590 10.855 1.731 1.00 0.21 H new ATOM 0 HO2' G A 23 -13.085 10.657 2.238 1.00 0.26 H new ATOM 0 H1' G A 23 -10.915 8.272 1.108 1.00 0.20 H new ATOM 0 H8 G A 23 -10.159 8.918 -2.361 1.00 0.21 H new ATOM 0 H1 G A 23 -4.926 9.697 1.245 1.00 0.21 H new ATOM 0 H21 G A 23 -6.970 9.788 4.016 1.00 0.24 H new ATOM 0 H22 G A 23 -5.342 9.864 3.334 1.00 0.24 H new ATOM 652 P U A 24 -12.571 13.827 0.414 1.00 0.23 P ATOM 653 OP1 U A 24 -13.802 14.617 0.633 1.00 0.30 O ATOM 654 OP2 U A 24 -11.862 14.020 -0.874 1.00 0.26 O ATOM 655 O5' U A 24 -11.538 14.148 1.571 1.00 0.25 O ATOM 656 C5' U A 24 -11.851 14.064 2.960 1.00 0.27 C ATOM 657 C4' U A 24 -10.604 13.763 3.827 1.00 0.23 C ATOM 658 O4' U A 24 -9.876 12.596 3.307 1.00 0.23 O ATOM 659 C3' U A 24 -9.563 14.891 3.903 1.00 0.20 C ATOM 660 O3' U A 24 -9.898 15.843 4.929 1.00 0.26 O ATOM 661 C2' U A 24 -8.253 14.115 4.131 1.00 0.21 C ATOM 662 O2' U A 24 -8.007 13.837 5.511 1.00 0.30 O ATOM 663 C1' U A 24 -8.458 12.813 3.323 1.00 0.21 C ATOM 664 N1 U A 24 -7.852 12.813 1.923 1.00 0.19 N ATOM 665 C2 U A 24 -6.414 12.808 1.814 1.00 0.22 C ATOM 666 O2 U A 24 -5.618 12.797 2.759 1.00 0.26 O ATOM 667 N3 U A 24 -5.936 12.807 0.489 1.00 0.22 N ATOM 668 C4 U A 24 -6.686 12.809 -0.701 1.00 0.21 C ATOM 669 O4 U A 24 -6.124 12.818 -1.801 1.00 0.26 O ATOM 670 C5 U A 24 -8.118 12.814 -0.501 1.00 0.20 C ATOM 671 C6 U A 24 -8.625 12.816 0.749 1.00 0.19 C ATOM 0 H5' U A 24 -12.596 13.283 3.116 1.00 0.27 H new ATOM 0 H5'' U A 24 -12.300 15.002 3.286 1.00 0.27 H new ATOM 0 H4' U A 24 -11.026 13.608 4.820 1.00 0.23 H new ATOM 0 H3' U A 24 -9.498 15.521 3.016 1.00 0.20 H new ATOM 0 H2' U A 24 -7.381 14.687 3.814 1.00 0.21 H new ATOM 0 HO2' U A 24 -7.884 14.679 5.997 1.00 0.30 H new ATOM 0 H1' U A 24 -7.917 11.997 3.803 1.00 0.21 H new ATOM 0 H3 U A 24 -4.922 12.805 0.379 1.00 0.22 H new ATOM 0 H5 U A 24 -8.782 12.816 -1.353 1.00 0.20 H new ATOM 0 H6 U A 24 -9.700 12.820 0.855 1.00 0.19 H new ATOM 682 P C A 25 -9.185 17.254 5.112 1.00 0.30 P ATOM 683 OP1 C A 25 -9.942 18.033 6.117 1.00 0.44 O ATOM 684 OP2 C A 25 -8.976 17.876 3.783 1.00 0.37 O ATOM 685 O5' C A 25 -7.798 16.815 5.755 1.00 0.30 O ATOM 686 C5' C A 25 -6.604 17.587 5.635 1.00 0.37 C ATOM 687 C4' C A 25 -5.390 16.668 5.389 1.00 0.36 C ATOM 688 O4' C A 25 -5.481 16.060 4.076 1.00 0.39 O ATOM 689 C3' C A 25 -4.057 17.395 5.300 1.00 0.47 C ATOM 690 O3' C A 25 -3.558 17.730 6.601 1.00 0.62 O ATOM 691 C2' C A 25 -3.161 16.407 4.521 1.00 0.47 C ATOM 692 O2' C A 25 -2.452 15.508 5.380 1.00 0.62 O ATOM 693 C1' C A 25 -4.187 15.626 3.637 1.00 0.35 C ATOM 694 N1 C A 25 -4.093 15.717 2.116 1.00 0.28 N ATOM 695 C2 C A 25 -2.811 15.608 1.449 1.00 0.26 C ATOM 696 O2 C A 25 -1.740 15.478 2.065 1.00 0.30 O ATOM 697 N3 C A 25 -2.780 15.650 0.071 1.00 0.27 N ATOM 698 C4 C A 25 -3.903 15.790 -0.663 1.00 0.28 C ATOM 699 N4 C A 25 -3.857 15.851 -2.020 1.00 0.32 N ATOM 700 C5 C A 25 -5.182 15.889 -0.022 1.00 0.32 C ATOM 701 C6 C A 25 -5.235 15.841 1.316 1.00 0.33 C ATOM 0 H5' C A 25 -6.448 18.170 6.542 1.00 0.37 H new ATOM 0 H5'' C A 25 -6.703 18.296 4.813 1.00 0.37 H new ATOM 0 H4' C A 25 -5.418 15.980 6.234 1.00 0.36 H new ATOM 0 H3' C A 25 -4.114 18.360 4.796 1.00 0.47 H new ATOM 0 H2' C A 25 -2.383 16.919 3.955 1.00 0.47 H new ATOM 0 HO2' C A 25 -2.408 15.885 6.283 1.00 0.62 H new ATOM 0 H1' C A 25 -3.961 14.571 3.790 1.00 0.35 H new ATOM 0 H41 C A 25 -4.719 15.957 -2.555 1.00 0.32 H new ATOM 0 H42 C A 25 -2.961 15.791 -2.503 1.00 0.32 H new ATOM 0 H5 C A 25 -6.084 16.000 -0.606 1.00 0.32 H new ATOM 0 H6 C A 25 -6.200 15.901 1.798 1.00 0.33 H new ATOM 713 P C A 26 -3.091 19.204 6.970 1.00 0.81 P ATOM 714 OP1 C A 26 -2.965 19.295 8.441 1.00 1.04 O ATOM 715 OP2 C A 26 -3.970 20.203 6.318 1.00 0.97 O ATOM 716 O5' C A 26 -1.651 19.294 6.297 1.00 0.66 O ATOM 717 C5' C A 26 -0.527 18.628 6.879 1.00 0.63 C ATOM 718 C4' C A 26 0.683 18.547 5.923 1.00 0.50 C ATOM 719 O4' C A 26 0.377 17.695 4.775 1.00 0.41 O ATOM 720 C3' C A 26 1.108 19.875 5.294 1.00 0.50 C ATOM 721 O3' C A 26 1.892 20.683 6.175 1.00 0.62 O ATOM 722 C2' C A 26 1.845 19.452 4.024 1.00 0.42 C ATOM 723 O2' C A 26 3.226 19.153 4.257 1.00 0.48 O ATOM 724 C1' C A 26 1.057 18.177 3.602 1.00 0.37 C ATOM 725 N1 C A 26 0.054 18.380 2.488 1.00 0.35 N ATOM 726 C2 C A 26 0.409 17.960 1.155 1.00 0.33 C ATOM 727 O2 C A 26 1.506 17.433 0.888 1.00 0.40 O ATOM 728 N3 C A 26 -0.503 18.163 0.144 1.00 0.35 N ATOM 729 C4 C A 26 -1.705 18.729 0.368 1.00 0.38 C ATOM 730 N4 C A 26 -2.570 18.909 -0.662 1.00 0.42 N ATOM 731 C5 C A 26 -2.073 19.155 1.693 1.00 0.46 C ATOM 732 C6 C A 26 -1.193 18.974 2.689 1.00 0.44 C ATOM 0 H5' C A 26 -0.820 17.620 7.173 1.00 0.63 H new ATOM 0 H5'' C A 26 -0.231 19.152 7.788 1.00 0.63 H new ATOM 0 H4' C A 26 1.479 18.171 6.566 1.00 0.50 H new ATOM 0 H3' C A 26 0.262 20.526 5.073 1.00 0.50 H new ATOM 0 H2' C A 26 1.870 20.237 3.268 1.00 0.42 H new ATOM 0 HO2' C A 26 3.493 19.501 5.133 1.00 0.48 H new ATOM 0 HO3' C A 26 2.137 21.517 5.723 1.00 0.62 H new ATOM 0 H1' C A 26 1.780 17.467 3.200 1.00 0.37 H new ATOM 0 H41 C A 26 -3.480 19.337 -0.494 1.00 0.42 H new ATOM 0 H42 C A 26 -2.310 18.616 -1.604 1.00 0.42 H new ATOM 0 H5 C A 26 -3.035 19.609 1.881 1.00 0.46 H new ATOM 0 H6 C A 26 -1.459 19.300 3.684 1.00 0.44 H new TER 745 C A 26 HETATM 746 C4 BDR A 29 2.329 -1.757 0.519 1.00 0.25 C HETATM 747 O BDR A 29 0.993 -1.769 0.015 1.00 0.25 O HETATM 748 C1 BDR A 29 0.615 -0.434 -0.341 1.00 0.21 C HETATM 749 C2 BDR A 29 1.874 0.421 -0.157 1.00 0.26 C HETATM 750 O2 BDR A 29 2.689 0.387 -1.338 1.00 0.32 O HETATM 751 C3 BDR A 29 2.499 -0.329 0.984 1.00 0.26 C HETATM 752 O3 BDR A 29 3.848 0.115 1.166 1.00 0.28 O HETATM 753 C5 BDR A 29 2.490 -2.732 1.682 1.00 0.27 C HETATM 754 O5 BDR A 29 2.299 -4.099 1.343 1.00 0.30 O HETATM 0 HO2 BDR A 29 3.635 0.407 -1.083 1.00 0.32 H new HETATM 0 H52 BDR A 29 3.488 -2.612 2.103 1.00 0.27 H new HETATM 0 H51 BDR A 29 1.780 -2.463 2.464 1.00 0.27 H new HETATM 0 H5 BDR A 29 2.066 -4.171 0.394 1.00 0.30 H new HETATM 0 H4 BDR A 29 3.069 -2.064 -0.220 1.00 0.25 H new HETATM 0 H3 BDR A 29 2.064 -0.187 1.973 1.00 0.26 H new HETATM 0 H2 BDR A 29 1.714 1.484 0.023 1.00 0.26 H new HETATM 763 C5 IDG A 30 4.303 0.059 4.768 1.00 0.28 C HETATM 764 O5 IDG A 30 4.112 -0.413 3.422 1.00 0.27 O HETATM 765 C1 IDG A 30 4.138 0.610 2.440 1.00 0.27 C HETATM 766 C2 IDG A 30 5.506 1.286 2.429 1.00 0.29 C HETATM 767 N2 IDG A 30 6.544 0.319 1.994 1.00 0.33 N HETATM 768 C3 IDG A 30 5.808 1.856 3.820 1.00 0.29 C HETATM 769 O3 IDG A 30 4.931 2.940 4.096 1.00 0.32 O HETATM 770 C4 IDG A 30 5.655 0.779 4.902 1.00 0.30 C HETATM 771 O4 IDG A 30 6.725 -0.155 4.815 1.00 0.32 O HETATM 772 C6 IDG A 30 4.155 -1.143 5.688 1.00 0.33 C HETATM 773 N6 IDG A 30 5.044 -2.267 5.310 1.00 0.33 N HETATM 0 HN62 IDG A 30 5.035 -3.130 5.854 1.00 0.33 H new HETATM 0 HN61 IDG A 30 5.665 -2.178 4.506 1.00 0.33 H new HETATM 0 HN22 IDG A 30 7.519 0.611 1.931 1.00 0.33 H new HETATM 0 HN21 IDG A 30 6.282 -0.638 1.757 1.00 0.33 H new HETATM 0 HO4 IDG A 30 7.579 0.317 4.900 1.00 0.32 H new HETATM 0 HO3 IDG A 30 5.126 3.300 4.986 1.00 0.32 H new HETATM 0 H62 IDG A 30 4.374 -0.841 6.712 1.00 0.33 H new HETATM 0 H61 IDG A 30 3.119 -1.483 5.671 1.00 0.33 H new HETATM 0 H5 IDG A 30 3.558 0.805 5.047 1.00 0.28 H new HETATM 0 H4 IDG A 30 5.687 1.263 5.878 1.00 0.30 H new HETATM 0 H3 IDG A 30 6.840 2.207 3.829 1.00 0.29 H new HETATM 0 H2 IDG A 30 5.506 2.113 1.719 1.00 0.29 H new HETATM 789 C5 BDG A 27 -3.773 -3.436 3.208 1.00 0.18 C HETATM 790 O5 BDG A 27 -2.665 -2.515 3.253 1.00 0.17 O HETATM 791 C1 BDG A 27 -1.832 -2.532 2.096 1.00 0.16 C HETATM 792 C2 BDG A 27 -1.268 -3.932 1.844 1.00 0.16 C HETATM 793 N2 BDG A 27 -0.509 -3.944 0.568 1.00 0.17 N HETATM 794 C3 BDG A 27 -2.390 -4.971 1.796 1.00 0.18 C HETATM 795 O3 BDG A 27 -1.831 -6.276 1.707 1.00 0.22 O HETATM 796 C4 BDG A 27 -3.254 -4.864 3.054 1.00 0.19 C HETATM 797 O4 BDG A 27 -4.353 -5.763 2.966 1.00 0.24 O HETATM 798 C6 BDG A 27 -4.574 -3.243 4.487 1.00 0.21 C HETATM 799 N6 BDG A 27 -5.424 -2.026 4.504 1.00 0.31 N HETATM 0 HN62 BDG A 27 -5.996 -1.815 5.321 1.00 0.31 H new HETATM 0 HN61 BDG A 27 -5.436 -1.401 3.698 1.00 0.31 H new HETATM 0 HN22 BDG A 27 -0.064 -4.804 0.247 1.00 0.17 H new HETATM 0 HN21 BDG A 27 -0.432 -3.092 0.012 1.00 0.17 H new HETATM 0 HO4 BDG A 27 -4.060 -6.663 3.220 1.00 0.24 H new HETATM 0 HO3 BDG A 27 -1.572 -6.583 2.601 1.00 0.22 H new HETATM 0 H62 BDG A 27 -5.209 -4.116 4.638 1.00 0.21 H new HETATM 0 H61 BDG A 27 -3.884 -3.201 5.330 1.00 0.21 H new HETATM 0 H5 BDG A 27 -4.420 -3.248 2.351 1.00 0.18 H new HETATM 0 H4 BDG A 27 -2.647 -5.122 3.922 1.00 0.19 H new HETATM 0 H3 BDG A 27 -3.012 -4.785 0.920 1.00 0.18 H new HETATM 0 H2 BDG A 27 -0.600 -4.190 2.666 1.00 0.16 H new HETATM 815 C1 NEB A 28 -3.513 1.729 -0.618 1.00 0.22 C HETATM 816 N1 NEB A 28 -3.835 3.172 -0.676 1.00 0.31 N HETATM 817 C2 NEB A 28 -4.477 1.081 0.365 1.00 0.23 C HETATM 818 C3 NEB A 28 -4.194 -0.410 0.479 1.00 0.20 C HETATM 819 N3 NEB A 28 -5.114 -0.932 1.477 1.00 0.32 N HETATM 820 C4 NEB A 28 -2.758 -0.651 0.936 1.00 0.16 C HETATM 821 O4 NEB A 28 -2.496 -2.068 0.956 1.00 0.16 O HETATM 822 C5 NEB A 28 -1.750 0.035 0.007 1.00 0.16 C HETATM 823 O5 NEB A 28 -0.429 -0.089 0.572 1.00 0.18 O HETATM 824 C6 NEB A 28 -2.068 1.521 -0.169 1.00 0.20 C HETATM 825 O6 NEB A 28 -1.187 2.086 -1.132 1.00 0.24 O HETATM 0 HO6 NEB A 28 -0.275 2.098 -0.774 1.00 0.24 H new HETATM 0 H6 NEB A 28 -1.934 2.014 0.794 1.00 0.20 H new HETATM 0 H5 NEB A 28 -1.806 -0.449 -0.968 1.00 0.16 H new HETATM 0 H4 NEB A 28 -2.644 -0.228 1.934 1.00 0.16 H new HETATM 0 H32 NEB A 28 -5.099 -1.924 1.715 1.00 0.32 H new HETATM 0 H31 NEB A 28 -5.774 -0.307 1.938 1.00 0.32 H new HETATM 0 H3 NEB A 28 -4.324 -0.900 -0.486 1.00 0.20 H new HETATM 0 H22 NEB A 28 -4.380 1.552 1.343 1.00 0.23 H new HETATM 0 H21 NEB A 28 -5.504 1.239 0.035 1.00 0.23 H new HETATM 0 H13 NEB A 28 -3.226 3.630 -1.354 1.00 0.31 H new HETATM 0 H12 NEB A 28 -4.808 3.293 -0.958 1.00 0.31 H new HETATM 0 H11 NEB A 28 -3.694 3.590 0.244 1.00 0.31 H new HETATM 0 H1 NEB A 28 -3.617 1.277 -1.604 1.00 0.22 H new