USER MOD reduce.3.24.130724 H: found=0, std=0, add=375, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 373 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 SER N :NH3+ 146:sc= 0.0282 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.388 X(o=-0.39,f=-0.26) USER MOD Single : A 6 HIS : no HD1:sc= -2.57! C(o=-2.6!,f=-9.8!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 MET CE :methyl -133:sc= -0.375 (180deg=-2.57!) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 131:sc= 0.118 (180deg=-0.163) USER MOD Single : A 20 GLN : amide:sc= -0.0879 X(o=-0.088,f=0) USER MOD Single : B 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 1 DT O5' : rot -31:sc= 1.64 USER MOD Single : B 2 DT C7 :methyl -30:sc= -5.71! (180deg=-10.4!) USER MOD Single : B 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 18 DT C7 :methyl 150:sc= -1.08 (180deg=-1.08) USER MOD Single : B 18 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 5.876 -35.254 23.894 1.00 0.38 N ATOM 2 CA SER A 1 7.151 -34.729 23.330 1.00 0.52 C ATOM 3 C SER A 1 7.642 -35.668 22.232 1.00 0.48 C ATOM 4 O SER A 1 6.950 -36.615 21.858 1.00 0.72 O ATOM 5 CB SER A 1 8.196 -34.631 24.442 1.00 0.94 C ATOM 6 OG SER A 1 8.513 -33.265 24.671 1.00 1.31 O ATOM 0 H1 SER A 1 5.828 -35.033 24.909 1.00 0.38 H new ATOM 0 H2 SER A 1 5.072 -34.811 23.405 1.00 0.38 H new ATOM 0 H3 SER A 1 5.836 -36.285 23.762 1.00 0.38 H new ATOM 0 HA SER A 1 6.987 -33.738 22.906 1.00 0.52 H new ATOM 0 HB2 SER A 1 7.814 -35.086 25.356 1.00 0.94 H new ATOM 0 HB3 SER A 1 9.094 -35.182 24.162 1.00 0.94 H new ATOM 0 HG SER A 1 9.181 -33.199 25.385 1.00 1.31 H new ATOM 14 N MET A 2 8.841 -35.399 21.722 1.00 0.29 N ATOM 15 CA MET A 2 9.418 -36.226 20.667 1.00 0.22 C ATOM 16 C MET A 2 10.508 -35.459 19.925 1.00 0.24 C ATOM 17 O MET A 2 11.592 -35.988 19.675 1.00 0.37 O ATOM 18 CB MET A 2 8.329 -36.652 19.679 1.00 0.17 C ATOM 19 CG MET A 2 7.931 -38.106 19.944 1.00 0.29 C ATOM 20 SD MET A 2 6.207 -38.360 19.453 1.00 0.76 S ATOM 21 CE MET A 2 6.397 -40.044 18.817 1.00 0.60 C ATOM 0 H MET A 2 9.428 -34.620 22.020 1.00 0.29 H new ATOM 0 HA MET A 2 9.857 -37.112 21.125 1.00 0.22 H new ATOM 0 HB2 MET A 2 7.459 -36.003 19.780 1.00 0.17 H new ATOM 0 HB3 MET A 2 8.690 -36.545 18.656 1.00 0.17 H new ATOM 0 HG2 MET A 2 8.582 -38.780 19.387 1.00 0.29 H new ATOM 0 HG3 MET A 2 8.058 -38.342 21.001 1.00 0.29 H new ATOM 0 HE1 MET A 2 5.435 -40.407 18.454 1.00 0.60 H new ATOM 0 HE2 MET A 2 7.117 -40.045 17.999 1.00 0.60 H new ATOM 0 HE3 MET A 2 6.753 -40.696 19.615 1.00 0.60 H new ATOM 31 N HIS A 3 10.213 -34.212 19.575 1.00 0.22 N ATOM 32 CA HIS A 3 11.176 -33.381 18.862 1.00 0.26 C ATOM 33 C HIS A 3 10.554 -32.037 18.495 1.00 0.24 C ATOM 34 O HIS A 3 11.107 -30.981 18.803 1.00 0.30 O ATOM 35 CB HIS A 3 11.644 -34.096 17.590 1.00 0.28 C ATOM 36 CG HIS A 3 13.109 -34.418 17.696 1.00 0.36 C ATOM 37 ND1 HIS A 3 13.611 -35.682 17.432 1.00 0.41 N ATOM 38 CD2 HIS A 3 14.195 -33.648 18.038 1.00 0.56 C ATOM 39 CE1 HIS A 3 14.943 -35.638 17.618 1.00 0.48 C ATOM 40 NE2 HIS A 3 15.351 -34.421 17.988 1.00 0.57 N ATOM 0 H HIS A 3 9.322 -33.757 19.772 1.00 0.22 H new ATOM 0 HA HIS A 3 12.032 -33.206 19.514 1.00 0.26 H new ATOM 0 HB2 HIS A 3 11.071 -35.012 17.445 1.00 0.28 H new ATOM 0 HB3 HIS A 3 11.463 -33.465 16.720 1.00 0.28 H new ATOM 0 HD2 HIS A 3 14.157 -32.602 18.305 1.00 0.56 H new ATOM 0 HE1 HIS A 3 15.602 -36.483 17.484 1.00 0.48 H new ATOM 0 HE2 HIS A 3 16.305 -34.122 18.190 1.00 0.57 H new ATOM 48 N PRO A 4 9.419 -32.062 17.848 1.00 0.20 N ATOM 49 CA PRO A 4 8.701 -30.824 17.430 1.00 0.20 C ATOM 50 C PRO A 4 8.646 -29.786 18.547 1.00 0.20 C ATOM 51 O PRO A 4 9.003 -30.070 19.690 1.00 0.46 O ATOM 52 CB PRO A 4 7.301 -31.325 17.076 1.00 0.22 C ATOM 53 CG PRO A 4 7.480 -32.754 16.678 1.00 0.21 C ATOM 54 CD PRO A 4 8.695 -33.278 17.445 1.00 0.20 C ATOM 0 HA PRO A 4 9.199 -30.318 16.603 1.00 0.20 H new ATOM 0 HB2 PRO A 4 6.625 -31.236 17.926 1.00 0.22 H new ATOM 0 HB3 PRO A 4 6.869 -30.742 16.263 1.00 0.22 H new ATOM 0 HG2 PRO A 4 6.591 -33.336 16.918 1.00 0.21 H new ATOM 0 HG3 PRO A 4 7.636 -32.839 15.603 1.00 0.21 H new ATOM 0 HD2 PRO A 4 8.395 -33.868 18.311 1.00 0.20 H new ATOM 0 HD3 PRO A 4 9.314 -33.921 16.819 1.00 0.20 H new ATOM 62 N GLY A 5 8.198 -28.582 18.207 1.00 0.26 N ATOM 63 CA GLY A 5 8.101 -27.509 19.190 1.00 0.25 C ATOM 64 C GLY A 5 9.318 -26.593 19.114 1.00 0.24 C ATOM 65 O GLY A 5 9.185 -25.371 19.059 1.00 0.37 O ATOM 0 H GLY A 5 7.899 -28.326 17.266 1.00 0.26 H new ATOM 0 HA2 GLY A 5 7.194 -26.931 19.015 1.00 0.25 H new ATOM 0 HA3 GLY A 5 8.021 -27.933 20.191 1.00 0.25 H new ATOM 69 N HIS A 6 10.504 -27.194 19.110 1.00 0.21 N ATOM 70 CA HIS A 6 11.740 -26.424 19.039 1.00 0.27 C ATOM 71 C HIS A 6 12.263 -26.383 17.607 1.00 0.24 C ATOM 72 O HIS A 6 13.285 -25.756 17.326 1.00 0.36 O ATOM 73 CB HIS A 6 12.797 -27.046 19.954 1.00 0.36 C ATOM 74 CG HIS A 6 12.122 -27.890 20.999 1.00 0.37 C ATOM 75 ND1 HIS A 6 11.265 -28.930 20.670 1.00 0.40 N ATOM 76 CD2 HIS A 6 12.167 -27.863 22.370 1.00 0.46 C ATOM 77 CE1 HIS A 6 10.834 -29.480 21.819 1.00 0.45 C ATOM 78 NE2 HIS A 6 11.353 -28.867 22.886 1.00 0.47 N ATOM 0 H HIS A 6 10.635 -28.205 19.155 1.00 0.21 H new ATOM 0 HA HIS A 6 11.531 -25.406 19.367 1.00 0.27 H new ATOM 0 HB2 HIS A 6 13.487 -27.655 19.369 1.00 0.36 H new ATOM 0 HB3 HIS A 6 13.388 -26.263 20.430 1.00 0.36 H new ATOM 0 HD2 HIS A 6 12.746 -27.168 22.960 1.00 0.46 H new ATOM 0 HE1 HIS A 6 10.152 -30.315 21.872 1.00 0.45 H new ATOM 0 HE2 HIS A 6 11.188 -29.087 23.868 1.00 0.47 H new ATOM 86 N LEU A 7 11.555 -27.056 16.706 1.00 0.18 N ATOM 87 CA LEU A 7 11.956 -27.092 15.304 1.00 0.19 C ATOM 88 C LEU A 7 11.416 -25.874 14.560 1.00 0.22 C ATOM 89 O LEU A 7 10.471 -25.228 15.014 1.00 0.42 O ATOM 90 CB LEU A 7 11.432 -28.368 14.643 1.00 0.19 C ATOM 91 CG LEU A 7 12.404 -29.519 14.915 1.00 0.18 C ATOM 92 CD1 LEU A 7 12.635 -29.649 16.422 1.00 0.17 C ATOM 93 CD2 LEU A 7 11.811 -30.823 14.377 1.00 0.24 C ATOM 0 H LEU A 7 10.707 -27.580 16.919 1.00 0.18 H new ATOM 0 HA LEU A 7 13.045 -27.079 15.258 1.00 0.19 H new ATOM 0 HB2 LEU A 7 10.444 -28.613 15.032 1.00 0.19 H new ATOM 0 HB3 LEU A 7 11.323 -28.216 13.569 1.00 0.19 H new ATOM 0 HG LEU A 7 13.353 -29.317 14.419 1.00 0.18 H new ATOM 0 HD11 LEU A 7 13.327 -30.469 16.615 1.00 0.17 H new ATOM 0 HD12 LEU A 7 13.056 -28.720 16.807 1.00 0.17 H new ATOM 0 HD13 LEU A 7 11.686 -29.851 16.919 1.00 0.17 H new ATOM 0 HD21 LEU A 7 12.502 -31.644 14.570 1.00 0.24 H new ATOM 0 HD22 LEU A 7 10.862 -31.023 14.874 1.00 0.24 H new ATOM 0 HD23 LEU A 7 11.646 -30.732 13.303 1.00 0.24 H new ATOM 105 N LYS A 8 12.023 -25.565 13.418 1.00 0.27 N ATOM 106 CA LYS A 8 11.593 -24.420 12.623 1.00 0.34 C ATOM 107 C LYS A 8 11.811 -24.688 11.137 1.00 0.40 C ATOM 108 O LYS A 8 12.920 -25.012 10.710 1.00 0.53 O ATOM 109 CB LYS A 8 12.376 -23.174 13.039 1.00 0.39 C ATOM 110 CG LYS A 8 13.844 -23.335 12.640 1.00 0.49 C ATOM 111 CD LYS A 8 14.100 -22.604 11.320 1.00 0.57 C ATOM 112 CE LYS A 8 14.214 -21.100 11.583 1.00 0.69 C ATOM 113 NZ LYS A 8 15.651 -20.726 11.715 1.00 1.40 N ATOM 0 H LYS A 8 12.807 -26.086 13.025 1.00 0.27 H new ATOM 0 HA LYS A 8 10.530 -24.257 12.799 1.00 0.34 H new ATOM 0 HB2 LYS A 8 11.953 -22.290 12.561 1.00 0.39 H new ATOM 0 HB3 LYS A 8 12.295 -23.024 14.116 1.00 0.39 H new ATOM 0 HG2 LYS A 8 14.490 -22.934 13.421 1.00 0.49 H new ATOM 0 HG3 LYS A 8 14.089 -24.392 12.536 1.00 0.49 H new ATOM 0 HD2 LYS A 8 15.016 -22.974 10.859 1.00 0.57 H new ATOM 0 HD3 LYS A 8 13.288 -22.801 10.620 1.00 0.57 H new ATOM 0 HE2 LYS A 8 13.755 -20.542 10.767 1.00 0.69 H new ATOM 0 HE3 LYS A 8 13.674 -20.837 12.492 1.00 0.69 H new ATOM 0 HZ1 LYS A 8 15.729 -19.704 11.894 1.00 1.40 H new ATOM 0 HZ2 LYS A 8 16.075 -21.249 12.508 1.00 1.40 H new ATOM 0 HZ3 LYS A 8 16.154 -20.963 10.836 1.00 1.40 H new ATOM 127 N GLY A 9 10.746 -24.549 10.354 1.00 0.36 N ATOM 128 CA GLY A 9 10.830 -24.777 8.916 1.00 0.41 C ATOM 129 C GLY A 9 10.121 -26.071 8.531 1.00 0.42 C ATOM 130 O GLY A 9 9.232 -26.538 9.242 1.00 0.55 O ATOM 0 H GLY A 9 9.820 -24.281 10.688 1.00 0.36 H new ATOM 0 HA2 GLY A 9 10.381 -23.939 8.383 1.00 0.41 H new ATOM 0 HA3 GLY A 9 11.875 -24.825 8.611 1.00 0.41 H new ATOM 134 N ARG A 10 10.521 -26.644 7.402 1.00 0.43 N ATOM 135 CA ARG A 10 9.918 -27.885 6.930 1.00 0.43 C ATOM 136 C ARG A 10 10.186 -29.018 7.915 1.00 0.35 C ATOM 137 O ARG A 10 9.466 -30.016 7.939 1.00 0.44 O ATOM 138 CB ARG A 10 10.488 -28.256 5.558 1.00 0.48 C ATOM 139 CG ARG A 10 10.388 -27.051 4.620 1.00 0.62 C ATOM 140 CD ARG A 10 10.001 -27.525 3.218 1.00 0.72 C ATOM 141 NE ARG A 10 10.962 -28.509 2.731 1.00 0.95 N ATOM 142 CZ ARG A 10 10.737 -29.199 1.618 1.00 1.26 C ATOM 143 NH1 ARG A 10 9.638 -29.005 0.941 1.00 1.45 N ATOM 144 NH2 ARG A 10 11.615 -30.071 1.202 1.00 1.47 N ATOM 0 H ARG A 10 11.255 -26.272 6.800 1.00 0.43 H new ATOM 0 HA ARG A 10 8.842 -27.735 6.848 1.00 0.43 H new ATOM 0 HB2 ARG A 10 11.528 -28.568 5.657 1.00 0.48 H new ATOM 0 HB3 ARG A 10 9.940 -29.101 5.141 1.00 0.48 H new ATOM 0 HG2 ARG A 10 9.646 -26.346 4.995 1.00 0.62 H new ATOM 0 HG3 ARG A 10 11.341 -26.523 4.587 1.00 0.62 H new ATOM 0 HD2 ARG A 10 9.002 -27.961 3.237 1.00 0.72 H new ATOM 0 HD3 ARG A 10 9.964 -26.675 2.537 1.00 0.72 H new ATOM 0 HE ARG A 10 11.822 -28.670 3.255 1.00 0.95 H new ATOM 0 HH11 ARG A 10 8.952 -28.324 1.266 1.00 1.45 H new ATOM 0 HH12 ARG A 10 9.465 -29.535 0.087 1.00 1.45 H new ATOM 0 HH21 ARG A 10 12.474 -30.223 1.731 1.00 1.47 H new ATOM 0 HH22 ARG A 10 11.442 -30.601 0.348 1.00 1.47 H new ATOM 158 N GLU A 11 11.226 -28.857 8.728 1.00 0.28 N ATOM 159 CA GLU A 11 11.578 -29.876 9.711 1.00 0.25 C ATOM 160 C GLU A 11 10.340 -30.333 10.473 1.00 0.25 C ATOM 161 O GLU A 11 10.102 -31.532 10.627 1.00 0.41 O ATOM 162 CB GLU A 11 12.609 -29.319 10.695 1.00 0.26 C ATOM 163 CG GLU A 11 13.906 -28.996 9.951 1.00 0.31 C ATOM 164 CD GLU A 11 15.017 -28.693 10.950 1.00 0.33 C ATOM 165 OE1 GLU A 11 15.240 -29.513 11.825 1.00 0.66 O ATOM 166 OE2 GLU A 11 15.630 -27.646 10.825 1.00 0.95 O ATOM 0 H GLU A 11 11.835 -28.039 8.726 1.00 0.28 H new ATOM 0 HA GLU A 11 12.004 -30.731 9.185 1.00 0.25 H new ATOM 0 HB2 GLU A 11 12.220 -28.421 11.175 1.00 0.26 H new ATOM 0 HB3 GLU A 11 12.802 -30.045 11.485 1.00 0.26 H new ATOM 0 HG2 GLU A 11 14.192 -29.837 9.320 1.00 0.31 H new ATOM 0 HG3 GLU A 11 13.754 -28.141 9.293 1.00 0.31 H new ATOM 173 N ILE A 12 9.554 -29.374 10.949 1.00 0.15 N ATOM 174 CA ILE A 12 8.342 -29.692 11.695 1.00 0.14 C ATOM 175 C ILE A 12 7.150 -29.805 10.750 1.00 0.16 C ATOM 176 O ILE A 12 6.180 -30.504 11.039 1.00 0.21 O ATOM 177 CB ILE A 12 8.068 -28.607 12.737 1.00 0.17 C ATOM 178 CG1 ILE A 12 6.875 -29.021 13.601 1.00 0.19 C ATOM 179 CG2 ILE A 12 7.752 -27.287 12.031 1.00 0.27 C ATOM 180 CD1 ILE A 12 6.664 -27.990 14.711 1.00 0.25 C ATOM 0 H ILE A 12 9.732 -28.376 10.833 1.00 0.15 H new ATOM 0 HA ILE A 12 8.487 -30.648 12.198 1.00 0.14 H new ATOM 0 HB ILE A 12 8.948 -28.479 13.367 1.00 0.17 H new ATOM 0 HG12 ILE A 12 5.978 -29.098 12.987 1.00 0.19 H new ATOM 0 HG13 ILE A 12 7.051 -30.006 14.034 1.00 0.19 H new ATOM 0 HG21 ILE A 12 7.557 -26.514 12.775 1.00 0.27 H new ATOM 0 HG22 ILE A 12 8.601 -26.991 11.415 1.00 0.27 H new ATOM 0 HG23 ILE A 12 6.872 -27.413 11.400 1.00 0.27 H new ATOM 0 HD11 ILE A 12 5.814 -28.286 15.326 1.00 0.25 H new ATOM 0 HD12 ILE A 12 7.559 -27.935 15.331 1.00 0.25 H new ATOM 0 HD13 ILE A 12 6.469 -27.013 14.268 1.00 0.25 H new ATOM 192 N GLY A 13 7.233 -29.112 9.619 1.00 0.21 N ATOM 193 CA GLY A 13 6.156 -29.141 8.636 1.00 0.26 C ATOM 194 C GLY A 13 6.069 -30.507 7.965 1.00 0.29 C ATOM 195 O GLY A 13 5.142 -30.775 7.201 1.00 0.37 O ATOM 0 H GLY A 13 8.028 -28.528 9.362 1.00 0.21 H new ATOM 0 HA2 GLY A 13 5.208 -28.909 9.122 1.00 0.26 H new ATOM 0 HA3 GLY A 13 6.325 -28.371 7.883 1.00 0.26 H new ATOM 199 N MET A 14 7.041 -31.366 8.254 1.00 0.25 N ATOM 200 CA MET A 14 7.065 -32.702 7.670 1.00 0.31 C ATOM 201 C MET A 14 6.974 -33.768 8.758 1.00 0.36 C ATOM 202 O MET A 14 6.593 -34.908 8.492 1.00 0.58 O ATOM 203 CB MET A 14 8.354 -32.899 6.869 1.00 0.32 C ATOM 204 CG MET A 14 8.433 -31.849 5.760 1.00 0.31 C ATOM 205 SD MET A 14 7.054 -32.078 4.611 1.00 0.32 S ATOM 206 CE MET A 14 6.526 -30.349 4.541 1.00 0.66 C ATOM 0 H MET A 14 7.817 -31.163 8.884 1.00 0.25 H new ATOM 0 HA MET A 14 6.205 -32.802 7.008 1.00 0.31 H new ATOM 0 HB2 MET A 14 9.219 -32.814 7.526 1.00 0.32 H new ATOM 0 HB3 MET A 14 8.377 -33.900 6.438 1.00 0.32 H new ATOM 0 HG2 MET A 14 8.400 -30.848 6.190 1.00 0.31 H new ATOM 0 HG3 MET A 14 9.381 -31.936 5.229 1.00 0.31 H new ATOM 0 HE1 MET A 14 5.444 -30.294 4.662 1.00 0.66 H new ATOM 0 HE2 MET A 14 7.009 -29.788 5.341 1.00 0.66 H new ATOM 0 HE3 MET A 14 6.806 -29.922 3.578 1.00 0.66 H new ATOM 216 N TRP A 15 7.329 -33.390 9.982 1.00 0.21 N ATOM 217 CA TRP A 15 7.285 -34.325 11.100 1.00 0.26 C ATOM 218 C TRP A 15 5.958 -34.215 11.845 1.00 0.31 C ATOM 219 O TRP A 15 5.372 -35.223 12.239 1.00 0.45 O ATOM 220 CB TRP A 15 8.438 -34.040 12.065 1.00 0.30 C ATOM 221 CG TRP A 15 8.720 -35.262 12.879 1.00 0.33 C ATOM 222 CD1 TRP A 15 8.102 -35.583 14.040 1.00 0.50 C ATOM 223 CD2 TRP A 15 9.676 -36.329 12.617 1.00 0.24 C ATOM 224 NE1 TRP A 15 8.618 -36.779 14.506 1.00 0.50 N ATOM 225 CE2 TRP A 15 9.592 -37.278 13.663 1.00 0.33 C ATOM 226 CE3 TRP A 15 10.601 -36.564 11.582 1.00 0.27 C ATOM 227 CZ2 TRP A 15 10.394 -38.420 13.682 1.00 0.29 C ATOM 228 CZ3 TRP A 15 11.410 -37.712 11.598 1.00 0.34 C ATOM 229 CH2 TRP A 15 11.308 -38.637 12.646 1.00 0.28 C ATOM 0 H TRP A 15 7.648 -32.452 10.223 1.00 0.21 H new ATOM 0 HA TRP A 15 7.382 -35.336 10.704 1.00 0.26 H new ATOM 0 HB2 TRP A 15 9.328 -33.747 11.508 1.00 0.30 H new ATOM 0 HB3 TRP A 15 8.182 -33.206 12.718 1.00 0.30 H new ATOM 0 HD1 TRP A 15 7.332 -35.000 14.524 1.00 0.50 H new ATOM 0 HE1 TRP A 15 8.316 -37.236 15.366 1.00 0.50 H new ATOM 0 HE3 TRP A 15 10.689 -35.857 10.770 1.00 0.27 H new ATOM 0 HZ2 TRP A 15 10.309 -39.131 14.491 1.00 0.29 H new ATOM 0 HZ3 TRP A 15 12.115 -37.883 10.798 1.00 0.34 H new ATOM 0 HH2 TRP A 15 11.935 -39.517 12.653 1.00 0.28 H new ATOM 240 N TYR A 16 5.490 -32.986 12.036 1.00 0.29 N ATOM 241 CA TYR A 16 4.231 -32.762 12.737 1.00 0.33 C ATOM 242 C TYR A 16 3.151 -32.287 11.771 1.00 0.37 C ATOM 243 O TYR A 16 2.188 -31.634 12.174 1.00 0.58 O ATOM 244 CB TYR A 16 4.426 -31.719 13.840 1.00 0.42 C ATOM 245 CG TYR A 16 3.731 -32.178 15.100 1.00 0.36 C ATOM 246 CD1 TYR A 16 4.195 -33.309 15.782 1.00 0.39 C ATOM 247 CD2 TYR A 16 2.623 -31.473 15.585 1.00 0.56 C ATOM 248 CE1 TYR A 16 3.552 -33.734 16.950 1.00 0.44 C ATOM 249 CE2 TYR A 16 1.979 -31.898 16.753 1.00 0.54 C ATOM 250 CZ TYR A 16 2.444 -33.029 17.435 1.00 0.39 C ATOM 251 OH TYR A 16 1.809 -33.448 18.587 1.00 0.45 O ATOM 0 H TYR A 16 5.958 -32.137 11.719 1.00 0.29 H new ATOM 0 HA TYR A 16 3.913 -33.706 13.180 1.00 0.33 H new ATOM 0 HB2 TYR A 16 5.489 -31.572 14.032 1.00 0.42 H new ATOM 0 HB3 TYR A 16 4.024 -30.758 13.520 1.00 0.42 H new ATOM 0 HD1 TYR A 16 5.049 -33.853 15.407 1.00 0.39 H new ATOM 0 HD2 TYR A 16 2.265 -30.601 15.058 1.00 0.56 H new ATOM 0 HE1 TYR A 16 3.910 -34.606 17.477 1.00 0.44 H new ATOM 0 HE2 TYR A 16 1.124 -31.354 17.128 1.00 0.54 H new ATOM 0 HH TYR A 16 1.060 -32.847 18.785 1.00 0.45 H new ATOM 261 N ALA A 17 3.315 -32.618 10.494 1.00 0.27 N ATOM 262 CA ALA A 17 2.343 -32.219 9.483 1.00 0.34 C ATOM 263 C ALA A 17 1.147 -33.166 9.492 1.00 0.29 C ATOM 264 O ALA A 17 0.313 -33.138 8.587 1.00 0.39 O ATOM 265 CB ALA A 17 2.994 -32.225 8.098 1.00 0.45 C ATOM 0 H ALA A 17 4.104 -33.157 10.137 1.00 0.27 H new ATOM 0 HA ALA A 17 1.997 -31.211 9.714 1.00 0.34 H new ATOM 0 HB1 ALA A 17 2.260 -31.926 7.350 1.00 0.45 H new ATOM 0 HB2 ALA A 17 3.830 -31.526 8.086 1.00 0.45 H new ATOM 0 HB3 ALA A 17 3.356 -33.228 7.870 1.00 0.45 H new ATOM 271 N LYS A 18 1.069 -34.002 10.523 1.00 0.25 N ATOM 272 CA LYS A 18 -0.030 -34.952 10.642 1.00 0.21 C ATOM 273 C LYS A 18 -1.342 -34.222 10.911 1.00 0.15 C ATOM 274 O LYS A 18 -2.385 -34.848 11.097 1.00 0.31 O ATOM 275 CB LYS A 18 0.252 -35.937 11.778 1.00 0.27 C ATOM 276 CG LYS A 18 0.800 -35.178 12.988 1.00 0.35 C ATOM 277 CD LYS A 18 0.770 -36.087 14.219 1.00 0.45 C ATOM 278 CE LYS A 18 0.714 -35.231 15.485 1.00 0.40 C ATOM 279 NZ LYS A 18 -0.699 -35.111 15.941 1.00 0.39 N ATOM 0 H LYS A 18 1.749 -34.041 11.283 1.00 0.25 H new ATOM 0 HA LYS A 18 -0.118 -35.498 9.703 1.00 0.21 H new ATOM 0 HB2 LYS A 18 -0.662 -36.466 12.050 1.00 0.27 H new ATOM 0 HB3 LYS A 18 0.970 -36.689 11.451 1.00 0.27 H new ATOM 0 HG2 LYS A 18 1.820 -34.848 12.792 1.00 0.35 H new ATOM 0 HG3 LYS A 18 0.205 -34.283 13.169 1.00 0.35 H new ATOM 0 HD2 LYS A 18 -0.096 -36.747 14.175 1.00 0.45 H new ATOM 0 HD3 LYS A 18 1.655 -36.723 14.236 1.00 0.45 H new ATOM 0 HE2 LYS A 18 1.323 -35.681 16.269 1.00 0.40 H new ATOM 0 HE3 LYS A 18 1.129 -34.243 15.287 1.00 0.40 H new ATOM 0 HZ1 LYS A 18 -0.738 -34.529 16.802 1.00 0.39 H new ATOM 0 HZ2 LYS A 18 -1.268 -34.663 15.194 1.00 0.39 H new ATOM 0 HZ3 LYS A 18 -1.079 -36.057 16.145 1.00 0.39 H new ATOM 293 N LYS A 19 -1.279 -32.895 10.931 1.00 0.18 N ATOM 294 CA LYS A 19 -2.468 -32.088 11.179 1.00 0.33 C ATOM 295 C LYS A 19 -3.062 -32.415 12.544 1.00 0.36 C ATOM 296 O LYS A 19 -2.429 -32.196 13.577 1.00 0.40 O ATOM 297 CB LYS A 19 -3.510 -32.346 10.090 1.00 0.44 C ATOM 298 CG LYS A 19 -2.939 -31.938 8.730 1.00 0.43 C ATOM 299 CD LYS A 19 -3.297 -32.996 7.684 1.00 0.50 C ATOM 300 CE LYS A 19 -3.023 -32.444 6.285 1.00 0.49 C ATOM 301 NZ LYS A 19 -1.566 -32.159 6.140 1.00 1.03 N ATOM 0 H LYS A 19 -0.425 -32.359 10.780 1.00 0.18 H new ATOM 0 HA LYS A 19 -2.181 -31.037 11.164 1.00 0.33 H new ATOM 0 HB2 LYS A 19 -3.786 -33.400 10.079 1.00 0.44 H new ATOM 0 HB3 LYS A 19 -4.418 -31.781 10.299 1.00 0.44 H new ATOM 0 HG2 LYS A 19 -3.339 -30.968 8.433 1.00 0.43 H new ATOM 0 HG3 LYS A 19 -1.856 -31.830 8.797 1.00 0.43 H new ATOM 0 HD2 LYS A 19 -2.711 -33.900 7.851 1.00 0.50 H new ATOM 0 HD3 LYS A 19 -4.347 -33.274 7.777 1.00 0.50 H new ATOM 0 HE2 LYS A 19 -3.341 -33.163 5.530 1.00 0.49 H new ATOM 0 HE3 LYS A 19 -3.601 -31.534 6.122 1.00 0.49 H new ATOM 0 HZ1 LYS A 19 -1.217 -32.577 5.254 1.00 1.03 H new ATOM 0 HZ2 LYS A 19 -1.414 -31.130 6.121 1.00 1.03 H new ATOM 0 HZ3 LYS A 19 -1.050 -32.570 6.944 1.00 1.03 H new ATOM 315 N GLN A 20 -4.283 -32.940 12.543 1.00 0.40 N ATOM 316 CA GLN A 20 -4.954 -33.294 13.788 1.00 0.47 C ATOM 317 C GLN A 20 -4.594 -34.717 14.205 1.00 0.55 C ATOM 318 O GLN A 20 -5.455 -35.389 14.750 1.00 1.37 O ATOM 319 CB GLN A 20 -6.469 -33.177 13.617 1.00 0.53 C ATOM 320 CG GLN A 20 -6.876 -31.703 13.659 1.00 0.27 C ATOM 321 CD GLN A 20 -8.080 -31.470 12.751 1.00 0.60 C ATOM 322 OE1 GLN A 20 -8.125 -30.479 12.021 1.00 1.07 O ATOM 323 NE2 GLN A 20 -9.064 -32.327 12.753 1.00 0.54 N ATOM 324 OXT GLN A 20 -3.465 -35.114 13.971 1.00 0.80 O ATOM 0 H GLN A 20 -4.825 -33.129 11.700 1.00 0.40 H new ATOM 0 HA GLN A 20 -4.623 -32.605 14.566 1.00 0.47 H new ATOM 0 HB2 GLN A 20 -6.774 -33.622 12.670 1.00 0.53 H new ATOM 0 HB3 GLN A 20 -6.978 -33.728 14.407 1.00 0.53 H new ATOM 0 HG2 GLN A 20 -7.119 -31.413 14.681 1.00 0.27 H new ATOM 0 HG3 GLN A 20 -6.042 -31.077 13.340 1.00 0.27 H new ATOM 0 HE21 GLN A 20 -9.025 -33.147 13.358 1.00 0.54 H new ATOM 0 HE22 GLN A 20 -9.872 -32.177 12.149 1.00 0.54 H new TER 333 GLN A 20 ATOM 334 O5' DT B 1 9.266 -22.279 -5.552 1.00 0.77 O ATOM 335 C5' DT B 1 9.701 -21.407 -6.598 1.00 0.73 C ATOM 336 C4' DT B 1 11.222 -21.268 -6.608 1.00 0.77 C ATOM 337 O4' DT B 1 11.818 -22.546 -6.811 1.00 0.82 O ATOM 338 C3' DT B 1 11.754 -20.345 -7.710 1.00 0.75 C ATOM 339 O3' DT B 1 12.423 -19.227 -7.115 1.00 0.75 O ATOM 340 C2' DT B 1 12.760 -21.195 -8.488 1.00 0.78 C ATOM 341 C1' DT B 1 13.026 -22.344 -7.529 1.00 0.87 C ATOM 342 N1 DT B 1 13.383 -23.618 -8.185 1.00 0.94 N ATOM 343 C2 DT B 1 14.570 -24.217 -7.809 1.00 1.07 C ATOM 344 O2 DT B 1 15.313 -23.723 -6.964 1.00 1.13 O ATOM 345 N3 DT B 1 14.874 -25.409 -8.440 1.00 1.15 N ATOM 346 C4 DT B 1 14.104 -26.043 -9.401 1.00 1.13 C ATOM 347 O4 DT B 1 14.472 -27.105 -9.898 1.00 1.23 O ATOM 348 C5 DT B 1 12.884 -25.342 -9.730 1.00 1.00 C ATOM 349 C7 DT B 1 11.940 -25.930 -10.774 1.00 0.99 C ATOM 350 C6 DT B 1 12.565 -24.178 -9.128 1.00 0.91 C ATOM 0 H5' DT B 1 9.245 -20.425 -6.469 1.00 0.73 H new ATOM 0 H5'' DT B 1 9.363 -21.792 -7.560 1.00 0.73 H new ATOM 0 H4' DT B 1 11.482 -20.833 -5.643 1.00 0.77 H new ATOM 0 H3' DT B 1 10.960 -19.960 -8.349 1.00 0.75 H new ATOM 0 H2' DT B 1 12.350 -21.544 -9.436 1.00 0.78 H new ATOM 0 H2'' DT B 1 13.669 -20.639 -8.719 1.00 0.78 H new ATOM 0 HO5' DT B 1 9.951 -22.960 -5.387 1.00 0.77 H new ATOM 0 H1' DT B 1 13.880 -22.073 -6.909 1.00 0.87 H new ATOM 0 H3 DT B 1 15.747 -25.864 -8.173 1.00 1.15 H new ATOM 0 H71 DT B 1 10.915 -25.639 -10.543 1.00 0.99 H new ATOM 0 H72 DT B 1 12.210 -25.555 -11.761 1.00 0.99 H new ATOM 0 H73 DT B 1 12.019 -27.017 -10.765 1.00 0.99 H new ATOM 0 H6 DT B 1 11.646 -23.678 -9.396 1.00 0.91 H new ATOM 364 P DT B 2 13.661 -19.447 -6.107 1.00 0.80 P ATOM 365 OP1 DT B 2 14.230 -18.121 -5.780 1.00 0.84 O ATOM 366 OP2 DT B 2 14.532 -20.506 -6.664 1.00 0.88 O ATOM 367 O5' DT B 2 12.944 -20.025 -4.786 1.00 0.72 O ATOM 368 C5' DT B 2 12.158 -19.168 -3.953 1.00 0.71 C ATOM 369 C4' DT B 2 11.719 -19.878 -2.675 1.00 0.62 C ATOM 370 O4' DT B 2 10.923 -21.017 -3.006 1.00 0.64 O ATOM 371 C3' DT B 2 12.886 -20.375 -1.812 1.00 0.50 C ATOM 372 O3' DT B 2 12.715 -19.907 -0.469 1.00 0.48 O ATOM 373 C2' DT B 2 12.768 -21.896 -1.846 1.00 0.48 C ATOM 374 C1' DT B 2 11.291 -22.082 -2.137 1.00 0.56 C ATOM 375 N1 DT B 2 10.959 -23.351 -2.811 1.00 0.59 N ATOM 376 C2 DT B 2 10.125 -24.228 -2.142 1.00 0.64 C ATOM 377 O2 DT B 2 9.673 -23.978 -1.027 1.00 0.63 O ATOM 378 N3 DT B 2 9.828 -25.406 -2.803 1.00 0.69 N ATOM 379 C4 DT B 2 10.287 -25.776 -4.056 1.00 0.68 C ATOM 380 O4 DT B 2 9.960 -26.852 -4.551 1.00 0.75 O ATOM 381 C5 DT B 2 11.151 -24.797 -4.677 1.00 0.63 C ATOM 382 C7 DT B 2 11.726 -25.076 -6.062 1.00 0.65 C ATOM 383 C6 DT B 2 11.456 -23.641 -4.053 1.00 0.60 C ATOM 0 H5' DT B 2 11.279 -18.830 -4.503 1.00 0.71 H new ATOM 0 H5'' DT B 2 12.735 -18.279 -3.697 1.00 0.71 H new ATOM 0 H4' DT B 2 11.163 -19.136 -2.102 1.00 0.62 H new ATOM 0 H3' DT B 2 13.855 -20.025 -2.169 1.00 0.50 H new ATOM 0 H2' DT B 2 13.397 -22.338 -2.619 1.00 0.48 H new ATOM 0 H2'' DT B 2 13.059 -22.351 -0.899 1.00 0.48 H new ATOM 0 H1' DT B 2 10.759 -22.093 -1.186 1.00 0.56 H new ATOM 0 H3 DT B 2 9.214 -26.064 -2.323 1.00 0.69 H new ATOM 0 H71 DT B 2 11.851 -26.151 -6.194 1.00 0.65 H new ATOM 0 H72 DT B 2 11.045 -24.693 -6.822 1.00 0.65 H new ATOM 0 H73 DT B 2 12.693 -24.584 -6.160 1.00 0.65 H new ATOM 0 H6 DT B 2 12.105 -22.930 -4.543 1.00 0.60 H new ATOM 396 P DG B 3 13.953 -19.918 0.561 1.00 0.38 P ATOM 397 OP1 DG B 3 13.544 -19.190 1.783 1.00 0.44 O ATOM 398 OP2 DG B 3 15.169 -19.501 -0.172 1.00 0.49 O ATOM 399 O5' DG B 3 14.095 -21.479 0.929 1.00 0.23 O ATOM 400 C5' DG B 3 13.452 -22.019 2.088 1.00 0.18 C ATOM 401 C4' DG B 3 11.939 -22.125 1.905 1.00 0.14 C ATOM 402 O4' DG B 3 11.368 -22.791 3.025 1.00 0.16 O ATOM 403 C3' DG B 3 11.225 -20.774 1.781 1.00 0.14 C ATOM 404 O3' DG B 3 10.689 -20.642 0.459 1.00 0.16 O ATOM 405 C2' DG B 3 10.080 -20.833 2.798 1.00 0.15 C ATOM 406 C1' DG B 3 10.041 -22.307 3.175 1.00 0.15 C ATOM 407 N9 DG B 3 9.620 -22.564 4.565 1.00 0.15 N ATOM 408 C8 DG B 3 10.104 -22.015 5.724 1.00 0.17 C ATOM 409 N7 DG B 3 9.516 -22.453 6.803 1.00 0.19 N ATOM 410 C5 DG B 3 8.574 -23.360 6.326 1.00 0.19 C ATOM 411 C6 DG B 3 7.635 -24.155 7.037 1.00 0.23 C ATOM 412 O6 DG B 3 7.448 -24.213 8.250 1.00 0.27 O ATOM 413 N1 DG B 3 6.871 -24.932 6.176 1.00 0.23 N ATOM 414 C2 DG B 3 6.995 -24.946 4.802 1.00 0.20 C ATOM 415 N2 DG B 3 6.172 -25.760 4.143 1.00 0.24 N ATOM 416 N3 DG B 3 7.879 -24.200 4.132 1.00 0.17 N ATOM 417 C4 DG B 3 8.631 -23.434 4.956 1.00 0.16 C ATOM 0 H5' DG B 3 13.670 -21.389 2.950 1.00 0.18 H new ATOM 0 H5'' DG B 3 13.861 -23.006 2.303 1.00 0.18 H new ATOM 0 H4' DG B 3 11.800 -22.670 0.971 1.00 0.14 H new ATOM 0 H3' DG B 3 11.892 -19.931 1.963 1.00 0.14 H new ATOM 0 H2' DG B 3 10.274 -20.199 3.663 1.00 0.15 H new ATOM 0 H2'' DG B 3 9.136 -20.501 2.365 1.00 0.15 H new ATOM 0 H1' DG B 3 9.309 -22.799 2.535 1.00 0.15 H new ATOM 0 H8 DG B 3 10.900 -21.286 5.742 1.00 0.17 H new ATOM 0 H1 DG B 3 6.164 -25.539 6.591 1.00 0.23 H new ATOM 0 H21 DG B 3 6.215 -25.815 3.125 1.00 0.24 H new ATOM 0 H22 DG B 3 5.498 -26.329 4.656 1.00 0.24 H new ATOM 429 P DG B 4 9.602 -19.501 0.127 1.00 0.20 P ATOM 430 OP1 DG B 4 9.711 -19.160 -1.309 1.00 0.27 O ATOM 431 OP2 DG B 4 9.720 -18.436 1.149 1.00 0.25 O ATOM 432 O5' DG B 4 8.205 -20.267 0.358 1.00 0.17 O ATOM 433 C5' DG B 4 7.807 -21.326 -0.518 1.00 0.20 C ATOM 434 C4' DG B 4 6.394 -21.812 -0.206 1.00 0.17 C ATOM 435 O4' DG B 4 6.333 -22.274 1.143 1.00 0.16 O ATOM 436 C3' DG B 4 5.317 -20.733 -0.366 1.00 0.16 C ATOM 437 O3' DG B 4 4.335 -21.180 -1.307 1.00 0.15 O ATOM 438 C2' DG B 4 4.683 -20.602 1.018 1.00 0.20 C ATOM 439 C1' DG B 4 5.061 -21.919 1.671 1.00 0.14 C ATOM 440 N9 DG B 4 5.186 -21.851 3.138 1.00 0.14 N ATOM 441 C8 DG B 4 6.031 -21.076 3.888 1.00 0.20 C ATOM 442 N7 DG B 4 5.899 -21.243 5.173 1.00 0.21 N ATOM 443 C5 DG B 4 4.897 -22.197 5.287 1.00 0.14 C ATOM 444 C6 DG B 4 4.324 -22.776 6.450 1.00 0.14 C ATOM 445 O6 DG B 4 4.603 -22.552 7.628 1.00 0.16 O ATOM 446 N1 DG B 4 3.336 -23.699 6.126 1.00 0.15 N ATOM 447 C2 DG B 4 2.950 -24.023 4.841 1.00 0.17 C ATOM 448 N2 DG B 4 1.982 -24.933 4.723 1.00 0.26 N ATOM 449 N3 DG B 4 3.489 -23.477 3.746 1.00 0.14 N ATOM 450 C4 DG B 4 4.452 -22.576 4.045 1.00 0.12 C ATOM 0 H5' DG B 4 8.507 -22.157 -0.427 1.00 0.20 H new ATOM 0 H5'' DG B 4 7.854 -20.982 -1.551 1.00 0.20 H new ATOM 0 H4' DG B 4 6.190 -22.603 -0.927 1.00 0.17 H new ATOM 0 H3' DG B 4 5.722 -19.787 -0.725 1.00 0.16 H new ATOM 0 H2' DG B 4 5.078 -19.747 1.567 1.00 0.20 H new ATOM 0 H2'' DG B 4 3.602 -20.472 0.960 1.00 0.20 H new ATOM 0 H1' DG B 4 4.270 -22.639 1.461 1.00 0.14 H new ATOM 0 H8 DG B 4 6.742 -20.389 3.453 1.00 0.20 H new ATOM 0 H1 DG B 4 2.861 -24.172 6.895 1.00 0.15 H new ATOM 0 H21 DG B 4 1.655 -25.213 3.798 1.00 0.26 H new ATOM 0 H22 DG B 4 1.569 -25.349 5.558 1.00 0.26 H new ATOM 462 P DG B 5 2.960 -20.365 -1.504 1.00 0.18 P ATOM 463 OP1 DG B 5 2.428 -20.671 -2.850 1.00 0.22 O ATOM 464 OP2 DG B 5 3.195 -18.959 -1.105 1.00 0.27 O ATOM 465 O5' DG B 5 1.990 -21.043 -0.412 1.00 0.21 O ATOM 466 C5' DG B 5 1.597 -22.412 -0.543 1.00 0.17 C ATOM 467 C4' DG B 5 0.452 -22.761 0.403 1.00 0.23 C ATOM 468 O4' DG B 5 0.861 -22.540 1.753 1.00 0.23 O ATOM 469 C3' DG B 5 -0.818 -21.927 0.172 1.00 0.32 C ATOM 470 O3' DG B 5 -1.944 -22.797 -0.006 1.00 0.36 O ATOM 471 C2' DG B 5 -0.990 -21.125 1.460 1.00 0.30 C ATOM 472 C1' DG B 5 -0.240 -21.986 2.460 1.00 0.23 C ATOM 473 N9 DG B 5 0.296 -21.250 3.620 1.00 0.24 N ATOM 474 C8 DG B 5 1.151 -20.180 3.633 1.00 0.29 C ATOM 475 N7 DG B 5 1.458 -19.763 4.828 1.00 0.32 N ATOM 476 C5 DG B 5 0.755 -20.618 5.672 1.00 0.29 C ATOM 477 C6 DG B 5 0.700 -20.649 7.091 1.00 0.32 C ATOM 478 O6 DG B 5 1.275 -19.916 7.893 1.00 0.39 O ATOM 479 N1 DG B 5 -0.128 -21.668 7.545 1.00 0.30 N ATOM 480 C2 DG B 5 -0.816 -22.548 6.734 1.00 0.25 C ATOM 481 N2 DG B 5 -1.564 -23.461 7.355 1.00 0.27 N ATOM 482 N3 DG B 5 -0.763 -22.519 5.399 1.00 0.21 N ATOM 483 C4 DG B 5 0.040 -21.531 4.940 1.00 0.23 C ATOM 0 H5' DG B 5 2.450 -23.057 -0.336 1.00 0.17 H new ATOM 0 H5'' DG B 5 1.292 -22.607 -1.571 1.00 0.17 H new ATOM 0 H4' DG B 5 0.214 -23.806 0.205 1.00 0.23 H new ATOM 0 H3' DG B 5 -0.745 -21.293 -0.712 1.00 0.32 H new ATOM 0 H2' DG B 5 -0.564 -20.125 1.380 1.00 0.30 H new ATOM 0 H2'' DG B 5 -2.039 -21.004 1.730 1.00 0.30 H new ATOM 0 H1' DG B 5 -0.939 -22.720 2.861 1.00 0.23 H new ATOM 0 H8 DG B 5 1.536 -19.723 2.733 1.00 0.29 H new ATOM 0 H1 DG B 5 -0.236 -21.774 8.554 1.00 0.30 H new ATOM 0 H21 DG B 5 -2.097 -24.140 6.811 1.00 0.27 H new ATOM 0 H22 DG B 5 -1.603 -23.480 8.374 1.00 0.27 H new ATOM 495 P DT B 6 -1.876 -24.024 -1.047 1.00 0.42 P ATOM 496 OP1 DT B 6 -1.262 -23.536 -2.302 1.00 0.48 O ATOM 497 OP2 DT B 6 -3.203 -24.680 -1.078 1.00 0.46 O ATOM 498 O5' DT B 6 -0.835 -25.017 -0.327 1.00 0.39 O ATOM 499 C5' DT B 6 -0.147 -26.026 -1.069 1.00 0.45 C ATOM 500 C4' DT B 6 -1.101 -27.099 -1.584 1.00 0.34 C ATOM 501 O4' DT B 6 -1.916 -26.558 -2.628 1.00 0.36 O ATOM 502 C3' DT B 6 -0.392 -28.332 -2.154 1.00 0.42 C ATOM 503 O3' DT B 6 -0.926 -29.509 -1.541 1.00 0.41 O ATOM 504 C2' DT B 6 -0.739 -28.322 -3.639 1.00 0.46 C ATOM 505 C1' DT B 6 -2.044 -27.549 -3.641 1.00 0.40 C ATOM 506 N1 DT B 6 -2.346 -26.863 -4.913 1.00 0.56 N ATOM 507 C2 DT B 6 -3.554 -27.152 -5.521 1.00 0.57 C ATOM 508 O2 DT B 6 -4.355 -27.947 -5.035 1.00 0.47 O ATOM 509 N3 DT B 6 -3.808 -26.494 -6.710 1.00 0.78 N ATOM 510 C4 DT B 6 -2.971 -25.584 -7.333 1.00 0.94 C ATOM 511 O4 DT B 6 -3.298 -25.055 -8.393 1.00 1.12 O ATOM 512 C5 DT B 6 -1.733 -25.345 -6.625 1.00 0.93 C ATOM 513 C7 DT B 6 -0.717 -24.364 -7.200 1.00 1.15 C ATOM 514 C6 DT B 6 -1.462 -25.976 -5.465 1.00 0.75 C ATOM 0 H5' DT B 6 0.612 -26.487 -0.438 1.00 0.45 H new ATOM 0 H5'' DT B 6 0.373 -25.568 -1.910 1.00 0.45 H new ATOM 0 H4' DT B 6 -1.687 -27.412 -0.720 1.00 0.34 H new ATOM 0 H3' DT B 6 0.684 -28.320 -1.979 1.00 0.42 H new ATOM 0 H2' DT B 6 0.029 -27.831 -4.236 1.00 0.46 H new ATOM 0 H2'' DT B 6 -0.858 -29.329 -4.039 1.00 0.46 H new ATOM 0 H1' DT B 6 -2.856 -28.258 -3.480 1.00 0.40 H new ATOM 0 H3 DT B 6 -4.695 -26.698 -7.171 1.00 0.78 H new ATOM 0 H71 DT B 6 -0.157 -23.902 -6.387 1.00 1.15 H new ATOM 0 H72 DT B 6 -0.029 -24.896 -7.857 1.00 1.15 H new ATOM 0 H73 DT B 6 -1.237 -23.592 -7.767 1.00 1.15 H new ATOM 0 H6 DT B 6 -0.528 -25.777 -4.961 1.00 0.75 H new ATOM 527 P DG B 7 -0.038 -30.845 -1.416 1.00 0.55 P ATOM 528 OP1 DG B 7 1.339 -30.531 -1.859 1.00 0.67 O ATOM 529 OP2 DG B 7 -0.781 -31.956 -2.052 1.00 0.68 O ATOM 530 O5' DG B 7 -0.010 -31.101 0.174 1.00 0.44 O ATOM 531 C5' DG B 7 0.977 -30.475 0.998 1.00 0.34 C ATOM 532 C4' DG B 7 0.619 -30.577 2.477 1.00 0.26 C ATOM 533 O4' DG B 7 1.732 -30.181 3.268 1.00 0.20 O ATOM 534 C3' DG B 7 -0.562 -29.695 2.893 1.00 0.32 C ATOM 535 O3' DG B 7 -1.665 -30.526 3.274 1.00 0.35 O ATOM 536 C2' DG B 7 -0.061 -28.905 4.109 1.00 0.35 C ATOM 537 C1' DG B 7 1.224 -29.633 4.476 1.00 0.24 C ATOM 538 N9 DG B 7 2.274 -28.767 5.044 1.00 0.20 N ATOM 539 C8 DG B 7 3.265 -28.085 4.389 1.00 0.22 C ATOM 540 N7 DG B 7 4.050 -27.406 5.177 1.00 0.20 N ATOM 541 C5 DG B 7 3.545 -27.656 6.449 1.00 0.15 C ATOM 542 C6 DG B 7 3.991 -27.184 7.715 1.00 0.15 C ATOM 543 O6 DG B 7 4.937 -26.440 7.961 1.00 0.19 O ATOM 544 N1 DG B 7 3.202 -27.674 8.746 1.00 0.13 N ATOM 545 C2 DG B 7 2.119 -28.512 8.585 1.00 0.14 C ATOM 546 N2 DG B 7 1.483 -28.877 9.699 1.00 0.18 N ATOM 547 N3 DG B 7 1.698 -28.956 7.397 1.00 0.16 N ATOM 548 C4 DG B 7 2.456 -28.488 6.378 1.00 0.15 C ATOM 0 H5' DG B 7 1.074 -29.426 0.718 1.00 0.34 H new ATOM 0 H5'' DG B 7 1.946 -30.942 0.824 1.00 0.34 H new ATOM 0 H4' DG B 7 0.340 -31.619 2.637 1.00 0.26 H new ATOM 0 H3' DG B 7 -0.897 -29.040 2.089 1.00 0.32 H new ATOM 0 H2' DG B 7 0.122 -27.859 3.864 1.00 0.35 H new ATOM 0 H2'' DG B 7 -0.782 -28.920 4.926 1.00 0.35 H new ATOM 0 H1' DG B 7 0.980 -30.370 5.242 1.00 0.24 H new ATOM 0 H8 DG B 7 3.385 -28.108 3.316 1.00 0.22 H new ATOM 0 H1 DG B 7 3.442 -27.392 9.697 1.00 0.13 H new ATOM 0 H21 DG B 7 0.674 -29.496 9.645 1.00 0.18 H new ATOM 0 H22 DG B 7 1.806 -28.537 10.605 1.00 0.18 H new ATOM 560 P DG B 8 -3.116 -29.886 3.550 1.00 0.38 P ATOM 561 OP1 DG B 8 -4.129 -30.956 3.417 1.00 0.50 O ATOM 562 OP2 DG B 8 -3.238 -28.650 2.745 1.00 0.44 O ATOM 563 O5' DG B 8 -3.027 -29.468 5.102 1.00 0.27 O ATOM 564 C5' DG B 8 -3.880 -28.451 5.634 1.00 0.20 C ATOM 565 C4' DG B 8 -3.527 -28.134 7.085 1.00 0.16 C ATOM 566 O4' DG B 8 -2.127 -27.958 7.215 1.00 0.16 O ATOM 567 C3' DG B 8 -4.159 -26.852 7.617 1.00 0.15 C ATOM 568 O3' DG B 8 -5.356 -27.168 8.339 1.00 0.19 O ATOM 569 C2' DG B 8 -3.108 -26.273 8.574 1.00 0.15 C ATOM 570 C1' DG B 8 -1.910 -27.215 8.408 1.00 0.16 C ATOM 571 N9 DG B 8 -0.614 -26.522 8.277 1.00 0.15 N ATOM 572 C8 DG B 8 0.171 -26.373 7.162 1.00 0.19 C ATOM 573 N7 DG B 8 1.256 -25.684 7.368 1.00 0.21 N ATOM 574 C5 DG B 8 1.192 -25.350 8.715 1.00 0.16 C ATOM 575 C6 DG B 8 2.100 -24.601 9.509 1.00 0.16 C ATOM 576 O6 DG B 8 3.155 -24.071 9.164 1.00 0.21 O ATOM 577 N1 DG B 8 1.663 -24.497 10.823 1.00 0.13 N ATOM 578 C2 DG B 8 0.495 -25.045 11.313 1.00 0.15 C ATOM 579 N2 DG B 8 0.245 -24.841 12.606 1.00 0.21 N ATOM 580 N3 DG B 8 -0.362 -25.749 10.566 1.00 0.15 N ATOM 581 C4 DG B 8 0.050 -25.860 9.282 1.00 0.13 C ATOM 0 H5' DG B 8 -4.919 -28.776 5.573 1.00 0.20 H new ATOM 0 H5'' DG B 8 -3.793 -27.548 5.030 1.00 0.20 H new ATOM 0 H4' DG B 8 -3.910 -28.981 7.655 1.00 0.16 H new ATOM 0 H3' DG B 8 -4.428 -26.155 6.823 1.00 0.15 H new ATOM 0 H2' DG B 8 -2.850 -25.247 8.313 1.00 0.15 H new ATOM 0 H2'' DG B 8 -3.467 -26.259 9.603 1.00 0.15 H new ATOM 0 H1' DG B 8 -1.849 -27.830 9.306 1.00 0.16 H new ATOM 0 H8 DG B 8 -0.088 -26.790 6.200 1.00 0.19 H new ATOM 0 H1 DG B 8 2.249 -23.976 11.475 1.00 0.13 H new ATOM 0 H21 DG B 8 -0.603 -25.221 13.028 1.00 0.21 H new ATOM 0 H22 DG B 8 0.901 -24.305 13.174 1.00 0.21 H new ATOM 593 P DG B 9 -5.301 -28.037 9.693 1.00 0.24 P ATOM 594 OP1 DG B 9 -4.106 -28.906 9.636 1.00 0.30 O ATOM 595 OP2 DG B 9 -6.637 -28.635 9.914 1.00 0.34 O ATOM 596 O5' DG B 9 -5.058 -26.919 10.826 1.00 0.21 O ATOM 597 C5' DG B 9 -4.918 -27.298 12.198 1.00 0.19 C ATOM 598 C4' DG B 9 -4.671 -26.087 13.095 1.00 0.17 C ATOM 599 O4' DG B 9 -3.463 -25.433 12.697 1.00 0.20 O ATOM 600 C3' DG B 9 -5.791 -25.037 13.047 1.00 0.20 C ATOM 601 O3' DG B 9 -6.238 -24.756 14.378 1.00 0.19 O ATOM 602 C2' DG B 9 -5.128 -23.796 12.456 1.00 0.21 C ATOM 603 C1' DG B 9 -3.671 -24.030 12.808 1.00 0.19 C ATOM 604 N9 DG B 9 -2.711 -23.352 11.913 1.00 0.21 N ATOM 605 C8 DG B 9 -2.683 -23.324 10.540 1.00 0.27 C ATOM 606 N7 DG B 9 -1.697 -22.631 10.046 1.00 0.28 N ATOM 607 C5 DG B 9 -1.020 -22.163 11.168 1.00 0.24 C ATOM 608 C6 DG B 9 0.142 -21.349 11.254 1.00 0.25 C ATOM 609 O6 DG B 9 0.811 -20.876 10.339 1.00 0.28 O ATOM 610 N1 DG B 9 0.497 -21.107 12.574 1.00 0.21 N ATOM 611 C2 DG B 9 -0.180 -21.588 13.676 1.00 0.18 C ATOM 612 N2 DG B 9 0.312 -21.248 14.867 1.00 0.17 N ATOM 613 N3 DG B 9 -1.273 -22.354 13.596 1.00 0.17 N ATOM 614 C4 DG B 9 -1.634 -22.600 12.315 1.00 0.20 C ATOM 0 H5' DG B 9 -4.091 -28.001 12.299 1.00 0.19 H new ATOM 0 H5'' DG B 9 -5.819 -27.817 12.526 1.00 0.19 H new ATOM 0 H4' DG B 9 -4.619 -26.481 14.110 1.00 0.17 H new ATOM 0 H3' DG B 9 -6.653 -25.367 12.467 1.00 0.20 H new ATOM 0 H2' DG B 9 -5.283 -23.723 11.380 1.00 0.21 H new ATOM 0 H2'' DG B 9 -5.513 -22.877 12.897 1.00 0.21 H new ATOM 0 H1' DG B 9 -3.492 -23.624 13.804 1.00 0.19 H new ATOM 0 H8 DG B 9 -3.413 -23.831 9.926 1.00 0.27 H new ATOM 0 H1 DG B 9 1.321 -20.530 12.742 1.00 0.21 H new ATOM 0 H21 DG B 9 -0.145 -21.573 15.719 1.00 0.17 H new ATOM 0 H22 DG B 9 1.145 -20.663 14.926 1.00 0.17 H new ATOM 626 P DT B 10 -6.689 -25.951 15.355 1.00 0.20 P ATOM 627 OP1 DT B 10 -7.699 -26.771 14.650 1.00 0.30 O ATOM 628 OP2 DT B 10 -7.000 -25.373 16.681 1.00 0.38 O ATOM 629 O5' DT B 10 -5.338 -26.815 15.485 1.00 0.25 O ATOM 630 C5' DT B 10 -5.387 -28.193 15.859 1.00 0.22 C ATOM 631 C4' DT B 10 -5.685 -28.363 17.345 1.00 0.18 C ATOM 632 O4' DT B 10 -6.965 -27.808 17.649 1.00 0.23 O ATOM 633 C3' DT B 10 -5.705 -29.824 17.808 1.00 0.18 C ATOM 634 O3' DT B 10 -4.724 -30.009 18.832 1.00 0.25 O ATOM 635 C2' DT B 10 -7.104 -30.034 18.387 1.00 0.18 C ATOM 636 C1' DT B 10 -7.550 -28.610 18.666 1.00 0.23 C ATOM 637 N1 DT B 10 -9.012 -28.410 18.616 1.00 0.28 N ATOM 638 C2 DT B 10 -9.626 -27.917 19.751 1.00 0.38 C ATOM 639 O2 DT B 10 -8.996 -27.650 20.772 1.00 0.48 O ATOM 640 N3 DT B 10 -10.995 -27.740 19.672 1.00 0.45 N ATOM 641 C4 DT B 10 -11.789 -28.010 18.571 1.00 0.45 C ATOM 642 O4 DT B 10 -13.002 -27.816 18.610 1.00 0.53 O ATOM 643 C5 DT B 10 -11.060 -28.522 17.432 1.00 0.41 C ATOM 644 C7 DT B 10 -11.813 -28.860 16.150 1.00 0.53 C ATOM 645 C6 DT B 10 -9.725 -28.703 17.485 1.00 0.33 C ATOM 0 H5' DT B 10 -4.435 -28.669 15.622 1.00 0.22 H new ATOM 0 H5'' DT B 10 -6.153 -28.702 15.274 1.00 0.22 H new ATOM 0 H4' DT B 10 -4.876 -27.850 17.865 1.00 0.18 H new ATOM 0 H3' DT B 10 -5.485 -30.523 17.001 1.00 0.18 H new ATOM 0 H2' DT B 10 -7.765 -30.538 17.682 1.00 0.18 H new ATOM 0 H2'' DT B 10 -7.083 -30.640 19.293 1.00 0.18 H new ATOM 0 H1' DT B 10 -7.241 -28.351 19.679 1.00 0.23 H new ATOM 0 H3 DT B 10 -11.463 -27.377 20.502 1.00 0.45 H new ATOM 0 H71 DT B 10 -11.157 -28.711 15.293 1.00 0.53 H new ATOM 0 H72 DT B 10 -12.138 -29.900 16.182 1.00 0.53 H new ATOM 0 H73 DT B 10 -12.683 -28.211 16.057 1.00 0.53 H new ATOM 0 H6 DT B 10 -9.208 -29.087 16.618 1.00 0.33 H new ATOM 658 P DG B 11 -3.174 -30.214 18.447 1.00 0.38 P ATOM 659 OP1 DG B 11 -3.050 -31.474 17.682 1.00 0.47 O ATOM 660 OP2 DG B 11 -2.361 -30.007 19.665 1.00 0.60 O ATOM 661 O5' DG B 11 -2.900 -28.985 17.442 1.00 0.34 O ATOM 662 C5' DG B 11 -1.935 -29.108 16.393 1.00 0.33 C ATOM 663 C4' DG B 11 -0.537 -28.720 16.865 1.00 0.25 C ATOM 664 O4' DG B 11 0.393 -28.908 15.800 1.00 0.25 O ATOM 665 C3' DG B 11 -0.420 -27.259 17.318 1.00 0.23 C ATOM 666 O3' DG B 11 0.014 -27.215 18.681 1.00 0.22 O ATOM 667 C2' DG B 11 0.653 -26.651 16.416 1.00 0.23 C ATOM 668 C1' DG B 11 1.371 -27.880 15.884 1.00 0.21 C ATOM 669 N9 DG B 11 1.954 -27.707 14.542 1.00 0.23 N ATOM 670 C8 DG B 11 1.570 -28.285 13.359 1.00 0.30 C ATOM 671 N7 DG B 11 2.287 -27.921 12.334 1.00 0.31 N ATOM 672 C5 DG B 11 3.217 -27.037 12.873 1.00 0.24 C ATOM 673 C6 DG B 11 4.265 -26.318 12.236 1.00 0.23 C ATOM 674 O6 DG B 11 4.580 -26.321 11.048 1.00 0.26 O ATOM 675 N1 DG B 11 4.971 -25.538 13.142 1.00 0.18 N ATOM 676 C2 DG B 11 4.705 -25.459 14.494 1.00 0.17 C ATOM 677 N2 DG B 11 5.494 -24.653 15.204 1.00 0.18 N ATOM 678 N3 DG B 11 3.720 -26.134 15.094 1.00 0.16 N ATOM 679 C4 DG B 11 3.021 -26.901 14.225 1.00 0.20 C ATOM 0 H5' DG B 11 -2.225 -28.474 15.555 1.00 0.33 H new ATOM 0 H5'' DG B 11 -1.924 -30.135 16.027 1.00 0.33 H new ATOM 0 H4' DG B 11 -0.325 -29.358 17.723 1.00 0.25 H new ATOM 0 H3' DG B 11 -1.368 -26.725 17.250 1.00 0.23 H new ATOM 0 H2' DG B 11 0.218 -26.056 15.613 1.00 0.23 H new ATOM 0 H2'' DG B 11 1.326 -25.996 16.970 1.00 0.23 H new ATOM 0 H1' DG B 11 2.200 -28.100 16.556 1.00 0.21 H new ATOM 0 H8 DG B 11 0.747 -28.980 13.284 1.00 0.30 H new ATOM 0 H1 DG B 11 5.745 -24.981 12.781 1.00 0.18 H new ATOM 0 H21 DG B 11 5.348 -24.552 16.208 1.00 0.18 H new ATOM 0 H22 DG B 11 6.244 -24.137 14.743 1.00 0.18 H new ATOM 691 P DG B 12 -0.287 -25.918 19.588 1.00 0.28 P ATOM 692 OP1 DG B 12 -0.009 -26.264 20.999 1.00 0.30 O ATOM 693 OP2 DG B 12 -1.616 -25.388 19.208 1.00 0.35 O ATOM 694 O5' DG B 12 0.833 -24.871 19.095 1.00 0.29 O ATOM 695 C5' DG B 12 2.076 -24.757 19.793 1.00 0.22 C ATOM 696 C4' DG B 12 2.880 -23.551 19.313 1.00 0.19 C ATOM 697 O4' DG B 12 3.232 -23.720 17.942 1.00 0.24 O ATOM 698 C3' DG B 12 2.127 -22.220 19.422 1.00 0.20 C ATOM 699 O3' DG B 12 2.824 -21.352 20.321 1.00 0.22 O ATOM 700 C2' DG B 12 2.154 -21.634 18.009 1.00 0.30 C ATOM 701 C1' DG B 12 3.265 -22.431 17.345 1.00 0.20 C ATOM 702 N9 DG B 12 3.104 -22.602 15.886 1.00 0.15 N ATOM 703 C8 DG B 12 2.139 -23.298 15.202 1.00 0.14 C ATOM 704 N7 DG B 12 2.282 -23.265 13.907 1.00 0.14 N ATOM 705 C5 DG B 12 3.424 -22.494 13.714 1.00 0.13 C ATOM 706 C6 DG B 12 4.070 -22.112 12.506 1.00 0.16 C ATOM 707 O6 DG B 12 3.753 -22.388 11.352 1.00 0.17 O ATOM 708 N1 DG B 12 5.191 -21.330 12.754 1.00 0.22 N ATOM 709 C2 DG B 12 5.636 -20.961 14.008 1.00 0.27 C ATOM 710 N2 DG B 12 6.734 -20.206 14.047 1.00 0.35 N ATOM 711 N3 DG B 12 5.030 -21.320 15.143 1.00 0.25 N ATOM 712 C4 DG B 12 3.934 -22.083 14.921 1.00 0.17 C ATOM 0 H5' DG B 12 2.660 -25.666 19.648 1.00 0.22 H new ATOM 0 H5'' DG B 12 1.887 -24.667 20.863 1.00 0.22 H new ATOM 0 H4' DG B 12 3.752 -23.505 19.965 1.00 0.19 H new ATOM 0 H3' DG B 12 1.111 -22.344 19.796 1.00 0.20 H new ATOM 0 H2' DG B 12 1.200 -21.763 17.498 1.00 0.30 H new ATOM 0 H2'' DG B 12 2.369 -20.566 18.017 1.00 0.30 H new ATOM 0 H1' DG B 12 4.201 -21.890 17.486 1.00 0.20 H new ATOM 0 H8 DG B 12 1.334 -23.825 15.692 1.00 0.14 H new ATOM 0 H1 DG B 12 5.726 -21.004 11.949 1.00 0.22 H new ATOM 0 H21 DG B 12 7.112 -19.901 14.944 1.00 0.35 H new ATOM 0 H22 DG B 12 7.196 -19.933 13.180 1.00 0.35 H new ATOM 724 P DG B 13 2.241 -19.891 20.665 1.00 0.26 P ATOM 725 OP1 DG B 13 2.661 -19.535 22.040 1.00 0.36 O ATOM 726 OP2 DG B 13 0.806 -19.868 20.304 1.00 0.32 O ATOM 727 O5' DG B 13 3.035 -18.942 19.635 1.00 0.22 O ATOM 728 C5' DG B 13 4.425 -18.666 19.830 1.00 0.23 C ATOM 729 C4' DG B 13 4.948 -17.662 18.807 1.00 0.16 C ATOM 730 O4' DG B 13 4.781 -18.186 17.486 1.00 0.18 O ATOM 731 C3' DG B 13 4.236 -16.304 18.848 1.00 0.16 C ATOM 732 O3' DG B 13 5.212 -15.255 18.876 1.00 0.19 O ATOM 733 C2' DG B 13 3.458 -16.245 17.540 1.00 0.17 C ATOM 734 C1' DG B 13 4.307 -17.134 16.651 1.00 0.15 C ATOM 735 N9 DG B 13 3.579 -17.743 15.521 1.00 0.14 N ATOM 736 C8 DG B 13 2.475 -18.554 15.548 1.00 0.18 C ATOM 737 N7 DG B 13 2.074 -18.941 14.368 1.00 0.20 N ATOM 738 C5 DG B 13 2.977 -18.342 13.495 1.00 0.17 C ATOM 739 C6 DG B 13 3.045 -18.400 12.076 1.00 0.20 C ATOM 740 O6 DG B 13 2.308 -19.004 11.301 1.00 0.25 O ATOM 741 N1 DG B 13 4.109 -17.651 11.588 1.00 0.22 N ATOM 742 C2 DG B 13 4.996 -16.936 12.366 1.00 0.24 C ATOM 743 N2 DG B 13 5.956 -16.277 11.717 1.00 0.34 N ATOM 744 N3 DG B 13 4.932 -16.882 13.700 1.00 0.21 N ATOM 745 C4 DG B 13 3.901 -17.606 14.192 1.00 0.16 C ATOM 0 H5' DG B 13 4.994 -19.592 19.755 1.00 0.23 H new ATOM 0 H5'' DG B 13 4.581 -18.276 20.836 1.00 0.23 H new ATOM 0 H4' DG B 13 5.996 -17.504 19.063 1.00 0.16 H new ATOM 0 H3' DG B 13 3.595 -16.188 19.722 1.00 0.16 H new ATOM 0 H2' DG B 13 2.441 -16.623 17.649 1.00 0.17 H new ATOM 0 H2'' DG B 13 3.381 -15.229 17.153 1.00 0.17 H new ATOM 0 H1' DG B 13 5.091 -16.519 16.209 1.00 0.15 H new ATOM 0 H8 DG B 13 1.981 -18.846 16.463 1.00 0.18 H new ATOM 0 H1 DG B 13 4.245 -17.628 10.577 1.00 0.22 H new ATOM 0 H21 DG B 13 6.642 -15.731 12.238 1.00 0.34 H new ATOM 0 H22 DG B 13 6.005 -16.319 10.699 1.00 0.34 H new ATOM 757 P DT B 14 6.189 -15.072 20.145 1.00 0.21 P ATOM 758 OP1 DT B 14 5.392 -15.273 21.375 1.00 0.30 O ATOM 759 OP2 DT B 14 6.957 -13.822 19.960 1.00 0.26 O ATOM 760 O5' DT B 14 7.203 -16.316 19.993 1.00 0.18 O ATOM 761 C5' DT B 14 8.190 -16.331 18.957 1.00 0.18 C ATOM 762 C4' DT B 14 9.467 -15.609 19.379 1.00 0.19 C ATOM 763 O4' DT B 14 9.186 -14.237 19.639 1.00 0.29 O ATOM 764 C3' DT B 14 10.118 -16.176 20.647 1.00 0.14 C ATOM 765 O3' DT B 14 11.391 -16.737 20.313 1.00 0.12 O ATOM 766 C2' DT B 14 10.312 -14.966 21.568 1.00 0.23 C ATOM 767 C1' DT B 14 10.118 -13.797 20.616 1.00 0.33 C ATOM 768 N1 DT B 14 9.576 -12.579 21.247 1.00 0.49 N ATOM 769 C2 DT B 14 10.302 -11.411 21.103 1.00 0.66 C ATOM 770 O2 DT B 14 11.360 -11.371 20.478 1.00 0.71 O ATOM 771 N3 DT B 14 9.767 -10.287 21.704 1.00 0.81 N ATOM 772 C4 DT B 14 8.588 -10.231 22.425 1.00 0.82 C ATOM 773 O4 DT B 14 8.204 -9.172 22.920 1.00 0.97 O ATOM 774 C5 DT B 14 7.899 -11.498 22.522 1.00 0.67 C ATOM 775 C7 DT B 14 6.582 -11.580 23.289 1.00 0.75 C ATOM 776 C6 DT B 14 8.400 -12.608 21.946 1.00 0.51 C ATOM 0 H5' DT B 14 7.785 -15.859 18.062 1.00 0.18 H new ATOM 0 H5'' DT B 14 8.426 -17.362 18.694 1.00 0.18 H new ATOM 0 H4' DT B 14 10.159 -15.746 18.548 1.00 0.19 H new ATOM 0 H3' DT B 14 9.516 -16.956 21.114 1.00 0.14 H new ATOM 0 H2' DT B 14 9.585 -14.953 22.380 1.00 0.23 H new ATOM 0 H2'' DT B 14 11.301 -14.958 22.025 1.00 0.23 H new ATOM 0 H1' DT B 14 11.094 -13.521 20.217 1.00 0.33 H new ATOM 0 H3 DT B 14 10.291 -9.417 21.607 1.00 0.81 H new ATOM 0 H71 DT B 14 5.957 -12.361 22.856 1.00 0.75 H new ATOM 0 H72 DT B 14 6.784 -11.814 24.334 1.00 0.75 H new ATOM 0 H73 DT B 14 6.063 -10.623 23.225 1.00 0.75 H new ATOM 0 H6 DT B 14 7.862 -13.540 22.038 1.00 0.51 H new ATOM 789 P DG B 15 11.507 -18.273 19.847 1.00 0.14 P ATOM 790 OP1 DG B 15 11.321 -19.134 21.036 1.00 0.22 O ATOM 791 OP2 DG B 15 12.724 -18.414 19.016 1.00 0.26 O ATOM 792 O5' DG B 15 10.222 -18.448 18.892 1.00 0.18 O ATOM 793 C5' DG B 15 10.019 -19.658 18.157 1.00 0.22 C ATOM 794 C4' DG B 15 10.845 -19.679 16.874 1.00 0.16 C ATOM 795 O4' DG B 15 10.563 -20.878 16.146 1.00 0.25 O ATOM 796 C3' DG B 15 10.564 -18.498 15.944 1.00 0.13 C ATOM 797 O3' DG B 15 11.803 -17.931 15.507 1.00 0.15 O ATOM 798 C2' DG B 15 9.823 -19.109 14.760 1.00 0.16 C ATOM 799 C1' DG B 15 10.326 -20.543 14.779 1.00 0.16 C ATOM 800 N9 DG B 15 9.365 -21.526 14.242 1.00 0.18 N ATOM 801 C8 DG B 15 8.434 -22.269 14.921 1.00 0.23 C ATOM 802 N7 DG B 15 7.728 -23.055 14.160 1.00 0.24 N ATOM 803 C5 DG B 15 8.223 -22.822 12.883 1.00 0.19 C ATOM 804 C6 DG B 15 7.840 -23.395 11.640 1.00 0.19 C ATOM 805 O6 DG B 15 6.971 -24.236 11.424 1.00 0.23 O ATOM 806 N1 DG B 15 8.591 -22.884 10.590 1.00 0.16 N ATOM 807 C2 DG B 15 9.588 -21.939 10.718 1.00 0.15 C ATOM 808 N2 DG B 15 10.200 -21.571 9.591 1.00 0.18 N ATOM 809 N3 DG B 15 9.950 -21.398 11.886 1.00 0.14 N ATOM 810 C4 DG B 15 9.228 -21.886 12.922 1.00 0.15 C ATOM 0 H5' DG B 15 8.962 -19.763 17.912 1.00 0.22 H new ATOM 0 H5'' DG B 15 10.289 -20.512 18.778 1.00 0.22 H new ATOM 0 H4' DG B 15 11.888 -19.620 17.186 1.00 0.16 H new ATOM 0 H3' DG B 15 9.990 -17.707 16.427 1.00 0.13 H new ATOM 0 H2' DG B 15 8.741 -19.054 14.883 1.00 0.16 H new ATOM 0 H2'' DG B 15 10.063 -18.605 13.824 1.00 0.16 H new ATOM 0 H1' DG B 15 11.213 -20.590 14.147 1.00 0.16 H new ATOM 0 H8 DG B 15 8.298 -22.208 15.991 1.00 0.23 H new ATOM 0 H1 DG B 15 8.390 -23.234 9.653 1.00 0.16 H new ATOM 0 H21 DG B 15 10.946 -20.876 9.619 1.00 0.18 H new ATOM 0 H22 DG B 15 9.922 -21.985 8.701 1.00 0.18 H new ATOM 822 P DG B 16 11.907 -16.358 15.180 1.00 0.19 P ATOM 823 OP1 DG B 16 13.330 -15.960 15.257 1.00 0.25 O ATOM 824 OP2 DG B 16 10.898 -15.648 15.997 1.00 0.25 O ATOM 825 O5' DG B 16 11.448 -16.285 13.640 1.00 0.16 O ATOM 826 C5' DG B 16 12.419 -16.332 12.591 1.00 0.15 C ATOM 827 C4' DG B 16 11.761 -16.252 11.217 1.00 0.18 C ATOM 828 O4' DG B 16 10.963 -17.412 11.000 1.00 0.19 O ATOM 829 C3' DG B 16 10.847 -15.034 11.038 1.00 0.23 C ATOM 830 O3' DG B 16 11.349 -14.213 9.979 1.00 0.31 O ATOM 831 C2' DG B 16 9.488 -15.616 10.644 1.00 0.24 C ATOM 832 C1' DG B 16 9.850 -17.026 10.207 1.00 0.20 C ATOM 833 N9 DG B 16 8.781 -18.021 10.414 1.00 0.17 N ATOM 834 C8 DG B 16 8.115 -18.336 11.570 1.00 0.20 C ATOM 835 N7 DG B 16 7.216 -19.269 11.424 1.00 0.20 N ATOM 836 C5 DG B 16 7.291 -19.598 10.074 1.00 0.17 C ATOM 837 C6 DG B 16 6.549 -20.556 9.329 1.00 0.18 C ATOM 838 O6 DG B 16 5.666 -21.313 9.726 1.00 0.22 O ATOM 839 N1 DG B 16 6.935 -20.571 7.994 1.00 0.21 N ATOM 840 C2 DG B 16 7.915 -19.765 7.446 1.00 0.23 C ATOM 841 N2 DG B 16 8.152 -19.920 6.144 1.00 0.31 N ATOM 842 N3 DG B 16 8.611 -18.866 8.147 1.00 0.21 N ATOM 843 C4 DG B 16 8.246 -18.838 9.449 1.00 0.17 C ATOM 0 H5' DG B 16 12.994 -17.255 12.667 1.00 0.15 H new ATOM 0 H5'' DG B 16 13.122 -15.507 12.707 1.00 0.15 H new ATOM 0 H4' DG B 16 12.581 -16.170 10.503 1.00 0.18 H new ATOM 0 H3' DG B 16 10.787 -14.421 11.937 1.00 0.23 H new ATOM 0 H2' DG B 16 8.789 -15.617 11.480 1.00 0.24 H new ATOM 0 H2'' DG B 16 9.021 -15.049 9.839 1.00 0.24 H new ATOM 0 H1' DG B 16 10.045 -17.006 9.135 1.00 0.20 H new ATOM 0 H8 DG B 16 8.317 -17.855 12.516 1.00 0.20 H new ATOM 0 H1 DG B 16 6.460 -21.225 7.372 1.00 0.21 H new ATOM 0 H21 DG B 16 8.864 -19.353 5.684 1.00 0.31 H new ATOM 0 H22 DG B 16 7.621 -20.606 5.607 1.00 0.31 H new ATOM 855 P DG B 17 10.601 -12.843 9.582 1.00 0.41 P ATOM 856 OP1 DG B 17 11.614 -11.891 9.073 1.00 0.54 O ATOM 857 OP2 DG B 17 9.722 -12.453 10.706 1.00 0.45 O ATOM 858 O5' DG B 17 9.670 -13.294 8.348 1.00 0.37 O ATOM 859 C5' DG B 17 10.248 -13.595 7.075 1.00 0.37 C ATOM 860 C4' DG B 17 9.176 -13.866 6.023 1.00 0.34 C ATOM 861 O4' DG B 17 8.385 -14.987 6.426 1.00 0.28 O ATOM 862 C3' DG B 17 8.219 -12.689 5.797 1.00 0.40 C ATOM 863 O3' DG B 17 8.124 -12.416 4.395 1.00 0.46 O ATOM 864 C2' DG B 17 6.876 -13.185 6.318 1.00 0.37 C ATOM 865 C1' DG B 17 7.019 -14.686 6.156 1.00 0.29 C ATOM 866 N9 DG B 17 6.189 -15.478 7.084 1.00 0.26 N ATOM 867 C8 DG B 17 6.102 -15.390 8.450 1.00 0.29 C ATOM 868 N7 DG B 17 5.267 -16.238 8.982 1.00 0.28 N ATOM 869 C5 DG B 17 4.765 -16.941 7.892 1.00 0.23 C ATOM 870 C6 DG B 17 3.812 -17.997 7.852 1.00 0.25 C ATOM 871 O6 DG B 17 3.220 -18.525 8.791 1.00 0.32 O ATOM 872 N1 DG B 17 3.585 -18.425 6.551 1.00 0.22 N ATOM 873 C2 DG B 17 4.195 -17.904 5.428 1.00 0.18 C ATOM 874 N2 DG B 17 3.850 -18.445 4.260 1.00 0.20 N ATOM 875 N3 DG B 17 5.089 -16.912 5.466 1.00 0.20 N ATOM 876 C4 DG B 17 5.324 -16.482 6.727 1.00 0.22 C ATOM 0 H5' DG B 17 10.898 -14.465 7.166 1.00 0.37 H new ATOM 0 H5'' DG B 17 10.873 -12.763 6.752 1.00 0.37 H new ATOM 0 H4' DG B 17 9.713 -14.048 5.092 1.00 0.34 H new ATOM 0 H3' DG B 17 8.547 -11.776 6.293 1.00 0.40 H new ATOM 0 H2' DG B 17 6.709 -12.899 7.357 1.00 0.37 H new ATOM 0 H2'' DG B 17 6.041 -12.789 5.740 1.00 0.37 H new ATOM 0 H1' DG B 17 6.691 -14.949 5.150 1.00 0.29 H new ATOM 0 H8 DG B 17 6.674 -14.682 9.032 1.00 0.29 H new ATOM 0 H1 DG B 17 2.916 -19.183 6.415 1.00 0.22 H new ATOM 0 H21 DG B 17 4.268 -18.101 3.395 1.00 0.20 H new ATOM 0 H22 DG B 17 3.168 -19.203 4.231 1.00 0.20 H new ATOM 888 P DT B 18 7.182 -11.226 3.855 1.00 0.59 P ATOM 889 OP1 DT B 18 7.885 -10.548 2.743 1.00 0.80 O ATOM 890 OP2 DT B 18 6.715 -10.441 5.020 1.00 0.77 O ATOM 891 O5' DT B 18 5.921 -12.019 3.245 1.00 0.40 O ATOM 892 C5' DT B 18 6.044 -12.738 2.013 1.00 0.34 C ATOM 893 C4' DT B 18 4.680 -13.031 1.391 1.00 0.19 C ATOM 894 O4' DT B 18 3.926 -13.883 2.264 1.00 0.26 O ATOM 895 C3' DT B 18 3.834 -11.781 1.141 1.00 0.24 C ATOM 896 O3' DT B 18 3.132 -11.872 -0.105 1.00 0.31 O ATOM 897 C2' DT B 18 2.870 -11.780 2.314 1.00 0.36 C ATOM 898 C1' DT B 18 2.660 -13.269 2.507 1.00 0.35 C ATOM 899 N1 DT B 18 2.219 -13.656 3.862 1.00 0.47 N ATOM 900 C2 DT B 18 1.050 -14.386 3.966 1.00 0.69 C ATOM 901 O2 DT B 18 0.389 -14.706 2.980 1.00 0.81 O ATOM 902 N3 DT B 18 0.664 -14.736 5.247 1.00 0.76 N ATOM 903 C4 DT B 18 1.339 -14.424 6.414 1.00 0.64 C ATOM 904 O4 DT B 18 0.905 -14.787 7.505 1.00 0.74 O ATOM 905 C5 DT B 18 2.549 -13.660 6.207 1.00 0.44 C ATOM 906 C7 DT B 18 3.392 -13.248 7.409 1.00 0.39 C ATOM 907 C6 DT B 18 2.945 -13.306 4.967 1.00 0.36 C ATOM 0 H5' DT B 18 6.572 -13.675 2.190 1.00 0.34 H new ATOM 0 H5'' DT B 18 6.647 -12.160 1.313 1.00 0.34 H new ATOM 0 H4' DT B 18 4.890 -13.499 0.429 1.00 0.19 H new ATOM 0 H3' DT B 18 4.427 -10.869 1.072 1.00 0.24 H new ATOM 0 H2' DT B 18 3.295 -11.304 3.198 1.00 0.36 H new ATOM 0 H2'' DT B 18 1.941 -11.257 2.086 1.00 0.36 H new ATOM 0 HO3' DT B 18 2.598 -11.061 -0.239 1.00 0.31 H new ATOM 0 H1' DT B 18 1.867 -13.586 1.830 1.00 0.35 H new ATOM 0 H3 DT B 18 -0.198 -15.274 5.340 1.00 0.76 H new ATOM 0 H71 DT B 18 4.439 -13.182 7.113 1.00 0.39 H new ATOM 0 H72 DT B 18 3.056 -12.277 7.774 1.00 0.39 H new ATOM 0 H73 DT B 18 3.285 -13.990 8.200 1.00 0.39 H new ATOM 0 H6 DT B 18 3.853 -12.735 4.844 1.00 0.36 H new TER 921 DT B 18