USER MOD reduce.3.24.130724 H: found=0, std=0, add=375, rem=0, adj=7 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+ 157:sc= 0.0155 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00995 USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.0135 X(o=-0.014,f=0) USER MOD Single : A 6 HIS : no HE2:sc= -3.98! C(o=-4!,f=-8.2!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 MET CE :methyl -104:sc= -0.297 (180deg=-1.12) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= -0.396 K(o=-0.4,f=-4.6!) USER MOD Single : B 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 1 DT O5' : rot -27:sc= 0.466 USER MOD Single : B 2 DT C7 :methyl 150:sc= 0 (180deg=0) 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= -0.327 (180deg=-0.327) USER MOD Single : B 18 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 18.500 -31.198 19.196 1.00 0.77 N ATOM 2 CA SER A 1 18.094 -32.632 19.214 1.00 0.58 C ATOM 3 C SER A 1 17.759 -33.082 17.797 1.00 0.56 C ATOM 4 O SER A 1 18.623 -33.098 16.920 1.00 0.74 O ATOM 5 CB SER A 1 16.873 -32.802 20.119 1.00 0.47 C ATOM 6 OG SER A 1 17.193 -32.349 21.428 1.00 0.71 O ATOM 0 H1 SER A 1 18.353 -30.784 20.139 1.00 0.77 H new ATOM 0 H2 SER A 1 19.505 -31.125 18.938 1.00 0.77 H new ATOM 0 H3 SER A 1 17.925 -30.683 18.499 1.00 0.77 H new ATOM 0 HA SER A 1 18.912 -33.241 19.598 1.00 0.58 H new ATOM 0 HB2 SER A 1 16.030 -32.237 19.722 1.00 0.47 H new ATOM 0 HB3 SER A 1 16.570 -33.849 20.148 1.00 0.47 H new ATOM 0 HG SER A 1 16.412 -32.455 22.011 1.00 0.71 H new ATOM 14 N MET A 2 16.500 -33.448 17.579 1.00 0.47 N ATOM 15 CA MET A 2 16.062 -33.899 16.262 1.00 0.59 C ATOM 16 C MET A 2 14.564 -34.185 16.262 1.00 0.55 C ATOM 17 O MET A 2 14.004 -34.616 15.254 1.00 0.85 O ATOM 18 CB MET A 2 16.827 -35.161 15.863 1.00 0.70 C ATOM 19 CG MET A 2 16.717 -35.371 14.351 1.00 0.40 C ATOM 20 SD MET A 2 18.313 -35.018 13.575 1.00 0.86 S ATOM 21 CE MET A 2 19.114 -36.590 13.982 1.00 1.47 C ATOM 0 H MET A 2 15.770 -33.442 18.291 1.00 0.47 H new ATOM 0 HA MET A 2 16.266 -33.108 15.541 1.00 0.59 H new ATOM 0 HB2 MET A 2 17.874 -35.071 16.153 1.00 0.70 H new ATOM 0 HB3 MET A 2 16.424 -36.025 16.391 1.00 0.70 H new ATOM 0 HG2 MET A 2 16.415 -36.396 14.137 1.00 0.40 H new ATOM 0 HG3 MET A 2 15.947 -34.719 13.938 1.00 0.40 H new ATOM 0 HE1 MET A 2 20.131 -36.592 13.591 1.00 1.47 H new ATOM 0 HE2 MET A 2 19.141 -36.715 15.064 1.00 1.47 H new ATOM 0 HE3 MET A 2 18.552 -37.411 13.536 1.00 1.47 H new ATOM 31 N HIS A 3 13.919 -33.942 17.400 1.00 0.34 N ATOM 32 CA HIS A 3 12.483 -34.178 17.518 1.00 0.37 C ATOM 33 C HIS A 3 11.724 -32.853 17.526 1.00 0.33 C ATOM 34 O HIS A 3 12.224 -31.844 18.019 1.00 0.29 O ATOM 35 CB HIS A 3 12.185 -34.947 18.806 1.00 0.38 C ATOM 36 CG HIS A 3 12.267 -36.426 18.538 1.00 0.48 C ATOM 37 ND1 HIS A 3 11.457 -37.341 19.193 1.00 0.59 N ATOM 38 CD2 HIS A 3 13.057 -37.164 17.691 1.00 0.64 C ATOM 39 CE1 HIS A 3 11.774 -38.566 18.734 1.00 0.74 C ATOM 40 NE2 HIS A 3 12.745 -38.515 17.817 1.00 0.78 N ATOM 0 H HIS A 3 14.363 -33.585 18.246 1.00 0.34 H new ATOM 0 HA HIS A 3 12.157 -34.767 16.661 1.00 0.37 H new ATOM 0 HB2 HIS A 3 12.897 -34.667 19.582 1.00 0.38 H new ATOM 0 HB3 HIS A 3 11.193 -34.688 19.175 1.00 0.38 H new ATOM 0 HD2 HIS A 3 13.807 -36.758 17.028 1.00 0.64 H new ATOM 0 HE1 HIS A 3 11.301 -39.479 19.066 1.00 0.74 H new ATOM 0 HE2 HIS A 3 13.167 -39.298 17.317 1.00 0.78 H new ATOM 48 N PRO A 4 10.532 -32.846 16.993 1.00 0.36 N ATOM 49 CA PRO A 4 9.677 -31.633 16.928 1.00 0.36 C ATOM 50 C PRO A 4 9.883 -30.706 18.123 1.00 0.35 C ATOM 51 O PRO A 4 10.400 -31.119 19.160 1.00 0.39 O ATOM 52 CB PRO A 4 8.268 -32.218 16.921 1.00 0.41 C ATOM 53 CG PRO A 4 8.393 -33.554 16.254 1.00 0.46 C ATOM 54 CD PRO A 4 9.857 -34.000 16.388 1.00 0.43 C ATOM 0 HA PRO A 4 9.901 -31.009 16.063 1.00 0.36 H new ATOM 0 HB2 PRO A 4 7.880 -32.320 17.935 1.00 0.41 H new ATOM 0 HB3 PRO A 4 7.577 -31.572 16.379 1.00 0.41 H new ATOM 0 HG2 PRO A 4 7.727 -34.280 16.720 1.00 0.46 H new ATOM 0 HG3 PRO A 4 8.107 -33.487 15.204 1.00 0.46 H new ATOM 0 HD2 PRO A 4 9.947 -34.887 17.015 1.00 0.43 H new ATOM 0 HD3 PRO A 4 10.287 -34.250 15.418 1.00 0.43 H new ATOM 62 N GLY A 5 9.474 -29.450 17.967 1.00 0.35 N ATOM 63 CA GLY A 5 9.618 -28.471 19.039 1.00 0.37 C ATOM 64 C GLY A 5 11.078 -28.076 19.220 1.00 0.36 C ATOM 65 O GLY A 5 11.385 -27.078 19.872 1.00 0.41 O ATOM 0 H GLY A 5 9.044 -29.089 17.116 1.00 0.35 H new ATOM 0 HA2 GLY A 5 9.023 -27.586 18.812 1.00 0.37 H new ATOM 0 HA3 GLY A 5 9.231 -28.885 19.970 1.00 0.37 H new ATOM 69 N HIS A 6 11.976 -28.867 18.641 1.00 0.34 N ATOM 70 CA HIS A 6 13.403 -28.589 18.748 1.00 0.36 C ATOM 71 C HIS A 6 13.960 -28.110 17.408 1.00 0.37 C ATOM 72 O HIS A 6 15.096 -27.643 17.330 1.00 0.42 O ATOM 73 CB HIS A 6 14.146 -29.848 19.201 1.00 0.35 C ATOM 74 CG HIS A 6 13.342 -30.547 20.264 1.00 0.36 C ATOM 75 ND1 HIS A 6 12.962 -31.875 20.150 1.00 0.38 N ATOM 76 CD2 HIS A 6 12.832 -30.114 21.463 1.00 0.63 C ATOM 77 CE1 HIS A 6 12.254 -32.192 21.249 1.00 0.43 C ATOM 78 NE2 HIS A 6 12.146 -31.154 22.083 1.00 0.64 N ATOM 0 H HIS A 6 11.743 -29.698 18.098 1.00 0.34 H new ATOM 0 HA HIS A 6 13.548 -27.800 19.486 1.00 0.36 H new ATOM 0 HB2 HIS A 6 14.306 -30.514 18.353 1.00 0.35 H new ATOM 0 HB3 HIS A 6 15.130 -29.584 19.588 1.00 0.35 H new ATOM 0 HD1 HIS A 6 13.180 -32.499 19.373 1.00 0.38 H new ATOM 0 HD2 HIS A 6 12.946 -29.118 21.864 1.00 0.63 H new ATOM 0 HE1 HIS A 6 11.826 -33.166 21.434 1.00 0.43 H new ATOM 86 N LEU A 7 13.151 -28.222 16.358 1.00 0.34 N ATOM 87 CA LEU A 7 13.574 -27.788 15.029 1.00 0.36 C ATOM 88 C LEU A 7 12.509 -26.903 14.391 1.00 0.35 C ATOM 89 O LEU A 7 11.341 -26.942 14.778 1.00 0.42 O ATOM 90 CB LEU A 7 13.847 -28.999 14.127 1.00 0.36 C ATOM 91 CG LEU A 7 12.841 -30.118 14.418 1.00 0.31 C ATOM 92 CD1 LEU A 7 13.068 -30.657 15.828 1.00 0.31 C ATOM 93 CD2 LEU A 7 11.414 -29.576 14.305 1.00 0.29 C ATOM 0 H LEU A 7 12.207 -28.606 16.400 1.00 0.34 H new ATOM 0 HA LEU A 7 14.494 -27.214 15.138 1.00 0.36 H new ATOM 0 HB2 LEU A 7 13.779 -28.703 13.080 1.00 0.36 H new ATOM 0 HB3 LEU A 7 14.862 -29.362 14.291 1.00 0.36 H new ATOM 0 HG LEU A 7 12.981 -30.920 13.694 1.00 0.31 H new ATOM 0 HD11 LEU A 7 12.352 -31.453 16.033 1.00 0.31 H new ATOM 0 HD12 LEU A 7 14.081 -31.051 15.908 1.00 0.31 H new ATOM 0 HD13 LEU A 7 12.934 -29.853 16.551 1.00 0.31 H new ATOM 0 HD21 LEU A 7 10.703 -30.376 14.513 1.00 0.29 H new ATOM 0 HD22 LEU A 7 11.273 -28.769 15.025 1.00 0.29 H new ATOM 0 HD23 LEU A 7 11.248 -29.196 13.297 1.00 0.29 H new ATOM 105 N LYS A 8 12.920 -26.104 13.411 1.00 0.30 N ATOM 106 CA LYS A 8 11.990 -25.212 12.727 1.00 0.29 C ATOM 107 C LYS A 8 12.127 -25.350 11.214 1.00 0.30 C ATOM 108 O LYS A 8 13.129 -25.865 10.716 1.00 0.38 O ATOM 109 CB LYS A 8 12.260 -23.761 13.133 1.00 0.28 C ATOM 110 CG LYS A 8 13.688 -23.377 12.739 1.00 0.44 C ATOM 111 CD LYS A 8 13.651 -22.423 11.543 1.00 0.45 C ATOM 112 CE LYS A 8 13.161 -21.046 12.001 1.00 0.40 C ATOM 113 NZ LYS A 8 13.847 -19.986 11.207 1.00 1.07 N ATOM 0 H LYS A 8 13.882 -26.056 13.075 1.00 0.30 H new ATOM 0 HA LYS A 8 10.976 -25.488 13.016 1.00 0.29 H new ATOM 0 HB2 LYS A 8 11.546 -23.097 12.645 1.00 0.28 H new ATOM 0 HB3 LYS A 8 12.124 -23.642 14.208 1.00 0.28 H new ATOM 0 HG2 LYS A 8 14.193 -22.902 13.580 1.00 0.44 H new ATOM 0 HG3 LYS A 8 14.259 -24.270 12.487 1.00 0.44 H new ATOM 0 HD2 LYS A 8 14.644 -22.339 11.101 1.00 0.45 H new ATOM 0 HD3 LYS A 8 12.991 -22.817 10.771 1.00 0.45 H new ATOM 0 HE2 LYS A 8 12.081 -20.971 11.872 1.00 0.40 H new ATOM 0 HE3 LYS A 8 13.365 -20.910 13.063 1.00 0.40 H new ATOM 0 HZ1 LYS A 8 13.515 -19.050 11.517 1.00 1.07 H new ATOM 0 HZ2 LYS A 8 14.875 -20.054 11.352 1.00 1.07 H new ATOM 0 HZ3 LYS A 8 13.630 -20.113 10.198 1.00 1.07 H new ATOM 127 N GLY A 9 11.114 -24.889 10.488 1.00 0.27 N ATOM 128 CA GLY A 9 11.131 -24.966 9.034 1.00 0.29 C ATOM 129 C GLY A 9 10.420 -26.223 8.548 1.00 0.33 C ATOM 130 O GLY A 9 9.675 -26.856 9.295 1.00 0.75 O ATOM 0 H GLY A 9 10.276 -24.461 10.881 1.00 0.27 H new ATOM 0 HA2 GLY A 9 10.648 -24.084 8.613 1.00 0.29 H new ATOM 0 HA3 GLY A 9 12.161 -24.965 8.678 1.00 0.29 H new ATOM 134 N ARG A 10 10.657 -26.575 7.291 1.00 0.29 N ATOM 135 CA ARG A 10 10.037 -27.759 6.708 1.00 0.24 C ATOM 136 C ARG A 10 10.298 -28.984 7.577 1.00 0.24 C ATOM 137 O ARG A 10 9.718 -30.048 7.360 1.00 0.47 O ATOM 138 CB ARG A 10 10.591 -28.001 5.303 1.00 0.27 C ATOM 139 CG ARG A 10 10.180 -26.849 4.385 1.00 0.31 C ATOM 140 CD ARG A 10 10.069 -27.356 2.946 1.00 0.22 C ATOM 141 NE ARG A 10 10.552 -26.344 2.015 1.00 0.17 N ATOM 142 CZ ARG A 10 9.721 -25.468 1.460 1.00 0.31 C ATOM 143 NH1 ARG A 10 8.448 -25.502 1.749 1.00 0.58 N ATOM 144 NH2 ARG A 10 10.176 -24.574 0.627 1.00 0.34 N ATOM 0 H ARG A 10 11.270 -26.061 6.658 1.00 0.29 H new ATOM 0 HA ARG A 10 8.962 -27.591 6.650 1.00 0.24 H new ATOM 0 HB2 ARG A 10 11.677 -28.082 5.338 1.00 0.27 H new ATOM 0 HB3 ARG A 10 10.214 -28.945 4.910 1.00 0.27 H new ATOM 0 HG2 ARG A 10 9.226 -26.434 4.710 1.00 0.31 H new ATOM 0 HG3 ARG A 10 10.914 -26.045 4.443 1.00 0.31 H new ATOM 0 HD2 ARG A 10 10.648 -28.272 2.830 1.00 0.22 H new ATOM 0 HD3 ARG A 10 9.032 -27.603 2.719 1.00 0.22 H new ATOM 0 HE ARG A 10 11.545 -26.307 1.785 1.00 0.17 H new ATOM 0 HH11 ARG A 10 8.091 -26.201 2.401 1.00 0.58 H new ATOM 0 HH12 ARG A 10 7.810 -24.830 1.323 1.00 0.58 H new ATOM 0 HH21 ARG A 10 11.170 -24.547 0.401 1.00 0.34 H new ATOM 0 HH22 ARG A 10 9.538 -23.902 0.201 1.00 0.34 H new ATOM 158 N GLU A 11 11.178 -28.827 8.561 1.00 0.20 N ATOM 159 CA GLU A 11 11.511 -29.928 9.457 1.00 0.25 C ATOM 160 C GLU A 11 10.281 -30.379 10.240 1.00 0.23 C ATOM 161 O GLU A 11 9.900 -31.548 10.194 1.00 0.33 O ATOM 162 CB GLU A 11 12.608 -29.494 10.432 1.00 0.28 C ATOM 163 CG GLU A 11 13.660 -30.600 10.545 1.00 0.52 C ATOM 164 CD GLU A 11 14.861 -30.098 11.340 1.00 0.42 C ATOM 165 OE1 GLU A 11 15.250 -28.961 11.132 1.00 0.51 O ATOM 166 OE2 GLU A 11 15.373 -30.858 12.144 1.00 0.58 O ATOM 0 H GLU A 11 11.670 -27.955 8.757 1.00 0.20 H new ATOM 0 HA GLU A 11 11.868 -30.764 8.855 1.00 0.25 H new ATOM 0 HB2 GLU A 11 13.072 -28.571 10.086 1.00 0.28 H new ATOM 0 HB3 GLU A 11 12.177 -29.286 11.411 1.00 0.28 H new ATOM 0 HG2 GLU A 11 13.230 -31.474 11.034 1.00 0.52 H new ATOM 0 HG3 GLU A 11 13.977 -30.915 9.551 1.00 0.52 H new ATOM 173 N ILE A 12 9.666 -29.445 10.959 1.00 0.18 N ATOM 174 CA ILE A 12 8.481 -29.762 11.749 1.00 0.22 C ATOM 175 C ILE A 12 7.252 -29.878 10.855 1.00 0.27 C ATOM 176 O ILE A 12 6.338 -30.653 11.138 1.00 0.37 O ATOM 177 CB ILE A 12 8.248 -28.675 12.800 1.00 0.21 C ATOM 178 CG1 ILE A 12 7.047 -29.057 13.668 1.00 0.29 C ATOM 179 CG2 ILE A 12 7.967 -27.342 12.103 1.00 0.20 C ATOM 180 CD1 ILE A 12 6.869 -28.021 14.779 1.00 0.34 C ATOM 0 H ILE A 12 9.965 -28.471 11.011 1.00 0.18 H new ATOM 0 HA ILE A 12 8.646 -30.719 12.244 1.00 0.22 H new ATOM 0 HB ILE A 12 9.135 -28.578 13.425 1.00 0.21 H new ATOM 0 HG12 ILE A 12 6.146 -29.109 13.057 1.00 0.29 H new ATOM 0 HG13 ILE A 12 7.197 -30.046 14.100 1.00 0.29 H new ATOM 0 HG21 ILE A 12 7.801 -26.568 12.852 1.00 0.20 H new ATOM 0 HG22 ILE A 12 8.820 -27.069 11.482 1.00 0.20 H new ATOM 0 HG23 ILE A 12 7.079 -27.438 11.478 1.00 0.20 H new ATOM 0 HD11 ILE A 12 6.013 -28.294 15.397 1.00 0.34 H new ATOM 0 HD12 ILE A 12 7.767 -27.991 15.396 1.00 0.34 H new ATOM 0 HD13 ILE A 12 6.699 -27.039 14.337 1.00 0.34 H new ATOM 192 N GLY A 13 7.236 -29.102 9.777 1.00 0.25 N ATOM 193 CA GLY A 13 6.111 -29.125 8.849 1.00 0.31 C ATOM 194 C GLY A 13 5.953 -30.501 8.213 1.00 0.27 C ATOM 195 O GLY A 13 4.907 -30.814 7.644 1.00 0.34 O ATOM 0 H GLY A 13 7.983 -28.454 9.525 1.00 0.25 H new ATOM 0 HA2 GLY A 13 5.195 -28.857 9.376 1.00 0.31 H new ATOM 0 HA3 GLY A 13 6.262 -28.376 8.071 1.00 0.31 H new ATOM 199 N MET A 14 6.996 -31.320 8.309 1.00 0.26 N ATOM 200 CA MET A 14 6.954 -32.658 7.732 1.00 0.34 C ATOM 201 C MET A 14 7.125 -33.723 8.812 1.00 0.33 C ATOM 202 O MET A 14 6.767 -34.885 8.612 1.00 0.46 O ATOM 203 CB MET A 14 8.062 -32.810 6.688 1.00 0.45 C ATOM 204 CG MET A 14 7.960 -31.677 5.666 1.00 0.49 C ATOM 205 SD MET A 14 6.619 -32.031 4.503 1.00 0.61 S ATOM 206 CE MET A 14 5.832 -30.402 4.559 1.00 0.61 C ATOM 0 H MET A 14 7.872 -31.084 8.776 1.00 0.26 H new ATOM 0 HA MET A 14 5.982 -32.794 7.259 1.00 0.34 H new ATOM 0 HB2 MET A 14 9.038 -32.790 7.173 1.00 0.45 H new ATOM 0 HB3 MET A 14 7.975 -33.774 6.187 1.00 0.45 H new ATOM 0 HG2 MET A 14 7.775 -30.731 6.174 1.00 0.49 H new ATOM 0 HG3 MET A 14 8.903 -31.571 5.129 1.00 0.49 H new ATOM 0 HE1 MET A 14 4.927 -30.456 5.164 1.00 0.61 H new ATOM 0 HE2 MET A 14 6.520 -29.680 4.999 1.00 0.61 H new ATOM 0 HE3 MET A 14 5.574 -30.087 3.548 1.00 0.61 H new ATOM 216 N TRP A 15 7.677 -33.326 9.954 1.00 0.25 N ATOM 217 CA TRP A 15 7.893 -34.264 11.050 1.00 0.31 C ATOM 218 C TRP A 15 6.737 -34.219 12.046 1.00 0.27 C ATOM 219 O TRP A 15 6.414 -35.225 12.677 1.00 0.50 O ATOM 220 CB TRP A 15 9.201 -33.934 11.771 1.00 0.36 C ATOM 221 CG TRP A 15 9.727 -35.163 12.439 1.00 0.42 C ATOM 222 CD1 TRP A 15 9.131 -35.802 13.473 1.00 0.49 C ATOM 223 CD2 TRP A 15 10.942 -35.911 12.143 1.00 0.45 C ATOM 224 NE1 TRP A 15 9.902 -36.894 13.829 1.00 0.56 N ATOM 225 CE2 TRP A 15 11.029 -37.004 13.039 1.00 0.54 C ATOM 226 CE3 TRP A 15 11.968 -35.750 11.194 1.00 0.43 C ATOM 227 CZ2 TRP A 15 12.094 -37.904 12.995 1.00 0.60 C ATOM 228 CZ3 TRP A 15 13.042 -36.655 11.146 1.00 0.49 C ATOM 229 CH2 TRP A 15 13.105 -37.728 12.045 1.00 0.57 C ATOM 0 H TRP A 15 7.980 -32.371 10.144 1.00 0.25 H new ATOM 0 HA TRP A 15 7.950 -35.268 10.629 1.00 0.31 H new ATOM 0 HB2 TRP A 15 9.934 -33.552 11.060 1.00 0.36 H new ATOM 0 HB3 TRP A 15 9.034 -33.150 12.509 1.00 0.36 H new ATOM 0 HD1 TRP A 15 8.205 -35.507 13.943 1.00 0.49 H new ATOM 0 HE1 TRP A 15 9.667 -37.539 14.583 1.00 0.56 H new ATOM 0 HE3 TRP A 15 11.930 -34.925 10.498 1.00 0.43 H new ATOM 0 HZ2 TRP A 15 12.137 -38.730 13.689 1.00 0.60 H new ATOM 0 HZ3 TRP A 15 13.823 -36.523 10.412 1.00 0.49 H new ATOM 0 HH2 TRP A 15 13.934 -38.419 12.004 1.00 0.57 H new ATOM 240 N TYR A 16 6.121 -33.051 12.189 1.00 0.18 N ATOM 241 CA TYR A 16 5.008 -32.901 13.121 1.00 0.21 C ATOM 242 C TYR A 16 3.779 -32.330 12.423 1.00 0.22 C ATOM 243 O TYR A 16 2.966 -31.646 13.045 1.00 0.28 O ATOM 244 CB TYR A 16 5.413 -31.983 14.275 1.00 0.24 C ATOM 245 CG TYR A 16 4.648 -32.372 15.518 1.00 0.36 C ATOM 246 CD1 TYR A 16 4.878 -33.614 16.122 1.00 0.44 C ATOM 247 CD2 TYR A 16 3.707 -31.492 16.066 1.00 0.55 C ATOM 248 CE1 TYR A 16 4.168 -33.976 17.272 1.00 0.62 C ATOM 249 CE2 TYR A 16 2.997 -31.854 17.217 1.00 0.73 C ATOM 250 CZ TYR A 16 3.228 -33.096 17.820 1.00 0.73 C ATOM 251 OH TYR A 16 2.527 -33.453 18.954 1.00 0.92 O ATOM 0 H TYR A 16 6.369 -32.203 11.679 1.00 0.18 H new ATOM 0 HA TYR A 16 4.757 -33.889 13.508 1.00 0.21 H new ATOM 0 HB2 TYR A 16 6.485 -32.059 14.456 1.00 0.24 H new ATOM 0 HB3 TYR A 16 5.206 -30.944 14.018 1.00 0.24 H new ATOM 0 HD1 TYR A 16 5.604 -34.293 15.700 1.00 0.44 H new ATOM 0 HD2 TYR A 16 3.529 -30.534 15.601 1.00 0.55 H new ATOM 0 HE1 TYR A 16 4.345 -34.935 17.737 1.00 0.62 H new ATOM 0 HE2 TYR A 16 2.271 -31.175 17.640 1.00 0.73 H new ATOM 0 HH TYR A 16 1.916 -32.728 19.203 1.00 0.92 H new ATOM 261 N ALA A 17 3.641 -32.617 11.133 1.00 0.20 N ATOM 262 CA ALA A 17 2.495 -32.125 10.377 1.00 0.23 C ATOM 263 C ALA A 17 1.233 -32.881 10.786 1.00 0.22 C ATOM 264 O ALA A 17 0.656 -33.628 9.995 1.00 0.22 O ATOM 265 CB ALA A 17 2.742 -32.290 8.875 1.00 0.27 C ATOM 0 H ALA A 17 4.299 -33.180 10.595 1.00 0.20 H new ATOM 0 HA ALA A 17 2.359 -31.066 10.596 1.00 0.23 H new ATOM 0 HB1 ALA A 17 1.879 -31.919 8.322 1.00 0.27 H new ATOM 0 HB2 ALA A 17 3.628 -31.724 8.588 1.00 0.27 H new ATOM 0 HB3 ALA A 17 2.895 -33.344 8.645 1.00 0.27 H new ATOM 271 N LYS A 18 0.815 -32.684 12.032 1.00 0.25 N ATOM 272 CA LYS A 18 -0.375 -33.352 12.545 1.00 0.27 C ATOM 273 C LYS A 18 -1.623 -32.847 11.827 1.00 0.32 C ATOM 274 O LYS A 18 -2.717 -33.381 12.013 1.00 0.42 O ATOM 275 CB LYS A 18 -0.508 -33.097 14.049 1.00 0.35 C ATOM 276 CG LYS A 18 -0.599 -34.431 14.794 1.00 0.32 C ATOM 277 CD LYS A 18 -1.991 -35.033 14.597 1.00 0.24 C ATOM 278 CE LYS A 18 -3.029 -34.163 15.309 1.00 0.21 C ATOM 279 NZ LYS A 18 -4.053 -35.036 15.950 1.00 0.31 N ATOM 0 H LYS A 18 1.280 -32.071 12.702 1.00 0.25 H new ATOM 0 HA LYS A 18 -0.276 -34.423 12.366 1.00 0.27 H new ATOM 0 HB2 LYS A 18 0.349 -32.527 14.408 1.00 0.35 H new ATOM 0 HB3 LYS A 18 -1.396 -32.497 14.249 1.00 0.35 H new ATOM 0 HG2 LYS A 18 0.162 -35.119 14.424 1.00 0.32 H new ATOM 0 HG3 LYS A 18 -0.403 -34.281 15.856 1.00 0.32 H new ATOM 0 HD2 LYS A 18 -2.223 -35.098 13.534 1.00 0.24 H new ATOM 0 HD3 LYS A 18 -2.019 -36.048 14.993 1.00 0.24 H new ATOM 0 HE2 LYS A 18 -2.544 -33.541 16.061 1.00 0.21 H new ATOM 0 HE3 LYS A 18 -3.505 -33.489 14.597 1.00 0.21 H new ATOM 0 HZ1 LYS A 18 -4.759 -34.445 16.434 1.00 0.31 H new ATOM 0 HZ2 LYS A 18 -4.523 -35.611 15.222 1.00 0.31 H new ATOM 0 HZ3 LYS A 18 -3.592 -35.662 16.641 1.00 0.31 H new ATOM 293 N LYS A 19 -1.452 -31.816 11.007 1.00 0.34 N ATOM 294 CA LYS A 19 -2.573 -31.250 10.266 1.00 0.38 C ATOM 295 C LYS A 19 -3.702 -30.863 11.216 1.00 0.45 C ATOM 296 O LYS A 19 -3.698 -29.773 11.788 1.00 0.83 O ATOM 297 CB LYS A 19 -3.087 -32.268 9.245 1.00 0.38 C ATOM 298 CG LYS A 19 -1.987 -32.568 8.227 1.00 0.34 C ATOM 299 CD LYS A 19 -2.449 -33.687 7.290 1.00 0.51 C ATOM 300 CE LYS A 19 -1.700 -33.581 5.960 1.00 0.40 C ATOM 301 NZ LYS A 19 -1.594 -34.932 5.339 1.00 0.47 N ATOM 0 H LYS A 19 -0.556 -31.358 10.839 1.00 0.34 H new ATOM 0 HA LYS A 19 -2.229 -30.355 9.747 1.00 0.38 H new ATOM 0 HB2 LYS A 19 -3.390 -33.185 9.750 1.00 0.38 H new ATOM 0 HB3 LYS A 19 -3.969 -31.877 8.738 1.00 0.38 H new ATOM 0 HG2 LYS A 19 -1.754 -31.671 7.653 1.00 0.34 H new ATOM 0 HG3 LYS A 19 -1.072 -32.864 8.741 1.00 0.34 H new ATOM 0 HD2 LYS A 19 -2.263 -34.659 7.748 1.00 0.51 H new ATOM 0 HD3 LYS A 19 -3.523 -33.614 7.121 1.00 0.51 H new ATOM 0 HE2 LYS A 19 -2.224 -32.901 5.289 1.00 0.40 H new ATOM 0 HE3 LYS A 19 -0.706 -33.165 6.123 1.00 0.40 H new ATOM 0 HZ1 LYS A 19 -1.085 -34.860 4.435 1.00 0.47 H new ATOM 0 HZ2 LYS A 19 -1.076 -35.568 5.978 1.00 0.47 H new ATOM 0 HZ3 LYS A 19 -2.547 -35.312 5.170 1.00 0.47 H new ATOM 315 N GLN A 20 -4.665 -31.764 11.380 1.00 0.33 N ATOM 316 CA GLN A 20 -5.797 -31.505 12.263 1.00 0.35 C ATOM 317 C GLN A 20 -5.992 -32.663 13.237 1.00 0.43 C ATOM 318 O GLN A 20 -6.618 -32.449 14.263 1.00 0.50 O ATOM 319 CB GLN A 20 -7.071 -31.309 11.438 1.00 0.33 C ATOM 320 CG GLN A 20 -7.275 -32.515 10.517 1.00 0.31 C ATOM 321 CD GLN A 20 -8.443 -33.359 11.015 1.00 0.26 C ATOM 322 OE1 GLN A 20 -8.421 -33.846 12.145 1.00 0.88 O ATOM 323 NE2 GLN A 20 -9.468 -33.564 10.233 1.00 0.45 N ATOM 324 OXT GLN A 20 -5.513 -33.745 12.944 1.00 0.51 O ATOM 0 H GLN A 20 -4.685 -32.673 10.917 1.00 0.33 H new ATOM 0 HA GLN A 20 -5.590 -30.598 12.831 1.00 0.35 H new ATOM 0 HB2 GLN A 20 -7.930 -31.193 12.099 1.00 0.33 H new ATOM 0 HB3 GLN A 20 -6.998 -30.396 10.848 1.00 0.33 H new ATOM 0 HG2 GLN A 20 -7.468 -32.177 9.499 1.00 0.31 H new ATOM 0 HG3 GLN A 20 -6.367 -33.117 10.486 1.00 0.31 H new ATOM 0 HE21 GLN A 20 -9.484 -33.159 9.297 1.00 0.45 H new ATOM 0 HE22 GLN A 20 -10.253 -34.129 10.558 1.00 0.45 H new TER 333 GLN A 20 ATOM 334 O5' DT B 1 18.010 -22.435 9.792 1.00 0.72 O ATOM 335 C5' DT B 1 19.146 -22.883 10.534 1.00 0.65 C ATOM 336 C4' DT B 1 19.993 -21.707 11.018 1.00 0.57 C ATOM 337 O4' DT B 1 21.118 -22.196 11.756 1.00 0.61 O ATOM 338 C3' DT B 1 20.538 -20.828 9.888 1.00 0.52 C ATOM 339 O3' DT B 1 20.280 -19.453 10.189 1.00 0.55 O ATOM 340 C2' DT B 1 22.041 -21.082 9.902 1.00 0.55 C ATOM 341 C1' DT B 1 22.268 -21.459 11.353 1.00 0.61 C ATOM 342 N1 DT B 1 23.453 -22.307 11.584 1.00 0.71 N ATOM 343 C2 DT B 1 24.419 -21.829 12.450 1.00 0.96 C ATOM 344 O2 DT B 1 24.314 -20.741 13.011 1.00 1.12 O ATOM 345 N3 DT B 1 25.515 -22.650 12.648 1.00 1.07 N ATOM 346 C4 DT B 1 25.723 -23.887 12.063 1.00 0.91 C ATOM 347 O4 DT B 1 26.738 -24.534 12.311 1.00 1.04 O ATOM 348 C5 DT B 1 24.661 -24.303 11.175 1.00 0.64 C ATOM 349 C7 DT B 1 24.760 -25.649 10.465 1.00 0.51 C ATOM 350 C6 DT B 1 23.582 -23.520 10.965 1.00 0.56 C ATOM 0 H5' DT B 1 19.754 -23.539 9.911 1.00 0.65 H new ATOM 0 H5'' DT B 1 18.815 -23.472 11.390 1.00 0.65 H new ATOM 0 H4' DT B 1 19.327 -21.098 11.629 1.00 0.57 H new ATOM 0 H3' DT B 1 20.084 -21.050 8.922 1.00 0.52 H new ATOM 0 H2' DT B 1 22.329 -21.882 9.220 1.00 0.55 H new ATOM 0 H2'' DT B 1 22.610 -20.198 9.614 1.00 0.55 H new ATOM 0 HO5' DT B 1 17.755 -21.538 10.094 1.00 0.72 H new ATOM 0 H1' DT B 1 22.436 -20.541 11.916 1.00 0.61 H new ATOM 0 H3 DT B 1 26.237 -22.312 13.284 1.00 1.07 H new ATOM 0 H71 DT B 1 23.759 -26.046 10.296 1.00 0.51 H new ATOM 0 H72 DT B 1 25.266 -25.519 9.508 1.00 0.51 H new ATOM 0 H73 DT B 1 25.326 -26.346 11.083 1.00 0.51 H new ATOM 0 H6 DT B 1 22.805 -23.858 10.295 1.00 0.56 H new ATOM 364 P DT B 2 18.780 -18.950 10.487 1.00 0.56 P ATOM 365 OP1 DT B 2 18.846 -17.546 10.950 1.00 0.74 O ATOM 366 OP2 DT B 2 18.107 -19.970 11.321 1.00 0.71 O ATOM 367 O5' DT B 2 18.105 -18.968 9.026 1.00 0.34 O ATOM 368 C5' DT B 2 16.695 -18.777 8.877 1.00 0.38 C ATOM 369 C4' DT B 2 16.311 -18.539 7.420 1.00 0.25 C ATOM 370 O4' DT B 2 16.982 -17.375 6.932 1.00 0.22 O ATOM 371 C3' DT B 2 16.674 -19.697 6.483 1.00 0.22 C ATOM 372 O3' DT B 2 15.512 -20.093 5.747 1.00 0.25 O ATOM 373 C2' DT B 2 17.711 -19.113 5.529 1.00 0.25 C ATOM 374 C1' DT B 2 17.391 -17.631 5.594 1.00 0.28 C ATOM 375 N1 DT B 2 18.532 -16.746 5.290 1.00 0.46 N ATOM 376 C2 DT B 2 18.369 -15.821 4.277 1.00 0.70 C ATOM 377 O2 DT B 2 17.321 -15.726 3.640 1.00 0.77 O ATOM 378 N3 DT B 2 19.456 -15.006 4.018 1.00 0.88 N ATOM 379 C4 DT B 2 20.672 -15.036 4.677 1.00 0.86 C ATOM 380 O4 DT B 2 21.574 -14.261 4.364 1.00 1.06 O ATOM 381 C5 DT B 2 20.750 -16.033 5.721 1.00 0.63 C ATOM 382 C7 DT B 2 22.036 -16.176 6.528 1.00 0.64 C ATOM 383 C6 DT B 2 19.705 -16.841 5.992 1.00 0.44 C ATOM 0 H5' DT B 2 16.377 -17.927 9.481 1.00 0.38 H new ATOM 0 H5'' DT B 2 16.167 -19.652 9.255 1.00 0.38 H new ATOM 0 H4' DT B 2 15.227 -18.429 7.417 1.00 0.25 H new ATOM 0 H3' DT B 2 17.048 -20.570 7.018 1.00 0.22 H new ATOM 0 H2' DT B 2 18.730 -19.326 5.852 1.00 0.25 H new ATOM 0 H2'' DT B 2 17.607 -19.510 4.519 1.00 0.25 H new ATOM 0 H1' DT B 2 16.633 -17.417 4.841 1.00 0.28 H new ATOM 0 H3 DT B 2 19.351 -14.319 3.272 1.00 0.88 H new ATOM 0 H71 DT B 2 21.798 -16.525 7.533 1.00 0.64 H new ATOM 0 H72 DT B 2 22.694 -16.895 6.040 1.00 0.64 H new ATOM 0 H73 DT B 2 22.537 -15.210 6.589 1.00 0.64 H new ATOM 0 H6 DT B 2 19.794 -17.577 6.777 1.00 0.44 H new ATOM 396 P DG B 3 14.605 -18.992 5.002 1.00 0.23 P ATOM 397 OP1 DG B 3 15.409 -18.387 3.916 1.00 0.21 O ATOM 398 OP2 DG B 3 13.988 -18.128 6.032 1.00 0.40 O ATOM 399 O5' DG B 3 13.444 -19.884 4.332 1.00 0.28 O ATOM 400 C5' DG B 3 13.711 -20.670 3.167 1.00 0.18 C ATOM 401 C4' DG B 3 12.435 -21.286 2.603 1.00 0.17 C ATOM 402 O4' DG B 3 11.846 -22.145 3.581 1.00 0.22 O ATOM 403 C3' DG B 3 11.374 -20.254 2.203 1.00 0.18 C ATOM 404 O3' DG B 3 10.952 -20.501 0.858 1.00 0.20 O ATOM 405 C2' DG B 3 10.213 -20.501 3.162 1.00 0.24 C ATOM 406 C1' DG B 3 10.437 -21.948 3.561 1.00 0.19 C ATOM 407 N9 DG B 3 9.917 -22.295 4.895 1.00 0.22 N ATOM 408 C8 DG B 3 10.299 -21.805 6.116 1.00 0.32 C ATOM 409 N7 DG B 3 9.646 -22.317 7.121 1.00 0.32 N ATOM 410 C5 DG B 3 8.764 -23.212 6.523 1.00 0.21 C ATOM 411 C6 DG B 3 7.793 -24.067 7.115 1.00 0.19 C ATOM 412 O6 DG B 3 7.519 -24.200 8.306 1.00 0.25 O ATOM 413 N1 DG B 3 7.116 -24.807 6.156 1.00 0.18 N ATOM 414 C2 DG B 3 7.341 -24.737 4.797 1.00 0.19 C ATOM 415 N2 DG B 3 6.589 -25.527 4.031 1.00 0.29 N ATOM 416 N3 DG B 3 8.252 -23.935 4.240 1.00 0.16 N ATOM 417 C4 DG B 3 8.923 -23.205 5.160 1.00 0.16 C ATOM 0 H5' DG B 3 14.419 -21.461 3.415 1.00 0.18 H new ATOM 0 H5'' DG B 3 14.182 -20.047 2.407 1.00 0.18 H new ATOM 0 H4' DG B 3 12.738 -21.824 1.705 1.00 0.17 H new ATOM 0 H3' DG B 3 11.744 -19.230 2.254 1.00 0.18 H new ATOM 0 H2' DG B 3 10.244 -19.831 4.021 1.00 0.24 H new ATOM 0 H2'' DG B 3 9.247 -20.356 2.679 1.00 0.24 H new ATOM 0 H1' DG B 3 9.905 -22.577 2.848 1.00 0.19 H new ATOM 0 H8 DG B 3 11.072 -21.061 6.235 1.00 0.32 H new ATOM 0 H1 DG B 3 6.396 -25.453 6.481 1.00 0.18 H new ATOM 0 H21 DG B 3 6.709 -25.520 3.018 1.00 0.29 H new ATOM 0 H22 DG B 3 5.893 -26.139 4.458 1.00 0.29 H new ATOM 429 P DG B 4 9.823 -19.579 0.174 1.00 0.25 P ATOM 430 OP1 DG B 4 10.047 -19.581 -1.289 1.00 0.31 O ATOM 431 OP2 DG B 4 9.767 -18.296 0.909 1.00 0.33 O ATOM 432 O5' DG B 4 8.469 -20.394 0.478 1.00 0.25 O ATOM 433 C5' DG B 4 8.169 -21.595 -0.240 1.00 0.20 C ATOM 434 C4' DG B 4 6.769 -22.109 0.082 1.00 0.21 C ATOM 435 O4' DG B 4 6.675 -22.412 1.472 1.00 0.26 O ATOM 436 C3' DG B 4 5.652 -21.106 -0.235 1.00 0.23 C ATOM 437 O3' DG B 4 4.801 -21.652 -1.249 1.00 0.28 O ATOM 438 C2' DG B 4 4.870 -20.955 1.072 1.00 0.26 C ATOM 439 C1' DG B 4 5.339 -22.155 1.880 1.00 0.28 C ATOM 440 N9 DG B 4 5.349 -21.938 3.338 1.00 0.32 N ATOM 441 C8 DG B 4 6.132 -21.084 4.071 1.00 0.39 C ATOM 442 N7 DG B 4 5.905 -21.127 5.353 1.00 0.41 N ATOM 443 C5 DG B 4 4.899 -22.077 5.485 1.00 0.34 C ATOM 444 C6 DG B 4 4.241 -22.548 6.652 1.00 0.32 C ATOM 445 O6 DG B 4 4.429 -22.210 7.820 1.00 0.36 O ATOM 446 N1 DG B 4 3.285 -23.508 6.346 1.00 0.23 N ATOM 447 C2 DG B 4 2.996 -23.958 5.073 1.00 0.19 C ATOM 448 N2 DG B 4 2.044 -24.885 4.975 1.00 0.15 N ATOM 449 N3 DG B 4 3.616 -23.515 3.975 1.00 0.21 N ATOM 450 C4 DG B 4 4.550 -22.579 4.255 1.00 0.28 C ATOM 0 H5' DG B 4 8.904 -22.361 0.008 1.00 0.20 H new ATOM 0 H5'' DG B 4 8.251 -21.409 -1.311 1.00 0.20 H new ATOM 0 H4' DG B 4 6.629 -22.988 -0.547 1.00 0.21 H new ATOM 0 H3' DG B 4 6.037 -20.151 -0.594 1.00 0.23 H new ATOM 0 H2' DG B 4 5.097 -20.015 1.574 1.00 0.26 H new ATOM 0 H2'' DG B 4 3.793 -20.975 0.905 1.00 0.26 H new ATOM 0 H1' DG B 4 4.645 -22.975 1.695 1.00 0.28 H new ATOM 0 H8 DG B 4 6.871 -20.434 3.626 1.00 0.39 H new ATOM 0 H1 DG B 4 2.757 -23.911 7.120 1.00 0.23 H new ATOM 0 H21 DG B 4 1.786 -25.256 4.061 1.00 0.15 H new ATOM 0 H22 DG B 4 1.573 -25.223 5.814 1.00 0.15 H new ATOM 462 P DG B 5 3.496 -20.847 -1.739 1.00 0.31 P ATOM 463 OP1 DG B 5 3.205 -21.240 -3.137 1.00 0.39 O ATOM 464 OP2 DG B 5 3.676 -19.418 -1.398 1.00 0.31 O ATOM 465 O5' DG B 5 2.337 -21.447 -0.796 1.00 0.29 O ATOM 466 C5' DG B 5 1.910 -22.804 -0.947 1.00 0.31 C ATOM 467 C4' DG B 5 0.702 -23.113 -0.068 1.00 0.23 C ATOM 468 O4' DG B 5 1.040 -22.884 1.300 1.00 0.22 O ATOM 469 C3' DG B 5 -0.528 -22.253 -0.383 1.00 0.19 C ATOM 470 O3' DG B 5 -1.628 -23.098 -0.747 1.00 0.24 O ATOM 471 C2' DG B 5 -0.845 -21.519 0.919 1.00 0.16 C ATOM 472 C1' DG B 5 -0.101 -22.346 1.956 1.00 0.15 C ATOM 473 N9 DG B 5 0.377 -21.572 3.118 1.00 0.15 N ATOM 474 C8 DG B 5 1.320 -20.578 3.152 1.00 0.18 C ATOM 475 N7 DG B 5 1.536 -20.097 4.344 1.00 0.20 N ATOM 476 C5 DG B 5 0.678 -20.823 5.161 1.00 0.20 C ATOM 477 C6 DG B 5 0.471 -20.741 6.564 1.00 0.25 C ATOM 478 O6 DG B 5 1.023 -19.996 7.373 1.00 0.28 O ATOM 479 N1 DG B 5 -0.486 -21.651 6.992 1.00 0.28 N ATOM 480 C2 DG B 5 -1.163 -22.531 6.173 1.00 0.26 C ATOM 481 N2 DG B 5 -2.049 -23.329 6.767 1.00 0.31 N ATOM 482 N3 DG B 5 -0.969 -22.611 4.852 1.00 0.21 N ATOM 483 C4 DG B 5 -0.038 -21.729 4.418 1.00 0.18 C ATOM 0 H5' DG B 5 2.730 -23.475 -0.689 1.00 0.31 H new ATOM 0 H5'' DG B 5 1.659 -22.993 -1.991 1.00 0.31 H new ATOM 0 H4' DG B 5 0.447 -24.154 -0.267 1.00 0.23 H new ATOM 0 H3' DG B 5 -0.351 -21.565 -1.209 1.00 0.19 H new ATOM 0 H2' DG B 5 -0.496 -20.487 0.898 1.00 0.16 H new ATOM 0 H2'' DG B 5 -1.916 -21.489 1.117 1.00 0.16 H new ATOM 0 H1' DG B 5 -0.793 -23.095 2.342 1.00 0.15 H new ATOM 0 H8 DG B 5 1.837 -20.226 2.272 1.00 0.18 H new ATOM 0 H1 DG B 5 -0.705 -21.671 7.988 1.00 0.28 H new ATOM 0 H21 DG B 5 -2.581 -24.001 6.214 1.00 0.31 H new ATOM 0 H22 DG B 5 -2.195 -23.268 7.775 1.00 0.31 H new ATOM 495 P DT B 6 -2.034 -24.374 0.150 1.00 0.23 P ATOM 496 OP1 DT B 6 -3.448 -24.221 0.560 1.00 0.35 O ATOM 497 OP2 DT B 6 -0.986 -24.575 1.174 1.00 0.27 O ATOM 498 O5' DT B 6 -1.945 -25.587 -0.906 1.00 0.23 O ATOM 499 C5' DT B 6 -2.252 -26.925 -0.505 1.00 0.31 C ATOM 500 C4' DT B 6 -2.016 -27.921 -1.639 1.00 0.30 C ATOM 501 O4' DT B 6 -2.854 -27.590 -2.752 1.00 0.35 O ATOM 502 C3' DT B 6 -0.571 -27.947 -2.152 1.00 0.21 C ATOM 503 O3' DT B 6 -0.120 -29.302 -2.233 1.00 0.21 O ATOM 504 C2' DT B 6 -0.659 -27.352 -3.551 1.00 0.26 C ATOM 505 C1' DT B 6 -2.078 -27.716 -3.940 1.00 0.27 C ATOM 506 N1 DT B 6 -2.675 -26.843 -4.970 1.00 0.42 N ATOM 507 C2 DT B 6 -3.097 -27.439 -6.142 1.00 0.45 C ATOM 508 O2 DT B 6 -2.987 -28.648 -6.338 1.00 0.38 O ATOM 509 N3 DT B 6 -3.654 -26.595 -7.086 1.00 0.65 N ATOM 510 C4 DT B 6 -3.820 -25.227 -6.959 1.00 0.80 C ATOM 511 O4 DT B 6 -4.329 -24.571 -7.864 1.00 0.98 O ATOM 512 C5 DT B 6 -3.349 -24.693 -5.700 1.00 0.77 C ATOM 513 C7 DT B 6 -3.473 -23.197 -5.427 1.00 0.97 C ATOM 514 C6 DT B 6 -2.802 -25.495 -4.765 1.00 0.60 C ATOM 0 H5' DT B 6 -3.292 -26.979 -0.183 1.00 0.31 H new ATOM 0 H5'' DT B 6 -1.638 -27.198 0.353 1.00 0.31 H new ATOM 0 H4' DT B 6 -2.245 -28.901 -1.221 1.00 0.30 H new ATOM 0 H3' DT B 6 0.119 -27.403 -1.506 1.00 0.21 H new ATOM 0 H2' DT B 6 -0.497 -26.274 -3.550 1.00 0.26 H new ATOM 0 H2'' DT B 6 0.077 -27.785 -4.229 1.00 0.26 H new ATOM 0 H1' DT B 6 -2.064 -28.718 -4.368 1.00 0.27 H new ATOM 0 H3 DT B 6 -3.972 -27.021 -7.957 1.00 0.65 H new ATOM 0 H71 DT B 6 -3.594 -23.031 -4.356 1.00 0.97 H new ATOM 0 H72 DT B 6 -2.574 -22.688 -5.774 1.00 0.97 H new ATOM 0 H73 DT B 6 -4.340 -22.801 -5.955 1.00 0.97 H new ATOM 0 H6 DT B 6 -2.457 -25.066 -3.836 1.00 0.60 H new ATOM 527 P DG B 7 1.242 -29.758 -1.505 1.00 0.18 P ATOM 528 OP1 DG B 7 2.215 -28.648 -1.599 1.00 0.28 O ATOM 529 OP2 DG B 7 1.607 -31.103 -2.006 1.00 0.32 O ATOM 530 O5' DG B 7 0.787 -29.901 0.033 1.00 0.23 O ATOM 531 C5' DG B 7 1.733 -29.733 1.091 1.00 0.22 C ATOM 532 C4' DG B 7 1.102 -30.000 2.454 1.00 0.17 C ATOM 533 O4' DG B 7 2.072 -29.775 3.483 1.00 0.24 O ATOM 534 C3' DG B 7 -0.104 -29.109 2.759 1.00 0.14 C ATOM 535 O3' DG B 7 -1.162 -29.908 3.306 1.00 0.17 O ATOM 536 C2' DG B 7 0.409 -28.131 3.807 1.00 0.19 C ATOM 537 C1' DG B 7 1.485 -28.955 4.492 1.00 0.14 C ATOM 538 N9 DG B 7 2.565 -28.154 5.100 1.00 0.19 N ATOM 539 C8 DG B 7 3.577 -27.471 4.479 1.00 0.28 C ATOM 540 N7 DG B 7 4.381 -26.858 5.301 1.00 0.31 N ATOM 541 C5 DG B 7 3.868 -27.155 6.558 1.00 0.23 C ATOM 542 C6 DG B 7 4.327 -26.763 7.845 1.00 0.23 C ATOM 543 O6 DG B 7 5.296 -26.060 8.128 1.00 0.30 O ATOM 544 N1 DG B 7 3.523 -27.279 8.852 1.00 0.16 N ATOM 545 C2 DG B 7 2.415 -28.074 8.649 1.00 0.13 C ATOM 546 N2 DG B 7 1.766 -28.475 9.744 1.00 0.15 N ATOM 547 N3 DG B 7 1.982 -28.445 7.440 1.00 0.12 N ATOM 548 C4 DG B 7 2.754 -27.950 6.446 1.00 0.16 C ATOM 0 H5' DG B 7 2.132 -28.719 1.066 1.00 0.22 H new ATOM 0 H5'' DG B 7 2.574 -30.410 0.939 1.00 0.22 H new ATOM 0 H4' DG B 7 0.759 -31.034 2.426 1.00 0.17 H new ATOM 0 H3' DG B 7 -0.497 -28.605 1.876 1.00 0.14 H new ATOM 0 H2' DG B 7 0.812 -27.223 3.358 1.00 0.19 H new ATOM 0 H2'' DG B 7 -0.375 -27.824 4.499 1.00 0.19 H new ATOM 0 H1' DG B 7 1.013 -29.510 5.303 1.00 0.14 H new ATOM 0 H8 DG B 7 3.698 -27.443 3.406 1.00 0.28 H new ATOM 0 H1 DG B 7 3.771 -27.053 9.815 1.00 0.16 H new ATOM 0 H21 DG B 7 0.938 -29.065 9.659 1.00 0.15 H new ATOM 0 H22 DG B 7 2.098 -28.191 10.666 1.00 0.15 H new ATOM 560 P DG B 8 -2.662 -29.326 3.396 1.00 0.27 P ATOM 561 OP1 DG B 8 -3.606 -30.447 3.195 1.00 0.41 O ATOM 562 OP2 DG B 8 -2.744 -28.129 2.529 1.00 0.30 O ATOM 563 O5' DG B 8 -2.769 -28.845 4.929 1.00 0.27 O ATOM 564 C5' DG B 8 -3.301 -29.719 5.929 1.00 0.31 C ATOM 565 C4' DG B 8 -3.286 -29.069 7.311 1.00 0.28 C ATOM 566 O4' DG B 8 -1.970 -28.625 7.620 1.00 0.27 O ATOM 567 C3' DG B 8 -4.206 -27.851 7.433 1.00 0.24 C ATOM 568 O3' DG B 8 -5.293 -28.169 8.309 1.00 0.22 O ATOM 569 C2' DG B 8 -3.339 -26.754 8.059 1.00 0.25 C ATOM 570 C1' DG B 8 -2.088 -27.508 8.491 1.00 0.25 C ATOM 571 N9 DG B 8 -0.845 -26.721 8.384 1.00 0.26 N ATOM 572 C8 DG B 8 -0.048 -26.532 7.286 1.00 0.27 C ATOM 573 N7 DG B 8 0.982 -25.766 7.505 1.00 0.32 N ATOM 574 C5 DG B 8 0.864 -25.420 8.846 1.00 0.30 C ATOM 575 C6 DG B 8 1.700 -24.599 9.648 1.00 0.33 C ATOM 576 O6 DG B 8 2.724 -24.001 9.319 1.00 0.39 O ATOM 577 N1 DG B 8 1.226 -24.508 10.950 1.00 0.32 N ATOM 578 C2 DG B 8 0.088 -25.130 11.422 1.00 0.31 C ATOM 579 N2 DG B 8 -0.207 -24.927 12.706 1.00 0.35 N ATOM 580 N3 DG B 8 -0.701 -25.903 10.667 1.00 0.29 N ATOM 581 C4 DG B 8 -0.252 -26.002 9.394 1.00 0.27 C ATOM 0 H5' DG B 8 -2.720 -30.641 5.954 1.00 0.31 H new ATOM 0 H5'' DG B 8 -4.323 -29.993 5.667 1.00 0.31 H new ATOM 0 H4' DG B 8 -3.641 -29.838 7.997 1.00 0.28 H new ATOM 0 H3' DG B 8 -4.622 -27.544 6.473 1.00 0.24 H new ATOM 0 H2' DG B 8 -3.107 -25.965 7.343 1.00 0.25 H new ATOM 0 H2'' DG B 8 -3.837 -26.280 8.905 1.00 0.25 H new ATOM 0 H1' DG B 8 -2.201 -27.771 9.543 1.00 0.25 H new ATOM 0 H8 DG B 8 -0.255 -26.978 6.325 1.00 0.27 H new ATOM 0 H1 DG B 8 1.759 -23.938 11.607 1.00 0.32 H new ATOM 0 H21 DG B 8 -1.036 -25.360 13.113 1.00 0.35 H new ATOM 0 H22 DG B 8 0.396 -24.339 13.281 1.00 0.35 H new ATOM 593 P DG B 9 -6.436 -27.080 8.621 1.00 0.25 P ATOM 594 OP1 DG B 9 -7.652 -27.798 9.066 1.00 0.37 O ATOM 595 OP2 DG B 9 -6.509 -26.144 7.478 1.00 0.35 O ATOM 596 O5' DG B 9 -5.830 -26.287 9.884 1.00 0.17 O ATOM 597 C5' DG B 9 -5.682 -26.941 11.147 1.00 0.22 C ATOM 598 C4' DG B 9 -5.284 -25.956 12.242 1.00 0.24 C ATOM 599 O4' DG B 9 -4.042 -25.336 11.899 1.00 0.26 O ATOM 600 C3' DG B 9 -6.306 -24.838 12.467 1.00 0.22 C ATOM 601 O3' DG B 9 -6.656 -24.786 13.855 1.00 0.27 O ATOM 602 C2' DG B 9 -5.579 -23.557 12.067 1.00 0.26 C ATOM 603 C1' DG B 9 -4.122 -23.954 12.230 1.00 0.22 C ATOM 604 N9 DG B 9 -3.194 -23.228 11.341 1.00 0.21 N ATOM 605 C8 DG B 9 -3.145 -23.223 9.968 1.00 0.24 C ATOM 606 N7 DG B 9 -2.193 -22.481 9.477 1.00 0.33 N ATOM 607 C5 DG B 9 -1.564 -21.954 10.599 1.00 0.31 C ATOM 608 C6 DG B 9 -0.452 -21.072 10.687 1.00 0.39 C ATOM 609 O6 DG B 9 0.203 -20.577 9.772 1.00 0.51 O ATOM 610 N1 DG B 9 -0.135 -20.786 12.008 1.00 0.35 N ATOM 611 C2 DG B 9 -0.800 -21.286 13.108 1.00 0.27 C ATOM 612 N2 DG B 9 -0.349 -20.896 14.301 1.00 0.28 N ATOM 613 N3 DG B 9 -1.845 -22.115 13.026 1.00 0.24 N ATOM 614 C4 DG B 9 -2.169 -22.405 11.745 1.00 0.24 C ATOM 0 H5' DG B 9 -4.927 -27.723 11.067 1.00 0.22 H new ATOM 0 H5'' DG B 9 -6.618 -27.429 11.417 1.00 0.22 H new ATOM 0 H4' DG B 9 -5.217 -26.542 13.159 1.00 0.24 H new ATOM 0 H3' DG B 9 -7.223 -24.986 11.896 1.00 0.22 H new ATOM 0 H2' DG B 9 -5.809 -23.261 11.044 1.00 0.26 H new ATOM 0 H2'' DG B 9 -5.847 -22.718 12.710 1.00 0.26 H new ATOM 0 H1' DG B 9 -3.825 -23.718 13.252 1.00 0.22 H new ATOM 0 H8 DG B 9 -3.833 -23.783 9.352 1.00 0.24 H new ATOM 0 H1 DG B 9 0.650 -20.158 12.178 1.00 0.35 H new ATOM 0 H21 DG B 9 -0.800 -21.232 15.152 1.00 0.28 H new ATOM 0 H22 DG B 9 0.447 -20.261 14.363 1.00 0.28 H new ATOM 626 P DT B 10 -7.421 -26.023 14.550 1.00 0.37 P ATOM 627 OP1 DT B 10 -8.333 -26.623 13.551 1.00 0.59 O ATOM 628 OP2 DT B 10 -7.951 -25.566 15.853 1.00 0.44 O ATOM 629 O5' DT B 10 -6.225 -27.065 14.829 1.00 0.36 O ATOM 630 C5' DT B 10 -5.416 -26.941 16.002 1.00 0.29 C ATOM 631 C4' DT B 10 -6.040 -27.658 17.196 1.00 0.20 C ATOM 632 O4' DT B 10 -7.376 -27.195 17.393 1.00 0.19 O ATOM 633 C3' DT B 10 -6.115 -29.183 17.042 1.00 0.22 C ATOM 634 O3' DT B 10 -5.319 -29.801 18.057 1.00 0.28 O ATOM 635 C2' DT B 10 -7.589 -29.533 17.258 1.00 0.25 C ATOM 636 C1' DT B 10 -8.126 -28.278 17.925 1.00 0.16 C ATOM 637 N1 DT B 10 -9.556 -28.016 17.664 1.00 0.18 N ATOM 638 C2 DT B 10 -10.385 -27.869 18.760 1.00 0.30 C ATOM 639 O2 DT B 10 -9.967 -27.948 19.913 1.00 0.54 O ATOM 640 N3 DT B 10 -11.718 -27.630 18.483 1.00 0.27 N ATOM 641 C4 DT B 10 -12.284 -27.525 17.224 1.00 0.34 C ATOM 642 O4 DT B 10 -13.487 -27.311 17.093 1.00 0.43 O ATOM 643 C5 DT B 10 -11.340 -27.690 16.141 1.00 0.50 C ATOM 644 C7 DT B 10 -11.828 -27.601 14.698 1.00 0.86 C ATOM 645 C6 DT B 10 -10.035 -27.925 16.385 1.00 0.40 C ATOM 0 H5' DT B 10 -5.281 -25.886 16.241 1.00 0.29 H new ATOM 0 H5'' DT B 10 -4.426 -27.353 15.807 1.00 0.29 H new ATOM 0 H4' DT B 10 -5.388 -27.432 18.040 1.00 0.20 H new ATOM 0 H3' DT B 10 -5.750 -29.522 16.073 1.00 0.22 H new ATOM 0 H2' DT B 10 -8.099 -29.744 16.318 1.00 0.25 H new ATOM 0 H2'' DT B 10 -7.710 -30.413 17.890 1.00 0.25 H new ATOM 0 H1' DT B 10 -8.031 -28.402 19.004 1.00 0.16 H new ATOM 0 H3 DT B 10 -12.343 -27.521 19.281 1.00 0.27 H new ATOM 0 H71 DT B 10 -11.026 -27.220 14.066 1.00 0.86 H new ATOM 0 H72 DT B 10 -12.123 -28.592 14.352 1.00 0.86 H new ATOM 0 H73 DT B 10 -12.684 -26.928 14.644 1.00 0.86 H new ATOM 0 H6 DT B 10 -9.354 -28.044 15.555 1.00 0.40 H new ATOM 658 P DG B 11 -3.833 -30.323 17.724 1.00 0.46 P ATOM 659 OP1 DG B 11 -3.934 -31.385 16.698 1.00 0.77 O ATOM 660 OP2 DG B 11 -3.139 -30.594 19.003 1.00 0.86 O ATOM 661 O5' DG B 11 -3.153 -29.030 17.046 1.00 0.26 O ATOM 662 C5' DG B 11 -2.058 -29.179 16.138 1.00 0.28 C ATOM 663 C4' DG B 11 -0.751 -28.684 16.749 1.00 0.24 C ATOM 664 O4' DG B 11 0.304 -28.841 15.801 1.00 0.28 O ATOM 665 C3' DG B 11 -0.780 -27.208 17.158 1.00 0.23 C ATOM 666 O3' DG B 11 -0.486 -27.094 18.555 1.00 0.29 O ATOM 667 C2' DG B 11 0.331 -26.549 16.341 1.00 0.21 C ATOM 668 C1' DG B 11 1.187 -27.736 15.934 1.00 0.23 C ATOM 669 N9 DG B 11 1.884 -27.564 14.646 1.00 0.22 N ATOM 670 C8 DG B 11 1.573 -28.106 13.426 1.00 0.24 C ATOM 671 N7 DG B 11 2.387 -27.757 12.470 1.00 0.23 N ATOM 672 C5 DG B 11 3.307 -26.925 13.100 1.00 0.20 C ATOM 673 C6 DG B 11 4.432 -26.242 12.563 1.00 0.22 C ATOM 674 O6 DG B 11 4.841 -26.239 11.404 1.00 0.24 O ATOM 675 N1 DG B 11 5.094 -25.508 13.539 1.00 0.25 N ATOM 676 C2 DG B 11 4.722 -25.438 14.866 1.00 0.27 C ATOM 677 N2 DG B 11 5.483 -24.679 15.654 1.00 0.34 N ATOM 678 N3 DG B 11 3.664 -26.080 15.372 1.00 0.25 N ATOM 679 C4 DG B 11 3.007 -26.801 14.434 1.00 0.21 C ATOM 0 H5' DG B 11 -2.265 -28.625 15.223 1.00 0.28 H new ATOM 0 H5'' DG B 11 -1.956 -30.228 15.859 1.00 0.28 H new ATOM 0 H4' DG B 11 -0.597 -29.280 17.648 1.00 0.24 H new ATOM 0 H3' DG B 11 -1.751 -26.746 16.980 1.00 0.23 H new ATOM 0 H2' DG B 11 -0.063 -26.017 15.475 1.00 0.21 H new ATOM 0 H2'' DG B 11 0.894 -25.826 16.931 1.00 0.21 H new ATOM 0 H1' DG B 11 1.959 -27.866 16.692 1.00 0.23 H new ATOM 0 H8 DG B 11 0.730 -28.763 13.271 1.00 0.24 H new ATOM 0 H1 DG B 11 5.919 -24.980 13.253 1.00 0.25 H new ATOM 0 H21 DG B 11 5.259 -24.588 16.645 1.00 0.34 H new ATOM 0 H22 DG B 11 6.290 -24.190 15.266 1.00 0.34 H new ATOM 691 P DG B 12 -1.012 -25.825 19.396 1.00 0.32 P ATOM 692 OP1 DG B 12 -0.848 -26.122 20.836 1.00 0.41 O ATOM 693 OP2 DG B 12 -2.342 -25.441 18.870 1.00 0.38 O ATOM 694 O5' DG B 12 0.039 -24.672 18.996 1.00 0.36 O ATOM 695 C5' DG B 12 1.214 -24.457 19.781 1.00 0.39 C ATOM 696 C4' DG B 12 1.996 -23.239 19.299 1.00 0.41 C ATOM 697 O4' DG B 12 2.444 -23.454 17.963 1.00 0.38 O ATOM 698 C3' DG B 12 1.183 -21.941 19.295 1.00 0.44 C ATOM 699 O3' DG B 12 1.746 -21.028 20.243 1.00 0.54 O ATOM 700 C2' DG B 12 1.335 -21.379 17.878 1.00 0.41 C ATOM 701 C1' DG B 12 2.497 -22.187 17.321 1.00 0.38 C ATOM 702 N9 DG B 12 2.434 -22.419 15.863 1.00 0.32 N ATOM 703 C8 DG B 12 1.526 -23.160 15.148 1.00 0.34 C ATOM 704 N7 DG B 12 1.752 -23.177 13.865 1.00 0.30 N ATOM 705 C5 DG B 12 2.890 -22.392 13.713 1.00 0.26 C ATOM 706 C6 DG B 12 3.605 -22.046 12.533 1.00 0.26 C ATOM 707 O6 DG B 12 3.369 -22.375 11.373 1.00 0.28 O ATOM 708 N1 DG B 12 4.695 -21.234 12.818 1.00 0.27 N ATOM 709 C2 DG B 12 5.054 -20.806 14.080 1.00 0.27 C ATOM 710 N2 DG B 12 6.133 -20.028 14.157 1.00 0.30 N ATOM 711 N3 DG B 12 4.382 -21.130 15.191 1.00 0.26 N ATOM 712 C4 DG B 12 3.316 -21.922 14.931 1.00 0.26 C ATOM 0 H5' DG B 12 1.850 -25.341 19.734 1.00 0.39 H new ATOM 0 H5'' DG B 12 0.934 -24.321 20.826 1.00 0.39 H new ATOM 0 H4' DG B 12 2.820 -23.124 20.004 1.00 0.41 H new ATOM 0 H3' DG B 12 0.138 -22.101 19.561 1.00 0.44 H new ATOM 0 H2' DG B 12 0.428 -21.515 17.289 1.00 0.41 H new ATOM 0 H2'' DG B 12 1.552 -20.311 17.887 1.00 0.41 H new ATOM 0 H1' DG B 12 3.413 -21.626 17.504 1.00 0.38 H new ATOM 0 H8 DG B 12 0.699 -23.682 15.607 1.00 0.34 H new ATOM 0 H1 DG B 12 5.274 -20.931 12.035 1.00 0.27 H new ATOM 0 H21 DG B 12 6.447 -19.680 15.063 1.00 0.30 H new ATOM 0 H22 DG B 12 6.644 -19.780 13.310 1.00 0.30 H new ATOM 724 P DG B 13 1.107 -19.565 20.450 1.00 0.64 P ATOM 725 OP1 DG B 13 1.373 -19.133 21.840 1.00 0.80 O ATOM 726 OP2 DG B 13 -0.283 -19.590 19.938 1.00 0.73 O ATOM 727 O5' DG B 13 1.990 -18.653 19.460 1.00 0.50 O ATOM 728 C5' DG B 13 3.371 -18.409 19.743 1.00 0.41 C ATOM 729 C4' DG B 13 4.017 -17.541 18.669 1.00 0.25 C ATOM 730 O4' DG B 13 3.859 -18.161 17.394 1.00 0.25 O ATOM 731 C3' DG B 13 3.418 -16.133 18.561 1.00 0.25 C ATOM 732 O3' DG B 13 4.435 -15.159 18.828 1.00 0.19 O ATOM 733 C2' DG B 13 2.951 -16.011 17.110 1.00 0.29 C ATOM 734 C1' DG B 13 3.721 -17.128 16.428 1.00 0.23 C ATOM 735 N9 DG B 13 3.050 -17.700 15.247 1.00 0.29 N ATOM 736 C8 DG B 13 1.897 -18.438 15.187 1.00 0.42 C ATOM 737 N7 DG B 13 1.571 -18.811 13.981 1.00 0.46 N ATOM 738 C5 DG B 13 2.579 -18.283 13.183 1.00 0.36 C ATOM 739 C6 DG B 13 2.762 -18.361 11.775 1.00 0.36 C ATOM 740 O6 DG B 13 2.053 -18.928 10.946 1.00 0.45 O ATOM 741 N1 DG B 13 3.910 -17.690 11.373 1.00 0.25 N ATOM 742 C2 DG B 13 4.774 -17.025 12.219 1.00 0.19 C ATOM 743 N2 DG B 13 5.827 -16.436 11.651 1.00 0.20 N ATOM 744 N3 DG B 13 4.603 -16.952 13.541 1.00 0.18 N ATOM 745 C4 DG B 13 3.490 -17.601 13.950 1.00 0.26 C ATOM 0 H5' DG B 13 3.902 -19.358 19.813 1.00 0.41 H new ATOM 0 H5'' DG B 13 3.464 -17.919 20.712 1.00 0.41 H new ATOM 0 H4' DG B 13 5.062 -17.444 18.962 1.00 0.25 H new ATOM 0 H3' DG B 13 2.605 -15.971 19.269 1.00 0.25 H new ATOM 0 H2' DG B 13 1.873 -16.144 17.017 1.00 0.29 H new ATOM 0 H2'' DG B 13 3.189 -15.035 16.687 1.00 0.29 H new ATOM 0 H1' DG B 13 4.664 -16.714 16.071 1.00 0.23 H new ATOM 0 H8 DG B 13 1.312 -18.688 16.059 1.00 0.42 H new ATOM 0 H1 DG B 13 4.131 -17.689 10.377 1.00 0.25 H new ATOM 0 H21 DG B 13 6.500 -15.930 12.226 1.00 0.20 H new ATOM 0 H22 DG B 13 5.959 -16.492 10.641 1.00 0.20 H new ATOM 757 P DT B 14 5.847 -15.200 18.052 1.00 0.21 P ATOM 758 OP1 DT B 14 6.641 -14.023 18.474 1.00 0.32 O ATOM 759 OP2 DT B 14 5.581 -15.431 16.615 1.00 0.26 O ATOM 760 O5' DT B 14 6.545 -16.520 18.657 1.00 0.25 O ATOM 761 C5' DT B 14 7.084 -16.513 19.982 1.00 0.27 C ATOM 762 C4' DT B 14 8.608 -16.446 19.973 1.00 0.27 C ATOM 763 O4' DT B 14 9.032 -15.244 19.318 1.00 0.29 O ATOM 764 C3' DT B 14 9.228 -16.433 21.365 1.00 0.35 C ATOM 765 O3' DT B 14 10.492 -17.105 21.339 1.00 0.40 O ATOM 766 C2' DT B 14 9.433 -14.956 21.639 1.00 0.37 C ATOM 767 C1' DT B 14 9.779 -14.448 20.246 1.00 0.34 C ATOM 768 N1 DT B 14 9.428 -13.034 20.004 1.00 0.37 N ATOM 769 C2 DT B 14 9.303 -12.630 18.689 1.00 0.37 C ATOM 770 O2 DT B 14 9.470 -13.404 17.748 1.00 0.38 O ATOM 771 N3 DT B 14 8.977 -11.302 18.490 1.00 0.41 N ATOM 772 C4 DT B 14 8.768 -10.357 19.480 1.00 0.45 C ATOM 773 O4 DT B 14 8.481 -9.198 19.189 1.00 0.49 O ATOM 774 C5 DT B 14 8.921 -10.870 20.823 1.00 0.45 C ATOM 775 C7 DT B 14 8.720 -9.934 22.011 1.00 0.54 C ATOM 776 C6 DT B 14 9.238 -12.162 21.043 1.00 0.42 C ATOM 0 H5' DT B 14 6.763 -17.411 20.510 1.00 0.27 H new ATOM 0 H5'' DT B 14 6.686 -15.660 20.532 1.00 0.27 H new ATOM 0 H4' DT B 14 8.940 -17.346 19.455 1.00 0.27 H new ATOM 0 H3' DT B 14 8.616 -16.930 22.117 1.00 0.35 H new ATOM 0 H2' DT B 14 8.537 -14.483 22.040 1.00 0.37 H new ATOM 0 H2'' DT B 14 10.235 -14.777 22.355 1.00 0.37 H new ATOM 0 H1' DT B 14 10.861 -14.523 20.133 1.00 0.34 H new ATOM 0 H3 DT B 14 8.881 -10.989 17.524 1.00 0.41 H new ATOM 0 H71 DT B 14 8.347 -10.502 22.863 1.00 0.54 H new ATOM 0 H72 DT B 14 9.670 -9.469 22.273 1.00 0.54 H new ATOM 0 H73 DT B 14 7.998 -9.161 21.747 1.00 0.54 H new ATOM 0 H6 DT B 14 9.344 -12.516 22.058 1.00 0.42 H new ATOM 789 P DG B 15 10.584 -18.664 20.943 1.00 0.38 P ATOM 790 OP1 DG B 15 9.349 -19.334 21.409 1.00 0.43 O ATOM 791 OP2 DG B 15 11.905 -19.173 21.372 1.00 0.49 O ATOM 792 O5' DG B 15 10.558 -18.624 19.333 1.00 0.33 O ATOM 793 C5' DG B 15 10.146 -19.770 18.583 1.00 0.27 C ATOM 794 C4' DG B 15 10.668 -19.719 17.150 1.00 0.19 C ATOM 795 O4' DG B 15 10.279 -20.902 16.463 1.00 0.21 O ATOM 796 C3' DG B 15 10.141 -18.533 16.339 1.00 0.17 C ATOM 797 O3' DG B 15 11.226 -17.651 16.032 1.00 0.20 O ATOM 798 C2' DG B 15 9.586 -19.144 15.048 1.00 0.16 C ATOM 799 C1' DG B 15 10.108 -20.574 15.092 1.00 0.16 C ATOM 800 N9 DG B 15 9.187 -21.570 14.517 1.00 0.20 N ATOM 801 C8 DG B 15 8.267 -22.351 15.161 1.00 0.27 C ATOM 802 N7 DG B 15 7.594 -23.139 14.370 1.00 0.31 N ATOM 803 C5 DG B 15 8.106 -22.860 13.106 1.00 0.26 C ATOM 804 C6 DG B 15 7.761 -23.411 11.843 1.00 0.29 C ATOM 805 O6 DG B 15 6.919 -24.270 11.589 1.00 0.32 O ATOM 806 N1 DG B 15 8.519 -22.854 10.820 1.00 0.32 N ATOM 807 C2 DG B 15 9.487 -21.886 10.990 1.00 0.32 C ATOM 808 N2 DG B 15 10.110 -21.474 9.886 1.00 0.42 N ATOM 809 N3 DG B 15 9.812 -21.367 12.179 1.00 0.26 N ATOM 810 C4 DG B 15 9.083 -21.899 13.187 1.00 0.22 C ATOM 0 H5' DG B 15 9.058 -19.827 18.573 1.00 0.27 H new ATOM 0 H5'' DG B 15 10.508 -20.675 19.071 1.00 0.27 H new ATOM 0 H4' DG B 15 11.750 -19.617 17.233 1.00 0.19 H new ATOM 0 H3' DG B 15 9.384 -17.963 16.878 1.00 0.17 H new ATOM 0 H2' DG B 15 8.497 -19.113 15.023 1.00 0.16 H new ATOM 0 H2'' DG B 15 9.941 -18.612 14.165 1.00 0.16 H new ATOM 0 H1' DG B 15 11.024 -20.609 14.502 1.00 0.16 H new ATOM 0 H8 DG B 15 8.112 -22.318 16.229 1.00 0.27 H new ATOM 0 H1 DG B 15 8.346 -23.186 9.871 1.00 0.32 H new ATOM 0 H21 DG B 15 10.836 -20.760 9.946 1.00 0.42 H new ATOM 0 H22 DG B 15 9.861 -21.873 8.981 1.00 0.42 H new ATOM 822 P DG B 16 10.942 -16.124 15.610 1.00 0.25 P ATOM 823 OP1 DG B 16 12.140 -15.321 15.939 1.00 0.31 O ATOM 824 OP2 DG B 16 9.621 -15.732 16.150 1.00 0.33 O ATOM 825 O5' DG B 16 10.821 -16.215 14.007 1.00 0.26 O ATOM 826 C5' DG B 16 11.996 -16.222 13.191 1.00 0.23 C ATOM 827 C4' DG B 16 11.645 -16.178 11.706 1.00 0.18 C ATOM 828 O4' DG B 16 10.869 -17.329 11.363 1.00 0.21 O ATOM 829 C3' DG B 16 10.835 -14.942 11.300 1.00 0.18 C ATOM 830 O3' DG B 16 11.457 -14.312 10.176 1.00 0.22 O ATOM 831 C2' DG B 16 9.471 -15.490 10.898 1.00 0.19 C ATOM 832 C1' DG B 16 9.812 -16.917 10.503 1.00 0.16 C ATOM 833 N9 DG B 16 8.701 -17.872 10.668 1.00 0.16 N ATOM 834 C8 DG B 16 7.999 -18.182 11.804 1.00 0.20 C ATOM 835 N7 DG B 16 7.070 -19.078 11.625 1.00 0.23 N ATOM 836 C5 DG B 16 7.159 -19.387 10.271 1.00 0.19 C ATOM 837 C6 DG B 16 6.398 -20.304 9.495 1.00 0.21 C ATOM 838 O6 DG B 16 5.479 -21.033 9.863 1.00 0.26 O ATOM 839 N1 DG B 16 6.810 -20.310 8.168 1.00 0.21 N ATOM 840 C2 DG B 16 7.829 -19.534 7.652 1.00 0.20 C ATOM 841 N2 DG B 16 8.084 -19.678 6.351 1.00 0.25 N ATOM 842 N3 DG B 16 8.545 -18.674 8.382 1.00 0.17 N ATOM 843 C4 DG B 16 8.156 -18.653 9.677 1.00 0.15 C ATOM 0 H5' DG B 16 12.581 -17.117 13.401 1.00 0.23 H new ATOM 0 H5'' DG B 16 12.621 -15.366 13.444 1.00 0.23 H new ATOM 0 H4' DG B 16 12.597 -16.147 11.176 1.00 0.18 H new ATOM 0 H3' DG B 16 10.766 -14.203 12.098 1.00 0.18 H new ATOM 0 H2' DG B 16 8.757 -15.453 11.721 1.00 0.19 H new ATOM 0 H2'' DG B 16 9.033 -14.931 10.071 1.00 0.19 H new ATOM 0 H1' DG B 16 10.068 -16.919 9.443 1.00 0.16 H new ATOM 0 H8 DG B 16 8.198 -17.724 12.762 1.00 0.20 H new ATOM 0 H1 DG B 16 6.323 -20.935 7.526 1.00 0.21 H new ATOM 0 H21 DG B 16 8.825 -19.131 5.913 1.00 0.25 H new ATOM 0 H22 DG B 16 7.538 -20.335 5.794 1.00 0.25 H new ATOM 855 P DG B 17 10.874 -12.930 9.590 1.00 0.22 P ATOM 856 OP1 DG B 17 11.983 -12.197 8.940 1.00 0.25 O ATOM 857 OP2 DG B 17 10.080 -12.275 10.653 1.00 0.25 O ATOM 858 O5' DG B 17 9.862 -13.431 8.442 1.00 0.23 O ATOM 859 C5' DG B 17 10.357 -13.809 7.154 1.00 0.23 C ATOM 860 C4' DG B 17 9.219 -14.059 6.168 1.00 0.21 C ATOM 861 O4' DG B 17 8.432 -15.163 6.612 1.00 0.23 O ATOM 862 C3' DG B 17 8.270 -12.867 6.003 1.00 0.16 C ATOM 863 O3' DG B 17 8.301 -12.416 4.645 1.00 0.19 O ATOM 864 C2' DG B 17 6.882 -13.417 6.332 1.00 0.21 C ATOM 865 C1' DG B 17 7.088 -14.918 6.218 1.00 0.20 C ATOM 866 N9 DG B 17 6.207 -15.717 7.091 1.00 0.21 N ATOM 867 C8 DG B 17 6.069 -15.663 8.455 1.00 0.25 C ATOM 868 N7 DG B 17 5.193 -16.501 8.930 1.00 0.25 N ATOM 869 C5 DG B 17 4.716 -17.163 7.806 1.00 0.21 C ATOM 870 C6 DG B 17 3.740 -18.190 7.703 1.00 0.21 C ATOM 871 O6 DG B 17 3.098 -18.724 8.607 1.00 0.23 O ATOM 872 N1 DG B 17 3.549 -18.580 6.384 1.00 0.20 N ATOM 873 C2 DG B 17 4.214 -18.049 5.298 1.00 0.22 C ATOM 874 N2 DG B 17 3.899 -18.553 4.106 1.00 0.29 N ATOM 875 N3 DG B 17 5.132 -17.082 5.394 1.00 0.20 N ATOM 876 C4 DG B 17 5.330 -16.690 6.674 1.00 0.18 C ATOM 0 H5' DG B 17 10.964 -14.710 7.246 1.00 0.23 H new ATOM 0 H5'' DG B 17 11.008 -13.024 6.769 1.00 0.23 H new ATOM 0 H4' DG B 17 9.700 -14.249 5.208 1.00 0.21 H new ATOM 0 H3' DG B 17 8.543 -12.027 6.642 1.00 0.16 H new ATOM 0 H2' DG B 17 6.557 -13.127 7.331 1.00 0.21 H new ATOM 0 H2'' DG B 17 6.127 -13.057 5.634 1.00 0.21 H new ATOM 0 H1' DG B 17 6.858 -15.215 5.195 1.00 0.20 H new ATOM 0 H8 DG B 17 6.636 -14.987 9.078 1.00 0.25 H new ATOM 0 H1 DG B 17 2.865 -19.315 6.204 1.00 0.20 H new ATOM 0 H21 DG B 17 4.358 -18.200 3.266 1.00 0.29 H new ATOM 0 H22 DG B 17 3.199 -19.292 4.033 1.00 0.29 H new ATOM 888 P DT B 18 7.483 -11.100 4.203 1.00 0.20 P ATOM 889 OP1 DT B 18 8.200 -10.467 3.074 1.00 0.27 O ATOM 890 OP2 DT B 18 7.181 -10.313 5.419 1.00 0.21 O ATOM 891 O5' DT B 18 6.102 -11.710 3.644 1.00 0.24 O ATOM 892 C5' DT B 18 6.043 -12.285 2.335 1.00 0.29 C ATOM 893 C4' DT B 18 4.604 -12.428 1.845 1.00 0.25 C ATOM 894 O4' DT B 18 3.902 -13.363 2.675 1.00 0.35 O ATOM 895 C3' DT B 18 3.807 -11.118 1.862 1.00 0.32 C ATOM 896 O3' DT B 18 3.080 -10.939 0.642 1.00 0.39 O ATOM 897 C2' DT B 18 2.863 -11.293 3.043 1.00 0.44 C ATOM 898 C1' DT B 18 2.641 -12.793 3.012 1.00 0.47 C ATOM 899 N1 DT B 18 2.200 -13.378 4.294 1.00 0.54 N ATOM 900 C2 DT B 18 1.032 -14.116 4.286 1.00 0.85 C ATOM 901 O2 DT B 18 0.372 -14.285 3.263 1.00 1.05 O ATOM 902 N3 DT B 18 0.648 -14.657 5.499 1.00 0.93 N ATOM 903 C4 DT B 18 1.321 -14.524 6.701 1.00 0.73 C ATOM 904 O4 DT B 18 0.888 -15.048 7.724 1.00 0.84 O ATOM 905 C5 DT B 18 2.530 -13.736 6.611 1.00 0.43 C ATOM 906 C7 DT B 18 3.373 -13.510 7.862 1.00 0.28 C ATOM 907 C6 DT B 18 2.926 -13.198 5.440 1.00 0.35 C ATOM 0 H5' DT B 18 6.523 -13.264 2.346 1.00 0.29 H new ATOM 0 H5'' DT B 18 6.604 -11.662 1.638 1.00 0.29 H new ATOM 0 H4' DT B 18 4.680 -12.764 0.811 1.00 0.25 H new ATOM 0 H3' DT B 18 4.442 -10.237 1.953 1.00 0.32 H new ATOM 0 H2' DT B 18 3.309 -10.961 3.981 1.00 0.44 H new ATOM 0 H2'' DT B 18 1.935 -10.735 2.916 1.00 0.44 H new ATOM 0 HO3' DT B 18 2.579 -10.097 0.680 1.00 0.39 H new ATOM 0 H1' DT B 18 1.842 -13.003 2.301 1.00 0.47 H new ATOM 0 H3 DT B 18 -0.212 -15.206 5.509 1.00 0.93 H new ATOM 0 H71 DT B 18 4.420 -13.399 7.580 1.00 0.28 H new ATOM 0 H72 DT B 18 3.036 -12.606 8.370 1.00 0.28 H new ATOM 0 H73 DT B 18 3.267 -14.363 8.532 1.00 0.28 H new ATOM 0 H6 DT B 18 3.834 -12.614 5.406 1.00 0.35 H new TER 921 DT B 18