USER MOD reduce.3.24.130724 H: found=0, std=0, add=656, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 657 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 Set 1.1: A 84 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 87 ASN : amide:sc= 1.6 K(o=1.6,f=-8.8!) USER MOD Set 2.2: A 89 HIS : no HD1:sc= 0 X(o=1.6,f=1.6) USER MOD Single : A 81 LYS NZ :NH3+ 167:sc= 1.22 (180deg=0.716) USER MOD Single : A 83 LYS NZ :NH3+ -164:sc= 1.09 (180deg=0.531) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -170:sc= 0.0855 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.184 USER MOD Single : A 97 LYS NZ :NH3+ 164:sc= 1.25 (180deg=1.01) USER MOD Single : A 100 ASN : amide:sc= 0.111 K(o=0.11,f=-1.3) USER MOD Single : A 101 HIS : no HE2:sc= 0.789 K(o=0.79,f=-2.4!) USER MOD Single : A 102 LYS NZ :NH3+ -166:sc= 1.22 (180deg=1.1) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -150:sc= 1.08 (180deg=0.529) USER MOD Single : A 108 LYS NZ :NH3+ -150:sc= 2.41 (180deg=0.317) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 125 HIS : no HD1:sc= 0 X(o=0,f=-0.058) USER MOD Single : B 1 DC O5' : rot 180:sc= 0 USER MOD Single : B 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 9 DT C7 :methyl -30:sc= -0.37 (180deg=-0.444) USER MOD Single : B 12 DG O3' : rot 180:sc= 0 USER MOD Single : C 13 DC O5' : rot 180:sc= 0 USER MOD Single : C 17 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 19 DT C7 :methyl 150:sc= -0.213 (180deg=-0.213) USER MOD Single : C 21 DT C7 :methyl -30:sc= -1.12 (180deg=-1.29) USER MOD Single : C 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 79 -0.870 6.352 9.632 1.00 1.00 N ATOM 2 CA ALA A 79 0.240 5.761 8.835 1.00 1.00 C ATOM 3 C ALA A 79 0.535 6.601 7.593 1.00 1.00 C ATOM 4 O ALA A 79 -0.333 7.315 7.111 1.00 1.00 O ATOM 5 CB ALA A 79 -0.126 4.317 8.444 1.00 1.00 C ATOM 0 HA ALA A 79 1.144 5.751 9.443 1.00 1.00 H new ATOM 0 HB1 ALA A 79 0.685 3.881 7.860 1.00 1.00 H new ATOM 0 HB2 ALA A 79 -0.283 3.725 9.345 1.00 1.00 H new ATOM 0 HB3 ALA A 79 -1.039 4.322 7.849 1.00 1.00 H new ATOM 11 N ARG A 80 1.753 6.507 7.046 1.00 1.00 N ATOM 12 CA ARG A 80 2.214 7.158 5.793 1.00 1.00 C ATOM 13 C ARG A 80 1.519 6.596 4.528 1.00 1.00 C ATOM 14 O ARG A 80 2.156 6.033 3.642 1.00 1.00 O ATOM 15 CB ARG A 80 3.759 7.095 5.731 1.00 1.00 C ATOM 16 CG ARG A 80 4.403 7.937 6.848 1.00 1.00 C ATOM 17 CD ARG A 80 4.456 9.436 6.521 1.00 1.00 C ATOM 18 NE ARG A 80 4.550 10.255 7.748 1.00 1.00 N ATOM 19 CZ ARG A 80 3.564 10.879 8.367 1.00 1.00 C ATOM 20 NH1 ARG A 80 2.334 10.835 7.963 1.00 1.00 N ATOM 21 NH2 ARG A 80 3.765 11.633 9.399 1.00 1.00 N ATOM 0 H ARG A 80 2.488 5.949 7.480 1.00 1.00 H new ATOM 0 HA ARG A 80 1.916 8.206 5.809 1.00 1.00 H new ATOM 0 HB2 ARG A 80 4.086 6.059 5.820 1.00 1.00 H new ATOM 0 HB3 ARG A 80 4.100 7.454 4.760 1.00 1.00 H new ATOM 0 HG2 ARG A 80 3.843 7.793 7.772 1.00 1.00 H new ATOM 0 HG3 ARG A 80 5.415 7.575 7.029 1.00 1.00 H new ATOM 0 HD2 ARG A 80 5.314 9.640 5.880 1.00 1.00 H new ATOM 0 HD3 ARG A 80 3.565 9.719 5.961 1.00 1.00 H new ATOM 0 HE ARG A 80 5.478 10.348 8.162 1.00 1.00 H new ATOM 0 HH11 ARG A 80 2.090 10.300 7.130 1.00 1.00 H new ATOM 0 HH12 ARG A 80 1.610 11.336 8.478 1.00 1.00 H new ATOM 0 HH21 ARG A 80 4.710 11.761 9.760 1.00 1.00 H new ATOM 0 HH22 ARG A 80 2.978 12.099 9.851 1.00 1.00 H new ATOM 35 N LYS A 81 0.185 6.699 4.485 1.00 1.00 N ATOM 36 CA LYS A 81 -0.734 6.288 3.423 1.00 1.00 C ATOM 37 C LYS A 81 -0.348 6.920 2.088 1.00 1.00 C ATOM 38 O LYS A 81 -0.089 8.116 1.973 1.00 1.00 O ATOM 39 CB LYS A 81 -2.167 6.705 3.804 1.00 1.00 C ATOM 40 CG LYS A 81 -2.787 5.854 4.925 1.00 1.00 C ATOM 41 CD LYS A 81 -3.801 6.656 5.753 1.00 1.00 C ATOM 42 CE LYS A 81 -4.565 5.732 6.712 1.00 1.00 C ATOM 43 NZ LYS A 81 -5.296 6.496 7.761 1.00 1.00 N ATOM 0 H LYS A 81 -0.323 7.111 5.268 1.00 1.00 H new ATOM 0 HA LYS A 81 -0.679 5.205 3.312 1.00 1.00 H new ATOM 0 HB2 LYS A 81 -2.160 7.749 4.116 1.00 1.00 H new ATOM 0 HB3 LYS A 81 -2.801 6.641 2.920 1.00 1.00 H new ATOM 0 HG2 LYS A 81 -3.279 4.984 4.491 1.00 1.00 H new ATOM 0 HG3 LYS A 81 -1.998 5.482 5.578 1.00 1.00 H new ATOM 0 HD2 LYS A 81 -3.285 7.431 6.320 1.00 1.00 H new ATOM 0 HD3 LYS A 81 -4.503 7.161 5.089 1.00 1.00 H new ATOM 0 HE2 LYS A 81 -5.273 5.127 6.145 1.00 1.00 H new ATOM 0 HE3 LYS A 81 -3.865 5.044 7.186 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -5.966 5.866 8.246 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -4.617 6.875 8.451 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -5.816 7.281 7.320 1.00 1.00 H new ATOM 57 N VAL A 82 -0.328 6.060 1.085 1.00 1.00 N ATOM 58 CA VAL A 82 -0.115 6.410 -0.323 1.00 1.00 C ATOM 59 C VAL A 82 -1.353 7.065 -0.936 1.00 1.00 C ATOM 60 O VAL A 82 -2.471 6.558 -0.804 1.00 1.00 O ATOM 61 CB VAL A 82 0.212 5.144 -1.145 1.00 1.00 C ATOM 62 CG1 VAL A 82 0.332 5.417 -2.653 1.00 1.00 C ATOM 63 CG2 VAL A 82 1.505 4.489 -0.650 1.00 1.00 C ATOM 0 H VAL A 82 -0.464 5.059 1.226 1.00 1.00 H new ATOM 0 HA VAL A 82 0.716 7.114 -0.353 1.00 1.00 H new ATOM 0 HB VAL A 82 -0.630 4.469 -0.996 1.00 1.00 H new ATOM 0 HG11 VAL A 82 0.563 4.488 -3.174 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -0.610 5.818 -3.026 1.00 1.00 H new ATOM 0 HG13 VAL A 82 1.129 6.139 -2.830 1.00 1.00 H new ATOM 0 HG21 VAL A 82 1.713 3.600 -1.245 1.00 1.00 H new ATOM 0 HG22 VAL A 82 2.331 5.193 -0.749 1.00 1.00 H new ATOM 0 HG23 VAL A 82 1.392 4.207 0.397 1.00 1.00 H new ATOM 73 N LYS A 83 -1.146 8.153 -1.674 1.00 1.00 N ATOM 74 CA LYS A 83 -2.137 8.763 -2.546 1.00 1.00 C ATOM 75 C LYS A 83 -1.691 8.482 -3.975 1.00 1.00 C ATOM 76 O LYS A 83 -0.558 8.779 -4.362 1.00 1.00 O ATOM 77 CB LYS A 83 -2.307 10.276 -2.337 1.00 1.00 C ATOM 78 CG LYS A 83 -3.489 10.598 -1.414 1.00 1.00 C ATOM 79 CD LYS A 83 -3.619 12.121 -1.238 1.00 1.00 C ATOM 80 CE LYS A 83 -4.999 12.560 -0.722 1.00 1.00 C ATOM 81 NZ LYS A 83 -5.255 12.147 0.686 1.00 1.00 N ATOM 0 H LYS A 83 -0.254 8.647 -1.679 1.00 1.00 H new ATOM 0 HA LYS A 83 -3.112 8.333 -2.317 1.00 1.00 H new ATOM 0 HB2 LYS A 83 -1.392 10.689 -1.912 1.00 1.00 H new ATOM 0 HB3 LYS A 83 -2.457 10.761 -3.302 1.00 1.00 H new ATOM 0 HG2 LYS A 83 -4.410 10.192 -1.833 1.00 1.00 H new ATOM 0 HG3 LYS A 83 -3.344 10.123 -0.444 1.00 1.00 H new ATOM 0 HD2 LYS A 83 -2.853 12.466 -0.543 1.00 1.00 H new ATOM 0 HD3 LYS A 83 -3.425 12.608 -2.194 1.00 1.00 H new ATOM 0 HE2 LYS A 83 -5.080 13.644 -0.797 1.00 1.00 H new ATOM 0 HE3 LYS A 83 -5.772 12.138 -1.364 1.00 1.00 H new ATOM 0 HZ1 LYS A 83 -6.272 12.222 0.890 1.00 1.00 H new ATOM 0 HZ2 LYS A 83 -4.947 11.163 0.821 1.00 1.00 H new ATOM 0 HZ3 LYS A 83 -4.725 12.767 1.331 1.00 1.00 H new ATOM 95 N GLN A 84 -2.558 7.835 -4.745 1.00 1.00 N ATOM 96 CA GLN A 84 -2.378 7.721 -6.175 1.00 1.00 C ATOM 97 C GLN A 84 -2.959 9.013 -6.740 1.00 1.00 C ATOM 98 O GLN A 84 -3.972 9.519 -6.255 1.00 1.00 O ATOM 99 CB GLN A 84 -3.057 6.455 -6.734 1.00 1.00 C ATOM 100 CG GLN A 84 -3.762 6.621 -8.086 1.00 1.00 C ATOM 101 CD GLN A 84 -4.384 5.309 -8.560 1.00 1.00 C ATOM 102 OE1 GLN A 84 -5.586 5.103 -8.479 1.00 1.00 O ATOM 103 NE2 GLN A 84 -3.603 4.366 -9.046 1.00 1.00 N ATOM 0 H GLN A 84 -3.399 7.379 -4.392 1.00 1.00 H new ATOM 0 HA GLN A 84 -1.332 7.605 -6.458 1.00 1.00 H new ATOM 0 HB2 GLN A 84 -2.303 5.674 -6.831 1.00 1.00 H new ATOM 0 HB3 GLN A 84 -3.787 6.104 -6.005 1.00 1.00 H new ATOM 0 HG2 GLN A 84 -4.537 7.382 -8.002 1.00 1.00 H new ATOM 0 HG3 GLN A 84 -3.047 6.975 -8.829 1.00 1.00 H new ATOM 0 HE21 GLN A 84 -2.598 4.524 -9.120 1.00 1.00 H new ATOM 0 HE22 GLN A 84 -4.003 3.478 -9.349 1.00 1.00 H new ATOM 112 N TYR A 85 -2.355 9.495 -7.807 1.00 1.00 N ATOM 113 CA TYR A 85 -2.841 10.628 -8.579 1.00 1.00 C ATOM 114 C TYR A 85 -2.903 10.205 -10.046 1.00 1.00 C ATOM 115 O TYR A 85 -2.017 9.495 -10.512 1.00 1.00 O ATOM 116 CB TYR A 85 -1.904 11.829 -8.370 1.00 1.00 C ATOM 117 CG TYR A 85 -1.704 12.274 -6.934 1.00 1.00 C ATOM 118 CD1 TYR A 85 -2.619 13.171 -6.359 1.00 1.00 C ATOM 119 CD2 TYR A 85 -0.586 11.837 -6.195 1.00 1.00 C ATOM 120 CE1 TYR A 85 -2.420 13.654 -5.053 1.00 1.00 C ATOM 121 CE2 TYR A 85 -0.376 12.317 -4.889 1.00 1.00 C ATOM 122 CZ TYR A 85 -1.291 13.233 -4.319 1.00 1.00 C ATOM 123 OH TYR A 85 -1.104 13.718 -3.063 1.00 1.00 O ATOM 0 H TYR A 85 -1.489 9.101 -8.174 1.00 1.00 H new ATOM 0 HA TYR A 85 -3.837 10.931 -8.255 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -0.930 11.582 -8.792 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -2.294 12.672 -8.940 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -3.482 13.492 -6.924 1.00 1.00 H new ATOM 0 HD2 TYR A 85 0.109 11.134 -6.631 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -3.127 14.343 -4.615 1.00 1.00 H new ATOM 0 HE2 TYR A 85 0.482 11.987 -4.323 1.00 1.00 H new ATOM 0 HH TYR A 85 -0.285 13.336 -2.684 1.00 1.00 H new ATOM 133 N LYS A 86 -3.920 10.645 -10.788 1.00 1.00 N ATOM 134 CA LYS A 86 -4.102 10.365 -12.221 1.00 1.00 C ATOM 135 C LYS A 86 -4.464 11.659 -12.941 1.00 1.00 C ATOM 136 O LYS A 86 -5.257 12.435 -12.423 1.00 1.00 O ATOM 137 CB LYS A 86 -5.186 9.282 -12.376 1.00 1.00 C ATOM 138 CG LYS A 86 -5.576 9.023 -13.841 1.00 1.00 C ATOM 139 CD LYS A 86 -6.424 7.749 -13.967 1.00 1.00 C ATOM 140 CE LYS A 86 -6.725 7.456 -15.444 1.00 1.00 C ATOM 141 NZ LYS A 86 -7.591 6.252 -15.606 1.00 1.00 N ATOM 0 H LYS A 86 -4.665 11.224 -10.401 1.00 1.00 H new ATOM 0 HA LYS A 86 -3.184 9.988 -12.671 1.00 1.00 H new ATOM 0 HB2 LYS A 86 -4.829 8.353 -11.932 1.00 1.00 H new ATOM 0 HB3 LYS A 86 -6.073 9.582 -11.818 1.00 1.00 H new ATOM 0 HG2 LYS A 86 -6.134 9.875 -14.229 1.00 1.00 H new ATOM 0 HG3 LYS A 86 -4.677 8.927 -14.449 1.00 1.00 H new ATOM 0 HD2 LYS A 86 -5.895 6.906 -13.522 1.00 1.00 H new ATOM 0 HD3 LYS A 86 -7.356 7.868 -13.415 1.00 1.00 H new ATOM 0 HE2 LYS A 86 -7.216 8.320 -15.893 1.00 1.00 H new ATOM 0 HE3 LYS A 86 -5.789 7.306 -15.982 1.00 1.00 H new ATOM 0 HZ1 LYS A 86 -7.771 6.088 -16.617 1.00 1.00 H new ATOM 0 HZ2 LYS A 86 -7.112 5.423 -15.200 1.00 1.00 H new ATOM 0 HZ3 LYS A 86 -8.494 6.405 -15.114 1.00 1.00 H new ATOM 155 N ASN A 87 -3.889 11.891 -14.115 1.00 1.00 N ATOM 156 CA ASN A 87 -4.039 13.157 -14.839 1.00 1.00 C ATOM 157 C ASN A 87 -4.989 13.031 -16.054 1.00 1.00 C ATOM 158 O ASN A 87 -4.608 12.419 -17.057 1.00 1.00 O ATOM 159 CB ASN A 87 -2.636 13.631 -15.229 1.00 1.00 C ATOM 160 CG ASN A 87 -2.619 15.009 -15.859 1.00 1.00 C ATOM 161 OD1 ASN A 87 -3.572 15.470 -16.465 1.00 1.00 O ATOM 162 ND2 ASN A 87 -1.546 15.733 -15.696 1.00 1.00 N ATOM 0 H ASN A 87 -3.304 11.208 -14.596 1.00 1.00 H new ATOM 0 HA ASN A 87 -4.513 13.901 -14.199 1.00 1.00 H new ATOM 0 HB2 ASN A 87 -2.003 13.638 -14.342 1.00 1.00 H new ATOM 0 HB3 ASN A 87 -2.200 12.916 -15.926 1.00 1.00 H new ATOM 0 HD21 ASN A 87 -1.507 16.679 -16.074 1.00 1.00 H new ATOM 0 HD22 ASN A 87 -0.746 15.353 -15.190 1.00 1.00 H new ATOM 169 N PRO A 88 -6.195 13.639 -16.016 1.00 1.00 N ATOM 170 CA PRO A 88 -7.150 13.659 -17.132 1.00 1.00 C ATOM 171 C PRO A 88 -6.595 14.162 -18.476 1.00 1.00 C ATOM 172 O PRO A 88 -7.092 13.770 -19.534 1.00 1.00 O ATOM 173 CB PRO A 88 -8.300 14.564 -16.669 1.00 1.00 C ATOM 174 CG PRO A 88 -8.258 14.475 -15.148 1.00 1.00 C ATOM 175 CD PRO A 88 -6.768 14.332 -14.865 1.00 1.00 C ATOM 0 HA PRO A 88 -7.447 12.632 -17.346 1.00 1.00 H new ATOM 0 HB2 PRO A 88 -8.162 15.590 -17.012 1.00 1.00 H new ATOM 0 HB3 PRO A 88 -9.258 14.223 -17.061 1.00 1.00 H new ATOM 0 HG2 PRO A 88 -8.676 15.365 -14.678 1.00 1.00 H new ATOM 0 HG3 PRO A 88 -8.825 13.622 -14.776 1.00 1.00 H new ATOM 0 HD2 PRO A 88 -6.303 15.308 -14.728 1.00 1.00 H new ATOM 0 HD3 PRO A 88 -6.599 13.767 -13.948 1.00 1.00 H new ATOM 183 N HIS A 89 -5.575 15.032 -18.454 1.00 1.00 N ATOM 184 CA HIS A 89 -5.010 15.694 -19.642 1.00 1.00 C ATOM 185 C HIS A 89 -3.920 14.882 -20.357 1.00 1.00 C ATOM 186 O HIS A 89 -3.617 15.171 -21.514 1.00 1.00 O ATOM 187 CB HIS A 89 -4.482 17.082 -19.240 1.00 1.00 C ATOM 188 CG HIS A 89 -5.517 17.930 -18.543 1.00 1.00 C ATOM 189 ND1 HIS A 89 -6.553 18.617 -19.152 1.00 1.00 N ATOM 190 CD2 HIS A 89 -5.616 18.139 -17.193 1.00 1.00 C ATOM 191 CE1 HIS A 89 -7.266 19.237 -18.191 1.00 1.00 C ATOM 192 NE2 HIS A 89 -6.714 18.958 -16.992 1.00 1.00 N ATOM 0 H HIS A 89 -5.107 15.302 -17.589 1.00 1.00 H new ATOM 0 HA HIS A 89 -5.817 15.786 -20.369 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -3.620 16.960 -18.585 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -4.134 17.604 -20.131 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -4.962 17.741 -16.431 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -8.136 19.856 -18.354 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -7.049 19.294 -16.089 1.00 1.00 H new ATOM 201 N THR A 90 -3.332 13.875 -19.696 1.00 1.00 N ATOM 202 CA THR A 90 -2.193 13.084 -20.216 1.00 1.00 C ATOM 203 C THR A 90 -2.394 11.567 -20.142 1.00 1.00 C ATOM 204 O THR A 90 -1.757 10.823 -20.890 1.00 1.00 O ATOM 205 CB THR A 90 -0.907 13.422 -19.446 1.00 1.00 C ATOM 206 OG1 THR A 90 -1.042 12.967 -18.121 1.00 1.00 O ATOM 207 CG2 THR A 90 -0.623 14.919 -19.356 1.00 1.00 C ATOM 0 H THR A 90 -3.635 13.577 -18.769 1.00 1.00 H new ATOM 0 HA THR A 90 -2.119 13.360 -21.268 1.00 1.00 H new ATOM 0 HB THR A 90 -0.092 12.945 -19.991 1.00 1.00 H new ATOM 0 HG1 THR A 90 -0.302 13.312 -17.580 1.00 1.00 H new ATOM 0 HG21 THR A 90 0.300 15.081 -18.799 1.00 1.00 H new ATOM 0 HG22 THR A 90 -0.518 15.330 -20.360 1.00 1.00 H new ATOM 0 HG23 THR A 90 -1.448 15.416 -18.845 1.00 1.00 H new ATOM 215 N GLY A 91 -3.280 11.091 -19.257 1.00 1.00 N ATOM 216 CA GLY A 91 -3.474 9.668 -18.964 1.00 1.00 C ATOM 217 C GLY A 91 -2.362 9.045 -18.103 1.00 1.00 C ATOM 218 O GLY A 91 -2.348 7.824 -17.929 1.00 1.00 O ATOM 0 H GLY A 91 -3.894 11.699 -18.714 1.00 1.00 H new ATOM 0 HA2 GLY A 91 -4.428 9.540 -18.453 1.00 1.00 H new ATOM 0 HA3 GLY A 91 -3.540 9.121 -19.904 1.00 1.00 H new ATOM 222 N GLU A 92 -1.431 9.842 -17.564 1.00 1.00 N ATOM 223 CA GLU A 92 -0.418 9.399 -16.619 1.00 1.00 C ATOM 224 C GLU A 92 -1.011 9.252 -15.220 1.00 1.00 C ATOM 225 O GLU A 92 -1.991 9.892 -14.838 1.00 1.00 O ATOM 226 CB GLU A 92 0.762 10.375 -16.562 1.00 1.00 C ATOM 227 CG GLU A 92 1.724 10.189 -17.735 1.00 1.00 C ATOM 228 CD GLU A 92 2.711 9.029 -17.492 1.00 1.00 C ATOM 229 OE1 GLU A 92 2.304 7.846 -17.570 1.00 1.00 O ATOM 230 OE2 GLU A 92 3.908 9.295 -17.222 1.00 1.00 O ATOM 0 H GLU A 92 -1.366 10.836 -17.783 1.00 1.00 H new ATOM 0 HA GLU A 92 -0.057 8.431 -16.967 1.00 1.00 H new ATOM 0 HB2 GLU A 92 0.385 11.398 -16.562 1.00 1.00 H new ATOM 0 HB3 GLU A 92 1.302 10.235 -15.626 1.00 1.00 H new ATOM 0 HG2 GLU A 92 1.155 9.997 -18.644 1.00 1.00 H new ATOM 0 HG3 GLU A 92 2.281 11.112 -17.897 1.00 1.00 H new ATOM 237 N VAL A 93 -0.333 8.422 -14.447 1.00 1.00 N ATOM 238 CA VAL A 93 -0.635 8.073 -13.061 1.00 1.00 C ATOM 239 C VAL A 93 0.665 8.070 -12.247 1.00 1.00 C ATOM 240 O VAL A 93 1.761 7.848 -12.767 1.00 1.00 O ATOM 241 CB VAL A 93 -1.312 6.694 -12.999 1.00 1.00 C ATOM 242 CG1 VAL A 93 -1.848 6.309 -11.605 1.00 1.00 C ATOM 243 CG2 VAL A 93 -2.494 6.610 -13.981 1.00 1.00 C ATOM 0 H VAL A 93 0.498 7.940 -14.789 1.00 1.00 H new ATOM 0 HA VAL A 93 -1.320 8.809 -12.640 1.00 1.00 H new ATOM 0 HB VAL A 93 -0.517 5.997 -13.264 1.00 1.00 H new ATOM 0 HG11 VAL A 93 -2.309 5.323 -11.652 1.00 1.00 H new ATOM 0 HG12 VAL A 93 -1.025 6.291 -10.891 1.00 1.00 H new ATOM 0 HG13 VAL A 93 -2.589 7.041 -11.285 1.00 1.00 H new ATOM 0 HG21 VAL A 93 -2.953 5.623 -13.915 1.00 1.00 H new ATOM 0 HG22 VAL A 93 -3.232 7.371 -13.728 1.00 1.00 H new ATOM 0 HG23 VAL A 93 -2.135 6.776 -14.997 1.00 1.00 H new ATOM 253 N ILE A 94 0.514 8.286 -10.948 1.00 1.00 N ATOM 254 CA ILE A 94 1.557 8.302 -9.919 1.00 1.00 C ATOM 255 C ILE A 94 0.994 7.722 -8.620 1.00 1.00 C ATOM 256 O ILE A 94 -0.217 7.620 -8.434 1.00 1.00 O ATOM 257 CB ILE A 94 2.094 9.726 -9.601 1.00 1.00 C ATOM 258 CG1 ILE A 94 1.536 10.869 -10.474 1.00 1.00 C ATOM 259 CG2 ILE A 94 3.634 9.728 -9.627 1.00 1.00 C ATOM 260 CD1 ILE A 94 1.927 12.247 -9.937 1.00 1.00 C ATOM 0 H ILE A 94 -0.408 8.469 -10.551 1.00 1.00 H new ATOM 0 HA ILE A 94 2.383 7.711 -10.314 1.00 1.00 H new ATOM 0 HB ILE A 94 1.722 9.947 -8.601 1.00 1.00 H new ATOM 0 HG12 ILE A 94 1.906 10.759 -11.493 1.00 1.00 H new ATOM 0 HG13 ILE A 94 0.450 10.793 -10.519 1.00 1.00 H new ATOM 0 HG21 ILE A 94 4.000 10.730 -9.403 1.00 1.00 H new ATOM 0 HG22 ILE A 94 4.011 9.028 -8.881 1.00 1.00 H new ATOM 0 HG23 ILE A 94 3.982 9.427 -10.615 1.00 1.00 H new ATOM 0 HD11 ILE A 94 1.512 13.020 -10.583 1.00 1.00 H new ATOM 0 HD12 ILE A 94 1.535 12.369 -8.927 1.00 1.00 H new ATOM 0 HD13 ILE A 94 3.013 12.335 -9.917 1.00 1.00 H new ATOM 272 N GLU A 95 1.896 7.450 -7.687 1.00 1.00 N ATOM 273 CA GLU A 95 1.658 7.005 -6.316 1.00 1.00 C ATOM 274 C GLU A 95 2.761 7.565 -5.406 1.00 1.00 C ATOM 275 O GLU A 95 3.947 7.305 -5.631 1.00 1.00 O ATOM 276 CB GLU A 95 1.716 5.475 -6.259 1.00 1.00 C ATOM 277 CG GLU A 95 0.414 4.814 -6.704 1.00 1.00 C ATOM 278 CD GLU A 95 0.563 3.281 -6.772 1.00 1.00 C ATOM 279 OE1 GLU A 95 0.827 2.642 -5.723 1.00 1.00 O ATOM 280 OE2 GLU A 95 0.415 2.703 -7.877 1.00 1.00 O ATOM 0 H GLU A 95 2.893 7.541 -7.882 1.00 1.00 H new ATOM 0 HA GLU A 95 0.680 7.356 -5.987 1.00 1.00 H new ATOM 0 HB2 GLU A 95 2.531 5.124 -6.892 1.00 1.00 H new ATOM 0 HB3 GLU A 95 1.946 5.163 -5.240 1.00 1.00 H new ATOM 0 HG2 GLU A 95 -0.385 5.074 -6.010 1.00 1.00 H new ATOM 0 HG3 GLU A 95 0.124 5.198 -7.682 1.00 1.00 H new ATOM 287 N THR A 96 2.382 8.328 -4.382 1.00 1.00 N ATOM 288 CA THR A 96 3.325 8.954 -3.432 1.00 1.00 C ATOM 289 C THR A 96 2.700 8.989 -2.032 1.00 1.00 C ATOM 290 O THR A 96 1.477 9.006 -1.895 1.00 1.00 O ATOM 291 CB THR A 96 3.777 10.372 -3.880 1.00 1.00 C ATOM 292 OG1 THR A 96 3.097 11.387 -3.169 1.00 1.00 O ATOM 293 CG2 THR A 96 3.562 10.698 -5.368 1.00 1.00 C ATOM 0 H THR A 96 1.404 8.536 -4.179 1.00 1.00 H new ATOM 0 HA THR A 96 4.227 8.343 -3.410 1.00 1.00 H new ATOM 0 HB THR A 96 4.847 10.351 -3.673 1.00 1.00 H new ATOM 0 HG1 THR A 96 3.407 12.265 -3.475 1.00 1.00 H new ATOM 0 HG21 THR A 96 3.911 11.710 -5.573 1.00 1.00 H new ATOM 0 HG22 THR A 96 4.121 9.990 -5.980 1.00 1.00 H new ATOM 0 HG23 THR A 96 2.501 10.625 -5.607 1.00 1.00 H new ATOM 301 N LYS A 97 3.511 9.000 -0.970 1.00 1.00 N ATOM 302 CA LYS A 97 3.043 9.155 0.425 1.00 1.00 C ATOM 303 C LYS A 97 3.098 10.626 0.888 1.00 1.00 C ATOM 304 O LYS A 97 2.932 10.910 2.077 1.00 1.00 O ATOM 305 CB LYS A 97 3.881 8.256 1.347 1.00 1.00 C ATOM 306 CG LYS A 97 3.962 6.778 0.915 1.00 1.00 C ATOM 307 CD LYS A 97 5.041 6.014 1.699 1.00 1.00 C ATOM 308 CE LYS A 97 5.402 4.662 1.065 1.00 1.00 C ATOM 309 NZ LYS A 97 6.148 4.821 -0.219 1.00 1.00 N ATOM 0 H LYS A 97 4.523 8.901 -1.048 1.00 1.00 H new ATOM 0 HA LYS A 97 1.998 8.848 0.475 1.00 1.00 H new ATOM 0 HB2 LYS A 97 4.892 8.659 1.402 1.00 1.00 H new ATOM 0 HB3 LYS A 97 3.464 8.303 2.353 1.00 1.00 H new ATOM 0 HG2 LYS A 97 2.994 6.301 1.069 1.00 1.00 H new ATOM 0 HG3 LYS A 97 4.179 6.722 -0.152 1.00 1.00 H new ATOM 0 HD2 LYS A 97 5.938 6.629 1.764 1.00 1.00 H new ATOM 0 HD3 LYS A 97 4.693 5.849 2.719 1.00 1.00 H new ATOM 0 HE2 LYS A 97 6.006 4.084 1.765 1.00 1.00 H new ATOM 0 HE3 LYS A 97 4.490 4.092 0.885 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 6.602 3.920 -0.471 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 5.487 5.098 -0.973 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 6.875 5.556 -0.109 1.00 1.00 H new ATOM 323 N GLY A 98 3.381 11.539 -0.045 1.00 1.00 N ATOM 324 CA GLY A 98 3.647 12.957 0.169 1.00 1.00 C ATOM 325 C GLY A 98 4.944 13.440 -0.492 1.00 1.00 C ATOM 326 O GLY A 98 5.552 12.746 -1.314 1.00 1.00 O ATOM 0 H GLY A 98 3.433 11.287 -1.032 1.00 1.00 H new ATOM 0 HA2 GLY A 98 2.811 13.539 -0.220 1.00 1.00 H new ATOM 0 HA3 GLY A 98 3.700 13.152 1.240 1.00 1.00 H new ATOM 330 N GLY A 99 5.363 14.639 -0.095 1.00 1.00 N ATOM 331 CA GLY A 99 6.660 15.221 -0.414 1.00 1.00 C ATOM 332 C GLY A 99 6.848 15.758 -1.839 1.00 1.00 C ATOM 333 O GLY A 99 6.057 15.540 -2.761 1.00 1.00 O ATOM 0 H GLY A 99 4.785 15.253 0.479 1.00 1.00 H new ATOM 0 HA2 GLY A 99 6.846 16.038 0.284 1.00 1.00 H new ATOM 0 HA3 GLY A 99 7.425 14.466 -0.232 1.00 1.00 H new ATOM 337 N ASN A 100 7.967 16.465 -2.006 1.00 1.00 N ATOM 338 CA ASN A 100 8.552 16.925 -3.262 1.00 1.00 C ATOM 339 C ASN A 100 8.816 15.698 -4.169 1.00 1.00 C ATOM 340 O ASN A 100 9.745 14.925 -3.937 1.00 1.00 O ATOM 341 CB ASN A 100 9.820 17.722 -2.875 1.00 1.00 C ATOM 342 CG ASN A 100 10.866 17.947 -3.957 1.00 1.00 C ATOM 343 OD1 ASN A 100 10.655 17.767 -5.149 1.00 1.00 O ATOM 344 ND2 ASN A 100 12.039 18.370 -3.537 1.00 1.00 N ATOM 0 H ASN A 100 8.529 16.751 -1.204 1.00 1.00 H new ATOM 0 HA ASN A 100 7.901 17.579 -3.842 1.00 1.00 H new ATOM 0 HB2 ASN A 100 9.504 18.697 -2.505 1.00 1.00 H new ATOM 0 HB3 ASN A 100 10.301 17.206 -2.044 1.00 1.00 H new ATOM 0 HD21 ASN A 100 12.786 18.552 -4.208 1.00 1.00 H new ATOM 0 HD22 ASN A 100 12.202 18.516 -2.541 1.00 1.00 H new ATOM 351 N HIS A 101 7.946 15.492 -5.172 1.00 1.00 N ATOM 352 CA HIS A 101 8.041 14.409 -6.168 1.00 1.00 C ATOM 353 C HIS A 101 7.886 14.989 -7.583 1.00 1.00 C ATOM 354 O HIS A 101 6.942 15.738 -7.836 1.00 1.00 O ATOM 355 CB HIS A 101 7.019 13.309 -5.814 1.00 1.00 C ATOM 356 CG HIS A 101 7.226 12.018 -6.570 1.00 1.00 C ATOM 357 ND1 HIS A 101 8.205 11.063 -6.322 1.00 1.00 N ATOM 358 CD2 HIS A 101 6.479 11.577 -7.630 1.00 1.00 C ATOM 359 CE1 HIS A 101 8.052 10.069 -7.221 1.00 1.00 C ATOM 360 NE2 HIS A 101 7.011 10.360 -8.026 1.00 1.00 N ATOM 0 H HIS A 101 7.133 16.091 -5.317 1.00 1.00 H new ATOM 0 HA HIS A 101 9.023 13.936 -6.150 1.00 1.00 H new ATOM 0 HB2 HIS A 101 7.074 13.106 -4.745 1.00 1.00 H new ATOM 0 HB3 HIS A 101 6.015 13.681 -6.017 1.00 1.00 H new ATOM 0 HD1 HIS A 101 8.914 11.106 -5.590 1.00 1.00 H new ATOM 0 HD2 HIS A 101 5.634 12.083 -8.074 1.00 1.00 H new ATOM 0 HE1 HIS A 101 8.665 9.182 -7.285 1.00 1.00 H new ATOM 369 N LYS A 102 8.778 14.621 -8.513 1.00 1.00 N ATOM 370 CA LYS A 102 8.927 15.249 -9.848 1.00 1.00 C ATOM 371 C LYS A 102 7.635 15.416 -10.658 1.00 1.00 C ATOM 372 O LYS A 102 7.181 16.544 -10.821 1.00 1.00 O ATOM 373 CB LYS A 102 10.050 14.532 -10.615 1.00 1.00 C ATOM 374 CG LYS A 102 10.539 15.391 -11.785 1.00 1.00 C ATOM 375 CD LYS A 102 11.883 14.872 -12.320 1.00 1.00 C ATOM 376 CE LYS A 102 12.656 16.065 -12.882 1.00 1.00 C ATOM 377 NZ LYS A 102 14.070 15.706 -13.177 1.00 1.00 N ATOM 0 H LYS A 102 9.437 13.858 -8.360 1.00 1.00 H new ATOM 0 HA LYS A 102 9.209 16.288 -9.680 1.00 1.00 H new ATOM 0 HB2 LYS A 102 10.880 14.320 -9.941 1.00 1.00 H new ATOM 0 HB3 LYS A 102 9.689 13.573 -10.987 1.00 1.00 H new ATOM 0 HG2 LYS A 102 9.797 15.382 -12.583 1.00 1.00 H new ATOM 0 HG3 LYS A 102 10.647 16.426 -11.462 1.00 1.00 H new ATOM 0 HD2 LYS A 102 12.450 14.390 -11.524 1.00 1.00 H new ATOM 0 HD3 LYS A 102 11.722 14.122 -13.095 1.00 1.00 H new ATOM 0 HE2 LYS A 102 12.171 16.418 -13.792 1.00 1.00 H new ATOM 0 HE3 LYS A 102 12.629 16.887 -12.167 1.00 1.00 H new ATOM 0 HZ1 LYS A 102 14.624 16.573 -13.327 1.00 1.00 H new ATOM 0 HZ2 LYS A 102 14.468 15.175 -12.376 1.00 1.00 H new ATOM 0 HZ3 LYS A 102 14.107 15.118 -14.034 1.00 1.00 H new ATOM 391 N THR A 103 6.983 14.331 -11.088 1.00 1.00 N ATOM 392 CA THR A 103 5.761 14.409 -11.929 1.00 1.00 C ATOM 393 C THR A 103 4.628 15.154 -11.221 1.00 1.00 C ATOM 394 O THR A 103 3.968 16.005 -11.814 1.00 1.00 O ATOM 395 CB THR A 103 5.282 13.013 -12.363 1.00 1.00 C ATOM 396 OG1 THR A 103 6.341 12.329 -12.998 1.00 1.00 O ATOM 397 CG2 THR A 103 4.109 13.125 -13.339 1.00 1.00 C ATOM 0 H THR A 103 7.275 13.378 -10.871 1.00 1.00 H new ATOM 0 HA THR A 103 6.035 14.973 -12.820 1.00 1.00 H new ATOM 0 HB THR A 103 4.958 12.467 -11.477 1.00 1.00 H new ATOM 0 HG1 THR A 103 6.037 11.439 -13.273 1.00 1.00 H new ATOM 0 HG21 THR A 103 3.785 12.127 -13.634 1.00 1.00 H new ATOM 0 HG22 THR A 103 3.283 13.647 -12.856 1.00 1.00 H new ATOM 0 HG23 THR A 103 4.423 13.681 -14.223 1.00 1.00 H new ATOM 405 N LEU A 104 4.456 14.894 -9.921 1.00 1.00 N ATOM 406 CA LEU A 104 3.450 15.549 -9.077 1.00 1.00 C ATOM 407 C LEU A 104 3.646 17.076 -9.048 1.00 1.00 C ATOM 408 O LEU A 104 2.670 17.820 -9.123 1.00 1.00 O ATOM 409 CB LEU A 104 3.515 14.905 -7.673 1.00 1.00 C ATOM 410 CG LEU A 104 2.459 15.381 -6.658 1.00 1.00 C ATOM 411 CD1 LEU A 104 1.035 15.125 -7.148 1.00 1.00 C ATOM 412 CD2 LEU A 104 2.645 14.634 -5.340 1.00 1.00 C ATOM 0 H LEU A 104 5.021 14.211 -9.417 1.00 1.00 H new ATOM 0 HA LEU A 104 2.452 15.399 -9.488 1.00 1.00 H new ATOM 0 HB2 LEU A 104 3.419 13.825 -7.786 1.00 1.00 H new ATOM 0 HB3 LEU A 104 4.503 15.095 -7.254 1.00 1.00 H new ATOM 0 HG LEU A 104 2.598 16.454 -6.529 1.00 1.00 H new ATOM 0 HD11 LEU A 104 0.324 15.477 -6.400 1.00 1.00 H new ATOM 0 HD12 LEU A 104 0.871 15.659 -8.084 1.00 1.00 H new ATOM 0 HD13 LEU A 104 0.893 14.057 -7.310 1.00 1.00 H new ATOM 0 HD21 LEU A 104 1.897 14.971 -4.622 1.00 1.00 H new ATOM 0 HD22 LEU A 104 2.529 13.563 -5.509 1.00 1.00 H new ATOM 0 HD23 LEU A 104 3.642 14.833 -4.946 1.00 1.00 H new ATOM 424 N LYS A 105 4.900 17.552 -9.018 1.00 1.00 N ATOM 425 CA LYS A 105 5.231 18.983 -9.089 1.00 1.00 C ATOM 426 C LYS A 105 4.915 19.587 -10.458 1.00 1.00 C ATOM 427 O LYS A 105 4.431 20.714 -10.513 1.00 1.00 O ATOM 428 CB LYS A 105 6.706 19.190 -8.684 1.00 1.00 C ATOM 429 CG LYS A 105 7.199 20.652 -8.741 1.00 1.00 C ATOM 430 CD LYS A 105 6.444 21.641 -7.833 1.00 1.00 C ATOM 431 CE LYS A 105 6.750 21.413 -6.343 1.00 1.00 C ATOM 432 NZ LYS A 105 5.998 22.366 -5.477 1.00 1.00 N ATOM 0 H LYS A 105 5.720 16.949 -8.943 1.00 1.00 H new ATOM 0 HA LYS A 105 4.598 19.520 -8.383 1.00 1.00 H new ATOM 0 HB2 LYS A 105 6.845 18.815 -7.670 1.00 1.00 H new ATOM 0 HB3 LYS A 105 7.335 18.585 -9.337 1.00 1.00 H new ATOM 0 HG2 LYS A 105 8.255 20.672 -8.472 1.00 1.00 H new ATOM 0 HG3 LYS A 105 7.126 21.002 -9.771 1.00 1.00 H new ATOM 0 HD2 LYS A 105 6.715 22.661 -8.106 1.00 1.00 H new ATOM 0 HD3 LYS A 105 5.372 21.540 -8.001 1.00 1.00 H new ATOM 0 HE2 LYS A 105 6.491 20.390 -6.070 1.00 1.00 H new ATOM 0 HE3 LYS A 105 7.820 21.528 -6.169 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 6.545 22.557 -4.614 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 5.844 23.256 -5.993 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 5.080 21.951 -5.220 1.00 1.00 H new ATOM 446 N GLU A 106 5.103 18.852 -11.556 1.00 1.00 N ATOM 447 CA GLU A 106 4.779 19.372 -12.888 1.00 1.00 C ATOM 448 C GLU A 106 3.282 19.571 -13.038 1.00 1.00 C ATOM 449 O GLU A 106 2.824 20.590 -13.536 1.00 1.00 O ATOM 450 CB GLU A 106 5.231 18.439 -14.015 1.00 1.00 C ATOM 451 CG GLU A 106 6.658 17.950 -13.847 1.00 1.00 C ATOM 452 CD GLU A 106 7.191 17.328 -15.151 1.00 1.00 C ATOM 453 OE1 GLU A 106 7.004 16.107 -15.376 1.00 1.00 O ATOM 454 OE2 GLU A 106 7.810 18.059 -15.962 1.00 1.00 O ATOM 0 H GLU A 106 5.475 17.902 -11.551 1.00 1.00 H new ATOM 0 HA GLU A 106 5.313 20.318 -12.972 1.00 1.00 H new ATOM 0 HB2 GLU A 106 4.562 17.580 -14.058 1.00 1.00 H new ATOM 0 HB3 GLU A 106 5.142 18.960 -14.968 1.00 1.00 H new ATOM 0 HG2 GLU A 106 7.297 18.781 -13.550 1.00 1.00 H new ATOM 0 HG3 GLU A 106 6.700 17.213 -13.045 1.00 1.00 H new ATOM 461 N TRP A 107 2.507 18.611 -12.546 1.00 1.00 N ATOM 462 CA TRP A 107 1.042 18.706 -12.573 1.00 1.00 C ATOM 463 C TRP A 107 0.510 19.904 -11.768 1.00 1.00 C ATOM 464 O TRP A 107 -0.410 20.598 -12.214 1.00 1.00 O ATOM 465 CB TRP A 107 0.417 17.398 -12.087 1.00 1.00 C ATOM 466 CG TRP A 107 0.658 16.153 -12.885 1.00 1.00 C ATOM 467 CD1 TRP A 107 1.482 15.997 -13.950 1.00 1.00 C ATOM 468 CD2 TRP A 107 0.062 14.845 -12.653 1.00 1.00 C ATOM 469 NE1 TRP A 107 1.441 14.687 -14.379 1.00 1.00 N ATOM 470 CE2 TRP A 107 0.627 13.923 -13.580 1.00 1.00 C ATOM 471 CE3 TRP A 107 -0.902 14.347 -11.755 1.00 1.00 C ATOM 472 CZ2 TRP A 107 0.321 12.559 -13.567 1.00 1.00 C ATOM 473 CZ3 TRP A 107 -1.275 12.990 -11.784 1.00 1.00 C ATOM 474 CH2 TRP A 107 -0.648 12.093 -12.668 1.00 1.00 C ATOM 0 H TRP A 107 2.864 17.755 -12.122 1.00 1.00 H new ATOM 0 HA TRP A 107 0.749 18.876 -13.609 1.00 1.00 H new ATOM 0 HB2 TRP A 107 0.773 17.216 -11.073 1.00 1.00 H new ATOM 0 HB3 TRP A 107 -0.661 17.548 -12.024 1.00 1.00 H new ATOM 0 HD1 TRP A 107 2.079 16.779 -14.395 1.00 1.00 H new ATOM 0 HE1 TRP A 107 1.951 14.331 -15.187 1.00 1.00 H new ATOM 0 HE3 TRP A 107 -1.359 15.012 -11.038 1.00 1.00 H new ATOM 0 HZ2 TRP A 107 0.822 11.877 -14.238 1.00 1.00 H new ATOM 0 HZ3 TRP A 107 -2.050 12.634 -11.121 1.00 1.00 H new ATOM 0 HH2 TRP A 107 -0.913 11.046 -12.654 1.00 1.00 H new ATOM 485 N LYS A 108 1.123 20.209 -10.615 1.00 1.00 N ATOM 486 CA LYS A 108 0.810 21.425 -9.845 1.00 1.00 C ATOM 487 C LYS A 108 1.189 22.707 -10.598 1.00 1.00 C ATOM 488 O LYS A 108 0.479 23.702 -10.486 1.00 1.00 O ATOM 489 CB LYS A 108 1.527 21.424 -8.488 1.00 1.00 C ATOM 490 CG LYS A 108 0.956 20.373 -7.536 1.00 1.00 C ATOM 491 CD LYS A 108 1.573 20.560 -6.150 1.00 1.00 C ATOM 492 CE LYS A 108 1.153 19.403 -5.241 1.00 1.00 C ATOM 493 NZ LYS A 108 1.624 19.619 -3.852 1.00 1.00 N ATOM 0 H LYS A 108 1.845 19.626 -10.191 1.00 1.00 H new ATOM 0 HA LYS A 108 -0.269 21.414 -9.694 1.00 1.00 H new ATOM 0 HB2 LYS A 108 2.590 21.235 -8.640 1.00 1.00 H new ATOM 0 HB3 LYS A 108 1.441 22.410 -8.032 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -0.128 20.467 -7.480 1.00 1.00 H new ATOM 0 HG3 LYS A 108 1.170 19.372 -7.910 1.00 1.00 H new ATOM 0 HD2 LYS A 108 2.660 20.599 -6.227 1.00 1.00 H new ATOM 0 HD3 LYS A 108 1.249 21.508 -5.722 1.00 1.00 H new ATOM 0 HE2 LYS A 108 0.067 19.305 -5.249 1.00 1.00 H new ATOM 0 HE3 LYS A 108 1.560 18.468 -5.625 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 1.798 18.700 -3.398 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 2.505 20.171 -3.866 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 0.899 20.138 -3.316 1.00 1.00 H new ATOM 507 N ALA A 109 2.270 22.683 -11.380 1.00 1.00 N ATOM 508 CA ALA A 109 2.681 23.817 -12.197 1.00 1.00 C ATOM 509 C ALA A 109 1.699 24.053 -13.357 1.00 1.00 C ATOM 510 O ALA A 109 1.245 25.174 -13.601 1.00 1.00 O ATOM 511 CB ALA A 109 4.077 23.533 -12.767 1.00 1.00 C ATOM 0 H ALA A 109 2.884 21.873 -11.462 1.00 1.00 H new ATOM 0 HA ALA A 109 2.693 24.711 -11.574 1.00 1.00 H new ATOM 0 HB1 ALA A 109 4.397 24.375 -13.381 1.00 1.00 H new ATOM 0 HB2 ALA A 109 4.783 23.392 -11.948 1.00 1.00 H new ATOM 0 HB3 ALA A 109 4.044 22.630 -13.377 1.00 1.00 H new ATOM 517 N LYS A 110 1.391 22.963 -14.070 1.00 1.00 N ATOM 518 CA LYS A 110 0.665 22.945 -15.327 1.00 1.00 C ATOM 519 C LYS A 110 -0.843 23.195 -15.199 1.00 1.00 C ATOM 520 O LYS A 110 -1.419 23.837 -16.079 1.00 1.00 O ATOM 521 CB LYS A 110 0.940 21.611 -16.039 1.00 1.00 C ATOM 522 CG LYS A 110 2.345 21.568 -16.672 1.00 1.00 C ATOM 523 CD LYS A 110 2.679 20.212 -17.316 1.00 1.00 C ATOM 524 CE LYS A 110 1.921 19.965 -18.633 1.00 1.00 C ATOM 525 NZ LYS A 110 2.502 20.724 -19.782 1.00 1.00 N ATOM 0 H LYS A 110 1.659 22.028 -13.763 1.00 1.00 H new ATOM 0 HA LYS A 110 1.034 23.785 -15.916 1.00 1.00 H new ATOM 0 HB2 LYS A 110 0.839 20.793 -15.326 1.00 1.00 H new ATOM 0 HB3 LYS A 110 0.189 21.453 -16.813 1.00 1.00 H new ATOM 0 HG2 LYS A 110 2.420 22.350 -17.428 1.00 1.00 H new ATOM 0 HG3 LYS A 110 3.088 21.792 -15.907 1.00 1.00 H new ATOM 0 HD2 LYS A 110 3.751 20.161 -17.506 1.00 1.00 H new ATOM 0 HD3 LYS A 110 2.442 19.414 -16.612 1.00 1.00 H new ATOM 0 HE2 LYS A 110 1.936 18.899 -18.862 1.00 1.00 H new ATOM 0 HE3 LYS A 110 0.877 20.249 -18.506 1.00 1.00 H new ATOM 0 HZ1 LYS A 110 1.955 20.522 -20.643 1.00 1.00 H new ATOM 0 HZ2 LYS A 110 2.465 21.743 -19.579 1.00 1.00 H new ATOM 0 HZ3 LYS A 110 3.491 20.435 -19.924 1.00 1.00 H new ATOM 539 N TRP A 111 -1.466 22.732 -14.106 1.00 1.00 N ATOM 540 CA TRP A 111 -2.924 22.823 -13.883 1.00 1.00 C ATOM 541 C TRP A 111 -3.302 23.337 -12.482 1.00 1.00 C ATOM 542 O TRP A 111 -4.120 24.253 -12.382 1.00 1.00 O ATOM 543 CB TRP A 111 -3.583 21.465 -14.172 1.00 1.00 C ATOM 544 CG TRP A 111 -3.370 20.939 -15.563 1.00 1.00 C ATOM 545 CD1 TRP A 111 -4.053 21.318 -16.667 1.00 1.00 C ATOM 546 CD2 TRP A 111 -2.371 19.982 -16.031 1.00 1.00 C ATOM 547 NE1 TRP A 111 -3.542 20.668 -17.777 1.00 1.00 N ATOM 548 CE2 TRP A 111 -2.494 19.837 -17.444 1.00 1.00 C ATOM 549 CE3 TRP A 111 -1.356 19.241 -15.397 1.00 1.00 C ATOM 550 CZ2 TRP A 111 -1.651 18.994 -18.187 1.00 1.00 C ATOM 551 CZ3 TRP A 111 -0.470 18.438 -16.139 1.00 1.00 C ATOM 552 CH2 TRP A 111 -0.634 18.284 -17.526 1.00 1.00 C ATOM 0 H TRP A 111 -0.969 22.277 -13.340 1.00 1.00 H new ATOM 0 HA TRP A 111 -3.305 23.569 -14.580 1.00 1.00 H new ATOM 0 HB2 TRP A 111 -3.200 20.733 -13.461 1.00 1.00 H new ATOM 0 HB3 TRP A 111 -4.655 21.553 -13.993 1.00 1.00 H new ATOM 0 HD1 TRP A 111 -4.873 22.021 -16.680 1.00 1.00 H new ATOM 0 HE1 TRP A 111 -3.897 20.789 -18.725 1.00 1.00 H new ATOM 0 HE3 TRP A 111 -1.255 19.290 -14.323 1.00 1.00 H new ATOM 0 HZ2 TRP A 111 -1.783 18.893 -19.254 1.00 1.00 H new ATOM 0 HZ3 TRP A 111 0.344 17.935 -15.638 1.00 1.00 H new ATOM 0 HH2 TRP A 111 0.017 17.624 -18.080 1.00 1.00 H new ATOM 563 N GLY A 112 -2.693 22.808 -11.410 1.00 1.00 N ATOM 564 CA GLY A 112 -2.806 23.357 -10.044 1.00 1.00 C ATOM 565 C GLY A 112 -2.947 22.310 -8.932 1.00 1.00 C ATOM 566 O GLY A 112 -3.478 21.228 -9.176 1.00 1.00 O ATOM 0 H GLY A 112 -2.102 21.979 -11.464 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -1.925 23.965 -9.839 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -3.668 24.023 -10.007 1.00 1.00 H new ATOM 570 N PRO A 113 -2.544 22.612 -7.682 1.00 1.00 N ATOM 571 CA PRO A 113 -2.672 21.683 -6.552 1.00 1.00 C ATOM 572 C PRO A 113 -4.120 21.296 -6.228 1.00 1.00 C ATOM 573 O PRO A 113 -4.378 20.145 -5.894 1.00 1.00 O ATOM 574 CB PRO A 113 -1.978 22.359 -5.366 1.00 1.00 C ATOM 575 CG PRO A 113 -1.952 23.840 -5.733 1.00 1.00 C ATOM 576 CD PRO A 113 -1.902 23.850 -7.256 1.00 1.00 C ATOM 0 HA PRO A 113 -2.204 20.731 -6.803 1.00 1.00 H new ATOM 0 HB2 PRO A 113 -2.523 22.190 -4.438 1.00 1.00 H new ATOM 0 HB3 PRO A 113 -0.971 21.968 -5.220 1.00 1.00 H new ATOM 0 HG2 PRO A 113 -2.836 24.358 -5.361 1.00 1.00 H new ATOM 0 HG3 PRO A 113 -1.085 24.341 -5.303 1.00 1.00 H new ATOM 0 HD2 PRO A 113 -2.422 24.719 -7.659 1.00 1.00 H new ATOM 0 HD3 PRO A 113 -0.873 23.900 -7.613 1.00 1.00 H new ATOM 584 N GLU A 114 -5.084 22.205 -6.409 1.00 1.00 N ATOM 585 CA GLU A 114 -6.509 21.926 -6.172 1.00 1.00 C ATOM 586 C GLU A 114 -7.015 20.811 -7.085 1.00 1.00 C ATOM 587 O GLU A 114 -7.672 19.862 -6.655 1.00 1.00 O ATOM 588 CB GLU A 114 -7.345 23.177 -6.452 1.00 1.00 C ATOM 589 CG GLU A 114 -6.781 24.455 -5.833 1.00 1.00 C ATOM 590 CD GLU A 114 -7.782 25.621 -5.949 1.00 1.00 C ATOM 591 OE1 GLU A 114 -7.775 26.333 -6.982 1.00 1.00 O ATOM 592 OE2 GLU A 114 -8.583 25.837 -5.005 1.00 1.00 O ATOM 0 H GLU A 114 -4.900 23.157 -6.725 1.00 1.00 H new ATOM 0 HA GLU A 114 -6.610 21.620 -5.131 1.00 1.00 H new ATOM 0 HB2 GLU A 114 -7.426 23.313 -7.530 1.00 1.00 H new ATOM 0 HB3 GLU A 114 -8.355 23.018 -6.074 1.00 1.00 H new ATOM 0 HG2 GLU A 114 -6.543 24.280 -4.784 1.00 1.00 H new ATOM 0 HG3 GLU A 114 -5.849 24.722 -6.331 1.00 1.00 H new ATOM 599 N ALA A 115 -6.643 20.937 -8.361 1.00 1.00 N ATOM 600 CA ALA A 115 -6.926 19.965 -9.406 1.00 1.00 C ATOM 601 C ALA A 115 -6.303 18.613 -9.041 1.00 1.00 C ATOM 602 O ALA A 115 -6.982 17.595 -8.927 1.00 1.00 O ATOM 603 CB ALA A 115 -6.350 20.489 -10.725 1.00 1.00 C ATOM 0 H ALA A 115 -6.121 21.745 -8.700 1.00 1.00 H new ATOM 0 HA ALA A 115 -8.002 19.824 -9.511 1.00 1.00 H new ATOM 0 HB1 ALA A 115 -6.553 19.772 -11.521 1.00 1.00 H new ATOM 0 HB2 ALA A 115 -6.813 21.445 -10.970 1.00 1.00 H new ATOM 0 HB3 ALA A 115 -5.273 20.623 -10.624 1.00 1.00 H new ATOM 609 N VAL A 116 -4.997 18.656 -8.783 1.00 1.00 N ATOM 610 CA VAL A 116 -4.152 17.505 -8.520 1.00 1.00 C ATOM 611 C VAL A 116 -4.645 16.693 -7.322 1.00 1.00 C ATOM 612 O VAL A 116 -4.797 15.478 -7.425 1.00 1.00 O ATOM 613 CB VAL A 116 -2.706 17.998 -8.357 1.00 1.00 C ATOM 614 CG1 VAL A 116 -1.739 16.991 -7.739 1.00 1.00 C ATOM 615 CG2 VAL A 116 -2.175 18.395 -9.739 1.00 1.00 C ATOM 0 H VAL A 116 -4.482 19.536 -8.751 1.00 1.00 H new ATOM 0 HA VAL A 116 -4.196 16.813 -9.361 1.00 1.00 H new ATOM 0 HB VAL A 116 -2.751 18.834 -7.659 1.00 1.00 H new ATOM 0 HG11 VAL A 116 -0.747 17.436 -7.668 1.00 1.00 H new ATOM 0 HG12 VAL A 116 -2.086 16.717 -6.743 1.00 1.00 H new ATOM 0 HG13 VAL A 116 -1.693 16.100 -8.365 1.00 1.00 H new ATOM 0 HG21 VAL A 116 -1.148 18.749 -9.646 1.00 1.00 H new ATOM 0 HG22 VAL A 116 -2.203 17.530 -10.402 1.00 1.00 H new ATOM 0 HG23 VAL A 116 -2.796 19.189 -10.153 1.00 1.00 H new ATOM 625 N GLU A 117 -4.962 17.348 -6.205 1.00 1.00 N ATOM 626 CA GLU A 117 -5.520 16.682 -5.024 1.00 1.00 C ATOM 627 C GLU A 117 -6.935 16.137 -5.285 1.00 1.00 C ATOM 628 O GLU A 117 -7.276 15.062 -4.789 1.00 1.00 O ATOM 629 CB GLU A 117 -5.571 17.654 -3.833 1.00 1.00 C ATOM 630 CG GLU A 117 -4.192 18.026 -3.269 1.00 1.00 C ATOM 631 CD GLU A 117 -4.359 18.953 -2.048 1.00 1.00 C ATOM 632 OE1 GLU A 117 -4.765 18.471 -0.959 1.00 1.00 O ATOM 633 OE2 GLU A 117 -4.120 20.180 -2.164 1.00 1.00 O ATOM 0 H GLU A 117 -4.840 18.354 -6.092 1.00 1.00 H new ATOM 0 HA GLU A 117 -4.864 15.843 -4.794 1.00 1.00 H new ATOM 0 HB2 GLU A 117 -6.083 18.565 -4.143 1.00 1.00 H new ATOM 0 HB3 GLU A 117 -6.168 17.207 -3.038 1.00 1.00 H new ATOM 0 HG2 GLU A 117 -3.652 17.124 -2.981 1.00 1.00 H new ATOM 0 HG3 GLU A 117 -3.597 18.523 -4.036 1.00 1.00 H new ATOM 640 N SER A 118 -7.754 16.840 -6.079 1.00 1.00 N ATOM 641 CA SER A 118 -9.111 16.393 -6.430 1.00 1.00 C ATOM 642 C SER A 118 -9.099 15.109 -7.276 1.00 1.00 C ATOM 643 O SER A 118 -9.962 14.238 -7.113 1.00 1.00 O ATOM 644 CB SER A 118 -9.873 17.509 -7.156 1.00 1.00 C ATOM 645 OG SER A 118 -11.234 17.153 -7.345 1.00 1.00 O ATOM 0 H SER A 118 -7.496 17.734 -6.496 1.00 1.00 H new ATOM 0 HA SER A 118 -9.626 16.160 -5.498 1.00 1.00 H new ATOM 0 HB2 SER A 118 -9.811 18.432 -6.579 1.00 1.00 H new ATOM 0 HB3 SER A 118 -9.407 17.705 -8.122 1.00 1.00 H new ATOM 0 HG SER A 118 -11.701 17.880 -7.808 1.00 1.00 H new ATOM 651 N TRP A 119 -8.084 14.941 -8.132 1.00 1.00 N ATOM 652 CA TRP A 119 -7.872 13.726 -8.922 1.00 1.00 C ATOM 653 C TRP A 119 -7.399 12.511 -8.095 1.00 1.00 C ATOM 654 O TRP A 119 -7.343 11.401 -8.635 1.00 1.00 O ATOM 655 CB TRP A 119 -6.833 13.985 -10.021 1.00 1.00 C ATOM 656 CG TRP A 119 -6.995 15.152 -10.954 1.00 1.00 C ATOM 657 CD1 TRP A 119 -8.150 15.780 -11.275 1.00 1.00 C ATOM 658 CD2 TRP A 119 -5.948 15.839 -11.712 1.00 1.00 C ATOM 659 NE1 TRP A 119 -7.888 16.826 -12.143 1.00 1.00 N ATOM 660 CE2 TRP A 119 -6.545 16.914 -12.439 1.00 1.00 C ATOM 661 CE3 TRP A 119 -4.553 15.664 -11.864 1.00 1.00 C ATOM 662 CZ2 TRP A 119 -5.795 17.777 -13.254 1.00 1.00 C ATOM 663 CZ3 TRP A 119 -3.792 16.521 -12.687 1.00 1.00 C ATOM 664 CH2 TRP A 119 -4.410 17.577 -13.376 1.00 1.00 C ATOM 0 H TRP A 119 -7.377 15.657 -8.297 1.00 1.00 H new ATOM 0 HA TRP A 119 -8.848 13.480 -9.340 1.00 1.00 H new ATOM 0 HB2 TRP A 119 -5.865 14.094 -9.532 1.00 1.00 H new ATOM 0 HB3 TRP A 119 -6.780 13.086 -10.634 1.00 1.00 H new ATOM 0 HD1 TRP A 119 -9.129 15.506 -10.909 1.00 1.00 H new ATOM 0 HE1 TRP A 119 -8.600 17.453 -12.517 1.00 1.00 H new ATOM 0 HE3 TRP A 119 -4.060 14.858 -11.340 1.00 1.00 H new ATOM 0 HZ2 TRP A 119 -6.278 18.586 -13.782 1.00 1.00 H new ATOM 0 HZ3 TRP A 119 -2.728 16.364 -12.788 1.00 1.00 H new ATOM 0 HH2 TRP A 119 -3.821 18.234 -13.999 1.00 1.00 H new ATOM 675 N ALA A 120 -6.993 12.689 -6.829 1.00 1.00 N ATOM 676 CA ALA A 120 -6.362 11.639 -6.048 1.00 1.00 C ATOM 677 C ALA A 120 -7.300 10.499 -5.614 1.00 1.00 C ATOM 678 O ALA A 120 -8.533 10.566 -5.651 1.00 1.00 O ATOM 679 CB ALA A 120 -5.627 12.228 -4.835 1.00 1.00 C ATOM 0 H ALA A 120 -7.098 13.570 -6.326 1.00 1.00 H new ATOM 0 HA ALA A 120 -5.645 11.176 -6.726 1.00 1.00 H new ATOM 0 HB1 ALA A 120 -5.162 11.423 -4.265 1.00 1.00 H new ATOM 0 HB2 ALA A 120 -4.858 12.921 -5.177 1.00 1.00 H new ATOM 0 HB3 ALA A 120 -6.338 12.758 -4.201 1.00 1.00 H new ATOM 685 N THR A 121 -6.622 9.472 -5.126 1.00 1.00 N ATOM 686 CA THR A 121 -7.089 8.151 -4.684 1.00 1.00 C ATOM 687 C THR A 121 -6.243 7.729 -3.493 1.00 1.00 C ATOM 688 O THR A 121 -5.045 7.976 -3.493 1.00 1.00 O ATOM 689 CB THR A 121 -6.878 7.149 -5.825 1.00 1.00 C ATOM 690 OG1 THR A 121 -7.590 7.541 -6.983 1.00 1.00 O ATOM 691 CG2 THR A 121 -7.376 5.764 -5.425 1.00 1.00 C ATOM 0 H THR A 121 -5.611 9.546 -5.014 1.00 1.00 H new ATOM 0 HA THR A 121 -8.144 8.184 -4.411 1.00 1.00 H new ATOM 0 HB THR A 121 -5.808 7.124 -6.033 1.00 1.00 H new ATOM 0 HG1 THR A 121 -7.438 6.887 -7.697 1.00 1.00 H new ATOM 0 HG21 THR A 121 -7.217 5.068 -6.249 1.00 1.00 H new ATOM 0 HG22 THR A 121 -6.828 5.420 -4.548 1.00 1.00 H new ATOM 0 HG23 THR A 121 -8.440 5.813 -5.192 1.00 1.00 H new ATOM 699 N LEU A 122 -6.825 7.054 -2.505 1.00 1.00 N ATOM 700 CA LEU A 122 -6.140 6.661 -1.267 1.00 1.00 C ATOM 701 C LEU A 122 -5.906 5.148 -1.268 1.00 1.00 C ATOM 702 O LEU A 122 -6.839 4.359 -1.432 1.00 1.00 O ATOM 703 CB LEU A 122 -6.965 7.165 -0.067 1.00 1.00 C ATOM 704 CG LEU A 122 -6.146 7.389 1.221 1.00 1.00 C ATOM 705 CD1 LEU A 122 -7.049 7.998 2.294 1.00 1.00 C ATOM 706 CD2 LEU A 122 -5.529 6.115 1.793 1.00 1.00 C ATOM 0 H LEU A 122 -7.801 6.758 -2.538 1.00 1.00 H new ATOM 0 HA LEU A 122 -5.153 7.118 -1.191 1.00 1.00 H new ATOM 0 HB2 LEU A 122 -7.449 8.102 -0.343 1.00 1.00 H new ATOM 0 HB3 LEU A 122 -7.757 6.446 0.141 1.00 1.00 H new ATOM 0 HG LEU A 122 -5.327 8.053 0.945 1.00 1.00 H new ATOM 0 HD11 LEU A 122 -6.474 8.158 3.206 1.00 1.00 H new ATOM 0 HD12 LEU A 122 -7.442 8.952 1.941 1.00 1.00 H new ATOM 0 HD13 LEU A 122 -7.876 7.319 2.501 1.00 1.00 H new ATOM 0 HD21 LEU A 122 -4.970 6.356 2.697 1.00 1.00 H new ATOM 0 HD22 LEU A 122 -6.320 5.404 2.034 1.00 1.00 H new ATOM 0 HD23 LEU A 122 -4.857 5.674 1.057 1.00 1.00 H new ATOM 718 N LEU A 123 -4.641 4.759 -1.106 1.00 1.00 N ATOM 719 CA LEU A 123 -4.123 3.398 -1.216 1.00 1.00 C ATOM 720 C LEU A 123 -3.437 2.967 0.091 1.00 1.00 C ATOM 721 O LEU A 123 -2.569 3.657 0.626 1.00 1.00 O ATOM 722 CB LEU A 123 -3.156 3.344 -2.412 1.00 1.00 C ATOM 723 CG LEU A 123 -3.781 3.710 -3.765 1.00 1.00 C ATOM 724 CD1 LEU A 123 -2.698 3.586 -4.832 1.00 1.00 C ATOM 725 CD2 LEU A 123 -4.946 2.800 -4.162 1.00 1.00 C ATOM 0 H LEU A 123 -3.906 5.429 -0.880 1.00 1.00 H new ATOM 0 HA LEU A 123 -4.941 2.697 -1.384 1.00 1.00 H new ATOM 0 HB2 LEU A 123 -2.323 4.020 -2.218 1.00 1.00 H new ATOM 0 HB3 LEU A 123 -2.741 2.338 -2.480 1.00 1.00 H new ATOM 0 HG LEU A 123 -4.175 4.723 -3.679 1.00 1.00 H new ATOM 0 HD11 LEU A 123 -3.116 3.841 -5.806 1.00 1.00 H new ATOM 0 HD12 LEU A 123 -1.879 4.266 -4.599 1.00 1.00 H new ATOM 0 HD13 LEU A 123 -2.325 2.562 -4.854 1.00 1.00 H new ATOM 0 HD21 LEU A 123 -5.341 3.115 -5.128 1.00 1.00 H new ATOM 0 HD22 LEU A 123 -4.596 1.770 -4.231 1.00 1.00 H new ATOM 0 HD23 LEU A 123 -5.732 2.866 -3.410 1.00 1.00 H new ATOM 737 N GLY A 124 -3.838 1.799 0.591 1.00 1.00 N ATOM 738 CA GLY A 124 -3.410 1.261 1.894 1.00 1.00 C ATOM 739 C GLY A 124 -2.166 0.356 1.862 1.00 1.00 C ATOM 740 O GLY A 124 -1.596 0.072 2.917 1.00 1.00 O ATOM 0 H GLY A 124 -4.483 1.183 0.096 1.00 1.00 H new ATOM 0 HA2 GLY A 124 -3.212 2.097 2.565 1.00 1.00 H new ATOM 0 HA3 GLY A 124 -4.237 0.696 2.324 1.00 1.00 H new ATOM 744 N HIS A 125 -1.741 -0.085 0.670 1.00 1.00 N ATOM 745 CA HIS A 125 -0.577 -0.957 0.439 1.00 1.00 C ATOM 746 C HIS A 125 0.061 -0.674 -0.936 1.00 1.00 C ATOM 747 O HIS A 125 -0.619 -0.872 -1.972 1.00 1.00 O ATOM 748 CB HIS A 125 -1.001 -2.424 0.585 1.00 1.00 C ATOM 749 CG HIS A 125 0.116 -3.402 0.318 1.00 1.00 C ATOM 750 ND1 HIS A 125 0.428 -3.966 -0.906 1.00 1.00 N ATOM 751 CD2 HIS A 125 1.006 -3.883 1.238 1.00 1.00 C ATOM 752 CE1 HIS A 125 1.492 -4.779 -0.735 1.00 1.00 C ATOM 753 NE2 HIS A 125 1.860 -4.742 0.564 1.00 1.00 N ATOM 0 H HIS A 125 -2.217 0.165 -0.196 1.00 1.00 H new ATOM 0 HA HIS A 125 0.187 -0.746 1.187 1.00 1.00 H new ATOM 0 HB2 HIS A 125 -1.381 -2.585 1.594 1.00 1.00 H new ATOM 0 HB3 HIS A 125 -1.823 -2.627 -0.102 1.00 1.00 H new ATOM 0 HD2 HIS A 125 1.038 -3.640 2.290 1.00 1.00 H new ATOM 0 HE1 HIS A 125 1.970 -5.362 -1.508 1.00 1.00 H new ATOM 0 HE2 HIS A 125 2.635 -5.259 0.979 1.00 1.00 H new TER 762 HIS A 125 ATOM 763 O5' DC B 1 -3.568 27.801 6.679 1.00 1.00 O ATOM 764 C5' DC B 1 -3.737 28.919 7.556 1.00 1.00 C ATOM 765 C4' DC B 1 -2.959 28.815 8.883 1.00 1.00 C ATOM 766 O4' DC B 1 -3.489 27.780 9.704 1.00 1.00 O ATOM 767 C3' DC B 1 -1.463 28.560 8.658 1.00 1.00 C ATOM 768 O3' DC B 1 -0.681 29.474 9.431 1.00 1.00 O ATOM 769 C2' DC B 1 -1.304 27.099 9.057 1.00 1.00 C ATOM 770 C1' DC B 1 -2.460 26.862 10.034 1.00 1.00 C ATOM 771 N1 DC B 1 -3.006 25.483 9.987 1.00 1.00 N ATOM 772 C2 DC B 1 -3.209 24.752 11.163 1.00 1.00 C ATOM 773 O2 DC B 1 -2.895 25.192 12.271 1.00 1.00 O ATOM 774 N3 DC B 1 -3.776 23.520 11.127 1.00 1.00 N ATOM 775 C4 DC B 1 -4.087 23.015 9.948 1.00 1.00 C ATOM 776 N4 DC B 1 -4.658 21.842 9.970 1.00 1.00 N ATOM 777 C5 DC B 1 -3.892 23.705 8.720 1.00 1.00 C ATOM 778 C6 DC B 1 -3.354 24.942 8.786 1.00 1.00 C ATOM 0 H5' DC B 1 -4.798 29.032 7.780 1.00 1.00 H new ATOM 0 H5'' DC B 1 -3.423 29.824 7.035 1.00 1.00 H new ATOM 0 H4' DC B 1 -3.073 29.776 9.384 1.00 1.00 H new ATOM 0 H3' DC B 1 -1.115 28.725 7.638 1.00 1.00 H new ATOM 0 H2' DC B 1 -1.369 26.438 8.192 1.00 1.00 H new ATOM 0 H2'' DC B 1 -0.338 26.915 9.527 1.00 1.00 H new ATOM 0 HO5' DC B 1 -4.093 27.943 5.864 1.00 1.00 H new ATOM 0 H1' DC B 1 -2.080 27.005 11.046 1.00 1.00 H new ATOM 0 H41 DC B 1 -4.927 21.389 9.096 1.00 1.00 H new ATOM 0 H42 DC B 1 -4.836 21.378 10.861 1.00 1.00 H new ATOM 0 H5 DC B 1 -4.163 23.259 7.775 1.00 1.00 H new ATOM 0 H6 DC B 1 -3.198 25.507 7.879 1.00 1.00 H new ATOM 791 P DG B 2 0.941 29.516 9.382 1.00 1.00 P ATOM 792 OP1 DG B 2 1.366 30.898 9.746 1.00 1.00 O ATOM 793 OP2 DG B 2 1.399 28.957 8.079 1.00 1.00 O ATOM 794 O5' DG B 2 1.412 28.503 10.563 1.00 1.00 O ATOM 795 C5' DG B 2 1.217 28.826 11.941 1.00 1.00 C ATOM 796 C4' DG B 2 1.755 27.765 12.924 1.00 1.00 C ATOM 797 O4' DG B 2 0.884 26.635 12.986 1.00 1.00 O ATOM 798 C3' DG B 2 3.175 27.271 12.583 1.00 1.00 C ATOM 799 O3' DG B 2 3.986 27.261 13.757 1.00 1.00 O ATOM 800 C2' DG B 2 2.869 25.890 12.004 1.00 1.00 C ATOM 801 C1' DG B 2 1.656 25.456 12.825 1.00 1.00 C ATOM 802 N9 DG B 2 0.852 24.409 12.161 1.00 1.00 N ATOM 803 C8 DG B 2 0.445 24.381 10.856 1.00 1.00 C ATOM 804 N7 DG B 2 -0.301 23.356 10.537 1.00 1.00 N ATOM 805 C5 DG B 2 -0.372 22.629 11.737 1.00 1.00 C ATOM 806 C6 DG B 2 -1.029 21.386 12.064 1.00 1.00 C ATOM 807 O6 DG B 2 -1.761 20.684 11.368 1.00 1.00 O ATOM 808 N1 DG B 2 -0.788 20.955 13.350 1.00 1.00 N ATOM 809 C2 DG B 2 -0.048 21.646 14.245 1.00 1.00 C ATOM 810 N2 DG B 2 0.088 21.105 15.425 1.00 1.00 N ATOM 811 N3 DG B 2 0.548 22.814 14.010 1.00 1.00 N ATOM 812 C4 DG B 2 0.356 23.255 12.728 1.00 1.00 C ATOM 0 H5' DG B 2 0.151 28.965 12.122 1.00 1.00 H new ATOM 0 H5'' DG B 2 1.703 29.779 12.151 1.00 1.00 H new ATOM 0 H4' DG B 2 1.799 28.268 13.890 1.00 1.00 H new ATOM 0 H3' DG B 2 3.751 27.885 11.891 1.00 1.00 H new ATOM 0 H2' DG B 2 2.644 25.936 10.939 1.00 1.00 H new ATOM 0 H2'' DG B 2 3.708 25.204 12.123 1.00 1.00 H new ATOM 0 H1' DG B 2 1.975 25.016 13.770 1.00 1.00 H new ATOM 0 H8 DG B 2 0.718 25.146 10.144 1.00 1.00 H new ATOM 0 H1 DG B 2 -1.191 20.065 13.643 1.00 1.00 H new ATOM 0 H21 DG B 2 0.635 21.579 16.143 1.00 1.00 H new ATOM 0 H22 DG B 2 -0.353 20.208 15.629 1.00 1.00 H new ATOM 824 P DC B 3 5.546 26.801 13.759 1.00 1.00 P ATOM 825 OP1 DC B 3 6.256 27.610 14.790 1.00 1.00 O ATOM 826 OP2 DC B 3 6.068 26.820 12.363 1.00 1.00 O ATOM 827 O5' DC B 3 5.476 25.262 14.264 1.00 1.00 O ATOM 828 C5' DC B 3 5.077 24.960 15.601 1.00 1.00 C ATOM 829 C4' DC B 3 4.966 23.456 15.906 1.00 1.00 C ATOM 830 O4' DC B 3 3.889 22.893 15.170 1.00 1.00 O ATOM 831 C3' DC B 3 6.254 22.668 15.609 1.00 1.00 C ATOM 832 O3' DC B 3 6.806 22.156 16.824 1.00 1.00 O ATOM 833 C2' DC B 3 5.789 21.570 14.649 1.00 1.00 C ATOM 834 C1' DC B 3 4.263 21.611 14.705 1.00 1.00 C ATOM 835 N1 DC B 3 3.647 21.377 13.378 1.00 1.00 N ATOM 836 C2 DC B 3 2.842 20.252 13.166 1.00 1.00 C ATOM 837 O2 DC B 3 2.668 19.396 14.036 1.00 1.00 O ATOM 838 N3 DC B 3 2.219 20.061 11.980 1.00 1.00 N ATOM 839 C4 DC B 3 2.419 20.942 11.027 1.00 1.00 C ATOM 840 N4 DC B 3 1.776 20.708 9.917 1.00 1.00 N ATOM 841 C5 DC B 3 3.245 22.095 11.164 1.00 1.00 C ATOM 842 C6 DC B 3 3.849 22.276 12.367 1.00 1.00 C ATOM 0 H5' DC B 3 4.113 25.430 15.794 1.00 1.00 H new ATOM 0 H5'' DC B 3 5.793 25.406 16.291 1.00 1.00 H new ATOM 0 H4' DC B 3 4.788 23.374 16.978 1.00 1.00 H new ATOM 0 H3' DC B 3 7.053 23.265 15.169 1.00 1.00 H new ATOM 0 H2' DC B 3 6.151 21.752 13.637 1.00 1.00 H new ATOM 0 H2'' DC B 3 6.168 20.594 14.953 1.00 1.00 H new ATOM 0 H1' DC B 3 3.913 20.819 15.367 1.00 1.00 H new ATOM 0 H41 DC B 3 1.876 21.344 9.126 1.00 1.00 H new ATOM 0 H42 DC B 3 1.173 19.889 9.840 1.00 1.00 H new ATOM 0 H5 DC B 3 3.384 22.791 10.350 1.00 1.00 H new ATOM 0 H6 DC B 3 4.490 23.131 12.526 1.00 1.00 H new ATOM 854 P DA B 4 8.260 21.429 16.897 1.00 1.00 P ATOM 855 OP1 DA B 4 8.696 21.437 18.323 1.00 1.00 O ATOM 856 OP2 DA B 4 9.161 22.043 15.881 1.00 1.00 O ATOM 857 O5' DA B 4 7.975 19.893 16.460 1.00 1.00 O ATOM 858 C5' DA B 4 7.137 19.052 17.250 1.00 1.00 C ATOM 859 C4' DA B 4 6.828 17.688 16.604 1.00 1.00 C ATOM 860 O4' DA B 4 5.879 17.802 15.548 1.00 1.00 O ATOM 861 C3' DA B 4 8.079 16.971 16.058 1.00 1.00 C ATOM 862 O3' DA B 4 8.194 15.672 16.640 1.00 1.00 O ATOM 863 C2' DA B 4 7.801 16.971 14.555 1.00 1.00 C ATOM 864 C1' DA B 4 6.278 16.930 14.505 1.00 1.00 C ATOM 865 N9 DA B 4 5.758 17.425 13.219 1.00 1.00 N ATOM 866 C8 DA B 4 6.077 18.611 12.625 1.00 1.00 C ATOM 867 N7 DA B 4 5.415 18.867 11.530 1.00 1.00 N ATOM 868 C5 DA B 4 4.638 17.708 11.371 1.00 1.00 C ATOM 869 C6 DA B 4 3.714 17.255 10.399 1.00 1.00 C ATOM 870 N6 DA B 4 3.338 17.965 9.359 1.00 1.00 N ATOM 871 N1 DA B 4 3.160 16.041 10.463 1.00 1.00 N ATOM 872 C2 DA B 4 3.485 15.279 11.501 1.00 1.00 C ATOM 873 N3 DA B 4 4.312 15.565 12.501 1.00 1.00 N ATOM 874 C4 DA B 4 4.862 16.807 12.377 1.00 1.00 C ATOM 0 H5' DA B 4 6.198 19.571 17.444 1.00 1.00 H new ATOM 0 H5'' DA B 4 7.614 18.885 18.216 1.00 1.00 H new ATOM 0 H4' DA B 4 6.414 17.088 17.414 1.00 1.00 H new ATOM 0 H3' DA B 4 9.036 17.437 16.290 1.00 1.00 H new ATOM 0 H2' DA B 4 8.200 17.861 14.068 1.00 1.00 H new ATOM 0 H2'' DA B 4 8.247 16.109 14.059 1.00 1.00 H new ATOM 0 H1' DA B 4 5.899 15.914 14.613 1.00 1.00 H new ATOM 0 H8 DA B 4 6.818 19.284 13.029 1.00 1.00 H new ATOM 0 H61 DA B 4 2.667 17.580 8.694 1.00 1.00 H new ATOM 0 H62 DA B 4 3.717 18.901 9.217 1.00 1.00 H new ATOM 0 H2 DA B 4 3.019 14.305 11.537 1.00 1.00 H new ATOM 886 P DT B 5 9.494 14.723 16.414 1.00 1.00 P ATOM 887 OP1 DT B 5 9.583 13.792 17.573 1.00 1.00 O ATOM 888 OP2 DT B 5 10.677 15.573 16.101 1.00 1.00 O ATOM 889 O5' DT B 5 9.115 13.866 15.092 1.00 1.00 O ATOM 890 C5' DT B 5 8.063 12.904 15.124 1.00 1.00 C ATOM 891 C4' DT B 5 7.807 12.231 13.766 1.00 1.00 C ATOM 892 O4' DT B 5 7.169 13.133 12.866 1.00 1.00 O ATOM 893 C3' DT B 5 9.084 11.688 13.096 1.00 1.00 C ATOM 894 O3' DT B 5 8.918 10.302 12.820 1.00 1.00 O ATOM 895 C2' DT B 5 9.191 12.575 11.852 1.00 1.00 C ATOM 896 C1' DT B 5 7.736 12.949 11.581 1.00 1.00 C ATOM 897 N1 DT B 5 7.530 14.185 10.773 1.00 1.00 N ATOM 898 C2 DT B 5 6.612 14.130 9.718 1.00 1.00 C ATOM 899 O2 DT B 5 6.052 13.096 9.360 1.00 1.00 O ATOM 900 N3 DT B 5 6.349 15.296 9.041 1.00 1.00 N ATOM 901 C4 DT B 5 6.983 16.495 9.264 1.00 1.00 C ATOM 902 O4 DT B 5 6.659 17.464 8.588 1.00 1.00 O ATOM 903 C5 DT B 5 8.004 16.470 10.315 1.00 1.00 C ATOM 904 C7 DT B 5 8.838 17.701 10.602 1.00 1.00 C ATOM 905 C6 DT B 5 8.224 15.346 11.043 1.00 1.00 C ATOM 0 H5' DT B 5 7.147 13.390 15.458 1.00 1.00 H new ATOM 0 H5'' DT B 5 8.304 12.138 15.861 1.00 1.00 H new ATOM 0 H4' DT B 5 7.159 11.381 13.982 1.00 1.00 H new ATOM 0 H3' DT B 5 9.996 11.732 13.691 1.00 1.00 H new ATOM 0 H2' DT B 5 9.808 13.455 12.034 1.00 1.00 H new ATOM 0 H2'' DT B 5 9.635 12.042 11.012 1.00 1.00 H new ATOM 0 H1' DT B 5 7.278 12.161 10.982 1.00 1.00 H new ATOM 0 H3 DT B 5 5.629 15.270 8.319 1.00 1.00 H new ATOM 0 H71 DT B 5 9.121 17.712 11.655 1.00 1.00 H new ATOM 0 H72 DT B 5 9.737 17.684 9.985 1.00 1.00 H new ATOM 0 H73 DT B 5 8.258 18.595 10.373 1.00 1.00 H new ATOM 0 H6 DT B 5 8.950 15.361 11.842 1.00 1.00 H new ATOM 918 P DA B 6 10.054 9.386 12.104 1.00 1.00 P ATOM 919 OP1 DA B 6 10.040 8.042 12.746 1.00 1.00 O ATOM 920 OP2 DA B 6 11.344 10.128 12.041 1.00 1.00 O ATOM 921 O5' DA B 6 9.458 9.257 10.603 1.00 1.00 O ATOM 922 C5' DA B 6 8.233 8.565 10.376 1.00 1.00 C ATOM 923 C4' DA B 6 7.796 8.506 8.905 1.00 1.00 C ATOM 924 O4' DA B 6 7.374 9.794 8.458 1.00 1.00 O ATOM 925 C3' DA B 6 8.894 7.980 7.966 1.00 1.00 C ATOM 926 O3' DA B 6 8.321 7.026 7.075 1.00 1.00 O ATOM 927 C2' DA B 6 9.387 9.275 7.328 1.00 1.00 C ATOM 928 C1' DA B 6 8.150 10.171 7.333 1.00 1.00 C ATOM 929 N9 DA B 6 8.498 11.604 7.421 1.00 1.00 N ATOM 930 C8 DA B 6 9.467 12.190 8.191 1.00 1.00 C ATOM 931 N7 DA B 6 9.600 13.482 8.021 1.00 1.00 N ATOM 932 C5 DA B 6 8.634 13.753 7.042 1.00 1.00 C ATOM 933 C6 DA B 6 8.225 14.916 6.347 1.00 1.00 C ATOM 934 N6 DA B 6 8.742 16.118 6.523 1.00 1.00 N ATOM 935 N1 DA B 6 7.259 14.871 5.433 1.00 1.00 N ATOM 936 C2 DA B 6 6.686 13.700 5.189 1.00 1.00 C ATOM 937 N3 DA B 6 6.952 12.530 5.759 1.00 1.00 N ATOM 938 C4 DA B 6 7.950 12.624 6.680 1.00 1.00 C ATOM 0 H5' DA B 6 7.446 9.046 10.956 1.00 1.00 H new ATOM 0 H5'' DA B 6 8.330 7.547 10.754 1.00 1.00 H new ATOM 0 H4' DA B 6 6.967 7.800 8.865 1.00 1.00 H new ATOM 0 H3' DA B 6 9.723 7.435 8.418 1.00 1.00 H new ATOM 0 H2' DA B 6 10.204 9.717 7.898 1.00 1.00 H new ATOM 0 H2'' DA B 6 9.757 9.108 6.316 1.00 1.00 H new ATOM 0 H1' DA B 6 7.603 10.042 6.399 1.00 1.00 H new ATOM 0 H8 DA B 6 10.075 11.630 8.886 1.00 1.00 H new ATOM 0 H61 DA B 6 8.391 16.908 5.982 1.00 1.00 H new ATOM 0 H62 DA B 6 9.492 16.256 7.200 1.00 1.00 H new ATOM 0 H2 DA B 6 5.911 13.697 4.437 1.00 1.00 H new ATOM 950 P DT B 7 9.139 6.332 5.859 1.00 1.00 P ATOM 951 OP1 DT B 7 8.505 5.017 5.562 1.00 1.00 O ATOM 952 OP2 DT B 7 10.601 6.363 6.153 1.00 1.00 O ATOM 953 O5' DT B 7 8.827 7.348 4.637 1.00 1.00 O ATOM 954 C5' DT B 7 7.481 7.585 4.243 1.00 1.00 C ATOM 955 C4' DT B 7 7.337 8.735 3.238 1.00 1.00 C ATOM 956 O4' DT B 7 7.756 9.960 3.818 1.00 1.00 O ATOM 957 C3' DT B 7 8.122 8.522 1.931 1.00 1.00 C ATOM 958 O3' DT B 7 7.252 8.745 0.824 1.00 1.00 O ATOM 959 C2' DT B 7 9.195 9.595 2.038 1.00 1.00 C ATOM 960 C1' DT B 7 8.438 10.674 2.807 1.00 1.00 C ATOM 961 N1 DT B 7 9.327 11.704 3.394 1.00 1.00 N ATOM 962 C2 DT B 7 9.148 13.037 3.006 1.00 1.00 C ATOM 963 O2 DT B 7 8.354 13.411 2.144 1.00 1.00 O ATOM 964 N3 DT B 7 9.932 13.968 3.639 1.00 1.00 N ATOM 965 C4 DT B 7 10.926 13.704 4.545 1.00 1.00 C ATOM 966 O4 DT B 7 11.560 14.661 4.995 1.00 1.00 O ATOM 967 C5 DT B 7 11.112 12.286 4.857 1.00 1.00 C ATOM 968 C7 DT B 7 12.196 11.858 5.829 1.00 1.00 C ATOM 969 C6 DT B 7 10.315 11.344 4.282 1.00 1.00 C ATOM 0 H5' DT B 7 6.885 7.808 5.128 1.00 1.00 H new ATOM 0 H5'' DT B 7 7.072 6.675 3.804 1.00 1.00 H new ATOM 0 H4' DT B 7 6.277 8.764 2.985 1.00 1.00 H new ATOM 0 H3' DT B 7 8.536 7.524 1.788 1.00 1.00 H new ATOM 0 H2' DT B 7 10.077 9.246 2.575 1.00 1.00 H new ATOM 0 H2'' DT B 7 9.532 9.942 1.061 1.00 1.00 H new ATOM 0 H1' DT B 7 7.774 11.234 2.149 1.00 1.00 H new ATOM 0 H3 DT B 7 9.759 14.948 3.414 1.00 1.00 H new ATOM 0 H71 DT B 7 11.887 10.947 6.341 1.00 1.00 H new ATOM 0 H72 DT B 7 13.121 11.671 5.283 1.00 1.00 H new ATOM 0 H73 DT B 7 12.360 12.648 6.562 1.00 1.00 H new ATOM 0 H6 DT B 7 10.460 10.302 4.526 1.00 1.00 H new ATOM 982 P DA B 8 7.490 8.080 -0.626 1.00 1.00 P ATOM 983 OP1 DA B 8 6.188 8.125 -1.343 1.00 1.00 O ATOM 984 OP2 DA B 8 8.128 6.752 -0.433 1.00 1.00 O ATOM 985 O5' DA B 8 8.526 9.072 -1.360 1.00 1.00 O ATOM 986 C5' DA B 8 8.052 10.221 -2.048 1.00 1.00 C ATOM 987 C4' DA B 8 9.156 11.179 -2.520 1.00 1.00 C ATOM 988 O4' DA B 8 9.580 12.009 -1.451 1.00 1.00 O ATOM 989 C3' DA B 8 10.407 10.507 -3.126 1.00 1.00 C ATOM 990 O3' DA B 8 10.463 10.743 -4.533 1.00 1.00 O ATOM 991 C2' DA B 8 11.551 11.159 -2.342 1.00 1.00 C ATOM 992 C1' DA B 8 10.910 12.390 -1.722 1.00 1.00 C ATOM 993 N9 DA B 8 11.535 12.824 -0.453 1.00 1.00 N ATOM 994 C8 DA B 8 11.802 12.099 0.688 1.00 1.00 C ATOM 995 N7 DA B 8 12.326 12.802 1.664 1.00 1.00 N ATOM 996 C5 DA B 8 12.401 14.092 1.114 1.00 1.00 C ATOM 997 C6 DA B 8 12.828 15.370 1.570 1.00 1.00 C ATOM 998 N6 DA B 8 13.257 15.670 2.783 1.00 1.00 N ATOM 999 N1 DA B 8 12.762 16.441 0.780 1.00 1.00 N ATOM 1000 C2 DA B 8 12.275 16.283 -0.436 1.00 1.00 C ATOM 1001 N3 DA B 8 11.832 15.177 -1.005 1.00 1.00 N ATOM 1002 C4 DA B 8 11.925 14.106 -0.172 1.00 1.00 C ATOM 0 H5' DA B 8 7.371 10.765 -1.394 1.00 1.00 H new ATOM 0 H5'' DA B 8 7.474 9.898 -2.914 1.00 1.00 H new ATOM 0 H4' DA B 8 8.687 11.748 -3.323 1.00 1.00 H new ATOM 0 H3' DA B 8 10.433 9.421 -3.040 1.00 1.00 H new ATOM 0 H2' DA B 8 11.947 10.488 -1.580 1.00 1.00 H new ATOM 0 H2'' DA B 8 12.382 11.426 -2.995 1.00 1.00 H new ATOM 0 H1' DA B 8 11.016 13.231 -2.408 1.00 1.00 H new ATOM 0 H8 DA B 8 11.597 11.042 0.772 1.00 1.00 H new ATOM 0 H61 DA B 8 13.540 16.625 3.002 1.00 1.00 H new ATOM 0 H62 DA B 8 13.305 14.946 3.500 1.00 1.00 H new ATOM 0 H2 DA B 8 12.233 17.174 -1.045 1.00 1.00 H new ATOM 1014 P DT B 9 11.689 10.203 -5.464 1.00 1.00 P ATOM 1015 OP1 DT B 9 11.097 9.671 -6.721 1.00 1.00 O ATOM 1016 OP2 DT B 9 12.614 9.338 -4.684 1.00 1.00 O ATOM 1017 O5' DT B 9 12.433 11.599 -5.799 1.00 1.00 O ATOM 1018 C5' DT B 9 11.741 12.612 -6.521 1.00 1.00 C ATOM 1019 C4' DT B 9 12.545 13.903 -6.725 1.00 1.00 C ATOM 1020 O4' DT B 9 12.710 14.568 -5.481 1.00 1.00 O ATOM 1021 C3' DT B 9 13.915 13.651 -7.361 1.00 1.00 C ATOM 1022 O3' DT B 9 14.099 14.523 -8.475 1.00 1.00 O ATOM 1023 C2' DT B 9 14.858 13.887 -6.187 1.00 1.00 C ATOM 1024 C1' DT B 9 14.080 14.844 -5.282 1.00 1.00 C ATOM 1025 N1 DT B 9 14.415 14.699 -3.842 1.00 1.00 N ATOM 1026 C2 DT B 9 14.734 15.858 -3.117 1.00 1.00 C ATOM 1027 O2 DT B 9 14.697 17.000 -3.581 1.00 1.00 O ATOM 1028 N3 DT B 9 15.116 15.681 -1.805 1.00 1.00 N ATOM 1029 C4 DT B 9 15.188 14.476 -1.149 1.00 1.00 C ATOM 1030 O4 DT B 9 15.494 14.469 0.040 1.00 1.00 O ATOM 1031 C5 DT B 9 14.847 13.306 -1.958 1.00 1.00 C ATOM 1032 C7 DT B 9 14.935 11.921 -1.348 1.00 1.00 C ATOM 1033 C6 DT B 9 14.454 13.453 -3.250 1.00 1.00 C ATOM 0 H5' DT B 9 10.818 12.852 -5.993 1.00 1.00 H new ATOM 0 H5'' DT B 9 11.457 12.217 -7.496 1.00 1.00 H new ATOM 0 H4' DT B 9 11.979 14.528 -7.415 1.00 1.00 H new ATOM 0 H3' DT B 9 14.071 12.662 -7.791 1.00 1.00 H new ATOM 0 H2' DT B 9 15.098 12.956 -5.673 1.00 1.00 H new ATOM 0 H2'' DT B 9 15.802 14.323 -6.513 1.00 1.00 H new ATOM 0 H1' DT B 9 14.344 15.868 -5.546 1.00 1.00 H new ATOM 0 H3 DT B 9 15.367 16.516 -1.276 1.00 1.00 H new ATOM 0 H71 DT B 9 15.713 11.908 -0.585 1.00 1.00 H new ATOM 0 H72 DT B 9 13.978 11.661 -0.895 1.00 1.00 H new ATOM 0 H73 DT B 9 15.177 11.196 -2.125 1.00 1.00 H new ATOM 0 H6 DT B 9 14.168 12.583 -3.822 1.00 1.00 H new ATOM 1046 P DG B 10 15.474 14.588 -9.337 1.00 1.00 P ATOM 1047 OP1 DG B 10 15.132 14.976 -10.733 1.00 1.00 O ATOM 1048 OP2 DG B 10 16.264 13.343 -9.120 1.00 1.00 O ATOM 1049 O5' DG B 10 16.253 15.826 -8.641 1.00 1.00 O ATOM 1050 C5' DG B 10 15.707 17.142 -8.687 1.00 1.00 C ATOM 1051 C4' DG B 10 16.597 18.220 -8.045 1.00 1.00 C ATOM 1052 O4' DG B 10 16.606 18.092 -6.622 1.00 1.00 O ATOM 1053 C3' DG B 10 18.048 18.181 -8.556 1.00 1.00 C ATOM 1054 O3' DG B 10 18.507 19.504 -8.828 1.00 1.00 O ATOM 1055 C2' DG B 10 18.747 17.488 -7.386 1.00 1.00 C ATOM 1056 C1' DG B 10 17.954 17.995 -6.185 1.00 1.00 C ATOM 1057 N9 DG B 10 18.047 17.092 -5.020 1.00 1.00 N ATOM 1058 C8 DG B 10 17.899 15.733 -5.017 1.00 1.00 C ATOM 1059 N7 DG B 10 17.969 15.177 -3.835 1.00 1.00 N ATOM 1060 C5 DG B 10 18.245 16.264 -2.990 1.00 1.00 C ATOM 1061 C6 DG B 10 18.480 16.330 -1.567 1.00 1.00 C ATOM 1062 O6 DG B 10 18.411 15.434 -0.725 1.00 1.00 O ATOM 1063 N1 DG B 10 18.836 17.583 -1.124 1.00 1.00 N ATOM 1064 C2 DG B 10 18.905 18.664 -1.929 1.00 1.00 C ATOM 1065 N2 DG B 10 19.283 19.777 -1.360 1.00 1.00 N ATOM 1066 N3 DG B 10 18.646 18.678 -3.235 1.00 1.00 N ATOM 1067 C4 DG B 10 18.328 17.436 -3.716 1.00 1.00 C ATOM 0 H5' DG B 10 14.740 17.139 -8.184 1.00 1.00 H new ATOM 0 H5'' DG B 10 15.524 17.411 -9.727 1.00 1.00 H new ATOM 0 H4' DG B 10 16.162 19.177 -8.334 1.00 1.00 H new ATOM 0 H3' DG B 10 18.219 17.661 -9.499 1.00 1.00 H new ATOM 0 H2' DG B 10 18.704 16.402 -7.472 1.00 1.00 H new ATOM 0 H2'' DG B 10 19.800 17.761 -7.322 1.00 1.00 H new ATOM 0 H1' DG B 10 18.355 18.952 -5.851 1.00 1.00 H new ATOM 0 H8 DG B 10 17.737 15.163 -5.920 1.00 1.00 H new ATOM 0 H1 DG B 10 19.059 17.701 -0.136 1.00 1.00 H new ATOM 0 H21 DG B 10 19.356 20.632 -1.911 1.00 1.00 H new ATOM 0 H22 DG B 10 19.505 19.791 -0.365 1.00 1.00 H new ATOM 1079 P DC B 11 19.980 19.828 -9.439 1.00 1.00 P ATOM 1080 OP1 DC B 11 19.825 20.931 -10.430 1.00 1.00 O ATOM 1081 OP2 DC B 11 20.631 18.564 -9.885 1.00 1.00 O ATOM 1082 O5' DC B 11 20.797 20.395 -8.155 1.00 1.00 O ATOM 1083 C5' DC B 11 20.415 21.621 -7.531 1.00 1.00 C ATOM 1084 C4' DC B 11 21.324 22.056 -6.364 1.00 1.00 C ATOM 1085 O4' DC B 11 21.152 21.182 -5.250 1.00 1.00 O ATOM 1086 C3' DC B 11 22.815 22.101 -6.741 1.00 1.00 C ATOM 1087 O3' DC B 11 23.417 23.302 -6.246 1.00 1.00 O ATOM 1088 C2' DC B 11 23.340 20.818 -6.096 1.00 1.00 C ATOM 1089 C1' DC B 11 22.406 20.621 -4.898 1.00 1.00 C ATOM 1090 N1 DC B 11 22.209 19.213 -4.464 1.00 1.00 N ATOM 1091 C2 DC B 11 22.307 18.877 -3.106 1.00 1.00 C ATOM 1092 O2 DC B 11 22.646 19.691 -2.248 1.00 1.00 O ATOM 1093 N3 DC B 11 22.036 17.619 -2.682 1.00 1.00 N ATOM 1094 C4 DC B 11 21.679 16.725 -3.580 1.00 1.00 C ATOM 1095 N4 DC B 11 21.369 15.549 -3.114 1.00 1.00 N ATOM 1096 C5 DC B 11 21.596 16.989 -4.972 1.00 1.00 C ATOM 1097 C6 DC B 11 21.867 18.256 -5.375 1.00 1.00 C ATOM 0 H5' DC B 11 19.394 21.523 -7.162 1.00 1.00 H new ATOM 0 H5'' DC B 11 20.408 22.410 -8.283 1.00 1.00 H new ATOM 0 H4' DC B 11 21.021 23.070 -6.105 1.00 1.00 H new ATOM 0 H3' DC B 11 23.031 22.132 -7.809 1.00 1.00 H new ATOM 0 H2' DC B 11 23.296 19.974 -6.784 1.00 1.00 H new ATOM 0 H2'' DC B 11 24.379 20.920 -5.784 1.00 1.00 H new ATOM 0 H1' DC B 11 22.876 21.110 -4.045 1.00 1.00 H new ATOM 0 H41 DC B 11 21.083 14.807 -3.752 1.00 1.00 H new ATOM 0 H42 DC B 11 21.412 15.370 -2.111 1.00 1.00 H new ATOM 0 H5 DC B 11 21.329 16.217 -5.678 1.00 1.00 H new ATOM 0 H6 DC B 11 21.812 18.509 -6.424 1.00 1.00 H new ATOM 1109 P DG B 12 24.916 23.771 -6.672 1.00 1.00 P ATOM 1110 OP1 DG B 12 25.041 25.225 -6.373 1.00 1.00 O ATOM 1111 OP2 DG B 12 25.197 23.314 -8.060 1.00 1.00 O ATOM 1112 O5' DG B 12 25.890 22.956 -5.666 1.00 1.00 O ATOM 1113 C5' DG B 12 25.949 23.279 -4.279 1.00 1.00 C ATOM 1114 C4' DG B 12 26.584 22.174 -3.421 1.00 1.00 C ATOM 1115 O4' DG B 12 25.741 21.036 -3.335 1.00 1.00 O ATOM 1116 C3' DG B 12 27.948 21.668 -3.915 1.00 1.00 C ATOM 1117 O3' DG B 12 29.034 22.365 -3.306 1.00 1.00 O ATOM 1118 C2' DG B 12 27.944 20.193 -3.508 1.00 1.00 C ATOM 1119 C1' DG B 12 26.549 19.955 -2.913 1.00 1.00 C ATOM 1120 N9 DG B 12 25.961 18.677 -3.349 1.00 1.00 N ATOM 1121 C8 DG B 12 25.679 18.282 -4.627 1.00 1.00 C ATOM 1122 N7 DG B 12 25.198 17.068 -4.723 1.00 1.00 N ATOM 1123 C5 DG B 12 25.181 16.618 -3.391 1.00 1.00 C ATOM 1124 C6 DG B 12 24.781 15.366 -2.799 1.00 1.00 C ATOM 1125 O6 DG B 12 24.329 14.347 -3.325 1.00 1.00 O ATOM 1126 N1 DG B 12 24.945 15.329 -1.433 1.00 1.00 N ATOM 1127 C2 DG B 12 25.452 16.348 -0.702 1.00 1.00 C ATOM 1128 N2 DG B 12 25.594 16.145 0.578 1.00 1.00 N ATOM 1129 N3 DG B 12 25.831 17.522 -1.192 1.00 1.00 N ATOM 1130 C4 DG B 12 25.663 17.601 -2.549 1.00 1.00 C ATOM 0 H5' DG B 12 24.940 23.476 -3.916 1.00 1.00 H new ATOM 0 H5'' DG B 12 26.519 24.200 -4.152 1.00 1.00 H new ATOM 0 H4' DG B 12 26.725 22.660 -2.455 1.00 1.00 H new ATOM 0 H3' DG B 12 28.084 21.822 -4.985 1.00 1.00 H new ATOM 0 H2' DG B 12 28.124 19.545 -4.366 1.00 1.00 H new ATOM 0 H2'' DG B 12 28.726 19.981 -2.779 1.00 1.00 H new ATOM 0 HO3' DG B 12 29.882 22.011 -3.647 1.00 1.00 H new ATOM 0 H1' DG B 12 26.618 19.898 -1.827 1.00 1.00 H new ATOM 0 H8 DG B 12 25.839 18.918 -5.485 1.00 1.00 H new ATOM 0 H1 DG B 12 24.667 14.480 -0.941 1.00 1.00 H new ATOM 0 H21 DG B 12 25.972 16.883 1.172 1.00 1.00 H new ATOM 0 H22 DG B 12 25.327 15.249 0.985 1.00 1.00 H new TER 1143 DG B 12 ATOM 1144 O5' DC C 13 23.201 8.100 4.179 1.00 1.00 O ATOM 1145 C5' DC C 13 24.547 8.268 4.633 1.00 1.00 C ATOM 1146 C4' DC C 13 25.001 9.738 4.731 1.00 1.00 C ATOM 1147 O4' DC C 13 25.073 10.338 3.439 1.00 1.00 O ATOM 1148 C3' DC C 13 24.052 10.574 5.602 1.00 1.00 C ATOM 1149 O3' DC C 13 24.793 11.395 6.505 1.00 1.00 O ATOM 1150 C2' DC C 13 23.268 11.366 4.557 1.00 1.00 C ATOM 1151 C1' DC C 13 24.317 11.538 3.454 1.00 1.00 C ATOM 1152 N1 DC C 13 23.792 11.826 2.096 1.00 1.00 N ATOM 1153 C2 DC C 13 24.359 12.853 1.328 1.00 1.00 C ATOM 1154 O2 DC C 13 25.211 13.622 1.779 1.00 1.00 O ATOM 1155 N3 DC C 13 23.992 13.038 0.033 1.00 1.00 N ATOM 1156 C4 DC C 13 23.055 12.259 -0.467 1.00 1.00 C ATOM 1157 N4 DC C 13 22.774 12.446 -1.728 1.00 1.00 N ATOM 1158 C5 DC C 13 22.422 11.221 0.270 1.00 1.00 C ATOM 1159 C6 DC C 13 22.822 11.036 1.551 1.00 1.00 C ATOM 0 H5' DC C 13 25.216 7.737 3.956 1.00 1.00 H new ATOM 0 H5'' DC C 13 24.649 7.802 5.613 1.00 1.00 H new ATOM 0 H4' DC C 13 25.989 9.725 5.192 1.00 1.00 H new ATOM 0 H3' DC C 13 23.396 9.996 6.253 1.00 1.00 H new ATOM 0 H2' DC C 13 22.389 10.825 4.206 1.00 1.00 H new ATOM 0 H2'' DC C 13 22.919 12.323 4.944 1.00 1.00 H new ATOM 0 HO5' DC C 13 22.986 7.145 4.141 1.00 1.00 H new ATOM 0 H1' DC C 13 24.904 12.425 3.693 1.00 1.00 H new ATOM 0 H41 DC C 13 22.058 11.878 -2.181 1.00 1.00 H new ATOM 0 H42 DC C 13 23.270 13.160 -2.261 1.00 1.00 H new ATOM 0 H5 DC C 13 21.654 10.605 -0.173 1.00 1.00 H new ATOM 0 H6 DC C 13 22.369 10.257 2.146 1.00 1.00 H new ATOM 1172 P DG C 14 24.085 12.276 7.672 1.00 1.00 P ATOM 1173 OP1 DG C 14 24.959 12.208 8.878 1.00 1.00 O ATOM 1174 OP2 DG C 14 22.667 11.844 7.813 1.00 1.00 O ATOM 1175 O5' DG C 14 24.091 13.798 7.101 1.00 1.00 O ATOM 1176 C5' DG C 14 25.290 14.576 7.071 1.00 1.00 C ATOM 1177 C4' DG C 14 25.090 16.070 6.739 1.00 1.00 C ATOM 1178 O4' DG C 14 24.884 16.261 5.340 1.00 1.00 O ATOM 1179 C3' DG C 14 23.920 16.717 7.500 1.00 1.00 C ATOM 1180 O3' DG C 14 24.297 18.020 7.951 1.00 1.00 O ATOM 1181 C2' DG C 14 22.828 16.694 6.428 1.00 1.00 C ATOM 1182 C1' DG C 14 23.613 16.863 5.132 1.00 1.00 C ATOM 1183 N9 DG C 14 22.967 16.222 3.970 1.00 1.00 N ATOM 1184 C8 DG C 14 22.376 14.991 3.923 1.00 1.00 C ATOM 1185 N7 DG C 14 21.949 14.636 2.741 1.00 1.00 N ATOM 1186 C5 DG C 14 22.252 15.751 1.947 1.00 1.00 C ATOM 1187 C6 DG C 14 22.024 16.017 0.548 1.00 1.00 C ATOM 1188 O6 DG C 14 21.543 15.287 -0.315 1.00 1.00 O ATOM 1189 N1 DG C 14 22.411 17.278 0.156 1.00 1.00 N ATOM 1190 C2 DG C 14 22.997 18.173 0.981 1.00 1.00 C ATOM 1191 N2 DG C 14 23.327 19.322 0.453 1.00 1.00 N ATOM 1192 N3 DG C 14 23.269 17.969 2.267 1.00 1.00 N ATOM 1193 C4 DG C 14 22.860 16.736 2.700 1.00 1.00 C ATOM 0 H5' DG C 14 25.968 14.143 6.335 1.00 1.00 H new ATOM 0 H5'' DG C 14 25.781 14.497 8.041 1.00 1.00 H new ATOM 0 H4' DG C 14 26.009 16.560 7.060 1.00 1.00 H new ATOM 0 H3' DG C 14 23.597 16.222 8.415 1.00 1.00 H new ATOM 0 H2' DG C 14 22.269 15.758 6.442 1.00 1.00 H new ATOM 0 H2'' DG C 14 22.106 17.498 6.570 1.00 1.00 H new ATOM 0 H1' DG C 14 23.677 17.927 4.902 1.00 1.00 H new ATOM 0 H8 DG C 14 22.270 14.362 4.794 1.00 1.00 H new ATOM 0 H1 DG C 14 22.246 17.553 -0.812 1.00 1.00 H new ATOM 0 H21 DG C 14 23.773 20.038 1.027 1.00 1.00 H new ATOM 0 H22 DG C 14 23.139 19.503 -0.533 1.00 1.00 H new ATOM 1205 P DC C 15 23.308 18.982 8.813 1.00 1.00 P ATOM 1206 OP1 DC C 15 24.153 19.980 9.527 1.00 1.00 O ATOM 1207 OP2 DC C 15 22.385 18.136 9.621 1.00 1.00 O ATOM 1208 O5' DC C 15 22.446 19.758 7.682 1.00 1.00 O ATOM 1209 C5' DC C 15 23.075 20.655 6.771 1.00 1.00 C ATOM 1210 C4' DC C 15 22.220 20.971 5.534 1.00 1.00 C ATOM 1211 O4' DC C 15 21.991 19.812 4.751 1.00 1.00 O ATOM 1212 C3' DC C 15 20.850 21.599 5.833 1.00 1.00 C ATOM 1213 O3' DC C 15 20.940 23.023 5.746 1.00 1.00 O ATOM 1214 C2' DC C 15 19.944 20.957 4.773 1.00 1.00 C ATOM 1215 C1' DC C 15 20.867 20.078 3.937 1.00 1.00 C ATOM 1216 N1 DC C 15 20.205 18.825 3.511 1.00 1.00 N ATOM 1217 C2 DC C 15 19.838 18.653 2.171 1.00 1.00 C ATOM 1218 O2 DC C 15 19.992 19.535 1.325 1.00 1.00 O ATOM 1219 N3 DC C 15 19.306 17.485 1.747 1.00 1.00 N ATOM 1220 C4 DC C 15 19.119 16.528 2.631 1.00 1.00 C ATOM 1221 N4 DC C 15 18.632 15.420 2.150 1.00 1.00 N ATOM 1222 C5 DC C 15 19.422 16.662 4.017 1.00 1.00 C ATOM 1223 C6 DC C 15 19.965 17.837 4.421 1.00 1.00 C ATOM 0 H5' DC C 15 24.023 20.226 6.448 1.00 1.00 H new ATOM 0 H5'' DC C 15 23.306 21.585 7.290 1.00 1.00 H new ATOM 0 H4' DC C 15 22.816 21.709 4.997 1.00 1.00 H new ATOM 0 H3' DC C 15 20.463 21.420 6.836 1.00 1.00 H new ATOM 0 H2' DC C 15 19.152 20.368 5.236 1.00 1.00 H new ATOM 0 H2'' DC C 15 19.459 21.715 4.158 1.00 1.00 H new ATOM 0 H1' DC C 15 21.151 20.584 3.014 1.00 1.00 H new ATOM 0 H41 DC C 15 18.457 14.629 2.769 1.00 1.00 H new ATOM 0 H42 DC C 15 18.425 15.344 1.154 1.00 1.00 H new ATOM 0 H5 DC C 15 19.227 15.862 4.716 1.00 1.00 H new ATOM 0 H6 DC C 15 20.207 17.991 5.462 1.00 1.00 H new ATOM 1235 P DA C 16 19.669 24.016 5.973 1.00 1.00 P ATOM 1236 OP1 DA C 16 20.207 25.380 6.246 1.00 1.00 O ATOM 1237 OP2 DA C 16 18.744 23.406 6.971 1.00 1.00 O ATOM 1238 O5' DA C 16 18.919 24.044 4.532 1.00 1.00 O ATOM 1239 C5' DA C 16 19.612 24.446 3.351 1.00 1.00 C ATOM 1240 C4' DA C 16 18.774 24.347 2.058 1.00 1.00 C ATOM 1241 O4' DA C 16 18.584 22.995 1.638 1.00 1.00 O ATOM 1242 C3' DA C 16 17.392 25.015 2.197 1.00 1.00 C ATOM 1243 O3' DA C 16 17.138 25.872 1.086 1.00 1.00 O ATOM 1244 C2' DA C 16 16.494 23.783 2.287 1.00 1.00 C ATOM 1245 C1' DA C 16 17.206 22.790 1.377 1.00 1.00 C ATOM 1246 N9 DA C 16 16.859 21.397 1.701 1.00 1.00 N ATOM 1247 C8 DA C 16 16.939 20.817 2.934 1.00 1.00 C ATOM 1248 N7 DA C 16 16.718 19.529 2.947 1.00 1.00 N ATOM 1249 C5 DA C 16 16.396 19.268 1.604 1.00 1.00 C ATOM 1250 C6 DA C 16 16.009 18.116 0.877 1.00 1.00 C ATOM 1251 N6 DA C 16 15.929 16.908 1.392 1.00 1.00 N ATOM 1252 N1 DA C 16 15.649 18.182 -0.405 1.00 1.00 N ATOM 1253 C2 DA C 16 15.691 19.369 -0.995 1.00 1.00 C ATOM 1254 N3 DA C 16 16.085 20.525 -0.471 1.00 1.00 N ATOM 1255 C4 DA C 16 16.427 20.408 0.846 1.00 1.00 C ATOM 0 H5' DA C 16 20.504 23.830 3.240 1.00 1.00 H new ATOM 0 H5'' DA C 16 19.949 25.475 3.474 1.00 1.00 H new ATOM 0 H4' DA C 16 19.353 24.881 1.305 1.00 1.00 H new ATOM 0 H3' DA C 16 17.255 25.685 3.046 1.00 1.00 H new ATOM 0 H2' DA C 16 16.415 23.412 3.309 1.00 1.00 H new ATOM 0 H2'' DA C 16 15.481 23.993 1.945 1.00 1.00 H new ATOM 0 H1' DA C 16 16.926 22.946 0.335 1.00 1.00 H new ATOM 0 H8 DA C 16 17.167 21.378 3.828 1.00 1.00 H new ATOM 0 H61 DA C 16 15.643 16.122 0.808 1.00 1.00 H new ATOM 0 H62 DA C 16 16.153 16.757 2.375 1.00 1.00 H new ATOM 0 H2 DA C 16 15.366 19.400 -2.025 1.00 1.00 H new ATOM 1267 P DT C 17 15.830 26.835 1.004 1.00 1.00 P ATOM 1268 OP1 DT C 17 16.132 27.928 0.037 1.00 1.00 O ATOM 1269 OP2 DT C 17 15.407 27.207 2.385 1.00 1.00 O ATOM 1270 O5' DT C 17 14.690 25.877 0.361 1.00 1.00 O ATOM 1271 C5' DT C 17 14.793 25.414 -0.985 1.00 1.00 C ATOM 1272 C4' DT C 17 13.740 24.359 -1.358 1.00 1.00 C ATOM 1273 O4' DT C 17 13.992 23.130 -0.687 1.00 1.00 O ATOM 1274 C3' DT C 17 12.288 24.787 -1.063 1.00 1.00 C ATOM 1275 O3' DT C 17 11.551 24.825 -2.283 1.00 1.00 O ATOM 1276 C2' DT C 17 11.835 23.715 -0.067 1.00 1.00 C ATOM 1277 C1' DT C 17 12.737 22.535 -0.423 1.00 1.00 C ATOM 1278 N1 DT C 17 12.869 21.509 0.647 1.00 1.00 N ATOM 1279 C2 DT C 17 12.699 20.160 0.300 1.00 1.00 C ATOM 1280 O2 DT C 17 12.412 19.749 -0.827 1.00 1.00 O ATOM 1281 N3 DT C 17 12.882 19.246 1.311 1.00 1.00 N ATOM 1282 C4 DT C 17 13.198 19.523 2.616 1.00 1.00 C ATOM 1283 O4 DT C 17 13.356 18.579 3.391 1.00 1.00 O ATOM 1284 C5 DT C 17 13.330 20.946 2.920 1.00 1.00 C ATOM 1285 C7 DT C 17 13.640 21.401 4.331 1.00 1.00 C ATOM 1286 C6 DT C 17 13.179 21.876 1.943 1.00 1.00 C ATOM 0 H5' DT C 17 15.787 24.993 -1.140 1.00 1.00 H new ATOM 0 H5'' DT C 17 14.698 26.264 -1.661 1.00 1.00 H new ATOM 0 H4' DT C 17 13.834 24.239 -2.437 1.00 1.00 H new ATOM 0 H3' DT C 17 12.153 25.785 -0.646 1.00 1.00 H new ATOM 0 H2' DT C 17 11.974 24.035 0.966 1.00 1.00 H new ATOM 0 H2'' DT C 17 10.780 23.470 -0.186 1.00 1.00 H new ATOM 0 H1' DT C 17 12.314 21.982 -1.262 1.00 1.00 H new ATOM 0 H3 DT C 17 12.771 18.262 1.065 1.00 1.00 H new ATOM 0 H71 DT C 17 14.204 22.333 4.297 1.00 1.00 H new ATOM 0 H72 DT C 17 12.709 21.560 4.875 1.00 1.00 H new ATOM 0 H73 DT C 17 14.231 20.638 4.838 1.00 1.00 H new ATOM 0 H6 DT C 17 13.303 22.922 2.183 1.00 1.00 H new ATOM 1299 P DA C 18 10.008 25.324 -2.356 1.00 1.00 P ATOM 1300 OP1 DA C 18 9.709 25.695 -3.770 1.00 1.00 O ATOM 1301 OP2 DA C 18 9.766 26.340 -1.292 1.00 1.00 O ATOM 1302 O5' DA C 18 9.179 23.981 -1.992 1.00 1.00 O ATOM 1303 C5' DA C 18 9.277 22.823 -2.812 1.00 1.00 C ATOM 1304 C4' DA C 18 8.419 21.648 -2.324 1.00 1.00 C ATOM 1305 O4' DA C 18 9.065 20.903 -1.303 1.00 1.00 O ATOM 1306 C3' DA C 18 7.019 22.029 -1.820 1.00 1.00 C ATOM 1307 O3' DA C 18 6.116 21.424 -2.741 1.00 1.00 O ATOM 1308 C2' DA C 18 7.026 21.493 -0.383 1.00 1.00 C ATOM 1309 C1' DA C 18 8.074 20.388 -0.435 1.00 1.00 C ATOM 1310 N9 DA C 18 8.739 20.032 0.837 1.00 1.00 N ATOM 1311 C8 DA C 18 9.117 20.852 1.867 1.00 1.00 C ATOM 1312 N7 DA C 18 9.690 20.233 2.873 1.00 1.00 N ATOM 1313 C5 DA C 18 9.675 18.890 2.460 1.00 1.00 C ATOM 1314 C6 DA C 18 10.071 17.650 3.027 1.00 1.00 C ATOM 1315 N6 DA C 18 10.589 17.459 4.227 1.00 1.00 N ATOM 1316 N1 DA C 18 9.947 16.512 2.350 1.00 1.00 N ATOM 1317 C2 DA C 18 9.452 16.566 1.129 1.00 1.00 C ATOM 1318 N3 DA C 18 9.004 17.629 0.478 1.00 1.00 N ATOM 1319 C4 DA C 18 9.135 18.771 1.208 1.00 1.00 C ATOM 0 H5' DA C 18 10.319 22.507 -2.856 1.00 1.00 H new ATOM 0 H5'' DA C 18 8.979 23.082 -3.828 1.00 1.00 H new ATOM 0 H4' DA C 18 8.292 21.045 -3.223 1.00 1.00 H new ATOM 0 H3' DA C 18 6.729 23.079 -1.781 1.00 1.00 H new ATOM 0 H2' DA C 18 7.292 22.268 0.336 1.00 1.00 H new ATOM 0 H2'' DA C 18 6.049 21.109 -0.091 1.00 1.00 H new ATOM 0 H1' DA C 18 7.573 19.469 -0.739 1.00 1.00 H new ATOM 0 H8 DA C 18 8.957 21.920 1.853 1.00 1.00 H new ATOM 0 H61 DA C 18 10.838 16.518 4.531 1.00 1.00 H new ATOM 0 H62 DA C 18 10.740 18.253 4.849 1.00 1.00 H new ATOM 0 H2 DA C 18 9.406 15.629 0.594 1.00 1.00 H new ATOM 1331 P DT C 19 4.529 21.510 -2.620 1.00 1.00 P ATOM 1332 OP1 DT C 19 3.980 21.192 -3.956 1.00 1.00 O ATOM 1333 OP2 DT C 19 4.115 22.753 -1.934 1.00 1.00 O ATOM 1334 O5' DT C 19 4.258 20.256 -1.721 1.00 1.00 O ATOM 1335 C5' DT C 19 4.539 18.944 -2.182 1.00 1.00 C ATOM 1336 C4' DT C 19 4.018 17.938 -1.161 1.00 1.00 C ATOM 1337 O4' DT C 19 5.016 17.794 -0.165 1.00 1.00 O ATOM 1338 C3' DT C 19 2.728 18.425 -0.460 1.00 1.00 C ATOM 1339 O3' DT C 19 1.778 17.407 -0.304 1.00 1.00 O ATOM 1340 C2' DT C 19 3.234 18.833 0.904 1.00 1.00 C ATOM 1341 C1' DT C 19 4.353 17.802 1.073 1.00 1.00 C ATOM 1342 N1 DT C 19 5.327 18.057 2.158 1.00 1.00 N ATOM 1343 C2 DT C 19 5.781 16.959 2.896 1.00 1.00 C ATOM 1344 O2 DT C 19 5.465 15.792 2.661 1.00 1.00 O ATOM 1345 N3 DT C 19 6.602 17.233 3.960 1.00 1.00 N ATOM 1346 C4 DT C 19 6.924 18.481 4.429 1.00 1.00 C ATOM 1347 O4 DT C 19 7.620 18.556 5.438 1.00 1.00 O ATOM 1348 C5 DT C 19 6.389 19.594 3.637 1.00 1.00 C ATOM 1349 C7 DT C 19 6.627 21.033 4.056 1.00 1.00 C ATOM 1350 C6 DT C 19 5.662 19.343 2.515 1.00 1.00 C ATOM 0 H5' DT C 19 5.612 18.816 -2.323 1.00 1.00 H new ATOM 0 H5'' DT C 19 4.068 18.776 -3.151 1.00 1.00 H new ATOM 0 H4' DT C 19 3.792 17.007 -1.680 1.00 1.00 H new ATOM 0 H3' DT C 19 2.229 19.209 -1.030 1.00 1.00 H new ATOM 0 H2' DT C 19 3.602 19.859 0.925 1.00 1.00 H new ATOM 0 H2'' DT C 19 2.469 18.753 1.677 1.00 1.00 H new ATOM 0 H1' DT C 19 3.902 16.854 1.365 1.00 1.00 H new ATOM 0 H3 DT C 19 7.011 16.435 4.447 1.00 1.00 H new ATOM 0 H71 DT C 19 6.654 21.670 3.172 1.00 1.00 H new ATOM 0 H72 DT C 19 5.821 21.359 4.713 1.00 1.00 H new ATOM 0 H73 DT C 19 7.577 21.106 4.585 1.00 1.00 H new ATOM 0 H6 DT C 19 5.342 20.167 1.894 1.00 1.00 H new ATOM 1363 P DA C 20 0.735 17.074 -1.484 1.00 1.00 P ATOM 1364 OP1 DA C 20 1.481 17.058 -2.771 1.00 1.00 O ATOM 1365 OP2 DA C 20 -0.433 17.985 -1.350 1.00 1.00 O ATOM 1366 O5' DA C 20 0.359 15.580 -1.017 1.00 1.00 O ATOM 1367 C5' DA C 20 -0.337 15.394 0.204 1.00 1.00 C ATOM 1368 C4' DA C 20 0.009 14.064 0.875 1.00 1.00 C ATOM 1369 O4' DA C 20 1.285 14.179 1.512 1.00 1.00 O ATOM 1370 C3' DA C 20 -1.035 13.810 1.963 1.00 1.00 C ATOM 1371 O3' DA C 20 -1.382 12.438 2.025 1.00 1.00 O ATOM 1372 C2' DA C 20 -0.313 14.357 3.186 1.00 1.00 C ATOM 1373 C1' DA C 20 1.157 14.076 2.916 1.00 1.00 C ATOM 1374 N9 DA C 20 1.997 15.091 3.598 1.00 1.00 N ATOM 1375 C8 DA C 20 2.094 16.423 3.280 1.00 1.00 C ATOM 1376 N7 DA C 20 2.813 17.137 4.104 1.00 1.00 N ATOM 1377 C5 DA C 20 3.237 16.186 5.038 1.00 1.00 C ATOM 1378 C6 DA C 20 4.054 16.234 6.193 1.00 1.00 C ATOM 1379 N6 DA C 20 4.641 17.332 6.626 1.00 1.00 N ATOM 1380 N1 DA C 20 4.296 15.149 6.932 1.00 1.00 N ATOM 1381 C2 DA C 20 3.745 14.012 6.525 1.00 1.00 C ATOM 1382 N3 DA C 20 2.956 13.801 5.473 1.00 1.00 N ATOM 1383 C4 DA C 20 2.744 14.939 4.749 1.00 1.00 C ATOM 0 H5' DA C 20 -1.410 15.435 0.017 1.00 1.00 H new ATOM 0 H5'' DA C 20 -0.100 16.213 0.883 1.00 1.00 H new ATOM 0 H4' DA C 20 0.027 13.260 0.139 1.00 1.00 H new ATOM 0 H3' DA C 20 -2.007 14.282 1.818 1.00 1.00 H new ATOM 0 H2' DA C 20 -0.497 15.424 3.311 1.00 1.00 H new ATOM 0 H2'' DA C 20 -0.650 13.866 4.099 1.00 1.00 H new ATOM 0 H1' DA C 20 1.478 13.102 3.284 1.00 1.00 H new ATOM 0 H8 DA C 20 1.611 16.849 2.413 1.00 1.00 H new ATOM 0 H61 DA C 20 5.219 17.304 7.466 1.00 1.00 H new ATOM 0 H62 DA C 20 4.517 18.210 6.121 1.00 1.00 H new ATOM 0 H2 DA C 20 3.966 13.143 7.127 1.00 1.00 H new ATOM 1395 P DT C 21 -2.686 11.943 2.831 1.00 1.00 P ATOM 1396 OP1 DT C 21 -3.108 10.624 2.296 1.00 1.00 O ATOM 1397 OP2 DT C 21 -3.693 13.038 2.802 1.00 1.00 O ATOM 1398 O5' DT C 21 -2.146 11.764 4.329 1.00 1.00 O ATOM 1399 C5' DT C 21 -1.181 10.768 4.616 1.00 1.00 C ATOM 1400 C4' DT C 21 -0.975 10.566 6.117 1.00 1.00 C ATOM 1401 O4' DT C 21 -0.103 11.563 6.623 1.00 1.00 O ATOM 1402 C3' DT C 21 -2.269 10.617 6.930 1.00 1.00 C ATOM 1403 O3' DT C 21 -2.190 9.596 7.911 1.00 1.00 O ATOM 1404 C2' DT C 21 -2.251 12.026 7.507 1.00 1.00 C ATOM 1405 C1' DT C 21 -0.752 12.275 7.661 1.00 1.00 C ATOM 1406 N1 DT C 21 -0.279 13.683 7.594 1.00 1.00 N ATOM 1407 C2 DT C 21 0.800 14.031 8.424 1.00 1.00 C ATOM 1408 O2 DT C 21 1.359 13.237 9.186 1.00 1.00 O ATOM 1409 N3 DT C 21 1.266 15.322 8.347 1.00 1.00 N ATOM 1410 C4 DT C 21 0.791 16.282 7.485 1.00 1.00 C ATOM 1411 O4 DT C 21 1.349 17.376 7.460 1.00 1.00 O ATOM 1412 C5 DT C 21 -0.324 15.866 6.640 1.00 1.00 C ATOM 1413 C7 DT C 21 -0.941 16.858 5.671 1.00 1.00 C ATOM 1414 C6 DT C 21 -0.809 14.600 6.702 1.00 1.00 C ATOM 0 H5' DT C 21 -0.232 11.044 4.156 1.00 1.00 H new ATOM 0 H5'' DT C 21 -1.492 9.825 4.165 1.00 1.00 H new ATOM 0 H4' DT C 21 -0.554 9.566 6.225 1.00 1.00 H new ATOM 0 H3' DT C 21 -3.196 10.443 6.383 1.00 1.00 H new ATOM 0 H2' DT C 21 -2.720 12.748 6.839 1.00 1.00 H new ATOM 0 H2'' DT C 21 -2.776 12.085 8.460 1.00 1.00 H new ATOM 0 H1' DT C 21 -0.516 11.951 8.674 1.00 1.00 H new ATOM 0 H3 DT C 21 2.022 15.588 8.978 1.00 1.00 H new ATOM 0 H71 DT C 21 -0.844 17.867 6.072 1.00 1.00 H new ATOM 0 H72 DT C 21 -0.427 16.797 4.712 1.00 1.00 H new ATOM 0 H73 DT C 21 -1.996 16.623 5.532 1.00 1.00 H new ATOM 0 H6 DT C 21 -1.617 14.305 6.049 1.00 1.00 H new ATOM 1427 P DG C 22 -3.413 9.198 8.853 1.00 1.00 P ATOM 1428 OP1 DG C 22 -3.240 7.759 9.168 1.00 1.00 O ATOM 1429 OP2 DG C 22 -4.698 9.634 8.255 1.00 1.00 O ATOM 1430 O5' DG C 22 -3.097 10.057 10.161 1.00 1.00 O ATOM 1431 C5' DG C 22 -1.994 9.720 10.988 1.00 1.00 C ATOM 1432 C4' DG C 22 -1.703 10.775 12.058 1.00 1.00 C ATOM 1433 O4' DG C 22 -1.100 11.925 11.474 1.00 1.00 O ATOM 1434 C3' DG C 22 -2.950 11.222 12.850 1.00 1.00 C ATOM 1435 O3' DG C 22 -2.699 11.040 14.242 1.00 1.00 O ATOM 1436 C2' DG C 22 -3.074 12.681 12.410 1.00 1.00 C ATOM 1437 C1' DG C 22 -1.617 13.042 12.166 1.00 1.00 C ATOM 1438 N9 DG C 22 -1.446 14.283 11.391 1.00 1.00 N ATOM 1439 C8 DG C 22 -2.081 14.647 10.239 1.00 1.00 C ATOM 1440 N7 DG C 22 -1.731 15.822 9.781 1.00 1.00 N ATOM 1441 C5 DG C 22 -0.805 16.281 10.731 1.00 1.00 C ATOM 1442 C6 DG C 22 -0.058 17.512 10.830 1.00 1.00 C ATOM 1443 O6 DG C 22 0.000 18.457 10.042 1.00 1.00 O ATOM 1444 N1 DG C 22 0.682 17.613 11.988 1.00 1.00 N ATOM 1445 C2 DG C 22 0.745 16.642 12.923 1.00 1.00 C ATOM 1446 N2 DG C 22 1.471 16.891 13.977 1.00 1.00 N ATOM 1447 N3 DG C 22 0.121 15.468 12.861 1.00 1.00 N ATOM 1448 C4 DG C 22 -0.651 15.350 11.737 1.00 1.00 C ATOM 0 H5' DG C 22 -1.108 9.587 10.366 1.00 1.00 H new ATOM 0 H5'' DG C 22 -2.190 8.763 11.473 1.00 1.00 H new ATOM 0 H4' DG C 22 -1.024 10.293 12.762 1.00 1.00 H new ATOM 0 H3' DG C 22 -3.874 10.672 12.671 1.00 1.00 H new ATOM 0 H2' DG C 22 -3.681 12.789 11.511 1.00 1.00 H new ATOM 0 H2'' DG C 22 -3.529 13.305 13.179 1.00 1.00 H new ATOM 0 H1' DG C 22 -1.097 13.245 13.102 1.00 1.00 H new ATOM 0 H8 DG C 22 -2.810 14.019 9.748 1.00 1.00 H new ATOM 0 H1 DG C 22 1.212 18.470 12.147 1.00 1.00 H new ATOM 0 H21 DG C 22 1.554 16.192 14.716 1.00 1.00 H new ATOM 0 H22 DG C 22 1.956 17.784 14.063 1.00 1.00 H new ATOM 1460 P DC C 23 -3.799 11.346 15.400 1.00 1.00 P ATOM 1461 OP1 DC C 23 -3.771 10.216 16.372 1.00 1.00 O ATOM 1462 OP2 DC C 23 -5.103 11.714 14.780 1.00 1.00 O ATOM 1463 O5' DC C 23 -3.186 12.663 16.121 1.00 1.00 O ATOM 1464 C5' DC C 23 -1.928 12.605 16.794 1.00 1.00 C ATOM 1465 C4' DC C 23 -1.526 13.909 17.511 1.00 1.00 C ATOM 1466 O4' DC C 23 -1.157 14.912 16.566 1.00 1.00 O ATOM 1467 C3' DC C 23 -2.642 14.455 18.421 1.00 1.00 C ATOM 1468 O3' DC C 23 -2.109 14.840 19.689 1.00 1.00 O ATOM 1469 C2' DC C 23 -3.185 15.611 17.576 1.00 1.00 C ATOM 1470 C1' DC C 23 -1.976 16.056 16.749 1.00 1.00 C ATOM 1471 N1 DC C 23 -2.325 16.634 15.429 1.00 1.00 N ATOM 1472 C2 DC C 23 -1.813 17.880 15.039 1.00 1.00 C ATOM 1473 O2 DC C 23 -1.094 18.560 15.772 1.00 1.00 O ATOM 1474 N3 DC C 23 -2.103 18.398 13.818 1.00 1.00 N ATOM 1475 C4 DC C 23 -2.886 17.701 13.019 1.00 1.00 C ATOM 1476 N4 DC C 23 -3.098 18.226 11.846 1.00 1.00 N ATOM 1477 C5 DC C 23 -3.438 16.430 13.353 1.00 1.00 C ATOM 1478 C6 DC C 23 -3.128 15.931 14.576 1.00 1.00 C ATOM 0 H5' DC C 23 -1.154 12.350 16.070 1.00 1.00 H new ATOM 0 H5'' DC C 23 -1.958 11.798 17.526 1.00 1.00 H new ATOM 0 H4' DC C 23 -0.672 13.660 18.141 1.00 1.00 H new ATOM 0 H3' DC C 23 -3.427 13.748 18.690 1.00 1.00 H new ATOM 0 H2' DC C 23 -4.009 15.289 16.939 1.00 1.00 H new ATOM 0 H2'' DC C 23 -3.563 16.421 18.201 1.00 1.00 H new ATOM 0 H1' DC C 23 -1.470 16.855 17.290 1.00 1.00 H new ATOM 0 H41 DC C 23 -3.694 17.745 11.172 1.00 1.00 H new ATOM 0 H42 DC C 23 -2.668 19.118 11.601 1.00 1.00 H new ATOM 0 H5 DC C 23 -4.072 15.890 12.666 1.00 1.00 H new ATOM 0 H6 DC C 23 -3.519 14.971 14.878 1.00 1.00 H new ATOM 1490 P DG C 24 -3.059 15.178 20.965 1.00 1.00 P ATOM 1491 OP1 DG C 24 -2.216 15.101 22.193 1.00 1.00 O ATOM 1492 OP2 DG C 24 -4.286 14.336 20.899 1.00 1.00 O ATOM 1493 O5' DG C 24 -3.491 16.722 20.733 1.00 1.00 O ATOM 1494 C5' DG C 24 -2.548 17.776 20.897 1.00 1.00 C ATOM 1495 C4' DG C 24 -2.991 19.098 20.251 1.00 1.00 C ATOM 1496 O4' DG C 24 -2.928 19.041 18.837 1.00 1.00 O ATOM 1497 C3' DG C 24 -4.413 19.564 20.597 1.00 1.00 C ATOM 1498 O3' DG C 24 -4.451 20.389 21.760 1.00 1.00 O ATOM 1499 C2' DG C 24 -4.839 20.345 19.353 1.00 1.00 C ATOM 1500 C1' DG C 24 -3.685 20.138 18.363 1.00 1.00 C ATOM 1501 N9 DG C 24 -4.159 19.908 16.987 1.00 1.00 N ATOM 1502 C8 DG C 24 -4.955 18.892 16.536 1.00 1.00 C ATOM 1503 N7 DG C 24 -5.301 18.991 15.277 1.00 1.00 N ATOM 1504 C5 DG C 24 -4.687 20.190 14.867 1.00 1.00 C ATOM 1505 C6 DG C 24 -4.688 20.902 13.609 1.00 1.00 C ATOM 1506 O6 DG C 24 -5.233 20.615 12.542 1.00 1.00 O ATOM 1507 N1 DG C 24 -3.981 22.086 13.644 1.00 1.00 N ATOM 1508 C2 DG C 24 -3.336 22.546 14.741 1.00 1.00 C ATOM 1509 N2 DG C 24 -2.715 23.687 14.629 1.00 1.00 N ATOM 1510 N3 DG C 24 -3.296 21.932 15.917 1.00 1.00 N ATOM 1511 C4 DG C 24 -3.991 20.754 15.917 1.00 1.00 C ATOM 0 H5' DG C 24 -1.595 17.471 20.465 1.00 1.00 H new ATOM 0 H5'' DG C 24 -2.378 17.939 21.961 1.00 1.00 H new ATOM 0 H4' DG C 24 -2.283 19.811 20.672 1.00 1.00 H new ATOM 0 H3' DG C 24 -5.072 18.729 20.834 1.00 1.00 H new ATOM 0 H2' DG C 24 -5.780 19.970 18.951 1.00 1.00 H new ATOM 0 H2'' DG C 24 -4.986 21.401 19.577 1.00 1.00 H new ATOM 0 HO3' DG C 24 -5.375 20.661 21.938 1.00 1.00 H new ATOM 0 H1' DG C 24 -3.075 21.040 18.311 1.00 1.00 H new ATOM 0 H8 DG C 24 -5.272 18.075 17.167 1.00 1.00 H new ATOM 0 H1 DG C 24 -3.942 22.647 12.793 1.00 1.00 H new ATOM 0 H21 DG C 24 -2.214 24.076 15.428 1.00 1.00 H new ATOM 0 H22 DG C 24 -2.730 24.191 13.742 1.00 1.00 H new TER 1524 DG C 24