USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 998 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 116 LYS NZ :NH3+ 129:sc= 1.1! (180deg=-0.168) USER MOD Set 1.2: A 119 ASN : amide:sc= -2.22! C(o=-1.1!,f=-8.7!) USER MOD Set 2.1: A 27 TYR OH : rot 180:sc= 0.186 USER MOD Set 2.2: A 28 LYS NZ :NH3+ 164:sc= 1.38 (180deg=1.11) USER MOD Single : A 8 HIS : no HE2:sc= -0.251 K(o=-0.25,f=-7.8!) USER MOD Single : A 9 LYS NZ :NH3+ -162:sc= 1.29 (180deg=0.824) USER MOD Single : A 13 THR OG1 : rot 180:sc=-0.00752 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl -145:sc= -0.211 (180deg=-0.853) USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 32 MET CE :methyl -166:sc= -0.122 (180deg=-0.474) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -83:sc= 1.28 USER MOD Single : A 59 SER OG : rot -48:sc= 1.33 USER MOD Single : A 62 THR OG1 : rot 79:sc= -0.142 USER MOD Single : A 63 LYS NZ :NH3+ 140:sc= 1.09 (180deg=-0.277!) USER MOD Single : A 64 LYS NZ :NH3+ -177:sc= 1.09 (180deg=0.953) USER MOD Single : A 65 MET CE :methyl -176:sc= -1.26 (180deg=-1.43) USER MOD Single : A 68 ASN : amide:sc= 1.16 K(o=1.2,f=-0.0056) USER MOD Single : A 70 LYS NZ :NH3+ -175:sc= 0.648 (180deg=0.584!) USER MOD Single : A 71 LYS NZ :NH3+ 155:sc= 1.27 (180deg=1.19) USER MOD Single : A 78 LYS NZ :NH3+ -126:sc= 0.569 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= 0.992 K(o=0.99,f=-1.1) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot -14:sc= 2.27 USER MOD Single : A 93 TYR OH : rot -10:sc= 0.292 USER MOD Single : A 97 LYS NZ :NH3+ 170:sc= 1.16 (180deg=1.12) USER MOD Single : A 98 MET CE :methyl -132:sc= -0.0297 (180deg=-2.36!) USER MOD Single : A 100 ASN : amide:sc= -2.7! C(o=-2.7!,f=-5.8!) USER MOD Single : A 106 GLN : amide:sc= -0.197 X(o=-0.2,f=-0.14) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 ASN : amide:sc= 0.681 K(o=0.68,f=-9.7!) USER MOD Single : A 120 THR OG1 : rot 66:sc= 0.628 USER MOD Single : A 121 HIS : no HD1:sc= -0.791 K(o=-0.79,f=-3.4!) USER MOD Single : A 123 GLN : amide:sc= -0.693 K(o=-0.69,f=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot -130:sc= 1.26 USER MOD Single : A 131 GLN : amide:sc= -0.63 K(o=-0.63,f=-0.093) USER MOD Single : A 133 LYS NZ :NH3+ -116:sc= 0.848 (180deg=-0.00967) USER MOD Single : A 134 LYS NZ :NH3+ 137:sc= 1.21 (180deg=-0.00462) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc= -1.14 X(o=-1.1,f=-0.87) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 115 N HIS A 8 -4.524 -16.711 2.587 1.00 0.00 N ATOM 116 CA HIS A 8 -4.603 -17.398 1.299 1.00 0.00 C ATOM 117 C HIS A 8 -4.607 -16.446 0.122 1.00 0.00 C ATOM 118 O HIS A 8 -5.330 -15.450 0.115 1.00 0.00 O ATOM 119 CB HIS A 8 -5.799 -18.375 1.217 1.00 0.00 C ATOM 120 CG HIS A 8 -7.150 -17.736 1.199 1.00 0.00 C ATOM 121 ND1 HIS A 8 -7.934 -17.682 0.077 1.00 0.00 N ATOM 122 CD2 HIS A 8 -7.855 -17.137 2.175 1.00 0.00 C ATOM 123 CE1 HIS A 8 -9.060 -17.085 0.361 1.00 0.00 C ATOM 124 NE2 HIS A 8 -9.040 -16.743 1.629 1.00 0.00 N ATOM 0 HA HIS A 8 -3.689 -17.989 1.235 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -5.690 -18.980 0.317 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -5.749 -19.055 2.067 1.00 0.00 H new ATOM 0 HD1 HIS A 8 -7.678 -18.051 -0.839 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -7.541 -16.995 3.199 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -9.870 -16.903 -0.330 1.00 0.00 H new ATOM 133 N LYS A 9 -3.790 -16.766 -0.843 1.00 0.00 N ATOM 134 CA LYS A 9 -3.678 -16.032 -2.076 1.00 0.00 C ATOM 135 C LYS A 9 -4.520 -16.626 -3.147 1.00 0.00 C ATOM 136 O LYS A 9 -4.558 -17.847 -3.332 1.00 0.00 O ATOM 137 CB LYS A 9 -2.251 -15.968 -2.579 1.00 0.00 C ATOM 138 CG LYS A 9 -1.440 -14.848 -1.996 1.00 0.00 C ATOM 139 CD LYS A 9 -1.225 -14.998 -0.503 1.00 0.00 C ATOM 140 CE LYS A 9 -0.422 -16.221 -0.088 1.00 0.00 C ATOM 141 NZ LYS A 9 -0.416 -16.361 1.391 1.00 0.00 N ATOM 0 H LYS A 9 -3.164 -17.570 -0.793 1.00 0.00 H new ATOM 0 HA LYS A 9 -4.024 -15.024 -1.848 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -1.757 -16.913 -2.355 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -2.265 -15.864 -3.664 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.472 -14.807 -2.496 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.941 -13.901 -2.193 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -0.718 -14.107 -0.133 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -2.198 -15.038 -0.013 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -0.849 -17.115 -0.542 1.00 0.00 H new ATOM 0 HE3 LYS A 9 0.601 -16.134 -0.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 0.360 -16.992 1.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -0.282 -15.427 1.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -1.322 -16.763 1.705 1.00 0.00 H new ATOM 155 N GLU A 10 -5.150 -15.770 -3.856 1.00 0.00 N ATOM 156 CA GLU A 10 -5.996 -16.124 -4.959 1.00 0.00 C ATOM 157 C GLU A 10 -5.466 -15.366 -6.176 1.00 0.00 C ATOM 158 O GLU A 10 -5.022 -14.221 -6.026 1.00 0.00 O ATOM 159 CB GLU A 10 -7.437 -15.686 -4.672 1.00 0.00 C ATOM 160 CG GLU A 10 -8.044 -16.199 -3.365 1.00 0.00 C ATOM 161 CD GLU A 10 -8.174 -17.696 -3.291 1.00 0.00 C ATOM 162 OE1 GLU A 10 -9.003 -18.268 -4.024 1.00 0.00 O ATOM 163 OE2 GLU A 10 -7.521 -18.318 -2.448 1.00 0.00 O ATOM 0 H GLU A 10 -5.098 -14.765 -3.689 1.00 0.00 H new ATOM 0 HA GLU A 10 -5.992 -17.201 -5.127 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -7.470 -14.597 -4.662 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -8.068 -16.016 -5.497 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -7.428 -15.857 -2.533 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -9.030 -15.753 -3.236 1.00 0.00 H new ATOM 170 N PRO A 11 -5.464 -15.969 -7.368 1.00 0.00 N ATOM 171 CA PRO A 11 -4.935 -15.313 -8.576 1.00 0.00 C ATOM 172 C PRO A 11 -5.808 -14.143 -9.065 1.00 0.00 C ATOM 173 O PRO A 11 -7.053 -14.198 -9.009 1.00 0.00 O ATOM 174 CB PRO A 11 -4.912 -16.435 -9.617 1.00 0.00 C ATOM 175 CG PRO A 11 -5.943 -17.411 -9.155 1.00 0.00 C ATOM 176 CD PRO A 11 -5.952 -17.335 -7.649 1.00 0.00 C ATOM 0 HA PRO A 11 -3.960 -14.865 -8.386 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.145 -16.055 -10.612 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -3.927 -16.899 -9.676 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -6.923 -17.164 -9.563 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -5.703 -18.419 -9.492 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -6.952 -17.495 -7.245 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -5.305 -18.091 -7.205 1.00 0.00 H new ATOM 184 N ALA A 12 -5.150 -13.095 -9.536 1.00 0.00 N ATOM 185 CA ALA A 12 -5.817 -11.913 -10.021 1.00 0.00 C ATOM 186 C ALA A 12 -5.042 -11.295 -11.182 1.00 0.00 C ATOM 187 O ALA A 12 -3.932 -11.721 -11.505 1.00 0.00 O ATOM 188 CB ALA A 12 -5.944 -10.908 -8.894 1.00 0.00 C ATOM 0 H ALA A 12 -4.133 -13.048 -9.590 1.00 0.00 H new ATOM 0 HA ALA A 12 -6.809 -12.190 -10.379 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -6.448 -10.013 -9.259 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -6.524 -11.345 -8.081 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -4.952 -10.642 -8.530 1.00 0.00 H new ATOM 194 N THR A 13 -5.652 -10.328 -11.830 1.00 0.00 N ATOM 195 CA THR A 13 -5.042 -9.569 -12.910 1.00 0.00 C ATOM 196 C THR A 13 -5.663 -8.165 -12.891 1.00 0.00 C ATOM 197 O THR A 13 -6.846 -8.047 -12.681 1.00 0.00 O ATOM 198 CB THR A 13 -5.308 -10.252 -14.282 1.00 0.00 C ATOM 199 OG1 THR A 13 -4.838 -11.619 -14.233 1.00 0.00 O ATOM 200 CG2 THR A 13 -4.578 -9.524 -15.409 1.00 0.00 C ATOM 0 H THR A 13 -6.607 -10.037 -11.620 1.00 0.00 H new ATOM 0 HA THR A 13 -3.962 -9.518 -12.772 1.00 0.00 H new ATOM 0 HB THR A 13 -6.380 -10.220 -14.478 1.00 0.00 H new ATOM 0 HG1 THR A 13 -5.005 -12.054 -15.095 1.00 0.00 H new ATOM 0 HG21 THR A 13 -4.782 -10.023 -16.356 1.00 0.00 H new ATOM 0 HG22 THR A 13 -4.925 -8.492 -15.460 1.00 0.00 H new ATOM 0 HG23 THR A 13 -3.505 -9.537 -15.216 1.00 0.00 H new ATOM 208 N LEU A 14 -4.877 -7.124 -13.069 1.00 0.00 N ATOM 209 CA LEU A 14 -5.396 -5.756 -12.974 1.00 0.00 C ATOM 210 C LEU A 14 -6.283 -5.395 -14.164 1.00 0.00 C ATOM 211 O LEU A 14 -5.974 -5.739 -15.301 1.00 0.00 O ATOM 212 CB LEU A 14 -4.258 -4.732 -12.905 1.00 0.00 C ATOM 213 CG LEU A 14 -4.709 -3.277 -12.709 1.00 0.00 C ATOM 214 CD1 LEU A 14 -5.176 -3.031 -11.285 1.00 0.00 C ATOM 215 CD2 LEU A 14 -3.640 -2.291 -13.133 1.00 0.00 C ATOM 0 H LEU A 14 -3.881 -7.187 -13.279 1.00 0.00 H new ATOM 0 HA LEU A 14 -5.987 -5.723 -12.059 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -3.593 -5.004 -12.086 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -3.675 -4.796 -13.824 1.00 0.00 H new ATOM 0 HG LEU A 14 -5.564 -3.111 -13.364 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -5.488 -1.992 -11.179 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -6.016 -3.688 -11.059 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -4.359 -3.237 -10.593 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -4.001 -1.274 -12.978 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.740 -2.452 -12.539 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -3.409 -2.437 -14.188 1.00 0.00 H new ATOM 227 N ILE A 15 -7.389 -4.729 -13.885 1.00 0.00 N ATOM 228 CA ILE A 15 -8.208 -4.159 -14.928 1.00 0.00 C ATOM 229 C ILE A 15 -7.914 -2.676 -14.953 1.00 0.00 C ATOM 230 O ILE A 15 -7.506 -2.128 -15.973 1.00 0.00 O ATOM 231 CB ILE A 15 -9.731 -4.401 -14.715 1.00 0.00 C ATOM 232 CG1 ILE A 15 -10.035 -5.899 -14.771 1.00 0.00 C ATOM 233 CG2 ILE A 15 -10.556 -3.643 -15.767 1.00 0.00 C ATOM 234 CD1 ILE A 15 -11.495 -6.241 -14.574 1.00 0.00 C ATOM 0 H ILE A 15 -7.738 -4.572 -12.940 1.00 0.00 H new ATOM 0 HA ILE A 15 -7.965 -4.642 -15.874 1.00 0.00 H new ATOM 0 HB ILE A 15 -10.009 -4.022 -13.732 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -9.708 -6.289 -15.735 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -9.448 -6.407 -14.006 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -11.617 -3.827 -15.599 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -10.355 -2.575 -15.686 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -10.281 -3.989 -16.763 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -11.626 -7.322 -14.628 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -11.824 -5.884 -13.598 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -12.089 -5.764 -15.354 1.00 0.00 H new ATOM 246 N LYS A 16 -8.102 -2.028 -13.812 1.00 0.00 N ATOM 247 CA LYS A 16 -7.758 -0.647 -13.672 1.00 0.00 C ATOM 248 C LYS A 16 -7.486 -0.307 -12.248 1.00 0.00 C ATOM 249 O LYS A 16 -8.138 -0.799 -11.326 1.00 0.00 O ATOM 250 CB LYS A 16 -8.824 0.287 -14.238 1.00 0.00 C ATOM 251 CG LYS A 16 -10.234 0.040 -13.704 1.00 0.00 C ATOM 252 CD LYS A 16 -11.257 1.002 -14.290 1.00 0.00 C ATOM 253 CE LYS A 16 -10.928 2.456 -13.967 1.00 0.00 C ATOM 254 NZ LYS A 16 -11.982 3.380 -14.434 1.00 0.00 N ATOM 0 H LYS A 16 -8.495 -2.453 -12.972 1.00 0.00 H new ATOM 0 HA LYS A 16 -6.851 -0.497 -14.257 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -8.541 1.316 -14.017 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -8.838 0.186 -15.323 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -10.531 -0.984 -13.932 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -10.230 0.137 -12.618 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -11.299 0.872 -15.371 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -12.246 0.760 -13.901 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -10.799 2.568 -12.890 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -9.979 2.725 -14.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -11.718 4.357 -14.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -12.088 3.293 -15.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -12.883 3.141 -13.972 1.00 0.00 H new ATOM 268 N ALA A 17 -6.526 0.502 -12.067 1.00 0.00 N ATOM 269 CA ALA A 17 -6.200 0.984 -10.761 1.00 0.00 C ATOM 270 C ALA A 17 -7.007 2.230 -10.556 1.00 0.00 C ATOM 271 O ALA A 17 -6.824 3.198 -11.288 1.00 0.00 O ATOM 272 CB ALA A 17 -4.710 1.272 -10.643 1.00 0.00 C ATOM 0 H ALA A 17 -5.931 0.861 -12.813 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.431 0.239 -9.999 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.488 1.637 -9.640 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.147 0.357 -10.829 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.426 2.028 -11.375 1.00 0.00 H new ATOM 278 N ILE A 18 -7.946 2.188 -9.630 1.00 0.00 N ATOM 279 CA ILE A 18 -8.817 3.320 -9.396 1.00 0.00 C ATOM 280 C ILE A 18 -8.001 4.428 -8.808 1.00 0.00 C ATOM 281 O ILE A 18 -8.022 5.562 -9.302 1.00 0.00 O ATOM 282 CB ILE A 18 -9.999 2.963 -8.453 1.00 0.00 C ATOM 283 CG1 ILE A 18 -10.806 1.809 -9.057 1.00 0.00 C ATOM 284 CG2 ILE A 18 -10.886 4.186 -8.184 1.00 0.00 C ATOM 285 CD1 ILE A 18 -12.034 1.421 -8.272 1.00 0.00 C ATOM 0 H ILE A 18 -8.124 1.383 -9.029 1.00 0.00 H new ATOM 0 HA ILE A 18 -9.255 3.628 -10.346 1.00 0.00 H new ATOM 0 HB ILE A 18 -9.598 2.644 -7.491 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -11.109 2.085 -10.067 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -10.158 0.937 -9.146 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -11.704 3.904 -7.521 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -10.292 4.970 -7.714 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -11.293 4.554 -9.126 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -12.542 0.597 -8.774 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -11.741 1.110 -7.269 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -12.708 2.275 -8.205 1.00 0.00 H new ATOM 297 N ASP A 19 -7.255 4.079 -7.798 1.00 0.00 N ATOM 298 CA ASP A 19 -6.367 4.980 -7.148 1.00 0.00 C ATOM 299 C ASP A 19 -5.384 4.125 -6.353 1.00 0.00 C ATOM 300 O ASP A 19 -5.271 2.929 -6.624 1.00 0.00 O ATOM 301 CB ASP A 19 -7.139 5.934 -6.234 1.00 0.00 C ATOM 302 CG ASP A 19 -6.426 7.250 -6.095 1.00 0.00 C ATOM 303 OD1 ASP A 19 -5.353 7.285 -5.476 1.00 0.00 O ATOM 304 OD2 ASP A 19 -6.933 8.272 -6.627 1.00 0.00 O ATOM 0 H ASP A 19 -7.253 3.139 -7.401 1.00 0.00 H new ATOM 0 HA ASP A 19 -5.838 5.602 -7.870 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.138 6.100 -6.637 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.263 5.479 -5.251 1.00 0.00 H new ATOM 309 N GLY A 20 -4.707 4.707 -5.386 1.00 0.00 N ATOM 310 CA GLY A 20 -3.694 4.001 -4.633 1.00 0.00 C ATOM 311 C GLY A 20 -4.201 2.854 -3.782 1.00 0.00 C ATOM 312 O GLY A 20 -3.698 1.737 -3.880 1.00 0.00 O ATOM 0 H GLY A 20 -4.843 5.677 -5.101 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -2.951 3.614 -5.330 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -3.183 4.714 -3.986 1.00 0.00 H new ATOM 316 N ASP A 21 -5.182 3.112 -2.953 1.00 0.00 N ATOM 317 CA ASP A 21 -5.660 2.073 -2.040 1.00 0.00 C ATOM 318 C ASP A 21 -6.908 1.367 -2.542 1.00 0.00 C ATOM 319 O ASP A 21 -7.413 0.460 -1.883 1.00 0.00 O ATOM 320 CB ASP A 21 -5.864 2.594 -0.596 1.00 0.00 C ATOM 321 CG ASP A 21 -6.830 3.749 -0.486 1.00 0.00 C ATOM 322 OD1 ASP A 21 -8.038 3.572 -0.750 1.00 0.00 O ATOM 323 OD2 ASP A 21 -6.391 4.872 -0.138 1.00 0.00 O ATOM 0 H ASP A 21 -5.664 4.008 -2.882 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.861 1.332 -2.012 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.223 1.774 0.027 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -4.899 2.902 -0.193 1.00 0.00 H new ATOM 328 N THR A 22 -7.398 1.756 -3.695 1.00 0.00 N ATOM 329 CA THR A 22 -8.570 1.124 -4.263 1.00 0.00 C ATOM 330 C THR A 22 -8.287 0.763 -5.727 1.00 0.00 C ATOM 331 O THR A 22 -7.941 1.631 -6.535 1.00 0.00 O ATOM 332 CB THR A 22 -9.800 2.060 -4.193 1.00 0.00 C ATOM 333 OG1 THR A 22 -9.892 2.641 -2.873 1.00 0.00 O ATOM 334 CG2 THR A 22 -11.073 1.267 -4.441 1.00 0.00 C ATOM 0 H THR A 22 -7.004 2.508 -4.261 1.00 0.00 H new ATOM 0 HA THR A 22 -8.792 0.225 -3.687 1.00 0.00 H new ATOM 0 HB THR A 22 -9.686 2.837 -4.949 1.00 0.00 H new ATOM 0 HG1 THR A 22 -10.670 3.235 -2.831 1.00 0.00 H new ATOM 0 HG21 THR A 22 -11.933 1.934 -4.390 1.00 0.00 H new ATOM 0 HG22 THR A 22 -11.029 0.807 -5.428 1.00 0.00 H new ATOM 0 HG23 THR A 22 -11.171 0.490 -3.683 1.00 0.00 H new ATOM 342 N VAL A 23 -8.426 -0.488 -6.068 1.00 0.00 N ATOM 343 CA VAL A 23 -8.156 -0.944 -7.415 1.00 0.00 C ATOM 344 C VAL A 23 -9.268 -1.840 -7.873 1.00 0.00 C ATOM 345 O VAL A 23 -10.045 -2.331 -7.058 1.00 0.00 O ATOM 346 CB VAL A 23 -6.789 -1.694 -7.552 1.00 0.00 C ATOM 347 CG1 VAL A 23 -5.616 -0.775 -7.235 1.00 0.00 C ATOM 348 CG2 VAL A 23 -6.747 -2.935 -6.669 1.00 0.00 C ATOM 0 H VAL A 23 -8.728 -1.222 -5.428 1.00 0.00 H new ATOM 0 HA VAL A 23 -8.092 -0.055 -8.043 1.00 0.00 H new ATOM 0 HB VAL A 23 -6.699 -2.012 -8.591 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -4.682 -1.328 -7.340 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -5.618 0.069 -7.925 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.707 -0.408 -6.213 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.785 -3.433 -6.787 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -6.880 -2.645 -5.627 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -7.546 -3.616 -6.961 1.00 0.00 H new ATOM 358 N LYS A 24 -9.364 -2.034 -9.149 1.00 0.00 N ATOM 359 CA LYS A 24 -10.360 -2.886 -9.694 1.00 0.00 C ATOM 360 C LYS A 24 -9.669 -3.880 -10.569 1.00 0.00 C ATOM 361 O LYS A 24 -9.064 -3.527 -11.599 1.00 0.00 O ATOM 362 CB LYS A 24 -11.366 -2.075 -10.481 1.00 0.00 C ATOM 363 CG LYS A 24 -12.633 -2.821 -10.818 1.00 0.00 C ATOM 364 CD LYS A 24 -13.635 -1.886 -11.449 1.00 0.00 C ATOM 365 CE LYS A 24 -14.958 -2.571 -11.696 1.00 0.00 C ATOM 366 NZ LYS A 24 -15.963 -1.623 -12.198 1.00 0.00 N ATOM 0 H LYS A 24 -8.750 -1.603 -9.841 1.00 0.00 H new ATOM 0 HA LYS A 24 -10.906 -3.401 -8.904 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -11.624 -1.183 -9.910 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.899 -1.737 -11.406 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -12.410 -3.641 -11.500 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -13.055 -3.263 -9.915 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -13.787 -1.024 -10.800 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -13.238 -1.510 -12.392 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -14.824 -3.378 -12.417 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -15.313 -3.026 -10.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -16.861 -2.122 -12.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -16.107 -0.867 -11.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -15.633 -1.208 -13.093 1.00 0.00 H new ATOM 380 N LEU A 25 -9.702 -5.089 -10.172 1.00 0.00 N ATOM 381 CA LEU A 25 -9.006 -6.084 -10.882 1.00 0.00 C ATOM 382 C LEU A 25 -9.902 -7.223 -11.259 1.00 0.00 C ATOM 383 O LEU A 25 -11.034 -7.334 -10.778 1.00 0.00 O ATOM 384 CB LEU A 25 -7.723 -6.526 -10.120 1.00 0.00 C ATOM 385 CG LEU A 25 -7.857 -6.990 -8.655 1.00 0.00 C ATOM 386 CD1 LEU A 25 -8.583 -8.319 -8.539 1.00 0.00 C ATOM 387 CD2 LEU A 25 -6.489 -7.070 -8.000 1.00 0.00 C ATOM 0 H LEU A 25 -10.209 -5.417 -9.350 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.665 -5.656 -11.825 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -7.267 -7.339 -10.684 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.022 -5.691 -10.140 1.00 0.00 H new ATOM 0 HG LEU A 25 -8.460 -6.248 -8.132 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -8.653 -8.605 -7.489 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -9.585 -8.224 -8.957 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -8.032 -9.083 -9.087 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.599 -7.399 -6.967 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.867 -7.782 -8.543 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.018 -6.087 -8.020 1.00 0.00 H new ATOM 399 N MET A 26 -9.410 -8.039 -12.116 1.00 0.00 N ATOM 400 CA MET A 26 -10.106 -9.175 -12.568 1.00 0.00 C ATOM 401 C MET A 26 -9.783 -10.286 -11.623 1.00 0.00 C ATOM 402 O MET A 26 -8.634 -10.760 -11.562 1.00 0.00 O ATOM 403 CB MET A 26 -9.660 -9.547 -13.971 1.00 0.00 C ATOM 404 CG MET A 26 -10.552 -10.575 -14.633 1.00 0.00 C ATOM 405 SD MET A 26 -10.061 -10.949 -16.323 1.00 0.00 S ATOM 406 CE MET A 26 -10.191 -9.329 -17.095 1.00 0.00 C ATOM 0 H MET A 26 -8.485 -7.928 -12.531 1.00 0.00 H new ATOM 0 HA MET A 26 -11.178 -8.982 -12.600 1.00 0.00 H new ATOM 0 HB2 MET A 26 -9.635 -8.648 -14.587 1.00 0.00 H new ATOM 0 HB3 MET A 26 -8.642 -9.933 -13.930 1.00 0.00 H new ATOM 0 HG2 MET A 26 -10.538 -11.493 -14.045 1.00 0.00 H new ATOM 0 HG3 MET A 26 -11.580 -10.211 -14.631 1.00 0.00 H new ATOM 0 HE1 MET A 26 -10.533 -9.443 -18.124 1.00 0.00 H new ATOM 0 HE2 MET A 26 -10.904 -8.718 -16.541 1.00 0.00 H new ATOM 0 HE3 MET A 26 -9.215 -8.843 -17.089 1.00 0.00 H new ATOM 416 N TYR A 27 -10.739 -10.651 -10.868 1.00 0.00 N ATOM 417 CA TYR A 27 -10.609 -11.673 -9.904 1.00 0.00 C ATOM 418 C TYR A 27 -11.299 -12.915 -10.410 1.00 0.00 C ATOM 419 O TYR A 27 -12.519 -12.975 -10.439 1.00 0.00 O ATOM 420 CB TYR A 27 -11.210 -11.206 -8.574 1.00 0.00 C ATOM 421 CG TYR A 27 -11.221 -12.266 -7.518 1.00 0.00 C ATOM 422 CD1 TYR A 27 -10.044 -12.766 -7.016 1.00 0.00 C ATOM 423 CD2 TYR A 27 -12.415 -12.774 -7.035 1.00 0.00 C ATOM 424 CE1 TYR A 27 -10.048 -13.747 -6.064 1.00 0.00 C ATOM 425 CE2 TYR A 27 -12.428 -13.756 -6.074 1.00 0.00 C ATOM 426 CZ TYR A 27 -11.242 -14.240 -5.592 1.00 0.00 C ATOM 427 OH TYR A 27 -11.242 -15.241 -4.645 1.00 0.00 O ATOM 0 H TYR A 27 -11.669 -10.234 -10.902 1.00 0.00 H new ATOM 0 HA TYR A 27 -9.557 -11.903 -9.736 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -10.644 -10.348 -8.210 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -12.231 -10.865 -8.746 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -9.103 -12.379 -7.378 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -13.350 -12.393 -7.419 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -9.115 -14.134 -5.683 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -13.366 -14.142 -5.702 1.00 0.00 H new ATOM 0 HH TYR A 27 -12.166 -15.476 -4.417 1.00 0.00 H new ATOM 437 N LYS A 28 -10.507 -13.858 -10.895 1.00 0.00 N ATOM 438 CA LYS A 28 -10.990 -15.154 -11.387 1.00 0.00 C ATOM 439 C LYS A 28 -11.968 -14.978 -12.547 1.00 0.00 C ATOM 440 O LYS A 28 -12.916 -15.749 -12.711 1.00 0.00 O ATOM 441 CB LYS A 28 -11.627 -15.959 -10.244 1.00 0.00 C ATOM 442 CG LYS A 28 -10.662 -16.269 -9.117 1.00 0.00 C ATOM 443 CD LYS A 28 -11.332 -17.042 -8.008 1.00 0.00 C ATOM 444 CE LYS A 28 -10.332 -17.393 -6.932 1.00 0.00 C ATOM 445 NZ LYS A 28 -10.968 -18.033 -5.773 1.00 0.00 N ATOM 0 H LYS A 28 -9.495 -13.751 -10.962 1.00 0.00 H new ATOM 0 HA LYS A 28 -10.134 -15.713 -11.764 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -12.474 -15.401 -9.844 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.021 -16.894 -10.643 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -9.821 -16.844 -9.505 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -10.256 -15.339 -8.719 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -12.142 -16.450 -7.582 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -11.779 -17.952 -8.409 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.576 -18.061 -7.345 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -9.816 -16.489 -6.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.242 -18.496 -5.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -11.460 -17.313 -5.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -11.653 -18.743 -6.101 1.00 0.00 H new ATOM 459 N GLY A 29 -11.713 -13.984 -13.358 1.00 0.00 N ATOM 460 CA GLY A 29 -12.529 -13.754 -14.529 1.00 0.00 C ATOM 461 C GLY A 29 -13.697 -12.806 -14.294 1.00 0.00 C ATOM 462 O GLY A 29 -14.556 -12.656 -15.166 1.00 0.00 O ATOM 0 H GLY A 29 -10.949 -13.320 -13.232 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -11.901 -13.350 -15.323 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -12.916 -14.710 -14.883 1.00 0.00 H new ATOM 466 N GLN A 30 -13.760 -12.193 -13.132 1.00 0.00 N ATOM 467 CA GLN A 30 -14.805 -11.218 -12.852 1.00 0.00 C ATOM 468 C GLN A 30 -14.203 -9.973 -12.208 1.00 0.00 C ATOM 469 O GLN A 30 -13.297 -10.081 -11.393 1.00 0.00 O ATOM 470 CB GLN A 30 -15.931 -11.825 -11.990 1.00 0.00 C ATOM 471 CG GLN A 30 -15.477 -12.390 -10.659 1.00 0.00 C ATOM 472 CD GLN A 30 -16.594 -13.025 -9.874 1.00 0.00 C ATOM 473 OE1 GLN A 30 -17.559 -13.548 -10.439 1.00 0.00 O ATOM 474 NE2 GLN A 30 -16.473 -13.005 -8.577 1.00 0.00 N ATOM 0 H GLN A 30 -13.105 -12.348 -12.365 1.00 0.00 H new ATOM 0 HA GLN A 30 -15.263 -10.922 -13.796 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -16.683 -11.057 -11.806 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -16.418 -12.618 -12.558 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -14.697 -13.131 -10.833 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -15.032 -11.592 -10.065 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -15.660 -12.563 -8.147 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -17.191 -13.431 -7.991 1.00 0.00 H new ATOM 483 N PRO A 31 -14.662 -8.784 -12.587 1.00 0.00 N ATOM 484 CA PRO A 31 -14.115 -7.535 -12.066 1.00 0.00 C ATOM 485 C PRO A 31 -14.562 -7.253 -10.631 1.00 0.00 C ATOM 486 O PRO A 31 -15.761 -7.170 -10.343 1.00 0.00 O ATOM 487 CB PRO A 31 -14.685 -6.480 -13.015 1.00 0.00 C ATOM 488 CG PRO A 31 -15.963 -7.063 -13.511 1.00 0.00 C ATOM 489 CD PRO A 31 -15.758 -8.547 -13.555 1.00 0.00 C ATOM 0 HA PRO A 31 -13.026 -7.555 -12.025 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -14.855 -5.535 -12.499 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -13.999 -6.275 -13.837 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -16.791 -6.804 -12.851 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -16.210 -6.675 -14.499 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -16.664 -9.084 -13.273 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -15.487 -8.883 -14.556 1.00 0.00 H new ATOM 497 N MET A 32 -13.624 -7.124 -9.738 1.00 0.00 N ATOM 498 CA MET A 32 -13.926 -6.811 -8.390 1.00 0.00 C ATOM 499 C MET A 32 -13.093 -5.624 -7.945 1.00 0.00 C ATOM 500 O MET A 32 -11.901 -5.525 -8.272 1.00 0.00 O ATOM 501 CB MET A 32 -13.673 -8.013 -7.485 1.00 0.00 C ATOM 502 CG MET A 32 -14.068 -7.752 -6.047 1.00 0.00 C ATOM 503 SD MET A 32 -13.819 -9.159 -4.930 1.00 0.00 S ATOM 504 CE MET A 32 -14.907 -10.374 -5.657 1.00 0.00 C ATOM 0 H MET A 32 -12.629 -7.235 -9.934 1.00 0.00 H new ATOM 0 HA MET A 32 -14.983 -6.553 -8.316 1.00 0.00 H new ATOM 0 HB2 MET A 32 -14.231 -8.870 -7.861 1.00 0.00 H new ATOM 0 HB3 MET A 32 -12.616 -8.278 -7.525 1.00 0.00 H new ATOM 0 HG2 MET A 32 -13.495 -6.903 -5.675 1.00 0.00 H new ATOM 0 HG3 MET A 32 -15.119 -7.464 -6.019 1.00 0.00 H new ATOM 0 HE1 MET A 32 -15.056 -11.195 -4.956 1.00 0.00 H new ATOM 0 HE2 MET A 32 -15.868 -9.912 -5.884 1.00 0.00 H new ATOM 0 HE3 MET A 32 -14.462 -10.757 -6.575 1.00 0.00 H new ATOM 514 N THR A 33 -13.727 -4.722 -7.264 1.00 0.00 N ATOM 515 CA THR A 33 -13.091 -3.577 -6.708 1.00 0.00 C ATOM 516 C THR A 33 -12.556 -3.975 -5.333 1.00 0.00 C ATOM 517 O THR A 33 -13.284 -4.525 -4.530 1.00 0.00 O ATOM 518 CB THR A 33 -14.133 -2.452 -6.555 1.00 0.00 C ATOM 519 OG1 THR A 33 -14.851 -2.299 -7.800 1.00 0.00 O ATOM 520 CG2 THR A 33 -13.465 -1.134 -6.202 1.00 0.00 C ATOM 0 H THR A 33 -14.729 -4.766 -7.076 1.00 0.00 H new ATOM 0 HA THR A 33 -12.280 -3.226 -7.346 1.00 0.00 H new ATOM 0 HB THR A 33 -14.817 -2.721 -5.750 1.00 0.00 H new ATOM 0 HG1 THR A 33 -15.517 -1.586 -7.708 1.00 0.00 H new ATOM 0 HG21 THR A 33 -14.223 -0.358 -6.100 1.00 0.00 H new ATOM 0 HG22 THR A 33 -12.925 -1.240 -5.261 1.00 0.00 H new ATOM 0 HG23 THR A 33 -12.766 -0.857 -6.992 1.00 0.00 H new ATOM 528 N PHE A 34 -11.303 -3.750 -5.101 1.00 0.00 N ATOM 529 CA PHE A 34 -10.665 -4.086 -3.839 1.00 0.00 C ATOM 530 C PHE A 34 -10.176 -2.844 -3.155 1.00 0.00 C ATOM 531 O PHE A 34 -9.743 -1.892 -3.826 1.00 0.00 O ATOM 532 CB PHE A 34 -9.449 -5.006 -4.057 1.00 0.00 C ATOM 533 CG PHE A 34 -9.746 -6.451 -4.329 1.00 0.00 C ATOM 534 CD1 PHE A 34 -10.215 -6.870 -5.552 1.00 0.00 C ATOM 535 CD2 PHE A 34 -9.519 -7.399 -3.347 1.00 0.00 C ATOM 536 CE1 PHE A 34 -10.457 -8.208 -5.788 1.00 0.00 C ATOM 537 CE2 PHE A 34 -9.763 -8.732 -3.580 1.00 0.00 C ATOM 538 CZ PHE A 34 -10.232 -9.138 -4.802 1.00 0.00 C ATOM 0 H PHE A 34 -10.674 -3.323 -5.781 1.00 0.00 H new ATOM 0 HA PHE A 34 -11.411 -4.595 -3.229 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -8.869 -4.613 -4.892 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -8.814 -4.948 -3.173 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -10.395 -6.147 -6.333 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -9.145 -7.087 -2.383 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -10.825 -8.526 -6.752 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -9.585 -9.458 -2.801 1.00 0.00 H new ATOM 0 HZ PHE A 34 -10.424 -10.184 -4.989 1.00 0.00 H new ATOM 548 N ARG A 35 -10.250 -2.826 -1.846 1.00 0.00 N ATOM 549 CA ARG A 35 -9.618 -1.777 -1.107 1.00 0.00 C ATOM 550 C ARG A 35 -8.679 -2.425 -0.122 1.00 0.00 C ATOM 551 O ARG A 35 -9.024 -3.426 0.497 1.00 0.00 O ATOM 552 CB ARG A 35 -10.583 -0.806 -0.387 1.00 0.00 C ATOM 553 CG ARG A 35 -9.820 0.429 0.096 1.00 0.00 C ATOM 554 CD ARG A 35 -10.631 1.454 0.863 1.00 0.00 C ATOM 555 NE ARG A 35 -9.793 2.654 1.080 1.00 0.00 N ATOM 556 CZ ARG A 35 -9.643 3.354 2.216 1.00 0.00 C ATOM 557 NH1 ARG A 35 -10.244 2.974 3.341 1.00 0.00 N ATOM 558 NH2 ARG A 35 -8.852 4.428 2.211 1.00 0.00 N ATOM 0 H ARG A 35 -10.738 -3.521 -1.281 1.00 0.00 H new ATOM 0 HA ARG A 35 -9.093 -1.142 -1.821 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -11.383 -0.507 -1.064 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.052 -1.308 0.459 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -8.997 0.098 0.730 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -9.377 0.920 -0.771 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -11.531 1.717 0.307 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -10.955 1.042 1.818 1.00 0.00 H new ATOM 0 HE ARG A 35 -9.268 2.989 0.272 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -10.830 2.139 3.349 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -10.119 3.518 4.195 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -8.373 4.705 1.354 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -8.726 4.972 3.064 1.00 0.00 H new ATOM 572 N LEU A 36 -7.502 -1.873 0.000 1.00 0.00 N ATOM 573 CA LEU A 36 -6.460 -2.428 0.852 1.00 0.00 C ATOM 574 C LEU A 36 -6.803 -2.371 2.363 1.00 0.00 C ATOM 575 O LEU A 36 -6.203 -3.086 3.164 1.00 0.00 O ATOM 576 CB LEU A 36 -5.090 -1.803 0.530 1.00 0.00 C ATOM 577 CG LEU A 36 -4.376 -2.268 -0.780 1.00 0.00 C ATOM 578 CD1 LEU A 36 -5.181 -1.974 -2.038 1.00 0.00 C ATOM 579 CD2 LEU A 36 -3.006 -1.633 -0.887 1.00 0.00 C ATOM 0 H LEU A 36 -7.228 -1.020 -0.488 1.00 0.00 H new ATOM 0 HA LEU A 36 -6.399 -3.491 0.619 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -5.217 -0.722 0.478 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.422 -2.006 1.367 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.280 -3.351 -0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.630 -2.321 -2.912 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -6.140 -2.490 -1.985 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.350 -0.900 -2.119 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.521 -1.966 -1.804 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.108 -0.548 -0.904 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.401 -1.927 -0.029 1.00 0.00 H new ATOM 591 N LEU A 37 -7.762 -1.500 2.726 1.00 0.00 N ATOM 592 CA LEU A 37 -8.355 -1.398 4.092 1.00 0.00 C ATOM 593 C LEU A 37 -7.405 -0.879 5.182 1.00 0.00 C ATOM 594 O LEU A 37 -7.677 0.157 5.800 1.00 0.00 O ATOM 595 CB LEU A 37 -8.988 -2.736 4.536 1.00 0.00 C ATOM 596 CG LEU A 37 -9.610 -2.767 5.947 1.00 0.00 C ATOM 597 CD1 LEU A 37 -10.811 -1.834 6.045 1.00 0.00 C ATOM 598 CD2 LEU A 37 -9.991 -4.185 6.343 1.00 0.00 C ATOM 0 H LEU A 37 -8.162 -0.828 2.071 1.00 0.00 H new ATOM 0 HA LEU A 37 -9.128 -0.637 3.988 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -9.761 -3.003 3.816 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.222 -3.510 4.483 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.855 -2.410 6.648 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -11.226 -1.880 7.052 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.497 -0.813 5.828 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -11.570 -2.141 5.326 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.427 -4.179 7.342 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -10.718 -4.579 5.632 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.102 -4.815 6.339 1.00 0.00 H new ATOM 610 N LEU A 38 -6.322 -1.607 5.425 1.00 0.00 N ATOM 611 CA LEU A 38 -5.378 -1.290 6.502 1.00 0.00 C ATOM 612 C LEU A 38 -4.649 0.007 6.218 1.00 0.00 C ATOM 613 O LEU A 38 -4.254 0.737 7.141 1.00 0.00 O ATOM 614 CB LEU A 38 -4.338 -2.434 6.750 1.00 0.00 C ATOM 615 CG LEU A 38 -4.786 -3.743 7.458 1.00 0.00 C ATOM 616 CD1 LEU A 38 -5.949 -4.414 6.778 1.00 0.00 C ATOM 617 CD2 LEU A 38 -3.631 -4.704 7.518 1.00 0.00 C ATOM 0 H LEU A 38 -6.069 -2.434 4.884 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.974 -1.183 7.408 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.924 -2.713 5.781 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.522 -2.011 7.335 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.113 -3.463 8.459 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.213 -5.322 7.321 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.803 -3.737 6.765 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.674 -4.670 5.755 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.947 -5.621 8.015 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.297 -4.935 6.506 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.811 -4.253 8.076 1.00 0.00 H new ATOM 629 N VAL A 39 -4.491 0.302 4.954 1.00 0.00 N ATOM 630 CA VAL A 39 -3.787 1.477 4.544 1.00 0.00 C ATOM 631 C VAL A 39 -4.760 2.509 4.005 1.00 0.00 C ATOM 632 O VAL A 39 -5.775 2.171 3.369 1.00 0.00 O ATOM 633 CB VAL A 39 -2.688 1.169 3.479 1.00 0.00 C ATOM 634 CG1 VAL A 39 -1.769 0.076 3.969 1.00 0.00 C ATOM 635 CG2 VAL A 39 -3.276 0.798 2.124 1.00 0.00 C ATOM 0 H VAL A 39 -4.847 -0.267 4.186 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.283 1.875 5.425 1.00 0.00 H new ATOM 0 HB VAL A 39 -2.115 2.086 3.340 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.009 -0.126 3.214 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -1.287 0.393 4.894 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.347 -0.830 4.153 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.469 0.594 1.421 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.899 -0.090 2.229 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -3.881 1.624 1.751 1.00 0.00 H new ATOM 645 N ASP A 40 -4.475 3.738 4.287 1.00 0.00 N ATOM 646 CA ASP A 40 -5.268 4.847 3.819 1.00 0.00 C ATOM 647 C ASP A 40 -4.325 5.917 3.330 1.00 0.00 C ATOM 648 O ASP A 40 -3.388 6.315 4.049 1.00 0.00 O ATOM 649 CB ASP A 40 -6.155 5.371 4.948 1.00 0.00 C ATOM 650 CG ASP A 40 -7.033 6.533 4.558 1.00 0.00 C ATOM 651 OD1 ASP A 40 -8.115 6.320 3.963 1.00 0.00 O ATOM 652 OD2 ASP A 40 -6.683 7.678 4.890 1.00 0.00 O ATOM 0 H ASP A 40 -3.675 4.013 4.857 1.00 0.00 H new ATOM 0 HA ASP A 40 -5.923 4.535 3.006 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -6.786 4.558 5.306 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -5.521 5.673 5.782 1.00 0.00 H new ATOM 657 N THR A 41 -4.515 6.340 2.122 1.00 0.00 N ATOM 658 CA THR A 41 -3.639 7.303 1.511 1.00 0.00 C ATOM 659 C THR A 41 -4.183 8.733 1.706 1.00 0.00 C ATOM 660 O THR A 41 -5.393 8.918 1.793 1.00 0.00 O ATOM 661 CB THR A 41 -3.471 6.963 0.008 1.00 0.00 C ATOM 662 OG1 THR A 41 -4.759 6.912 -0.633 1.00 0.00 O ATOM 663 CG2 THR A 41 -2.789 5.608 -0.145 1.00 0.00 C ATOM 0 H THR A 41 -5.282 6.030 1.525 1.00 0.00 H new ATOM 0 HA THR A 41 -2.661 7.259 1.990 1.00 0.00 H new ATOM 0 HB THR A 41 -2.861 7.737 -0.458 1.00 0.00 H new ATOM 0 HG1 THR A 41 -5.160 6.029 -0.491 1.00 0.00 H new ATOM 0 HG21 THR A 41 -2.674 5.376 -1.204 1.00 0.00 H new ATOM 0 HG22 THR A 41 -1.807 5.639 0.328 1.00 0.00 H new ATOM 0 HG23 THR A 41 -3.397 4.839 0.331 1.00 0.00 H new ATOM 671 N PRO A 42 -3.313 9.749 1.847 1.00 0.00 N ATOM 672 CA PRO A 42 -3.746 11.136 1.983 1.00 0.00 C ATOM 673 C PRO A 42 -3.832 11.853 0.621 1.00 0.00 C ATOM 674 O PRO A 42 -3.031 11.579 -0.282 1.00 0.00 O ATOM 675 CB PRO A 42 -2.636 11.769 2.846 1.00 0.00 C ATOM 676 CG PRO A 42 -1.505 10.764 2.885 1.00 0.00 C ATOM 677 CD PRO A 42 -1.854 9.655 1.923 1.00 0.00 C ATOM 0 HA PRO A 42 -4.743 11.214 2.416 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -2.302 12.714 2.418 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -3.000 11.985 3.851 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -0.563 11.235 2.603 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -1.375 10.371 3.893 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -1.387 9.801 0.949 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -1.529 8.682 2.290 1.00 0.00 H new ATOM 910 N GLU A 57 2.442 9.716 -6.022 1.00 0.00 N ATOM 911 CA GLU A 57 1.421 9.287 -5.124 1.00 0.00 C ATOM 912 C GLU A 57 1.020 7.842 -5.284 1.00 0.00 C ATOM 913 O GLU A 57 1.440 7.146 -6.230 1.00 0.00 O ATOM 914 CB GLU A 57 0.260 10.286 -5.018 1.00 0.00 C ATOM 915 CG GLU A 57 0.444 11.307 -3.873 1.00 0.00 C ATOM 916 CD GLU A 57 1.800 12.031 -3.853 1.00 0.00 C ATOM 917 OE1 GLU A 57 2.854 11.368 -3.753 1.00 0.00 O ATOM 918 OE2 GLU A 57 1.840 13.271 -3.808 1.00 0.00 O ATOM 0 HA GLU A 57 1.876 9.297 -4.133 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.161 10.821 -5.962 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -0.670 9.739 -4.863 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -0.347 12.053 -3.943 1.00 0.00 H new ATOM 0 HG3 GLU A 57 0.312 10.790 -2.922 1.00 0.00 H new ATOM 925 N ALA A 58 0.250 7.368 -4.337 1.00 0.00 N ATOM 926 CA ALA A 58 -0.133 5.983 -4.282 1.00 0.00 C ATOM 927 C ALA A 58 -0.854 5.546 -5.550 1.00 0.00 C ATOM 928 O ALA A 58 -0.700 4.421 -5.982 1.00 0.00 O ATOM 929 CB ALA A 58 -0.989 5.734 -3.070 1.00 0.00 C ATOM 0 H ALA A 58 -0.130 7.936 -3.580 1.00 0.00 H new ATOM 0 HA ALA A 58 0.775 5.385 -4.205 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -1.275 4.683 -3.036 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -0.428 5.987 -2.170 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -1.885 6.352 -3.124 1.00 0.00 H new ATOM 935 N SER A 59 -1.592 6.478 -6.159 1.00 0.00 N ATOM 936 CA SER A 59 -2.369 6.235 -7.364 1.00 0.00 C ATOM 937 C SER A 59 -1.499 5.600 -8.465 1.00 0.00 C ATOM 938 O SER A 59 -1.828 4.543 -9.018 1.00 0.00 O ATOM 939 CB SER A 59 -2.894 7.579 -7.855 1.00 0.00 C ATOM 940 OG SER A 59 -3.365 8.370 -6.762 1.00 0.00 O ATOM 0 H SER A 59 -1.663 7.437 -5.818 1.00 0.00 H new ATOM 0 HA SER A 59 -3.184 5.547 -7.139 1.00 0.00 H new ATOM 0 HB2 SER A 59 -2.103 8.113 -8.382 1.00 0.00 H new ATOM 0 HB3 SER A 59 -3.702 7.420 -8.569 1.00 0.00 H new ATOM 0 HG SER A 59 -3.947 7.826 -6.191 1.00 0.00 H new ATOM 946 N ALA A 60 -0.373 6.223 -8.738 1.00 0.00 N ATOM 947 CA ALA A 60 0.504 5.764 -9.779 1.00 0.00 C ATOM 948 C ALA A 60 1.432 4.684 -9.270 1.00 0.00 C ATOM 949 O ALA A 60 1.797 3.777 -10.020 1.00 0.00 O ATOM 950 CB ALA A 60 1.291 6.921 -10.349 1.00 0.00 C ATOM 0 H ALA A 60 -0.047 7.055 -8.246 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.105 5.333 -10.574 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.951 6.559 -11.137 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.604 7.660 -10.762 1.00 0.00 H new ATOM 0 HB3 ALA A 60 1.886 7.380 -9.560 1.00 0.00 H new ATOM 956 N PHE A 61 1.773 4.762 -7.991 1.00 0.00 N ATOM 957 CA PHE A 61 2.699 3.824 -7.362 1.00 0.00 C ATOM 958 C PHE A 61 2.114 2.411 -7.383 1.00 0.00 C ATOM 959 O PHE A 61 2.777 1.460 -7.854 1.00 0.00 O ATOM 960 CB PHE A 61 2.981 4.264 -5.923 1.00 0.00 C ATOM 961 CG PHE A 61 4.150 3.583 -5.257 1.00 0.00 C ATOM 962 CD1 PHE A 61 4.014 2.341 -4.663 1.00 0.00 C ATOM 963 CD2 PHE A 61 5.379 4.211 -5.204 1.00 0.00 C ATOM 964 CE1 PHE A 61 5.079 1.740 -4.031 1.00 0.00 C ATOM 965 CE2 PHE A 61 6.449 3.615 -4.579 1.00 0.00 C ATOM 966 CZ PHE A 61 6.298 2.380 -3.991 1.00 0.00 C ATOM 0 H PHE A 61 1.416 5.478 -7.358 1.00 0.00 H new ATOM 0 HA PHE A 61 3.636 3.817 -7.920 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.157 5.340 -5.918 1.00 0.00 H new ATOM 0 HB3 PHE A 61 2.088 4.084 -5.324 1.00 0.00 H new ATOM 0 HD1 PHE A 61 3.060 1.836 -4.696 1.00 0.00 H new ATOM 0 HD2 PHE A 61 5.501 5.183 -5.659 1.00 0.00 H new ATOM 0 HE1 PHE A 61 4.959 0.771 -3.569 1.00 0.00 H new ATOM 0 HE2 PHE A 61 7.406 4.115 -4.550 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.137 1.912 -3.497 1.00 0.00 H new ATOM 976 N THR A 62 0.880 2.284 -6.893 1.00 0.00 N ATOM 977 CA THR A 62 0.167 1.029 -6.885 1.00 0.00 C ATOM 978 C THR A 62 0.004 0.534 -8.313 1.00 0.00 C ATOM 979 O THR A 62 0.308 -0.626 -8.621 1.00 0.00 O ATOM 980 CB THR A 62 -1.233 1.205 -6.241 1.00 0.00 C ATOM 981 OG1 THR A 62 -1.097 1.701 -4.905 1.00 0.00 O ATOM 982 CG2 THR A 62 -2.007 -0.108 -6.223 1.00 0.00 C ATOM 0 H THR A 62 0.354 3.060 -6.491 1.00 0.00 H new ATOM 0 HA THR A 62 0.735 0.305 -6.301 1.00 0.00 H new ATOM 0 HB THR A 62 -1.791 1.921 -6.845 1.00 0.00 H new ATOM 0 HG1 THR A 62 -0.923 2.665 -4.930 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.983 0.051 -5.765 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.139 -0.466 -7.244 1.00 0.00 H new ATOM 0 HG23 THR A 62 -1.453 -0.849 -5.647 1.00 0.00 H new ATOM 990 N LYS A 63 -0.416 1.449 -9.188 1.00 0.00 N ATOM 991 CA LYS A 63 -0.652 1.148 -10.583 1.00 0.00 C ATOM 992 C LYS A 63 0.606 0.556 -11.241 1.00 0.00 C ATOM 993 O LYS A 63 0.563 -0.525 -11.800 1.00 0.00 O ATOM 994 CB LYS A 63 -1.124 2.409 -11.323 1.00 0.00 C ATOM 995 CG LYS A 63 -1.545 2.163 -12.759 1.00 0.00 C ATOM 996 CD LYS A 63 -2.083 3.430 -13.420 1.00 0.00 C ATOM 997 CE LYS A 63 -2.690 3.144 -14.798 1.00 0.00 C ATOM 998 NZ LYS A 63 -1.694 2.689 -15.803 1.00 0.00 N ATOM 0 H LYS A 63 -0.600 2.421 -8.939 1.00 0.00 H new ATOM 0 HA LYS A 63 -1.439 0.396 -10.647 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.963 2.844 -10.779 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -0.321 3.146 -11.312 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -0.693 1.790 -13.328 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.310 1.387 -12.785 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -2.839 3.882 -12.777 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -1.277 4.156 -13.522 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -3.463 2.383 -14.694 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -3.178 4.047 -15.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -2.108 1.932 -16.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -1.428 3.487 -16.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.849 2.329 -15.316 1.00 0.00 H new ATOM 1012 N LYS A 64 1.721 1.252 -11.121 1.00 0.00 N ATOM 1013 CA LYS A 64 2.990 0.803 -11.707 1.00 0.00 C ATOM 1014 C LYS A 64 3.432 -0.560 -11.207 1.00 0.00 C ATOM 1015 O LYS A 64 3.784 -1.436 -12.013 1.00 0.00 O ATOM 1016 CB LYS A 64 4.121 1.835 -11.519 1.00 0.00 C ATOM 1017 CG LYS A 64 4.398 2.801 -12.706 1.00 0.00 C ATOM 1018 CD LYS A 64 3.278 3.821 -13.023 1.00 0.00 C ATOM 1019 CE LYS A 64 2.017 3.186 -13.595 1.00 0.00 C ATOM 1020 NZ LYS A 64 2.261 2.450 -14.852 1.00 0.00 N ATOM 0 H LYS A 64 1.783 2.139 -10.621 1.00 0.00 H new ATOM 0 HA LYS A 64 2.789 0.707 -12.774 1.00 0.00 H new ATOM 0 HB2 LYS A 64 3.889 2.436 -10.640 1.00 0.00 H new ATOM 0 HB3 LYS A 64 5.041 1.293 -11.301 1.00 0.00 H new ATOM 0 HG2 LYS A 64 5.315 3.351 -12.495 1.00 0.00 H new ATOM 0 HG3 LYS A 64 4.583 2.204 -13.599 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.021 4.361 -12.111 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.658 4.556 -13.732 1.00 0.00 H new ATOM 0 HE2 LYS A 64 1.593 2.504 -12.858 1.00 0.00 H new ATOM 0 HE3 LYS A 64 1.274 3.963 -13.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 1.360 2.083 -15.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 2.686 3.090 -15.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 2.909 1.657 -14.670 1.00 0.00 H new ATOM 1034 N MET A 65 3.386 -0.762 -9.911 1.00 0.00 N ATOM 1035 CA MET A 65 3.860 -2.022 -9.349 1.00 0.00 C ATOM 1036 C MET A 65 2.992 -3.206 -9.751 1.00 0.00 C ATOM 1037 O MET A 65 3.510 -4.293 -9.993 1.00 0.00 O ATOM 1038 CB MET A 65 4.081 -1.969 -7.825 1.00 0.00 C ATOM 1039 CG MET A 65 2.840 -1.746 -6.974 1.00 0.00 C ATOM 1040 SD MET A 65 3.215 -1.639 -5.204 1.00 0.00 S ATOM 1041 CE MET A 65 3.980 -3.232 -4.900 1.00 0.00 C ATOM 0 H MET A 65 3.034 -0.089 -9.230 1.00 0.00 H new ATOM 0 HA MET A 65 4.843 -2.179 -9.793 1.00 0.00 H new ATOM 0 HB2 MET A 65 4.547 -2.904 -7.514 1.00 0.00 H new ATOM 0 HB3 MET A 65 4.792 -1.172 -7.609 1.00 0.00 H new ATOM 0 HG2 MET A 65 2.346 -0.828 -7.293 1.00 0.00 H new ATOM 0 HG3 MET A 65 2.137 -2.562 -7.144 1.00 0.00 H new ATOM 0 HE1 MET A 65 4.198 -3.334 -3.837 1.00 0.00 H new ATOM 0 HE2 MET A 65 3.301 -4.027 -5.210 1.00 0.00 H new ATOM 0 HE3 MET A 65 4.907 -3.305 -5.469 1.00 0.00 H new ATOM 1051 N VAL A 66 1.692 -3.001 -9.858 1.00 0.00 N ATOM 1052 CA VAL A 66 0.812 -4.095 -10.261 1.00 0.00 C ATOM 1053 C VAL A 66 0.859 -4.347 -11.784 1.00 0.00 C ATOM 1054 O VAL A 66 0.668 -5.473 -12.231 1.00 0.00 O ATOM 1055 CB VAL A 66 -0.667 -3.943 -9.775 1.00 0.00 C ATOM 1056 CG1 VAL A 66 -0.747 -3.920 -8.257 1.00 0.00 C ATOM 1057 CG2 VAL A 66 -1.320 -2.712 -10.355 1.00 0.00 C ATOM 0 H VAL A 66 1.226 -2.112 -9.678 1.00 0.00 H new ATOM 0 HA VAL A 66 1.213 -4.970 -9.749 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.214 -4.814 -10.136 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.787 -3.813 -7.949 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.344 -4.850 -7.857 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.168 -3.080 -7.875 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.346 -2.640 -9.995 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.765 -1.826 -10.047 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.321 -2.779 -11.443 1.00 0.00 H new ATOM 1067 N GLU A 67 1.138 -3.306 -12.578 1.00 0.00 N ATOM 1068 CA GLU A 67 1.232 -3.476 -14.033 1.00 0.00 C ATOM 1069 C GLU A 67 2.519 -4.196 -14.422 1.00 0.00 C ATOM 1070 O GLU A 67 2.549 -4.967 -15.377 1.00 0.00 O ATOM 1071 CB GLU A 67 1.126 -2.143 -14.784 1.00 0.00 C ATOM 1072 CG GLU A 67 -0.206 -1.443 -14.603 1.00 0.00 C ATOM 1073 CD GLU A 67 -0.342 -0.210 -15.450 1.00 0.00 C ATOM 1074 OE1 GLU A 67 0.159 0.874 -15.070 1.00 0.00 O ATOM 1075 OE2 GLU A 67 -0.989 -0.280 -16.504 1.00 0.00 O ATOM 0 H GLU A 67 1.300 -2.355 -12.246 1.00 0.00 H new ATOM 0 HA GLU A 67 0.381 -4.090 -14.328 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.923 -1.481 -14.445 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.291 -2.321 -15.847 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.011 -2.136 -14.849 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.328 -1.172 -13.554 1.00 0.00 H new ATOM 1082 N ASN A 68 3.572 -3.955 -13.664 1.00 0.00 N ATOM 1083 CA ASN A 68 4.874 -4.598 -13.913 1.00 0.00 C ATOM 1084 C ASN A 68 4.923 -5.984 -13.306 1.00 0.00 C ATOM 1085 O ASN A 68 5.834 -6.784 -13.599 1.00 0.00 O ATOM 1086 CB ASN A 68 6.039 -3.753 -13.364 1.00 0.00 C ATOM 1087 CG ASN A 68 6.376 -2.552 -14.226 1.00 0.00 C ATOM 1088 OD1 ASN A 68 7.222 -2.629 -15.116 1.00 0.00 O ATOM 1089 ND2 ASN A 68 5.751 -1.439 -13.969 1.00 0.00 N ATOM 0 H ASN A 68 3.564 -3.319 -12.866 1.00 0.00 H new ATOM 0 HA ASN A 68 4.985 -4.679 -14.994 1.00 0.00 H new ATOM 0 HB2 ASN A 68 5.787 -3.410 -12.360 1.00 0.00 H new ATOM 0 HB3 ASN A 68 6.923 -4.384 -13.273 1.00 0.00 H new ATOM 0 HD21 ASN A 68 5.958 -0.601 -14.512 1.00 0.00 H new ATOM 0 HD22 ASN A 68 5.054 -1.405 -13.225 1.00 0.00 H new ATOM 1096 N ALA A 69 3.950 -6.268 -12.476 1.00 0.00 N ATOM 1097 CA ALA A 69 3.866 -7.517 -11.782 1.00 0.00 C ATOM 1098 C ALA A 69 3.579 -8.645 -12.724 1.00 0.00 C ATOM 1099 O ALA A 69 2.701 -8.535 -13.591 1.00 0.00 O ATOM 1100 CB ALA A 69 2.804 -7.453 -10.715 1.00 0.00 C ATOM 0 H ALA A 69 3.187 -5.625 -12.265 1.00 0.00 H new ATOM 0 HA ALA A 69 4.832 -7.704 -11.314 1.00 0.00 H new ATOM 0 HB1 ALA A 69 2.752 -8.410 -10.196 1.00 0.00 H new ATOM 0 HB2 ALA A 69 3.051 -6.666 -10.002 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.839 -7.236 -11.174 1.00 0.00 H new ATOM 1106 N LYS A 70 4.340 -9.713 -12.597 1.00 0.00 N ATOM 1107 CA LYS A 70 4.103 -10.893 -13.389 1.00 0.00 C ATOM 1108 C LYS A 70 2.869 -11.544 -12.835 1.00 0.00 C ATOM 1109 O LYS A 70 1.925 -11.885 -13.552 1.00 0.00 O ATOM 1110 CB LYS A 70 5.262 -11.892 -13.264 1.00 0.00 C ATOM 1111 CG LYS A 70 6.650 -11.302 -13.378 1.00 0.00 C ATOM 1112 CD LYS A 70 6.852 -10.454 -14.617 1.00 0.00 C ATOM 1113 CE LYS A 70 8.116 -9.638 -14.463 1.00 0.00 C ATOM 1114 NZ LYS A 70 8.018 -8.712 -13.301 1.00 0.00 N ATOM 0 H LYS A 70 5.127 -9.784 -11.952 1.00 0.00 H new ATOM 0 HA LYS A 70 4.001 -10.615 -14.438 1.00 0.00 H new ATOM 0 HB2 LYS A 70 5.180 -12.398 -12.302 1.00 0.00 H new ATOM 0 HB3 LYS A 70 5.146 -12.654 -14.035 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.850 -10.694 -12.496 1.00 0.00 H new ATOM 0 HG3 LYS A 70 7.380 -12.111 -13.380 1.00 0.00 H new ATOM 0 HD2 LYS A 70 6.921 -11.090 -15.500 1.00 0.00 H new ATOM 0 HD3 LYS A 70 5.996 -9.796 -14.765 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.969 -10.304 -14.330 1.00 0.00 H new ATOM 0 HE3 LYS A 70 8.297 -9.066 -15.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 8.862 -8.105 -13.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 7.169 -8.119 -13.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 7.954 -9.264 -12.422 1.00 0.00 H new ATOM 1128 N LYS A 71 2.875 -11.682 -11.542 1.00 0.00 N ATOM 1129 CA LYS A 71 1.784 -12.265 -10.846 1.00 0.00 C ATOM 1130 C LYS A 71 1.106 -11.256 -9.953 1.00 0.00 C ATOM 1131 O LYS A 71 1.757 -10.439 -9.322 1.00 0.00 O ATOM 1132 CB LYS A 71 2.221 -13.455 -9.998 1.00 0.00 C ATOM 1133 CG LYS A 71 3.213 -13.148 -8.901 1.00 0.00 C ATOM 1134 CD LYS A 71 3.327 -14.327 -7.970 1.00 0.00 C ATOM 1135 CE LYS A 71 4.230 -14.033 -6.804 1.00 0.00 C ATOM 1136 NZ LYS A 71 4.181 -15.116 -5.811 1.00 0.00 N ATOM 0 H LYS A 71 3.647 -11.388 -10.943 1.00 0.00 H new ATOM 0 HA LYS A 71 1.084 -12.611 -11.606 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.335 -13.901 -9.547 1.00 0.00 H new ATOM 0 HB3 LYS A 71 2.656 -14.207 -10.656 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.187 -12.919 -9.333 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.894 -12.265 -8.347 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.337 -14.598 -7.604 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.710 -15.187 -8.518 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.254 -13.904 -7.156 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.933 -13.094 -6.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 5.065 -15.125 -5.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.377 -14.962 -5.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.066 -16.028 -6.297 1.00 0.00 H new ATOM 1150 N ILE A 72 -0.179 -11.290 -9.935 1.00 0.00 N ATOM 1151 CA ILE A 72 -0.945 -10.520 -9.014 1.00 0.00 C ATOM 1152 C ILE A 72 -1.749 -11.504 -8.193 1.00 0.00 C ATOM 1153 O ILE A 72 -2.470 -12.345 -8.754 1.00 0.00 O ATOM 1154 CB ILE A 72 -1.883 -9.523 -9.741 1.00 0.00 C ATOM 1155 CG1 ILE A 72 -1.045 -8.649 -10.683 1.00 0.00 C ATOM 1156 CG2 ILE A 72 -2.638 -8.661 -8.723 1.00 0.00 C ATOM 1157 CD1 ILE A 72 -1.806 -7.543 -11.383 1.00 0.00 C ATOM 0 H ILE A 72 -0.739 -11.861 -10.568 1.00 0.00 H new ATOM 0 HA ILE A 72 -0.288 -9.919 -8.385 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.623 -10.072 -10.324 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -0.231 -8.203 -10.111 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.590 -9.290 -11.438 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.292 -7.966 -9.249 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.235 -9.302 -8.075 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.924 -8.101 -8.120 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.126 -6.983 -12.025 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.602 -7.976 -11.988 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.238 -6.872 -10.640 1.00 0.00 H new ATOM 1169 N GLU A 73 -1.559 -11.480 -6.908 1.00 0.00 N ATOM 1170 CA GLU A 73 -2.263 -12.380 -6.025 1.00 0.00 C ATOM 1171 C GLU A 73 -2.986 -11.554 -4.998 1.00 0.00 C ATOM 1172 O GLU A 73 -2.466 -10.535 -4.544 1.00 0.00 O ATOM 1173 CB GLU A 73 -1.289 -13.318 -5.291 1.00 0.00 C ATOM 1174 CG GLU A 73 -0.351 -14.107 -6.186 1.00 0.00 C ATOM 1175 CD GLU A 73 0.577 -15.002 -5.397 1.00 0.00 C ATOM 1176 OE1 GLU A 73 1.661 -14.547 -4.979 1.00 0.00 O ATOM 1177 OE2 GLU A 73 0.255 -16.194 -5.197 1.00 0.00 O ATOM 0 H GLU A 73 -0.917 -10.842 -6.438 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.951 -12.986 -6.615 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -0.691 -12.725 -4.599 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -1.869 -14.020 -4.691 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -0.936 -14.713 -6.877 1.00 0.00 H new ATOM 0 HG3 GLU A 73 0.239 -13.417 -6.789 1.00 0.00 H new ATOM 1184 N VAL A 74 -4.165 -11.947 -4.652 1.00 0.00 N ATOM 1185 CA VAL A 74 -4.897 -11.264 -3.621 1.00 0.00 C ATOM 1186 C VAL A 74 -4.986 -12.177 -2.394 1.00 0.00 C ATOM 1187 O VAL A 74 -5.412 -13.330 -2.496 1.00 0.00 O ATOM 1188 CB VAL A 74 -6.313 -10.777 -4.104 1.00 0.00 C ATOM 1189 CG1 VAL A 74 -6.176 -9.819 -5.274 1.00 0.00 C ATOM 1190 CG2 VAL A 74 -7.207 -11.930 -4.510 1.00 0.00 C ATOM 0 H VAL A 74 -4.651 -12.742 -5.067 1.00 0.00 H new ATOM 0 HA VAL A 74 -4.361 -10.353 -3.354 1.00 0.00 H new ATOM 0 HB VAL A 74 -6.775 -10.268 -3.258 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -7.165 -9.493 -5.595 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -5.589 -8.953 -4.968 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -5.675 -10.323 -6.100 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -8.173 -11.544 -4.836 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -6.742 -12.481 -5.328 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -7.351 -12.596 -3.659 1.00 0.00 H new ATOM 1200 N GLU A 75 -4.505 -11.709 -1.274 1.00 0.00 N ATOM 1201 CA GLU A 75 -4.487 -12.516 -0.069 1.00 0.00 C ATOM 1202 C GLU A 75 -5.608 -12.098 0.860 1.00 0.00 C ATOM 1203 O GLU A 75 -5.584 -11.007 1.413 1.00 0.00 O ATOM 1204 CB GLU A 75 -3.137 -12.369 0.629 1.00 0.00 C ATOM 1205 CG GLU A 75 -2.924 -13.260 1.848 1.00 0.00 C ATOM 1206 CD GLU A 75 -1.563 -13.034 2.498 1.00 0.00 C ATOM 1207 OE1 GLU A 75 -1.400 -12.069 3.244 1.00 0.00 O ATOM 1208 OE2 GLU A 75 -0.618 -13.822 2.258 1.00 0.00 O ATOM 0 H GLU A 75 -4.118 -10.772 -1.164 1.00 0.00 H new ATOM 0 HA GLU A 75 -4.635 -13.562 -0.339 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.349 -12.580 -0.095 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -3.018 -11.330 0.936 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -3.710 -13.067 2.578 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.014 -14.305 1.552 1.00 0.00 H new ATOM 1215 N PHE A 76 -6.590 -12.944 1.009 1.00 0.00 N ATOM 1216 CA PHE A 76 -7.705 -12.648 1.885 1.00 0.00 C ATOM 1217 C PHE A 76 -7.338 -13.005 3.318 1.00 0.00 C ATOM 1218 O PHE A 76 -6.613 -14.017 3.556 1.00 0.00 O ATOM 1219 CB PHE A 76 -8.985 -13.366 1.436 1.00 0.00 C ATOM 1220 CG PHE A 76 -9.504 -12.910 0.099 1.00 0.00 C ATOM 1221 CD1 PHE A 76 -10.278 -11.768 -0.003 1.00 0.00 C ATOM 1222 CD2 PHE A 76 -9.229 -13.623 -1.049 1.00 0.00 C ATOM 1223 CE1 PHE A 76 -10.763 -11.344 -1.224 1.00 0.00 C ATOM 1224 CE2 PHE A 76 -9.711 -13.206 -2.271 1.00 0.00 C ATOM 1225 CZ PHE A 76 -10.478 -12.069 -2.360 1.00 0.00 C ATOM 0 H PHE A 76 -6.647 -13.847 0.537 1.00 0.00 H new ATOM 0 HA PHE A 76 -7.913 -11.579 1.833 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -8.792 -14.438 1.393 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -9.759 -13.211 2.187 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.506 -11.199 0.886 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -8.629 -14.519 -0.990 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -11.363 -10.448 -1.288 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -9.485 -13.774 -3.161 1.00 0.00 H new ATOM 0 HZ PHE A 76 -10.856 -11.745 -3.318 1.00 0.00 H new ATOM 1235 N ASP A 77 -7.836 -12.186 4.252 1.00 0.00 N ATOM 1236 CA ASP A 77 -7.493 -12.270 5.678 1.00 0.00 C ATOM 1237 C ASP A 77 -8.398 -13.300 6.420 1.00 0.00 C ATOM 1238 O ASP A 77 -9.091 -14.105 5.786 1.00 0.00 O ATOM 1239 CB ASP A 77 -7.587 -10.850 6.320 1.00 0.00 C ATOM 1240 CG ASP A 77 -6.836 -10.714 7.653 1.00 0.00 C ATOM 1241 OD1 ASP A 77 -7.427 -10.971 8.707 1.00 0.00 O ATOM 1242 OD2 ASP A 77 -5.637 -10.356 7.651 1.00 0.00 O ATOM 0 H ASP A 77 -8.496 -11.438 4.037 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.468 -12.629 5.776 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.192 -10.118 5.616 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.637 -10.604 6.480 1.00 0.00 H new ATOM 1247 N LYS A 78 -8.393 -13.253 7.744 1.00 0.00 N ATOM 1248 CA LYS A 78 -9.072 -14.222 8.591 1.00 0.00 C ATOM 1249 C LYS A 78 -10.537 -13.811 8.812 1.00 0.00 C ATOM 1250 O LYS A 78 -11.394 -14.645 9.146 1.00 0.00 O ATOM 1251 CB LYS A 78 -8.334 -14.289 9.964 1.00 0.00 C ATOM 1252 CG LYS A 78 -8.599 -13.073 10.871 1.00 0.00 C ATOM 1253 CD LYS A 78 -7.621 -12.935 12.038 1.00 0.00 C ATOM 1254 CE LYS A 78 -6.249 -12.476 11.559 1.00 0.00 C ATOM 1255 NZ LYS A 78 -5.330 -12.157 12.680 1.00 0.00 N ATOM 0 H LYS A 78 -7.907 -12.526 8.270 1.00 0.00 H new ATOM 0 HA LYS A 78 -9.058 -15.198 8.107 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -8.641 -15.195 10.487 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -7.262 -14.371 9.786 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -8.556 -12.167 10.267 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.612 -13.144 11.267 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -8.014 -12.221 12.762 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -7.528 -13.892 12.552 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -5.805 -13.256 10.941 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -6.365 -11.595 10.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -4.955 -11.194 12.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -5.847 -12.216 13.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -4.543 -12.837 12.688 1.00 0.00 H new ATOM 1269 N GLY A 79 -10.813 -12.531 8.617 1.00 0.00 N ATOM 1270 CA GLY A 79 -12.122 -11.997 8.897 1.00 0.00 C ATOM 1271 C GLY A 79 -13.056 -12.060 7.716 1.00 0.00 C ATOM 1272 O GLY A 79 -13.304 -13.138 7.164 1.00 0.00 O ATOM 0 H GLY A 79 -10.142 -11.848 8.265 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -12.561 -12.548 9.729 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -12.023 -10.960 9.218 1.00 0.00 H new ATOM 1276 N GLN A 80 -13.565 -10.924 7.322 1.00 0.00 N ATOM 1277 CA GLN A 80 -14.504 -10.837 6.252 1.00 0.00 C ATOM 1278 C GLN A 80 -13.792 -10.669 4.927 1.00 0.00 C ATOM 1279 O GLN A 80 -12.752 -10.030 4.849 1.00 0.00 O ATOM 1280 CB GLN A 80 -15.512 -9.724 6.511 1.00 0.00 C ATOM 1281 CG GLN A 80 -14.916 -8.370 6.840 1.00 0.00 C ATOM 1282 CD GLN A 80 -15.977 -7.339 7.139 1.00 0.00 C ATOM 1283 OE1 GLN A 80 -16.391 -7.175 8.274 1.00 0.00 O ATOM 1284 NE2 GLN A 80 -16.438 -6.656 6.131 1.00 0.00 N ATOM 0 H GLN A 80 -13.332 -10.025 7.745 1.00 0.00 H new ATOM 0 HA GLN A 80 -15.063 -11.771 6.198 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -16.146 -9.619 5.630 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -16.159 -10.027 7.334 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -14.252 -8.466 7.699 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -14.307 -8.030 6.003 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -16.069 -6.818 5.194 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -17.168 -5.959 6.278 1.00 0.00 H new ATOM 1293 N ARG A 81 -14.348 -11.242 3.906 1.00 0.00 N ATOM 1294 CA ARG A 81 -13.717 -11.271 2.604 1.00 0.00 C ATOM 1295 C ARG A 81 -13.994 -9.989 1.812 1.00 0.00 C ATOM 1296 O ARG A 81 -13.197 -9.586 0.956 1.00 0.00 O ATOM 1297 CB ARG A 81 -14.197 -12.517 1.855 1.00 0.00 C ATOM 1298 CG ARG A 81 -13.539 -12.769 0.525 1.00 0.00 C ATOM 1299 CD ARG A 81 -13.960 -14.113 -0.020 1.00 0.00 C ATOM 1300 NE ARG A 81 -15.396 -14.167 -0.340 1.00 0.00 N ATOM 1301 CZ ARG A 81 -16.291 -15.032 0.177 1.00 0.00 C ATOM 1302 NH1 ARG A 81 -15.956 -15.858 1.157 1.00 0.00 N ATOM 1303 NH2 ARG A 81 -17.530 -15.042 -0.272 1.00 0.00 N ATOM 0 H ARG A 81 -15.255 -11.707 3.942 1.00 0.00 H new ATOM 0 HA ARG A 81 -12.635 -11.321 2.728 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -14.034 -13.387 2.491 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -15.272 -12.433 1.698 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -13.811 -11.982 -0.178 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -12.455 -12.737 0.636 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -13.383 -14.335 -0.918 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -13.724 -14.887 0.710 1.00 0.00 H new ATOM 0 HE ARG A 81 -15.746 -13.487 -1.015 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -15.008 -15.846 1.532 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -16.646 -16.506 1.536 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -17.810 -14.396 -1.010 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -18.209 -15.696 0.118 1.00 0.00 H new ATOM 1317 N THR A 82 -15.086 -9.336 2.116 1.00 0.00 N ATOM 1318 CA THR A 82 -15.454 -8.136 1.425 1.00 0.00 C ATOM 1319 C THR A 82 -15.849 -7.034 2.393 1.00 0.00 C ATOM 1320 O THR A 82 -16.318 -7.298 3.498 1.00 0.00 O ATOM 1321 CB THR A 82 -16.575 -8.389 0.380 1.00 0.00 C ATOM 1322 OG1 THR A 82 -17.571 -9.264 0.930 1.00 0.00 O ATOM 1323 CG2 THR A 82 -16.016 -8.996 -0.899 1.00 0.00 C ATOM 0 H THR A 82 -15.739 -9.622 2.846 1.00 0.00 H new ATOM 0 HA THR A 82 -14.571 -7.801 0.881 1.00 0.00 H new ATOM 0 HB THR A 82 -17.025 -7.427 0.135 1.00 0.00 H new ATOM 0 HG1 THR A 82 -18.275 -9.417 0.266 1.00 0.00 H new ATOM 0 HG21 THR A 82 -16.827 -9.160 -1.609 1.00 0.00 H new ATOM 0 HG22 THR A 82 -15.284 -8.316 -1.335 1.00 0.00 H new ATOM 0 HG23 THR A 82 -15.536 -9.947 -0.671 1.00 0.00 H new ATOM 1331 N ASP A 83 -15.592 -5.832 1.982 1.00 0.00 N ATOM 1332 CA ASP A 83 -15.896 -4.609 2.697 1.00 0.00 C ATOM 1333 C ASP A 83 -17.398 -4.322 2.685 1.00 0.00 C ATOM 1334 O ASP A 83 -18.139 -4.884 1.868 1.00 0.00 O ATOM 1335 CB ASP A 83 -15.124 -3.457 2.020 1.00 0.00 C ATOM 1336 CG ASP A 83 -15.481 -2.093 2.535 1.00 0.00 C ATOM 1337 OD1 ASP A 83 -15.130 -1.759 3.671 1.00 0.00 O ATOM 1338 OD2 ASP A 83 -16.184 -1.369 1.820 1.00 0.00 O ATOM 0 H ASP A 83 -15.137 -5.656 1.086 1.00 0.00 H new ATOM 0 HA ASP A 83 -15.594 -4.709 3.740 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -14.055 -3.618 2.161 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -15.313 -3.489 0.947 1.00 0.00 H new ATOM 1343 N LYS A 84 -17.816 -3.434 3.566 1.00 0.00 N ATOM 1344 CA LYS A 84 -19.193 -2.987 3.727 1.00 0.00 C ATOM 1345 C LYS A 84 -19.756 -2.415 2.405 1.00 0.00 C ATOM 1346 O LYS A 84 -20.952 -2.511 2.134 1.00 0.00 O ATOM 1347 CB LYS A 84 -19.185 -1.896 4.800 1.00 0.00 C ATOM 1348 CG LYS A 84 -20.534 -1.347 5.214 1.00 0.00 C ATOM 1349 CD LYS A 84 -20.340 -0.240 6.233 1.00 0.00 C ATOM 1350 CE LYS A 84 -21.652 0.314 6.739 1.00 0.00 C ATOM 1351 NZ LYS A 84 -21.435 1.428 7.676 1.00 0.00 N ATOM 0 H LYS A 84 -17.178 -2.982 4.221 1.00 0.00 H new ATOM 0 HA LYS A 84 -19.827 -3.826 4.013 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -18.691 -2.293 5.687 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -18.575 -1.067 4.440 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -21.065 -0.964 4.343 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -21.147 -2.142 5.638 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -19.761 -0.622 7.074 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -19.758 0.565 5.785 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -22.254 0.656 5.897 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -22.216 -0.476 7.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -22.353 1.788 8.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -20.881 1.094 8.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -20.917 2.191 7.195 1.00 0.00 H new ATOM 1365 N TYR A 85 -18.889 -1.842 1.586 1.00 0.00 N ATOM 1366 CA TYR A 85 -19.292 -1.277 0.309 1.00 0.00 C ATOM 1367 C TYR A 85 -19.046 -2.260 -0.846 1.00 0.00 C ATOM 1368 O TYR A 85 -19.047 -1.881 -2.015 1.00 0.00 O ATOM 1369 CB TYR A 85 -18.576 0.061 0.063 1.00 0.00 C ATOM 1370 CG TYR A 85 -19.019 1.175 0.991 1.00 0.00 C ATOM 1371 CD1 TYR A 85 -18.428 1.362 2.236 1.00 0.00 C ATOM 1372 CD2 TYR A 85 -20.041 2.035 0.618 1.00 0.00 C ATOM 1373 CE1 TYR A 85 -18.847 2.374 3.078 1.00 0.00 C ATOM 1374 CE2 TYR A 85 -20.467 3.045 1.451 1.00 0.00 C ATOM 1375 CZ TYR A 85 -19.870 3.213 2.679 1.00 0.00 C ATOM 1376 OH TYR A 85 -20.310 4.219 3.521 1.00 0.00 O ATOM 0 H TYR A 85 -17.893 -1.756 1.786 1.00 0.00 H new ATOM 0 HA TYR A 85 -20.365 -1.089 0.348 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -17.502 -0.087 0.176 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -18.749 0.370 -0.968 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -17.629 0.706 2.549 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -20.512 1.910 -0.346 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -18.378 2.509 4.042 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -21.266 3.702 1.142 1.00 0.00 H new ATOM 0 HH TYR A 85 -21.033 4.717 3.086 1.00 0.00 H new ATOM 1386 N GLY A 86 -18.832 -3.514 -0.511 1.00 0.00 N ATOM 1387 CA GLY A 86 -18.680 -4.549 -1.515 1.00 0.00 C ATOM 1388 C GLY A 86 -17.346 -4.520 -2.226 1.00 0.00 C ATOM 1389 O GLY A 86 -17.250 -4.896 -3.399 1.00 0.00 O ATOM 0 H GLY A 86 -18.759 -3.844 0.451 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -18.807 -5.523 -1.042 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -19.476 -4.446 -2.252 1.00 0.00 H new ATOM 1393 N ARG A 87 -16.339 -4.037 -1.550 1.00 0.00 N ATOM 1394 CA ARG A 87 -14.983 -4.074 -2.070 1.00 0.00 C ATOM 1395 C ARG A 87 -14.304 -5.307 -1.508 1.00 0.00 C ATOM 1396 O ARG A 87 -14.649 -5.739 -0.438 1.00 0.00 O ATOM 1397 CB ARG A 87 -14.161 -2.817 -1.679 1.00 0.00 C ATOM 1398 CG ARG A 87 -14.389 -1.540 -2.506 1.00 0.00 C ATOM 1399 CD ARG A 87 -15.805 -0.996 -2.430 1.00 0.00 C ATOM 1400 NE ARG A 87 -15.907 0.334 -3.061 1.00 0.00 N ATOM 1401 CZ ARG A 87 -17.050 0.966 -3.374 1.00 0.00 C ATOM 1402 NH1 ARG A 87 -18.212 0.363 -3.236 1.00 0.00 N ATOM 1403 NH2 ARG A 87 -17.020 2.203 -3.828 1.00 0.00 N ATOM 0 H ARG A 87 -16.425 -3.608 -0.629 1.00 0.00 H new ATOM 0 HA ARG A 87 -15.032 -4.098 -3.159 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -14.374 -2.586 -0.635 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -13.103 -3.073 -1.739 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -13.697 -0.770 -2.164 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -14.146 -1.747 -3.548 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -16.489 -1.687 -2.923 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -16.115 -0.930 -1.387 1.00 0.00 H new ATOM 0 HE ARG A 87 -15.034 0.815 -3.278 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -18.251 -0.595 -2.888 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -19.073 0.854 -3.477 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -16.127 2.683 -3.942 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -17.890 2.681 -4.065 1.00 0.00 H new ATOM 1417 N GLY A 88 -13.390 -5.879 -2.221 1.00 0.00 N ATOM 1418 CA GLY A 88 -12.681 -7.016 -1.705 1.00 0.00 C ATOM 1419 C GLY A 88 -11.655 -6.585 -0.688 1.00 0.00 C ATOM 1420 O GLY A 88 -11.029 -5.525 -0.848 1.00 0.00 O ATOM 0 H GLY A 88 -13.114 -5.584 -3.158 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -13.384 -7.713 -1.248 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -12.191 -7.547 -2.521 1.00 0.00 H new ATOM 1424 N LEU A 89 -11.502 -7.361 0.355 1.00 0.00 N ATOM 1425 CA LEU A 89 -10.550 -7.064 1.392 1.00 0.00 C ATOM 1426 C LEU A 89 -9.434 -8.055 1.314 1.00 0.00 C ATOM 1427 O LEU A 89 -9.548 -9.179 1.820 1.00 0.00 O ATOM 1428 CB LEU A 89 -11.201 -7.118 2.776 1.00 0.00 C ATOM 1429 CG LEU A 89 -12.307 -6.103 3.048 1.00 0.00 C ATOM 1430 CD1 LEU A 89 -12.875 -6.294 4.437 1.00 0.00 C ATOM 1431 CD2 LEU A 89 -11.785 -4.696 2.879 1.00 0.00 C ATOM 0 H LEU A 89 -12.035 -8.217 0.508 1.00 0.00 H new ATOM 0 HA LEU A 89 -10.170 -6.053 1.245 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -11.612 -8.117 2.921 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -10.421 -6.982 3.525 1.00 0.00 H new ATOM 0 HG LEU A 89 -13.107 -6.264 2.325 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -13.662 -5.561 4.612 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -13.288 -7.299 4.526 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -12.084 -6.160 5.175 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -12.587 -3.984 3.077 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -10.967 -4.525 3.579 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.424 -4.562 1.859 1.00 0.00 H new ATOM 1443 N ALA A 90 -8.383 -7.679 0.650 1.00 0.00 N ATOM 1444 CA ALA A 90 -7.287 -8.563 0.456 1.00 0.00 C ATOM 1445 C ALA A 90 -5.996 -7.805 0.382 1.00 0.00 C ATOM 1446 O ALA A 90 -5.960 -6.633 -0.007 1.00 0.00 O ATOM 1447 CB ALA A 90 -7.481 -9.377 -0.816 1.00 0.00 C ATOM 0 H ALA A 90 -8.266 -6.756 0.232 1.00 0.00 H new ATOM 0 HA ALA A 90 -7.245 -9.239 1.310 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -6.634 -10.049 -0.951 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.398 -9.961 -0.738 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -7.550 -8.705 -1.671 1.00 0.00 H new ATOM 1453 N TYR A 91 -4.951 -8.462 0.765 1.00 0.00 N ATOM 1454 CA TYR A 91 -3.636 -7.937 0.661 1.00 0.00 C ATOM 1455 C TYR A 91 -3.156 -8.290 -0.713 1.00 0.00 C ATOM 1456 O TYR A 91 -2.946 -9.451 -1.017 1.00 0.00 O ATOM 1457 CB TYR A 91 -2.703 -8.574 1.684 1.00 0.00 C ATOM 1458 CG TYR A 91 -3.132 -8.447 3.122 1.00 0.00 C ATOM 1459 CD1 TYR A 91 -4.059 -9.319 3.660 1.00 0.00 C ATOM 1460 CD2 TYR A 91 -2.587 -7.485 3.950 1.00 0.00 C ATOM 1461 CE1 TYR A 91 -4.431 -9.241 4.972 1.00 0.00 C ATOM 1462 CE2 TYR A 91 -2.964 -7.396 5.271 1.00 0.00 C ATOM 1463 CZ TYR A 91 -3.889 -8.278 5.776 1.00 0.00 C ATOM 1464 OH TYR A 91 -4.232 -8.238 7.110 1.00 0.00 O ATOM 0 H TYR A 91 -4.992 -9.399 1.167 1.00 0.00 H new ATOM 0 HA TYR A 91 -3.643 -6.862 0.843 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -2.600 -9.633 1.446 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -1.715 -8.126 1.577 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -4.499 -10.078 3.030 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -1.856 -6.794 3.556 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -5.152 -9.939 5.373 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -2.535 -6.636 5.908 1.00 0.00 H new ATOM 0 HH TYR A 91 -5.019 -8.802 7.263 1.00 0.00 H new ATOM 1474 N ILE A 92 -3.055 -7.330 -1.549 1.00 0.00 N ATOM 1475 CA ILE A 92 -2.660 -7.584 -2.896 1.00 0.00 C ATOM 1476 C ILE A 92 -1.145 -7.654 -3.023 1.00 0.00 C ATOM 1477 O ILE A 92 -0.417 -6.767 -2.539 1.00 0.00 O ATOM 1478 CB ILE A 92 -3.276 -6.538 -3.846 1.00 0.00 C ATOM 1479 CG1 ILE A 92 -4.802 -6.569 -3.654 1.00 0.00 C ATOM 1480 CG2 ILE A 92 -2.897 -6.830 -5.307 1.00 0.00 C ATOM 1481 CD1 ILE A 92 -5.568 -5.593 -4.492 1.00 0.00 C ATOM 0 H ILE A 92 -3.240 -6.351 -1.331 1.00 0.00 H new ATOM 0 HA ILE A 92 -3.044 -8.561 -3.191 1.00 0.00 H new ATOM 0 HB ILE A 92 -2.890 -5.546 -3.612 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -5.160 -7.574 -3.876 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -5.024 -6.376 -2.605 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.344 -6.077 -5.956 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -1.813 -6.803 -5.414 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -3.265 -7.817 -5.588 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.633 -5.693 -4.284 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -5.246 -4.579 -4.256 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -5.383 -5.796 -5.547 1.00 0.00 H new ATOM 1493 N TYR A 93 -0.689 -8.731 -3.594 1.00 0.00 N ATOM 1494 CA TYR A 93 0.697 -8.955 -3.858 1.00 0.00 C ATOM 1495 C TYR A 93 0.939 -8.737 -5.328 1.00 0.00 C ATOM 1496 O TYR A 93 0.348 -9.416 -6.176 1.00 0.00 O ATOM 1497 CB TYR A 93 1.107 -10.400 -3.487 1.00 0.00 C ATOM 1498 CG TYR A 93 1.137 -10.718 -2.000 1.00 0.00 C ATOM 1499 CD1 TYR A 93 -0.013 -10.688 -1.226 1.00 0.00 C ATOM 1500 CD2 TYR A 93 2.328 -11.063 -1.377 1.00 0.00 C ATOM 1501 CE1 TYR A 93 0.026 -10.979 0.118 1.00 0.00 C ATOM 1502 CE2 TYR A 93 2.368 -11.363 -0.031 1.00 0.00 C ATOM 1503 CZ TYR A 93 1.213 -11.316 0.712 1.00 0.00 C ATOM 1504 OH TYR A 93 1.247 -11.603 2.064 1.00 0.00 O ATOM 0 H TYR A 93 -1.291 -9.497 -3.896 1.00 0.00 H new ATOM 0 HA TYR A 93 1.290 -8.266 -3.257 1.00 0.00 H new ATOM 0 HB2 TYR A 93 0.417 -11.090 -3.973 1.00 0.00 H new ATOM 0 HB3 TYR A 93 2.096 -10.595 -3.901 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -0.956 -10.432 -1.686 1.00 0.00 H new ATOM 0 HD2 TYR A 93 3.239 -11.097 -1.956 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -0.880 -10.942 0.705 1.00 0.00 H new ATOM 0 HE2 TYR A 93 3.303 -11.634 0.437 1.00 0.00 H new ATOM 0 HH TYR A 93 0.387 -11.366 2.471 1.00 0.00 H new ATOM 1514 N ALA A 94 1.805 -7.827 -5.624 1.00 0.00 N ATOM 1515 CA ALA A 94 2.176 -7.533 -6.967 1.00 0.00 C ATOM 1516 C ALA A 94 3.540 -8.081 -7.174 1.00 0.00 C ATOM 1517 O ALA A 94 4.495 -7.592 -6.577 1.00 0.00 O ATOM 1518 CB ALA A 94 2.194 -6.037 -7.190 1.00 0.00 C ATOM 0 H ALA A 94 2.283 -7.257 -4.927 1.00 0.00 H new ATOM 0 HA ALA A 94 1.463 -7.973 -7.665 1.00 0.00 H new ATOM 0 HB1 ALA A 94 2.479 -5.826 -8.221 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.202 -5.628 -6.997 1.00 0.00 H new ATOM 0 HB3 ALA A 94 2.914 -5.577 -6.513 1.00 0.00 H new ATOM 1524 N ASP A 95 3.619 -9.155 -7.935 1.00 0.00 N ATOM 1525 CA ASP A 95 4.883 -9.829 -8.290 1.00 0.00 C ATOM 1526 C ASP A 95 5.514 -10.414 -7.016 1.00 0.00 C ATOM 1527 O ASP A 95 6.708 -10.707 -6.943 1.00 0.00 O ATOM 1528 CB ASP A 95 5.831 -8.816 -8.951 1.00 0.00 C ATOM 1529 CG ASP A 95 6.879 -9.423 -9.831 1.00 0.00 C ATOM 1530 OD1 ASP A 95 7.979 -9.764 -9.344 1.00 0.00 O ATOM 1531 OD2 ASP A 95 6.641 -9.522 -11.034 1.00 0.00 O ATOM 0 H ASP A 95 2.797 -9.604 -8.339 1.00 0.00 H new ATOM 0 HA ASP A 95 4.695 -10.639 -8.994 1.00 0.00 H new ATOM 0 HB2 ASP A 95 5.239 -8.117 -9.542 1.00 0.00 H new ATOM 0 HB3 ASP A 95 6.323 -8.236 -8.170 1.00 0.00 H new ATOM 1536 N GLY A 96 4.676 -10.606 -6.016 1.00 0.00 N ATOM 1537 CA GLY A 96 5.129 -11.117 -4.754 1.00 0.00 C ATOM 1538 C GLY A 96 5.415 -10.021 -3.749 1.00 0.00 C ATOM 1539 O GLY A 96 5.680 -10.305 -2.573 1.00 0.00 O ATOM 0 H GLY A 96 3.676 -10.412 -6.062 1.00 0.00 H new ATOM 0 HA2 GLY A 96 4.374 -11.790 -4.347 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.032 -11.707 -4.909 1.00 0.00 H new ATOM 1543 N LYS A 97 5.368 -8.779 -4.191 1.00 0.00 N ATOM 1544 CA LYS A 97 5.564 -7.662 -3.298 1.00 0.00 C ATOM 1545 C LYS A 97 4.204 -7.220 -2.795 1.00 0.00 C ATOM 1546 O LYS A 97 3.338 -6.868 -3.597 1.00 0.00 O ATOM 1547 CB LYS A 97 6.271 -6.454 -3.975 1.00 0.00 C ATOM 1548 CG LYS A 97 7.668 -6.700 -4.573 1.00 0.00 C ATOM 1549 CD LYS A 97 7.626 -7.248 -6.004 1.00 0.00 C ATOM 1550 CE LYS A 97 9.035 -7.375 -6.577 1.00 0.00 C ATOM 1551 NZ LYS A 97 9.053 -7.710 -8.026 1.00 0.00 N ATOM 0 H LYS A 97 5.196 -8.522 -5.163 1.00 0.00 H new ATOM 0 HA LYS A 97 6.213 -7.993 -2.487 1.00 0.00 H new ATOM 0 HB2 LYS A 97 5.623 -6.086 -4.771 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.355 -5.656 -3.238 1.00 0.00 H new ATOM 0 HG2 LYS A 97 8.229 -5.765 -4.565 1.00 0.00 H new ATOM 0 HG3 LYS A 97 8.209 -7.402 -3.938 1.00 0.00 H new ATOM 0 HD2 LYS A 97 7.136 -8.222 -6.011 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.030 -6.587 -6.634 1.00 0.00 H new ATOM 0 HE2 LYS A 97 9.569 -6.438 -6.421 1.00 0.00 H new ATOM 0 HE3 LYS A 97 9.576 -8.145 -6.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 10.022 -7.616 -8.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 8.725 -8.688 -8.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 8.424 -7.061 -8.540 1.00 0.00 H new ATOM 1565 N MET A 98 3.992 -7.258 -1.500 1.00 0.00 N ATOM 1566 CA MET A 98 2.716 -6.851 -0.957 1.00 0.00 C ATOM 1567 C MET A 98 2.561 -5.328 -1.044 1.00 0.00 C ATOM 1568 O MET A 98 3.291 -4.570 -0.382 1.00 0.00 O ATOM 1569 CB MET A 98 2.454 -7.406 0.480 1.00 0.00 C ATOM 1570 CG MET A 98 3.461 -7.011 1.568 1.00 0.00 C ATOM 1571 SD MET A 98 5.112 -7.735 1.373 1.00 0.00 S ATOM 1572 CE MET A 98 4.778 -9.474 1.622 1.00 0.00 C ATOM 0 H MET A 98 4.678 -7.563 -0.809 1.00 0.00 H new ATOM 0 HA MET A 98 1.939 -7.302 -1.574 1.00 0.00 H new ATOM 0 HB2 MET A 98 1.465 -7.076 0.797 1.00 0.00 H new ATOM 0 HB3 MET A 98 2.424 -8.494 0.424 1.00 0.00 H new ATOM 0 HG2 MET A 98 3.555 -5.925 1.580 1.00 0.00 H new ATOM 0 HG3 MET A 98 3.062 -7.307 2.538 1.00 0.00 H new ATOM 0 HE1 MET A 98 5.501 -9.886 2.326 1.00 0.00 H new ATOM 0 HE2 MET A 98 3.771 -9.598 2.021 1.00 0.00 H new ATOM 0 HE3 MET A 98 4.858 -10.000 0.671 1.00 0.00 H new ATOM 1582 N VAL A 99 1.607 -4.907 -1.877 1.00 0.00 N ATOM 1583 CA VAL A 99 1.335 -3.493 -2.198 1.00 0.00 C ATOM 1584 C VAL A 99 1.142 -2.664 -0.938 1.00 0.00 C ATOM 1585 O VAL A 99 1.717 -1.591 -0.810 1.00 0.00 O ATOM 1586 CB VAL A 99 0.078 -3.356 -3.111 1.00 0.00 C ATOM 1587 CG1 VAL A 99 -0.209 -1.902 -3.440 1.00 0.00 C ATOM 1588 CG2 VAL A 99 0.253 -4.154 -4.395 1.00 0.00 C ATOM 0 H VAL A 99 0.983 -5.552 -2.362 1.00 0.00 H new ATOM 0 HA VAL A 99 2.205 -3.115 -2.734 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.772 -3.757 -2.559 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.091 -1.840 -4.078 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.389 -1.349 -2.518 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.646 -1.471 -3.961 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.636 -4.044 -5.016 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.123 -3.784 -4.938 1.00 0.00 H new ATOM 0 HG23 VAL A 99 0.397 -5.207 -4.152 1.00 0.00 H new ATOM 1598 N ASN A 100 0.366 -3.211 0.000 1.00 0.00 N ATOM 1599 CA ASN A 100 0.083 -2.553 1.291 1.00 0.00 C ATOM 1600 C ASN A 100 1.346 -2.054 1.959 1.00 0.00 C ATOM 1601 O ASN A 100 1.451 -0.888 2.313 1.00 0.00 O ATOM 1602 CB ASN A 100 -0.643 -3.499 2.276 1.00 0.00 C ATOM 1603 CG ASN A 100 -2.127 -3.670 2.022 1.00 0.00 C ATOM 1604 OD1 ASN A 100 -2.924 -2.916 2.522 1.00 0.00 O ATOM 1605 ND2 ASN A 100 -2.508 -4.690 1.286 1.00 0.00 N ATOM 0 H ASN A 100 -0.086 -4.119 -0.107 1.00 0.00 H new ATOM 0 HA ASN A 100 -0.564 -1.708 1.054 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -0.167 -4.479 2.233 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -0.504 -3.121 3.289 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -3.501 -4.860 1.125 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -1.811 -5.311 0.876 1.00 0.00 H new ATOM 1612 N GLU A 101 2.323 -2.928 2.066 1.00 0.00 N ATOM 1613 CA GLU A 101 3.526 -2.625 2.777 1.00 0.00 C ATOM 1614 C GLU A 101 4.387 -1.677 1.968 1.00 0.00 C ATOM 1615 O GLU A 101 4.980 -0.768 2.505 1.00 0.00 O ATOM 1616 CB GLU A 101 4.238 -3.931 3.105 1.00 0.00 C ATOM 1617 CG GLU A 101 5.374 -3.812 4.083 1.00 0.00 C ATOM 1618 CD GLU A 101 6.698 -3.489 3.473 1.00 0.00 C ATOM 1619 OE1 GLU A 101 7.047 -4.067 2.403 1.00 0.00 O ATOM 1620 OE2 GLU A 101 7.443 -2.715 4.074 1.00 0.00 O ATOM 0 H GLU A 101 2.297 -3.864 1.661 1.00 0.00 H new ATOM 0 HA GLU A 101 3.303 -2.116 3.714 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.507 -4.634 3.505 1.00 0.00 H new ATOM 0 HB3 GLU A 101 4.620 -4.361 2.179 1.00 0.00 H new ATOM 0 HG2 GLU A 101 5.128 -3.039 4.811 1.00 0.00 H new ATOM 0 HG3 GLU A 101 5.462 -4.750 4.631 1.00 0.00 H new ATOM 1627 N ALA A 102 4.381 -1.870 0.672 1.00 0.00 N ATOM 1628 CA ALA A 102 5.174 -1.064 -0.248 1.00 0.00 C ATOM 1629 C ALA A 102 4.744 0.407 -0.231 1.00 0.00 C ATOM 1630 O ALA A 102 5.596 1.308 -0.229 1.00 0.00 O ATOM 1631 CB ALA A 102 5.115 -1.637 -1.655 1.00 0.00 C ATOM 0 H ALA A 102 3.825 -2.593 0.215 1.00 0.00 H new ATOM 0 HA ALA A 102 6.209 -1.100 0.092 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.714 -1.020 -2.325 1.00 0.00 H new ATOM 0 HB2 ALA A 102 5.508 -2.654 -1.651 1.00 0.00 H new ATOM 0 HB3 ALA A 102 4.081 -1.649 -2.000 1.00 0.00 H new ATOM 1637 N LEU A 103 3.433 0.643 -0.209 1.00 0.00 N ATOM 1638 CA LEU A 103 2.888 1.998 -0.127 1.00 0.00 C ATOM 1639 C LEU A 103 3.303 2.651 1.179 1.00 0.00 C ATOM 1640 O LEU A 103 3.746 3.803 1.212 1.00 0.00 O ATOM 1641 CB LEU A 103 1.348 1.977 -0.190 1.00 0.00 C ATOM 1642 CG LEU A 103 0.715 1.340 -1.419 1.00 0.00 C ATOM 1643 CD1 LEU A 103 -0.798 1.448 -1.353 1.00 0.00 C ATOM 1644 CD2 LEU A 103 1.245 1.979 -2.676 1.00 0.00 C ATOM 0 H LEU A 103 2.725 -0.090 -0.247 1.00 0.00 H new ATOM 0 HA LEU A 103 3.279 2.563 -0.973 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.980 1.452 0.691 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.992 3.005 -0.120 1.00 0.00 H new ATOM 0 HG LEU A 103 0.980 0.283 -1.438 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.235 0.988 -2.239 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.161 0.936 -0.462 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.086 2.498 -1.310 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.782 1.512 -3.545 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.012 3.044 -2.669 1.00 0.00 H new ATOM 0 HD23 LEU A 103 2.326 1.845 -2.725 1.00 0.00 H new ATOM 1656 N VAL A 104 3.166 1.907 2.244 1.00 0.00 N ATOM 1657 CA VAL A 104 3.439 2.402 3.568 1.00 0.00 C ATOM 1658 C VAL A 104 4.938 2.606 3.824 1.00 0.00 C ATOM 1659 O VAL A 104 5.340 3.662 4.292 1.00 0.00 O ATOM 1660 CB VAL A 104 2.810 1.494 4.655 1.00 0.00 C ATOM 1661 CG1 VAL A 104 3.109 2.014 6.032 1.00 0.00 C ATOM 1662 CG2 VAL A 104 1.320 1.422 4.473 1.00 0.00 C ATOM 0 H VAL A 104 2.860 0.934 2.218 1.00 0.00 H new ATOM 0 HA VAL A 104 2.969 3.383 3.631 1.00 0.00 H new ATOM 0 HB VAL A 104 3.245 0.500 4.549 1.00 0.00 H new ATOM 0 HG11 VAL A 104 2.656 1.358 6.775 1.00 0.00 H new ATOM 0 HG12 VAL A 104 4.188 2.043 6.184 1.00 0.00 H new ATOM 0 HG13 VAL A 104 2.701 3.019 6.138 1.00 0.00 H new ATOM 0 HG21 VAL A 104 0.890 0.781 5.243 1.00 0.00 H new ATOM 0 HG22 VAL A 104 0.895 2.422 4.554 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.093 1.010 3.490 1.00 0.00 H new ATOM 1672 N ARG A 105 5.764 1.633 3.443 1.00 0.00 N ATOM 1673 CA ARG A 105 7.200 1.679 3.752 1.00 0.00 C ATOM 1674 C ARG A 105 7.907 2.783 2.995 1.00 0.00 C ATOM 1675 O ARG A 105 8.978 3.207 3.389 1.00 0.00 O ATOM 1676 CB ARG A 105 7.892 0.352 3.439 1.00 0.00 C ATOM 1677 CG ARG A 105 8.064 0.075 1.956 1.00 0.00 C ATOM 1678 CD ARG A 105 8.732 -1.251 1.717 1.00 0.00 C ATOM 1679 NE ARG A 105 9.028 -1.469 0.310 1.00 0.00 N ATOM 1680 CZ ARG A 105 9.232 -2.657 -0.253 1.00 0.00 C ATOM 1681 NH1 ARG A 105 8.930 -3.773 0.412 1.00 0.00 N ATOM 1682 NH2 ARG A 105 9.663 -2.725 -1.507 1.00 0.00 N ATOM 0 H ARG A 105 5.470 0.806 2.923 1.00 0.00 H new ATOM 0 HA ARG A 105 7.267 1.878 4.822 1.00 0.00 H new ATOM 0 HB2 ARG A 105 8.873 0.345 3.915 1.00 0.00 H new ATOM 0 HB3 ARG A 105 7.316 -0.459 3.884 1.00 0.00 H new ATOM 0 HG2 ARG A 105 7.090 0.086 1.467 1.00 0.00 H new ATOM 0 HG3 ARG A 105 8.657 0.869 1.503 1.00 0.00 H new ATOM 0 HD2 ARG A 105 9.656 -1.300 2.293 1.00 0.00 H new ATOM 0 HD3 ARG A 105 8.087 -2.052 2.080 1.00 0.00 H new ATOM 0 HE ARG A 105 9.084 -0.647 -0.292 1.00 0.00 H new ATOM 0 HH11 ARG A 105 8.542 -3.716 1.354 1.00 0.00 H new ATOM 0 HH12 ARG A 105 9.087 -4.683 -0.021 1.00 0.00 H new ATOM 0 HH21 ARG A 105 9.836 -1.869 -2.034 1.00 0.00 H new ATOM 0 HH22 ARG A 105 9.821 -3.633 -1.943 1.00 0.00 H new ATOM 1696 N GLN A 106 7.323 3.210 1.890 1.00 0.00 N ATOM 1697 CA GLN A 106 7.912 4.253 1.087 1.00 0.00 C ATOM 1698 C GLN A 106 7.285 5.605 1.453 1.00 0.00 C ATOM 1699 O GLN A 106 7.677 6.660 0.947 1.00 0.00 O ATOM 1700 CB GLN A 106 7.751 3.924 -0.400 1.00 0.00 C ATOM 1701 CG GLN A 106 8.458 4.890 -1.349 1.00 0.00 C ATOM 1702 CD GLN A 106 9.954 4.990 -1.107 1.00 0.00 C ATOM 1703 OE1 GLN A 106 10.734 4.233 -1.676 1.00 0.00 O ATOM 1704 NE2 GLN A 106 10.367 5.925 -0.278 1.00 0.00 N ATOM 0 H GLN A 106 6.440 2.846 1.532 1.00 0.00 H new ATOM 0 HA GLN A 106 8.981 4.319 1.291 1.00 0.00 H new ATOM 0 HB2 GLN A 106 8.131 2.918 -0.578 1.00 0.00 H new ATOM 0 HB3 GLN A 106 6.688 3.911 -0.642 1.00 0.00 H new ATOM 0 HG2 GLN A 106 8.285 4.570 -2.376 1.00 0.00 H new ATOM 0 HG3 GLN A 106 8.014 5.880 -1.244 1.00 0.00 H new ATOM 0 HE21 GLN A 106 9.691 6.537 0.178 1.00 0.00 H new ATOM 0 HE22 GLN A 106 11.364 6.037 -0.092 1.00 0.00 H new ATOM 1713 N GLY A 107 6.336 5.556 2.351 1.00 0.00 N ATOM 1714 CA GLY A 107 5.709 6.739 2.844 1.00 0.00 C ATOM 1715 C GLY A 107 4.716 7.361 1.897 1.00 0.00 C ATOM 1716 O GLY A 107 4.747 8.563 1.705 1.00 0.00 O ATOM 0 H GLY A 107 5.981 4.690 2.757 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.201 6.503 3.779 1.00 0.00 H new ATOM 0 HA3 GLY A 107 6.480 7.474 3.076 1.00 0.00 H new ATOM 1720 N LEU A 108 3.855 6.556 1.277 1.00 0.00 N ATOM 1721 CA LEU A 108 2.767 7.107 0.444 1.00 0.00 C ATOM 1722 C LEU A 108 1.417 6.785 1.068 1.00 0.00 C ATOM 1723 O LEU A 108 0.385 7.336 0.681 1.00 0.00 O ATOM 1724 CB LEU A 108 2.775 6.622 -1.040 1.00 0.00 C ATOM 1725 CG LEU A 108 4.024 6.927 -1.882 1.00 0.00 C ATOM 1726 CD1 LEU A 108 5.156 6.001 -1.541 1.00 0.00 C ATOM 1727 CD2 LEU A 108 3.717 6.853 -3.355 1.00 0.00 C ATOM 0 H LEU A 108 3.880 5.538 1.328 1.00 0.00 H new ATOM 0 HA LEU A 108 2.942 8.183 0.416 1.00 0.00 H new ATOM 0 HB2 LEU A 108 2.624 5.542 -1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 108 1.915 7.064 -1.543 1.00 0.00 H new ATOM 0 HG LEU A 108 4.333 7.945 -1.643 1.00 0.00 H new ATOM 0 HD11 LEU A 108 6.023 6.245 -2.155 1.00 0.00 H new ATOM 0 HD12 LEU A 108 5.414 6.114 -0.488 1.00 0.00 H new ATOM 0 HD13 LEU A 108 4.854 4.971 -1.732 1.00 0.00 H new ATOM 0 HD21 LEU A 108 4.619 7.073 -3.926 1.00 0.00 H new ATOM 0 HD22 LEU A 108 3.366 5.852 -3.604 1.00 0.00 H new ATOM 0 HD23 LEU A 108 2.944 7.581 -3.603 1.00 0.00 H new ATOM 1739 N ALA A 109 1.423 5.895 2.031 1.00 0.00 N ATOM 1740 CA ALA A 109 0.209 5.504 2.707 1.00 0.00 C ATOM 1741 C ALA A 109 0.449 5.441 4.193 1.00 0.00 C ATOM 1742 O ALA A 109 1.586 5.247 4.630 1.00 0.00 O ATOM 1743 CB ALA A 109 -0.283 4.158 2.197 1.00 0.00 C ATOM 0 H ALA A 109 2.263 5.424 2.367 1.00 0.00 H new ATOM 0 HA ALA A 109 -0.560 6.249 2.499 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -1.199 3.883 2.720 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -0.482 4.225 1.127 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.479 3.400 2.377 1.00 0.00 H new ATOM 1749 N LYS A 110 -0.598 5.634 4.954 1.00 0.00 N ATOM 1750 CA LYS A 110 -0.526 5.561 6.395 1.00 0.00 C ATOM 1751 C LYS A 110 -1.364 4.395 6.846 1.00 0.00 C ATOM 1752 O LYS A 110 -2.240 3.930 6.089 1.00 0.00 O ATOM 1753 CB LYS A 110 -1.096 6.829 7.041 1.00 0.00 C ATOM 1754 CG LYS A 110 -0.437 8.127 6.625 1.00 0.00 C ATOM 1755 CD LYS A 110 -1.038 9.294 7.379 1.00 0.00 C ATOM 1756 CE LYS A 110 -0.423 10.621 6.962 1.00 0.00 C ATOM 1757 NZ LYS A 110 -1.024 11.755 7.688 1.00 0.00 N ATOM 0 H LYS A 110 -1.528 5.847 4.593 1.00 0.00 H new ATOM 0 HA LYS A 110 0.518 5.451 6.690 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -2.158 6.890 6.805 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -1.015 6.732 8.124 1.00 0.00 H new ATOM 0 HG2 LYS A 110 0.635 8.075 6.818 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -0.561 8.277 5.553 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -2.114 9.323 7.205 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -0.892 9.148 8.449 1.00 0.00 H new ATOM 0 HE2 LYS A 110 0.651 10.598 7.148 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -0.558 10.763 5.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -0.579 12.642 7.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -2.044 11.792 7.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -0.873 11.632 8.710 1.00 0.00 H new ATOM 1771 N VAL A 111 -1.122 3.922 8.041 1.00 0.00 N ATOM 1772 CA VAL A 111 -1.940 2.889 8.608 1.00 0.00 C ATOM 1773 C VAL A 111 -3.176 3.555 9.187 1.00 0.00 C ATOM 1774 O VAL A 111 -3.076 4.531 9.957 1.00 0.00 O ATOM 1775 CB VAL A 111 -1.190 2.083 9.706 1.00 0.00 C ATOM 1776 CG1 VAL A 111 -2.078 0.989 10.299 1.00 0.00 C ATOM 1777 CG2 VAL A 111 0.071 1.469 9.131 1.00 0.00 C ATOM 0 H VAL A 111 -0.360 4.240 8.641 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.208 2.171 7.832 1.00 0.00 H new ATOM 0 HB VAL A 111 -0.925 2.774 10.506 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.523 0.445 11.063 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -2.963 1.441 10.746 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.382 0.300 9.511 1.00 0.00 H new ATOM 0 HG21 VAL A 111 0.589 0.907 9.908 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.191 0.799 8.312 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.723 2.259 8.759 1.00 0.00 H new ATOM 1787 N ALA A 112 -4.308 3.054 8.833 1.00 0.00 N ATOM 1788 CA ALA A 112 -5.553 3.639 9.234 1.00 0.00 C ATOM 1789 C ALA A 112 -6.230 2.744 10.228 1.00 0.00 C ATOM 1790 O ALA A 112 -5.617 1.796 10.736 1.00 0.00 O ATOM 1791 CB ALA A 112 -6.438 3.822 8.019 1.00 0.00 C ATOM 0 H ALA A 112 -4.403 2.221 8.253 1.00 0.00 H new ATOM 0 HA ALA A 112 -5.370 4.610 9.694 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -7.386 4.267 8.323 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -5.942 4.478 7.303 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -6.624 2.853 7.555 1.00 0.00 H new ATOM 1797 N TYR A 113 -7.465 3.066 10.560 1.00 0.00 N ATOM 1798 CA TYR A 113 -8.242 2.225 11.430 1.00 0.00 C ATOM 1799 C TYR A 113 -8.606 0.956 10.701 1.00 0.00 C ATOM 1800 O TYR A 113 -9.556 0.911 9.907 1.00 0.00 O ATOM 1801 CB TYR A 113 -9.487 2.939 11.971 1.00 0.00 C ATOM 1802 CG TYR A 113 -9.153 4.087 12.886 1.00 0.00 C ATOM 1803 CD1 TYR A 113 -9.011 3.890 14.252 1.00 0.00 C ATOM 1804 CD2 TYR A 113 -8.954 5.358 12.386 1.00 0.00 C ATOM 1805 CE1 TYR A 113 -8.677 4.933 15.086 1.00 0.00 C ATOM 1806 CE2 TYR A 113 -8.625 6.406 13.210 1.00 0.00 C ATOM 1807 CZ TYR A 113 -8.487 6.190 14.558 1.00 0.00 C ATOM 1808 OH TYR A 113 -8.133 7.237 15.381 1.00 0.00 O ATOM 0 H TYR A 113 -7.946 3.905 10.237 1.00 0.00 H new ATOM 0 HA TYR A 113 -7.635 1.978 12.301 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -10.080 3.309 11.134 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -10.107 2.221 12.508 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -9.165 2.905 14.667 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -9.059 5.532 11.325 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -8.565 4.766 16.147 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -8.476 7.394 12.800 1.00 0.00 H new ATOM 0 HH TYR A 113 -8.038 8.054 14.848 1.00 0.00 H new ATOM 1818 N VAL A 114 -7.780 -0.022 10.909 1.00 0.00 N ATOM 1819 CA VAL A 114 -7.920 -1.329 10.351 1.00 0.00 C ATOM 1820 C VAL A 114 -9.188 -1.958 10.873 1.00 0.00 C ATOM 1821 O VAL A 114 -9.423 -1.969 12.098 1.00 0.00 O ATOM 1822 CB VAL A 114 -6.713 -2.191 10.773 1.00 0.00 C ATOM 1823 CG1 VAL A 114 -6.843 -3.600 10.266 1.00 0.00 C ATOM 1824 CG2 VAL A 114 -5.413 -1.568 10.295 1.00 0.00 C ATOM 0 H VAL A 114 -6.953 0.075 11.499 1.00 0.00 H new ATOM 0 HA VAL A 114 -7.963 -1.264 9.264 1.00 0.00 H new ATOM 0 HB VAL A 114 -6.697 -2.228 11.862 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -5.976 -4.181 10.581 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -7.749 -4.051 10.672 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -6.898 -3.591 9.177 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -4.575 -2.193 10.604 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -5.425 -1.489 9.208 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -5.304 -0.574 10.730 1.00 0.00 H new ATOM 1834 N TYR A 115 -10.014 -2.468 9.987 1.00 0.00 N ATOM 1835 CA TYR A 115 -11.206 -3.085 10.438 1.00 0.00 C ATOM 1836 C TYR A 115 -10.932 -4.508 10.849 1.00 0.00 C ATOM 1837 O TYR A 115 -10.890 -5.419 10.026 1.00 0.00 O ATOM 1838 CB TYR A 115 -12.378 -3.010 9.447 1.00 0.00 C ATOM 1839 CG TYR A 115 -13.647 -3.547 10.078 1.00 0.00 C ATOM 1840 CD1 TYR A 115 -14.334 -2.789 11.010 1.00 0.00 C ATOM 1841 CD2 TYR A 115 -14.116 -4.826 9.799 1.00 0.00 C ATOM 1842 CE1 TYR A 115 -15.452 -3.276 11.640 1.00 0.00 C ATOM 1843 CE2 TYR A 115 -15.231 -5.325 10.439 1.00 0.00 C ATOM 1844 CZ TYR A 115 -15.896 -4.547 11.356 1.00 0.00 C ATOM 1845 OH TYR A 115 -17.003 -5.046 12.012 1.00 0.00 O ATOM 0 H TYR A 115 -9.874 -2.461 8.977 1.00 0.00 H new ATOM 0 HA TYR A 115 -11.533 -2.508 11.303 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -12.530 -1.977 9.134 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -12.141 -3.583 8.551 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -13.984 -1.795 11.246 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -13.601 -5.436 9.072 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -15.981 -2.664 12.356 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -15.580 -6.323 10.220 1.00 0.00 H new ATOM 0 HH TYR A 115 -17.187 -5.956 11.697 1.00 0.00 H new ATOM 1855 N LYS A 116 -10.675 -4.663 12.117 1.00 0.00 N ATOM 1856 CA LYS A 116 -10.476 -5.946 12.722 1.00 0.00 C ATOM 1857 C LYS A 116 -11.811 -6.696 12.647 1.00 0.00 C ATOM 1858 O LYS A 116 -12.869 -6.056 12.693 1.00 0.00 O ATOM 1859 CB LYS A 116 -9.994 -5.734 14.162 1.00 0.00 C ATOM 1860 CG LYS A 116 -8.661 -4.994 14.203 1.00 0.00 C ATOM 1861 CD LYS A 116 -8.321 -4.457 15.584 1.00 0.00 C ATOM 1862 CE LYS A 116 -7.050 -3.596 15.549 1.00 0.00 C ATOM 1863 NZ LYS A 116 -5.819 -4.378 15.282 1.00 0.00 N ATOM 0 H LYS A 116 -10.597 -3.884 12.771 1.00 0.00 H new ATOM 0 HA LYS A 116 -9.718 -6.540 12.212 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -10.742 -5.169 14.718 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -9.891 -6.699 14.658 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -7.868 -5.667 13.876 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -8.689 -4.166 13.494 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -9.154 -3.864 15.962 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -8.181 -5.288 16.276 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -7.159 -2.830 14.781 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -6.944 -3.078 16.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -5.289 -3.936 14.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -5.227 -4.397 16.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -6.076 -5.350 15.018 1.00 0.00 H new ATOM 1877 N PRO A 117 -11.815 -8.032 12.557 1.00 0.00 N ATOM 1878 CA PRO A 117 -10.628 -8.878 12.686 1.00 0.00 C ATOM 1879 C PRO A 117 -9.737 -9.005 11.436 1.00 0.00 C ATOM 1880 O PRO A 117 -8.823 -9.831 11.432 1.00 0.00 O ATOM 1881 CB PRO A 117 -11.221 -10.229 13.050 1.00 0.00 C ATOM 1882 CG PRO A 117 -12.541 -10.263 12.362 1.00 0.00 C ATOM 1883 CD PRO A 117 -13.020 -8.836 12.281 1.00 0.00 C ATOM 0 HA PRO A 117 -9.942 -8.445 13.413 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -10.580 -11.045 12.717 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -11.335 -10.333 14.129 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -12.448 -10.698 11.367 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -13.250 -10.879 12.914 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -13.433 -8.610 11.298 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -13.806 -8.638 13.010 1.00 0.00 H new ATOM 1891 N ASN A 118 -9.945 -8.191 10.411 1.00 0.00 N ATOM 1892 CA ASN A 118 -9.072 -8.254 9.224 1.00 0.00 C ATOM 1893 C ASN A 118 -7.776 -7.574 9.503 1.00 0.00 C ATOM 1894 O ASN A 118 -7.595 -6.407 9.197 1.00 0.00 O ATOM 1895 CB ASN A 118 -9.688 -7.662 7.946 1.00 0.00 C ATOM 1896 CG ASN A 118 -10.830 -8.458 7.377 1.00 0.00 C ATOM 1897 OD1 ASN A 118 -11.622 -9.059 8.097 1.00 0.00 O ATOM 1898 ND2 ASN A 118 -10.903 -8.498 6.075 1.00 0.00 N ATOM 0 H ASN A 118 -10.687 -7.493 10.365 1.00 0.00 H new ATOM 0 HA ASN A 118 -8.924 -9.317 9.031 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -10.037 -6.652 8.160 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -8.909 -7.576 7.189 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -11.637 -9.042 5.622 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -10.226 -7.985 5.510 1.00 0.00 H new ATOM 1905 N ASN A 119 -6.897 -8.289 10.143 1.00 0.00 N ATOM 1906 CA ASN A 119 -5.618 -7.759 10.523 1.00 0.00 C ATOM 1907 C ASN A 119 -4.613 -8.850 10.803 1.00 0.00 C ATOM 1908 O ASN A 119 -4.507 -9.371 11.914 1.00 0.00 O ATOM 1909 CB ASN A 119 -5.681 -6.722 11.688 1.00 0.00 C ATOM 1910 CG ASN A 119 -6.166 -7.238 13.051 1.00 0.00 C ATOM 1911 OD1 ASN A 119 -5.732 -6.753 14.082 1.00 0.00 O ATOM 1912 ND2 ASN A 119 -7.076 -8.164 13.074 1.00 0.00 N ATOM 0 H ASN A 119 -7.047 -9.260 10.418 1.00 0.00 H new ATOM 0 HA ASN A 119 -5.272 -7.201 9.653 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -4.685 -6.299 11.820 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -6.336 -5.906 11.381 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -7.441 -8.498 13.966 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -7.426 -8.557 12.200 1.00 0.00 H new ATOM 1919 N THR A 120 -3.963 -9.271 9.784 1.00 0.00 N ATOM 1920 CA THR A 120 -2.871 -10.189 9.937 1.00 0.00 C ATOM 1921 C THR A 120 -1.559 -9.460 9.681 1.00 0.00 C ATOM 1922 O THR A 120 -0.563 -9.675 10.364 1.00 0.00 O ATOM 1923 CB THR A 120 -2.999 -11.400 8.987 1.00 0.00 C ATOM 1924 OG1 THR A 120 -4.262 -12.045 9.199 1.00 0.00 O ATOM 1925 CG2 THR A 120 -1.878 -12.412 9.217 1.00 0.00 C ATOM 0 H THR A 120 -4.161 -8.999 8.821 1.00 0.00 H new ATOM 0 HA THR A 120 -2.891 -10.572 10.957 1.00 0.00 H new ATOM 0 HB THR A 120 -2.927 -11.032 7.963 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.986 -11.445 8.923 1.00 0.00 H new ATOM 0 HG21 THR A 120 -1.999 -13.251 8.532 1.00 0.00 H new ATOM 0 HG22 THR A 120 -0.914 -11.934 9.039 1.00 0.00 H new ATOM 0 HG23 THR A 120 -1.919 -12.774 10.244 1.00 0.00 H new ATOM 1933 N HIS A 121 -1.565 -8.541 8.730 1.00 0.00 N ATOM 1934 CA HIS A 121 -0.324 -7.874 8.381 1.00 0.00 C ATOM 1935 C HIS A 121 -0.343 -6.424 8.830 1.00 0.00 C ATOM 1936 O HIS A 121 0.484 -5.634 8.394 1.00 0.00 O ATOM 1937 CB HIS A 121 0.002 -7.993 6.872 1.00 0.00 C ATOM 1938 CG HIS A 121 0.057 -9.412 6.341 1.00 0.00 C ATOM 1939 ND1 HIS A 121 1.211 -10.137 6.189 1.00 0.00 N ATOM 1940 CD2 HIS A 121 -0.932 -10.216 5.899 1.00 0.00 C ATOM 1941 CE1 HIS A 121 0.917 -11.314 5.672 1.00 0.00 C ATOM 1942 NE2 HIS A 121 -0.373 -11.380 5.490 1.00 0.00 N ATOM 0 H HIS A 121 -2.386 -8.247 8.201 1.00 0.00 H new ATOM 0 HA HIS A 121 0.477 -8.385 8.915 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -0.748 -7.438 6.308 1.00 0.00 H new ATOM 0 HB3 HIS A 121 0.962 -7.513 6.684 1.00 0.00 H new ATOM 0 HD2 HIS A 121 -1.984 -9.974 5.875 1.00 0.00 H new ATOM 0 HE1 HIS A 121 1.627 -12.094 5.438 1.00 0.00 H new ATOM 0 HE2 HIS A 121 -0.878 -12.177 5.103 1.00 0.00 H new ATOM 1951 N GLU A 122 -1.289 -6.088 9.733 1.00 0.00 N ATOM 1952 CA GLU A 122 -1.367 -4.747 10.338 1.00 0.00 C ATOM 1953 C GLU A 122 -0.020 -4.392 10.973 1.00 0.00 C ATOM 1954 O GLU A 122 0.507 -3.308 10.770 1.00 0.00 O ATOM 1955 CB GLU A 122 -2.452 -4.709 11.434 1.00 0.00 C ATOM 1956 CG GLU A 122 -2.497 -3.387 12.206 1.00 0.00 C ATOM 1957 CD GLU A 122 -3.461 -3.400 13.369 1.00 0.00 C ATOM 1958 OE1 GLU A 122 -3.122 -3.930 14.435 1.00 0.00 O ATOM 1959 OE2 GLU A 122 -4.567 -2.869 13.256 1.00 0.00 O ATOM 0 H GLU A 122 -2.010 -6.732 10.058 1.00 0.00 H new ATOM 0 HA GLU A 122 -1.618 -4.031 9.555 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -3.425 -4.886 10.976 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -2.276 -5.524 12.136 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -1.498 -3.157 12.575 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -2.776 -2.585 11.522 1.00 0.00 H new ATOM 1966 N GLN A 123 0.534 -5.360 11.708 1.00 0.00 N ATOM 1967 CA GLN A 123 1.816 -5.222 12.410 1.00 0.00 C ATOM 1968 C GLN A 123 2.931 -4.845 11.437 1.00 0.00 C ATOM 1969 O GLN A 123 3.742 -3.952 11.707 1.00 0.00 O ATOM 1970 CB GLN A 123 2.178 -6.542 13.092 1.00 0.00 C ATOM 1971 CG GLN A 123 1.095 -7.097 13.998 1.00 0.00 C ATOM 1972 CD GLN A 123 1.514 -8.356 14.744 1.00 0.00 C ATOM 1973 OE1 GLN A 123 1.040 -8.615 15.844 1.00 0.00 O ATOM 1974 NE2 GLN A 123 2.395 -9.139 14.166 1.00 0.00 N ATOM 0 H GLN A 123 0.100 -6.274 11.835 1.00 0.00 H new ATOM 0 HA GLN A 123 1.712 -4.432 13.154 1.00 0.00 H new ATOM 0 HB2 GLN A 123 2.408 -7.282 12.325 1.00 0.00 H new ATOM 0 HB3 GLN A 123 3.086 -6.397 13.678 1.00 0.00 H new ATOM 0 HG2 GLN A 123 0.811 -6.333 14.722 1.00 0.00 H new ATOM 0 HG3 GLN A 123 0.210 -7.316 13.401 1.00 0.00 H new ATOM 0 HE21 GLN A 123 2.770 -8.895 13.250 1.00 0.00 H new ATOM 0 HE22 GLN A 123 2.704 -9.991 14.633 1.00 0.00 H new ATOM 1983 N LEU A 124 2.927 -5.509 10.294 1.00 0.00 N ATOM 1984 CA LEU A 124 3.913 -5.298 9.252 1.00 0.00 C ATOM 1985 C LEU A 124 3.823 -3.873 8.718 1.00 0.00 C ATOM 1986 O LEU A 124 4.822 -3.202 8.528 1.00 0.00 O ATOM 1987 CB LEU A 124 3.682 -6.303 8.115 1.00 0.00 C ATOM 1988 CG LEU A 124 4.617 -6.192 6.910 1.00 0.00 C ATOM 1989 CD1 LEU A 124 6.056 -6.482 7.303 1.00 0.00 C ATOM 1990 CD2 LEU A 124 4.162 -7.116 5.792 1.00 0.00 C ATOM 0 H LEU A 124 2.231 -6.217 10.062 1.00 0.00 H new ATOM 0 HA LEU A 124 4.909 -5.449 9.669 1.00 0.00 H new ATOM 0 HB2 LEU A 124 3.771 -7.309 8.525 1.00 0.00 H new ATOM 0 HB3 LEU A 124 2.656 -6.191 7.763 1.00 0.00 H new ATOM 0 HG LEU A 124 4.574 -5.166 6.544 1.00 0.00 H new ATOM 0 HD11 LEU A 124 6.697 -6.395 6.426 1.00 0.00 H new ATOM 0 HD12 LEU A 124 6.378 -5.766 8.060 1.00 0.00 H new ATOM 0 HD13 LEU A 124 6.127 -7.492 7.706 1.00 0.00 H new ATOM 0 HD21 LEU A 124 4.840 -7.022 4.944 1.00 0.00 H new ATOM 0 HD22 LEU A 124 4.166 -8.146 6.147 1.00 0.00 H new ATOM 0 HD23 LEU A 124 3.153 -6.843 5.482 1.00 0.00 H new ATOM 2002 N LEU A 125 2.620 -3.410 8.532 1.00 0.00 N ATOM 2003 CA LEU A 125 2.396 -2.083 8.009 1.00 0.00 C ATOM 2004 C LEU A 125 2.724 -1.044 9.048 1.00 0.00 C ATOM 2005 O LEU A 125 3.248 0.004 8.738 1.00 0.00 O ATOM 2006 CB LEU A 125 0.956 -1.945 7.551 1.00 0.00 C ATOM 2007 CG LEU A 125 0.520 -2.971 6.521 1.00 0.00 C ATOM 2008 CD1 LEU A 125 -0.896 -2.732 6.093 1.00 0.00 C ATOM 2009 CD2 LEU A 125 1.443 -2.940 5.343 1.00 0.00 C ATOM 0 H LEU A 125 1.769 -3.934 8.735 1.00 0.00 H new ATOM 0 HA LEU A 125 3.053 -1.926 7.153 1.00 0.00 H new ATOM 0 HB2 LEU A 125 0.303 -2.022 8.420 1.00 0.00 H new ATOM 0 HB3 LEU A 125 0.815 -0.948 7.134 1.00 0.00 H new ATOM 0 HG LEU A 125 0.567 -3.960 6.976 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -1.184 -3.480 5.355 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -1.555 -2.804 6.958 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -0.981 -1.738 5.654 1.00 0.00 H new ATOM 0 HD21 LEU A 125 1.122 -3.680 4.610 1.00 0.00 H new ATOM 0 HD22 LEU A 125 1.423 -1.948 4.891 1.00 0.00 H new ATOM 0 HD23 LEU A 125 2.457 -3.169 5.669 1.00 0.00 H new ATOM 2021 N ARG A 126 2.443 -1.375 10.280 1.00 0.00 N ATOM 2022 CA ARG A 126 2.659 -0.502 11.412 1.00 0.00 C ATOM 2023 C ARG A 126 4.145 -0.181 11.548 1.00 0.00 C ATOM 2024 O ARG A 126 4.534 0.984 11.717 1.00 0.00 O ATOM 2025 CB ARG A 126 2.130 -1.209 12.647 1.00 0.00 C ATOM 2026 CG ARG A 126 1.875 -0.341 13.845 1.00 0.00 C ATOM 2027 CD ARG A 126 1.123 -1.139 14.889 1.00 0.00 C ATOM 2028 NE ARG A 126 0.807 -0.348 16.076 1.00 0.00 N ATOM 2029 CZ ARG A 126 -0.122 -0.670 16.996 1.00 0.00 C ATOM 2030 NH1 ARG A 126 -0.762 -1.837 16.940 1.00 0.00 N ATOM 2031 NH2 ARG A 126 -0.379 0.164 17.985 1.00 0.00 N ATOM 0 H ARG A 126 2.048 -2.280 10.535 1.00 0.00 H new ATOM 0 HA ARG A 126 2.135 0.445 11.280 1.00 0.00 H new ATOM 0 HB2 ARG A 126 1.200 -1.712 12.383 1.00 0.00 H new ATOM 0 HB3 ARG A 126 2.842 -1.984 12.930 1.00 0.00 H new ATOM 0 HG2 ARG A 126 2.819 0.019 14.255 1.00 0.00 H new ATOM 0 HG3 ARG A 126 1.298 0.537 13.556 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.199 -1.521 14.454 1.00 0.00 H new ATOM 0 HD3 ARG A 126 1.720 -2.003 15.180 1.00 0.00 H new ATOM 0 HE ARG A 126 1.331 0.515 16.219 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -0.550 -2.499 16.194 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -1.463 -2.068 17.643 1.00 0.00 H new ATOM 0 HH21 ARG A 126 0.125 1.048 18.050 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -1.082 -0.075 18.684 1.00 0.00 H new ATOM 2045 N LYS A 127 4.969 -1.206 11.416 1.00 0.00 N ATOM 2046 CA LYS A 127 6.408 -1.031 11.499 1.00 0.00 C ATOM 2047 C LYS A 127 6.939 -0.313 10.265 1.00 0.00 C ATOM 2048 O LYS A 127 7.819 0.542 10.363 1.00 0.00 O ATOM 2049 CB LYS A 127 7.133 -2.350 11.724 1.00 0.00 C ATOM 2050 CG LYS A 127 7.020 -3.342 10.586 1.00 0.00 C ATOM 2051 CD LYS A 127 7.642 -4.643 10.947 1.00 0.00 C ATOM 2052 CE LYS A 127 9.139 -4.515 11.177 1.00 0.00 C ATOM 2053 NZ LYS A 127 9.734 -5.793 11.587 1.00 0.00 N ATOM 0 H LYS A 127 4.667 -2.166 11.251 1.00 0.00 H new ATOM 0 HA LYS A 127 6.609 -0.407 12.370 1.00 0.00 H new ATOM 0 HB2 LYS A 127 8.188 -2.142 11.902 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.742 -2.813 12.630 1.00 0.00 H new ATOM 0 HG2 LYS A 127 5.970 -3.494 10.335 1.00 0.00 H new ATOM 0 HG3 LYS A 127 7.505 -2.938 9.697 1.00 0.00 H new ATOM 0 HD2 LYS A 127 7.169 -5.033 11.848 1.00 0.00 H new ATOM 0 HD3 LYS A 127 7.458 -5.366 10.152 1.00 0.00 H new ATOM 0 HE2 LYS A 127 9.620 -4.166 10.263 1.00 0.00 H new ATOM 0 HE3 LYS A 127 9.327 -3.763 11.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 10.756 -5.669 11.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 9.292 -6.113 12.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 9.576 -6.504 10.844 1.00 0.00 H new ATOM 2067 N SER A 128 6.416 -0.676 9.110 1.00 0.00 N ATOM 2068 CA SER A 128 6.755 -0.012 7.867 1.00 0.00 C ATOM 2069 C SER A 128 6.339 1.485 7.872 1.00 0.00 C ATOM 2070 O SER A 128 7.018 2.325 7.272 1.00 0.00 O ATOM 2071 CB SER A 128 6.194 -0.807 6.685 1.00 0.00 C ATOM 2072 OG SER A 128 6.880 -2.052 6.585 1.00 0.00 O ATOM 0 H SER A 128 5.746 -1.438 9.007 1.00 0.00 H new ATOM 0 HA SER A 128 7.839 0.005 7.756 1.00 0.00 H new ATOM 0 HB2 SER A 128 5.126 -0.977 6.821 1.00 0.00 H new ATOM 0 HB3 SER A 128 6.311 -0.239 5.762 1.00 0.00 H new ATOM 0 HG SER A 128 7.189 -2.182 5.664 1.00 0.00 H new ATOM 2078 N GLU A 129 5.256 1.808 8.572 1.00 0.00 N ATOM 2079 CA GLU A 129 4.817 3.187 8.734 1.00 0.00 C ATOM 2080 C GLU A 129 5.819 3.949 9.581 1.00 0.00 C ATOM 2081 O GLU A 129 6.278 5.028 9.206 1.00 0.00 O ATOM 2082 CB GLU A 129 3.441 3.239 9.398 1.00 0.00 C ATOM 2083 CG GLU A 129 2.961 4.645 9.651 1.00 0.00 C ATOM 2084 CD GLU A 129 1.689 4.706 10.441 1.00 0.00 C ATOM 2085 OE1 GLU A 129 1.742 4.543 11.685 1.00 0.00 O ATOM 2086 OE2 GLU A 129 0.628 4.945 9.856 1.00 0.00 O ATOM 0 H GLU A 129 4.662 1.124 9.040 1.00 0.00 H new ATOM 0 HA GLU A 129 4.748 3.646 7.748 1.00 0.00 H new ATOM 0 HB2 GLU A 129 2.719 2.723 8.765 1.00 0.00 H new ATOM 0 HB3 GLU A 129 3.480 2.699 10.344 1.00 0.00 H new ATOM 0 HG2 GLU A 129 3.737 5.196 10.182 1.00 0.00 H new ATOM 0 HG3 GLU A 129 2.811 5.147 8.695 1.00 0.00 H new ATOM 2093 N ALA A 130 6.165 3.364 10.717 1.00 0.00 N ATOM 2094 CA ALA A 130 7.131 3.941 11.643 1.00 0.00 C ATOM 2095 C ALA A 130 8.482 4.139 10.951 1.00 0.00 C ATOM 2096 O ALA A 130 9.203 5.112 11.209 1.00 0.00 O ATOM 2097 CB ALA A 130 7.271 3.040 12.855 1.00 0.00 C ATOM 0 H ALA A 130 5.782 2.470 11.026 1.00 0.00 H new ATOM 0 HA ALA A 130 6.777 4.918 11.971 1.00 0.00 H new ATOM 0 HB1 ALA A 130 7.994 3.472 13.548 1.00 0.00 H new ATOM 0 HB2 ALA A 130 6.305 2.945 13.351 1.00 0.00 H new ATOM 0 HB3 ALA A 130 7.615 2.055 12.539 1.00 0.00 H new ATOM 2103 N GLN A 131 8.781 3.229 10.049 1.00 0.00 N ATOM 2104 CA GLN A 131 9.980 3.255 9.243 1.00 0.00 C ATOM 2105 C GLN A 131 9.976 4.500 8.358 1.00 0.00 C ATOM 2106 O GLN A 131 10.940 5.276 8.330 1.00 0.00 O ATOM 2107 CB GLN A 131 9.981 2.015 8.368 1.00 0.00 C ATOM 2108 CG GLN A 131 11.255 1.753 7.602 1.00 0.00 C ATOM 2109 CD GLN A 131 11.124 0.528 6.728 1.00 0.00 C ATOM 2110 OE1 GLN A 131 11.385 -0.592 7.164 1.00 0.00 O ATOM 2111 NE2 GLN A 131 10.730 0.718 5.497 1.00 0.00 N ATOM 0 H GLN A 131 8.179 2.429 9.852 1.00 0.00 H new ATOM 0 HA GLN A 131 10.865 3.276 9.879 1.00 0.00 H new ATOM 0 HB2 GLN A 131 9.773 1.149 8.997 1.00 0.00 H new ATOM 0 HB3 GLN A 131 9.161 2.096 7.655 1.00 0.00 H new ATOM 0 HG2 GLN A 131 11.496 2.619 6.985 1.00 0.00 H new ATOM 0 HG3 GLN A 131 12.081 1.618 8.300 1.00 0.00 H new ATOM 0 HE21 GLN A 131 10.522 1.661 5.168 1.00 0.00 H new ATOM 0 HE22 GLN A 131 10.631 -0.076 4.865 1.00 0.00 H new ATOM 2120 N ALA A 132 8.862 4.694 7.679 1.00 0.00 N ATOM 2121 CA ALA A 132 8.665 5.817 6.781 1.00 0.00 C ATOM 2122 C ALA A 132 8.717 7.147 7.535 1.00 0.00 C ATOM 2123 O ALA A 132 9.235 8.155 7.018 1.00 0.00 O ATOM 2124 CB ALA A 132 7.342 5.655 6.055 1.00 0.00 C ATOM 0 H ALA A 132 8.058 4.069 7.736 1.00 0.00 H new ATOM 0 HA ALA A 132 9.474 5.830 6.051 1.00 0.00 H new ATOM 0 HB1 ALA A 132 7.192 6.497 5.380 1.00 0.00 H new ATOM 0 HB2 ALA A 132 7.353 4.728 5.482 1.00 0.00 H new ATOM 0 HB3 ALA A 132 6.530 5.623 6.781 1.00 0.00 H new ATOM 2130 N LYS A 133 8.204 7.136 8.758 1.00 0.00 N ATOM 2131 CA LYS A 133 8.191 8.297 9.617 1.00 0.00 C ATOM 2132 C LYS A 133 9.595 8.752 9.985 1.00 0.00 C ATOM 2133 O LYS A 133 9.915 9.936 9.870 1.00 0.00 O ATOM 2134 CB LYS A 133 7.392 8.010 10.885 1.00 0.00 C ATOM 2135 CG LYS A 133 5.899 7.890 10.674 1.00 0.00 C ATOM 2136 CD LYS A 133 5.179 7.484 11.951 1.00 0.00 C ATOM 2137 CE LYS A 133 3.681 7.485 11.739 1.00 0.00 C ATOM 2138 NZ LYS A 133 2.943 6.920 12.876 1.00 0.00 N ATOM 0 H LYS A 133 7.782 6.308 9.180 1.00 0.00 H new ATOM 0 HA LYS A 133 7.715 9.104 9.060 1.00 0.00 H new ATOM 0 HB2 LYS A 133 7.759 7.084 11.328 1.00 0.00 H new ATOM 0 HB3 LYS A 133 7.581 8.805 11.606 1.00 0.00 H new ATOM 0 HG2 LYS A 133 5.504 8.843 10.321 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.700 7.154 9.895 1.00 0.00 H new ATOM 0 HD2 LYS A 133 5.508 6.492 12.261 1.00 0.00 H new ATOM 0 HD3 LYS A 133 5.439 8.172 12.756 1.00 0.00 H new ATOM 0 HE2 LYS A 133 3.344 8.507 11.565 1.00 0.00 H new ATOM 0 HE3 LYS A 133 3.446 6.915 10.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 2.449 6.056 12.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 3.608 6.689 13.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 2.248 7.614 13.219 1.00 0.00 H new ATOM 2152 N LYS A 134 10.446 7.819 10.387 1.00 0.00 N ATOM 2153 CA LYS A 134 11.785 8.174 10.838 1.00 0.00 C ATOM 2154 C LYS A 134 12.732 8.572 9.698 1.00 0.00 C ATOM 2155 O LYS A 134 13.791 9.167 9.934 1.00 0.00 O ATOM 2156 CB LYS A 134 12.374 7.117 11.822 1.00 0.00 C ATOM 2157 CG LYS A 134 12.465 5.661 11.328 1.00 0.00 C ATOM 2158 CD LYS A 134 13.628 5.405 10.374 1.00 0.00 C ATOM 2159 CE LYS A 134 13.652 3.937 9.940 1.00 0.00 C ATOM 2160 NZ LYS A 134 14.724 3.618 8.965 1.00 0.00 N ATOM 0 H LYS A 134 10.237 6.821 10.411 1.00 0.00 H new ATOM 0 HA LYS A 134 11.680 9.089 11.421 1.00 0.00 H new ATOM 0 HB2 LYS A 134 13.376 7.440 12.103 1.00 0.00 H new ATOM 0 HB3 LYS A 134 11.770 7.128 12.729 1.00 0.00 H new ATOM 0 HG2 LYS A 134 12.562 5.000 12.190 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.533 5.398 10.828 1.00 0.00 H new ATOM 0 HD2 LYS A 134 13.536 6.048 9.498 1.00 0.00 H new ATOM 0 HD3 LYS A 134 14.569 5.662 10.861 1.00 0.00 H new ATOM 0 HE2 LYS A 134 13.777 3.309 10.822 1.00 0.00 H new ATOM 0 HE3 LYS A 134 12.687 3.682 9.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 15.174 2.718 9.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 14.314 3.536 8.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 15.436 4.376 8.972 1.00 0.00 H new ATOM 2174 N GLU A 135 12.355 8.256 8.471 1.00 0.00 N ATOM 2175 CA GLU A 135 13.144 8.667 7.320 1.00 0.00 C ATOM 2176 C GLU A 135 12.533 9.876 6.630 1.00 0.00 C ATOM 2177 O GLU A 135 13.104 10.406 5.661 1.00 0.00 O ATOM 2178 CB GLU A 135 13.335 7.514 6.345 1.00 0.00 C ATOM 2179 CG GLU A 135 14.026 6.353 6.994 1.00 0.00 C ATOM 2180 CD GLU A 135 14.487 5.298 6.050 1.00 0.00 C ATOM 2181 OE1 GLU A 135 15.199 5.615 5.080 1.00 0.00 O ATOM 2182 OE2 GLU A 135 14.232 4.109 6.320 1.00 0.00 O ATOM 0 H GLU A 135 11.516 7.721 8.246 1.00 0.00 H new ATOM 0 HA GLU A 135 14.128 8.961 7.685 1.00 0.00 H new ATOM 0 HB2 GLU A 135 12.365 7.194 5.964 1.00 0.00 H new ATOM 0 HB3 GLU A 135 13.918 7.853 5.489 1.00 0.00 H new ATOM 0 HG2 GLU A 135 14.886 6.724 7.551 1.00 0.00 H new ATOM 0 HG3 GLU A 135 13.348 5.902 7.718 1.00 0.00 H new ATOM 2189 N LYS A 136 11.381 10.322 7.154 1.00 0.00 N ATOM 2190 CA LYS A 136 10.639 11.472 6.625 1.00 0.00 C ATOM 2191 C LYS A 136 10.377 11.298 5.141 1.00 0.00 C ATOM 2192 O LYS A 136 10.706 12.183 4.330 1.00 0.00 O ATOM 2193 CB LYS A 136 11.376 12.794 6.869 1.00 0.00 C ATOM 2194 CG LYS A 136 11.668 13.101 8.326 1.00 0.00 C ATOM 2195 CD LYS A 136 12.346 14.460 8.485 1.00 0.00 C ATOM 2196 CE LYS A 136 13.723 14.507 7.829 1.00 0.00 C ATOM 2197 NZ LYS A 136 14.308 15.863 7.885 1.00 0.00 N ATOM 0 H LYS A 136 10.936 9.889 7.964 1.00 0.00 H new ATOM 0 HA LYS A 136 9.690 11.514 7.160 1.00 0.00 H new ATOM 0 HB2 LYS A 136 12.318 12.775 6.321 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.781 13.607 6.453 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.739 13.088 8.895 1.00 0.00 H new ATOM 0 HG3 LYS A 136 12.308 12.323 8.742 1.00 0.00 H new ATOM 0 HD2 LYS A 136 11.712 15.232 8.048 1.00 0.00 H new ATOM 0 HD3 LYS A 136 12.444 14.691 9.546 1.00 0.00 H new ATOM 0 HE2 LYS A 136 14.388 13.803 8.328 1.00 0.00 H new ATOM 0 HE3 LYS A 136 13.642 14.188 6.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 15.243 15.857 7.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 13.685 16.531 7.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 14.408 16.157 8.877 1.00 0.00 H new ATOM 2211 N LEU A 137 9.841 10.149 4.780 1.00 0.00 N ATOM 2212 CA LEU A 137 9.555 9.847 3.383 1.00 0.00 C ATOM 2213 C LEU A 137 8.404 10.701 2.907 1.00 0.00 C ATOM 2214 O LEU A 137 7.723 11.233 3.714 1.00 0.00 O ATOM 2215 CB LEU A 137 9.327 8.356 3.178 1.00 0.00 C ATOM 2216 CG LEU A 137 10.568 7.479 3.415 1.00 0.00 C ATOM 2217 CD1 LEU A 137 10.231 6.024 3.316 1.00 0.00 C ATOM 2218 CD2 LEU A 137 11.665 7.812 2.421 1.00 0.00 C ATOM 0 H LEU A 137 9.593 9.405 5.432 1.00 0.00 H new ATOM 0 HA LEU A 137 10.420 10.097 2.768 1.00 0.00 H new ATOM 0 HB2 LEU A 137 8.533 8.028 3.849 1.00 0.00 H new ATOM 0 HB3 LEU A 137 8.972 8.193 2.160 1.00 0.00 H new ATOM 0 HG LEU A 137 10.924 7.689 4.424 1.00 0.00 H new ATOM 0 HD11 LEU A 137 11.129 5.430 3.488 1.00 0.00 H new ATOM 0 HD12 LEU A 137 9.480 5.773 4.065 1.00 0.00 H new ATOM 0 HD13 LEU A 137 9.838 5.808 2.322 1.00 0.00 H new ATOM 0 HD21 LEU A 137 12.532 7.178 2.610 1.00 0.00 H new ATOM 0 HD22 LEU A 137 11.303 7.639 1.408 1.00 0.00 H new ATOM 0 HD23 LEU A 137 11.950 8.858 2.531 1.00 0.00 H new ATOM 2230 N ASN A 138 8.180 10.771 1.610 1.00 0.00 N ATOM 2231 CA ASN A 138 7.287 11.786 0.953 1.00 0.00 C ATOM 2232 C ASN A 138 6.056 12.313 1.747 1.00 0.00 C ATOM 2233 O ASN A 138 5.895 13.524 1.849 1.00 0.00 O ATOM 2234 CB ASN A 138 6.920 11.417 -0.490 1.00 0.00 C ATOM 2235 CG ASN A 138 5.995 10.239 -0.628 1.00 0.00 C ATOM 2236 OD1 ASN A 138 4.781 10.411 -0.692 1.00 0.00 O ATOM 2237 ND2 ASN A 138 6.541 9.053 -0.676 1.00 0.00 N ATOM 0 H ASN A 138 8.607 10.126 0.945 1.00 0.00 H new ATOM 0 HA ASN A 138 7.944 12.656 0.943 1.00 0.00 H new ATOM 0 HB2 ASN A 138 6.456 12.282 -0.964 1.00 0.00 H new ATOM 0 HB3 ASN A 138 7.837 11.206 -1.040 1.00 0.00 H new ATOM 0 HD21 ASN A 138 5.953 8.225 -0.770 1.00 0.00 H new ATOM 0 HD22 ASN A 138 7.555 8.956 -0.619 1.00 0.00 H new ATOM 2244 N ILE A 139 5.203 11.459 2.327 1.00 0.00 N ATOM 2245 CA ILE A 139 4.050 12.016 3.070 1.00 0.00 C ATOM 2246 C ILE A 139 4.432 12.467 4.494 1.00 0.00 C ATOM 2247 O ILE A 139 3.685 13.199 5.159 1.00 0.00 O ATOM 2248 CB ILE A 139 2.813 11.082 3.159 1.00 0.00 C ATOM 2249 CG1 ILE A 139 3.124 9.810 3.955 1.00 0.00 C ATOM 2250 CG2 ILE A 139 2.281 10.760 1.778 1.00 0.00 C ATOM 2251 CD1 ILE A 139 1.944 8.883 4.120 1.00 0.00 C ATOM 0 H ILE A 139 5.273 10.442 2.306 1.00 0.00 H new ATOM 0 HA ILE A 139 3.761 12.877 2.468 1.00 0.00 H new ATOM 0 HB ILE A 139 2.031 11.614 3.701 1.00 0.00 H new ATOM 0 HG12 ILE A 139 3.930 9.270 3.457 1.00 0.00 H new ATOM 0 HG13 ILE A 139 3.492 10.092 4.942 1.00 0.00 H new ATOM 0 HG21 ILE A 139 1.415 10.104 1.866 1.00 0.00 H new ATOM 0 HG22 ILE A 139 1.989 11.683 1.276 1.00 0.00 H new ATOM 0 HG23 ILE A 139 3.056 10.261 1.197 1.00 0.00 H new ATOM 0 HD11 ILE A 139 2.247 8.007 4.694 1.00 0.00 H new ATOM 0 HD12 ILE A 139 1.144 9.403 4.646 1.00 0.00 H new ATOM 0 HD13 ILE A 139 1.588 8.568 3.139 1.00 0.00 H new ATOM 2263 N TRP A 140 5.580 12.035 4.940 1.00 0.00 N ATOM 2264 CA TRP A 140 6.097 12.346 6.261 1.00 0.00 C ATOM 2265 C TRP A 140 7.200 13.390 6.134 1.00 0.00 C ATOM 2266 O TRP A 140 7.787 13.832 7.123 1.00 0.00 O ATOM 2267 CB TRP A 140 6.664 11.082 6.922 1.00 0.00 C ATOM 2268 CG TRP A 140 5.693 9.944 6.981 1.00 0.00 C ATOM 2269 CD1 TRP A 140 5.726 8.804 6.238 1.00 0.00 C ATOM 2270 CD2 TRP A 140 4.532 9.848 7.809 1.00 0.00 C ATOM 2271 NE1 TRP A 140 4.668 7.994 6.568 1.00 0.00 N ATOM 2272 CE2 TRP A 140 3.919 8.614 7.525 1.00 0.00 C ATOM 2273 CE3 TRP A 140 3.953 10.683 8.767 1.00 0.00 C ATOM 2274 CZ2 TRP A 140 2.762 8.195 8.165 1.00 0.00 C ATOM 2275 CZ3 TRP A 140 2.804 10.266 9.399 1.00 0.00 C ATOM 2276 CH2 TRP A 140 2.217 9.033 9.095 1.00 0.00 C ATOM 0 H TRP A 140 6.202 11.443 4.389 1.00 0.00 H new ATOM 0 HA TRP A 140 5.287 12.733 6.879 1.00 0.00 H new ATOM 0 HB2 TRP A 140 7.551 10.763 6.374 1.00 0.00 H new ATOM 0 HB3 TRP A 140 6.986 11.326 7.934 1.00 0.00 H new ATOM 0 HD1 TRP A 140 6.476 8.571 5.496 1.00 0.00 H new ATOM 0 HE1 TRP A 140 4.474 7.078 6.164 1.00 0.00 H new ATOM 0 HE3 TRP A 140 4.398 11.637 9.007 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 2.309 7.242 7.936 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 2.347 10.902 10.143 1.00 0.00 H new ATOM 0 HH2 TRP A 140 1.313 8.738 9.607 1.00 0.00 H new ATOM 2287 N SER A 141 7.486 13.743 4.901 1.00 0.00 N ATOM 2288 CA SER A 141 8.485 14.714 4.571 1.00 0.00 C ATOM 2289 C SER A 141 7.969 16.091 4.929 1.00 0.00 C ATOM 2290 O SER A 141 6.752 16.324 4.920 1.00 0.00 O ATOM 2291 CB SER A 141 8.843 14.603 3.070 1.00 0.00 C ATOM 2292 OG SER A 141 9.863 15.516 2.674 1.00 0.00 O ATOM 0 H SER A 141 7.015 13.349 4.086 1.00 0.00 H new ATOM 0 HA SER A 141 9.397 14.533 5.140 1.00 0.00 H new ATOM 0 HB2 SER A 141 9.169 13.586 2.854 1.00 0.00 H new ATOM 0 HB3 SER A 141 7.949 14.784 2.474 1.00 0.00 H new ATOM 0 HG SER A 141 10.051 15.402 1.719 1.00 0.00 H new