USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 846 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 106 CYS SG : rot -67:sc= -6.18! USER MOD Set 1.2: A 107 LYS NZ :NH3+ -112:sc= 2.41 (180deg=-0.0216) USER MOD Set 2.1: A 34 LYS NZ :NH3+ -153:sc= 1.45 (180deg=1.11) USER MOD Set 2.2: A 96 MET CE :methyl -173:sc= -0.514 (180deg=-0.562) USER MOD Set 2.3: A 102 CYS SG : rot -60:sc= -9.53! USER MOD Set 3.1: A 55 HIS : no HD1:sc= -2.7! K(o=-2.4!,f=-3.2) USER MOD Set 3.2: A 69 SER OG : rot -25:sc= 0.277 USER MOD Single : A 37 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.19) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot -7:sc= 1.27 USER MOD Single : A 45 THR OG1 : rot -85:sc= 0.76 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0.265 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ -132:sc= 0.0323 (180deg=-0.723) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot -70:sc= 0.147 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= -0.171 X(o=-0.17,f=-0.35) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 148 N GLY A 31 -1.377 10.924 8.135 1.00 0.00 N ATOM 149 CA GLY A 31 -0.699 11.172 6.813 1.00 0.00 C ATOM 150 C GLY A 31 -0.913 10.205 5.638 1.00 0.00 C ATOM 151 O GLY A 31 -0.186 10.331 4.648 1.00 0.00 O ATOM 0 HA2 GLY A 31 -1.003 12.163 6.475 1.00 0.00 H new ATOM 0 HA3 GLY A 31 0.373 11.216 7.004 1.00 0.00 H new ATOM 155 N VAL A 32 -1.902 9.299 5.712 1.00 0.00 N ATOM 156 CA VAL A 32 -1.989 8.169 4.718 1.00 0.00 C ATOM 157 C VAL A 32 -3.313 7.338 4.734 1.00 0.00 C ATOM 158 O VAL A 32 -3.872 7.039 5.788 1.00 0.00 O ATOM 159 CB VAL A 32 -0.848 7.057 4.926 1.00 0.00 C ATOM 160 CG1 VAL A 32 -0.824 5.987 3.800 1.00 0.00 C ATOM 161 CG2 VAL A 32 0.593 7.495 5.060 1.00 0.00 C ATOM 0 H VAL A 32 -2.639 9.307 6.417 1.00 0.00 H new ATOM 0 HA VAL A 32 -1.897 8.723 3.784 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.176 6.685 5.897 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -0.031 5.266 4.000 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -1.784 5.471 3.767 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -0.640 6.472 2.841 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.228 6.620 5.194 1.00 0.00 H new ATOM 0 HG22 VAL A 32 0.896 8.029 4.160 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.695 8.152 5.923 1.00 0.00 H new ATOM 171 N LEU A 33 -3.745 6.894 3.533 1.00 0.00 N ATOM 172 CA LEU A 33 -4.799 5.843 3.364 1.00 0.00 C ATOM 173 C LEU A 33 -4.695 5.148 1.962 1.00 0.00 C ATOM 174 O LEU A 33 -3.553 4.960 1.509 1.00 0.00 O ATOM 175 CB LEU A 33 -6.210 6.066 3.991 1.00 0.00 C ATOM 176 CG LEU A 33 -6.986 4.832 4.525 1.00 0.00 C ATOM 177 CD1 LEU A 33 -6.206 3.917 5.488 1.00 0.00 C ATOM 178 CD2 LEU A 33 -8.232 5.330 5.272 1.00 0.00 C ATOM 0 H LEU A 33 -3.380 7.247 2.649 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.541 5.073 4.091 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -6.099 6.770 4.816 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.834 6.550 3.240 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.210 4.230 3.645 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.843 3.088 5.798 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.322 3.526 4.983 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.900 4.488 6.365 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -8.792 4.477 5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -7.928 5.967 6.102 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -8.862 5.900 4.589 1.00 0.00 H new ATOM 190 N LYS A 34 -5.788 4.781 1.237 1.00 0.00 N ATOM 191 CA LYS A 34 -5.605 3.954 -0.004 1.00 0.00 C ATOM 192 C LYS A 34 -6.744 4.059 -1.067 1.00 0.00 C ATOM 193 O LYS A 34 -7.908 4.317 -0.754 1.00 0.00 O ATOM 194 CB LYS A 34 -5.428 2.431 0.361 1.00 0.00 C ATOM 195 CG LYS A 34 -4.186 2.004 1.186 1.00 0.00 C ATOM 196 CD LYS A 34 -3.759 0.529 1.054 1.00 0.00 C ATOM 197 CE LYS A 34 -3.102 0.222 -0.302 1.00 0.00 C ATOM 198 NZ LYS A 34 -2.340 -1.039 -0.252 1.00 0.00 N ATOM 0 H LYS A 34 -6.752 5.023 1.465 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.710 4.376 -0.460 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -6.315 2.118 0.912 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -5.416 1.867 -0.571 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -3.346 2.632 0.891 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -4.385 2.211 2.238 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -3.062 0.283 1.855 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -4.632 -0.111 1.184 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -3.869 0.156 -1.074 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -2.438 1.040 -0.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -1.572 -1.009 -0.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -1.937 -1.163 0.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -2.973 -1.836 -0.467 1.00 0.00 H new ATOM 211 N VAL A 35 -6.406 3.769 -2.332 1.00 0.00 N ATOM 212 CA VAL A 35 -7.400 3.725 -3.460 1.00 0.00 C ATOM 213 C VAL A 35 -7.745 2.220 -3.722 1.00 0.00 C ATOM 214 O VAL A 35 -6.895 1.498 -4.258 1.00 0.00 O ATOM 215 CB VAL A 35 -6.863 4.375 -4.784 1.00 0.00 C ATOM 216 CG1 VAL A 35 -7.948 4.512 -5.879 1.00 0.00 C ATOM 217 CG2 VAL A 35 -6.186 5.750 -4.654 1.00 0.00 C ATOM 0 H VAL A 35 -5.451 3.558 -2.620 1.00 0.00 H new ATOM 0 HA VAL A 35 -8.276 4.304 -3.168 1.00 0.00 H new ATOM 0 HB VAL A 35 -6.096 3.653 -5.064 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.512 4.968 -6.768 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.337 3.526 -6.131 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -8.760 5.139 -5.510 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -5.860 6.089 -5.637 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.895 6.467 -4.239 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -5.323 5.670 -3.993 1.00 0.00 H new ATOM 227 N ILE A 36 -8.951 1.728 -3.372 1.00 0.00 N ATOM 228 CA ILE A 36 -9.306 0.285 -3.614 1.00 0.00 C ATOM 229 C ILE A 36 -9.709 -0.020 -5.097 1.00 0.00 C ATOM 230 O ILE A 36 -10.635 0.581 -5.649 1.00 0.00 O ATOM 231 CB ILE A 36 -10.205 -0.413 -2.503 1.00 0.00 C ATOM 232 CG1 ILE A 36 -9.335 -1.148 -1.432 1.00 0.00 C ATOM 233 CG2 ILE A 36 -11.285 -1.406 -3.016 1.00 0.00 C ATOM 234 CD1 ILE A 36 -8.642 -2.461 -1.883 1.00 0.00 C ATOM 0 H ILE A 36 -9.688 2.279 -2.932 1.00 0.00 H new ATOM 0 HA ILE A 36 -8.360 -0.239 -3.473 1.00 0.00 H new ATOM 0 HB ILE A 36 -10.742 0.431 -2.070 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -8.565 -0.458 -1.086 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -9.969 -1.374 -0.575 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -11.833 -1.817 -2.168 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -11.977 -0.882 -3.676 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -10.804 -2.216 -3.564 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.070 -2.874 -1.052 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -9.397 -3.182 -2.197 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -7.972 -2.251 -2.716 1.00 0.00 H new ATOM 246 N LYS A 37 -9.009 -0.995 -5.706 1.00 0.00 N ATOM 247 CA LYS A 37 -9.340 -1.499 -7.069 1.00 0.00 C ATOM 248 C LYS A 37 -9.903 -2.966 -6.995 1.00 0.00 C ATOM 249 O LYS A 37 -10.995 -3.273 -7.478 1.00 0.00 O ATOM 250 CB LYS A 37 -8.069 -1.328 -7.952 1.00 0.00 C ATOM 251 CG LYS A 37 -8.255 -1.864 -9.388 1.00 0.00 C ATOM 252 CD LYS A 37 -7.119 -1.505 -10.372 1.00 0.00 C ATOM 253 CE LYS A 37 -5.856 -2.379 -10.268 1.00 0.00 C ATOM 254 NZ LYS A 37 -6.095 -3.723 -10.835 1.00 0.00 N ATOM 0 H LYS A 37 -8.205 -1.457 -5.280 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.143 -0.927 -7.534 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -7.803 -0.272 -7.996 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -7.234 -1.847 -7.482 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.349 -2.949 -9.345 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.194 -1.478 -9.785 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -7.506 -1.575 -11.389 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -6.835 -0.465 -10.210 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -5.032 -1.899 -10.796 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -5.556 -2.469 -9.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -5.187 -4.215 -10.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -6.701 -4.269 -10.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -6.566 -3.632 -11.758 1.00 0.00 H new ATOM 267 N ARG A 38 -9.113 -3.861 -6.400 1.00 0.00 N ATOM 268 CA ARG A 38 -9.418 -5.292 -6.216 1.00 0.00 C ATOM 269 C ARG A 38 -9.562 -5.451 -4.633 1.00 0.00 C ATOM 270 O ARG A 38 -8.559 -5.483 -3.917 1.00 0.00 O ATOM 271 CB ARG A 38 -8.214 -5.993 -6.903 1.00 0.00 C ATOM 272 CG ARG A 38 -8.368 -7.498 -7.194 1.00 0.00 C ATOM 273 CD ARG A 38 -7.025 -8.135 -7.586 1.00 0.00 C ATOM 274 NE ARG A 38 -7.181 -9.610 -7.563 1.00 0.00 N ATOM 275 CZ ARG A 38 -6.196 -10.488 -7.426 1.00 0.00 C ATOM 276 NH1 ARG A 38 -4.934 -10.180 -7.350 1.00 0.00 N ATOM 277 NH2 ARG A 38 -6.520 -11.729 -7.356 1.00 0.00 N ATOM 0 H ARG A 38 -8.204 -3.604 -6.015 1.00 0.00 H new ATOM 0 HA ARG A 38 -10.324 -5.718 -6.647 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -8.014 -5.482 -7.845 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -7.335 -5.856 -6.273 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -8.768 -8.001 -6.313 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -9.089 -7.642 -7.998 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -6.723 -7.801 -8.579 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -6.242 -7.826 -6.893 1.00 0.00 H new ATOM 0 HE ARG A 38 -8.126 -9.981 -7.661 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -4.644 -9.203 -7.395 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -4.235 -10.915 -7.245 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -7.501 -12.004 -7.406 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -5.796 -12.440 -7.250 1.00 0.00 H new ATOM 290 N GLU A 39 -10.789 -5.444 -4.074 1.00 0.00 N ATOM 291 CA GLU A 39 -11.096 -5.536 -2.592 1.00 0.00 C ATOM 292 C GLU A 39 -10.280 -6.448 -1.590 1.00 0.00 C ATOM 293 O GLU A 39 -9.536 -5.947 -0.746 1.00 0.00 O ATOM 294 CB GLU A 39 -12.628 -5.825 -2.448 1.00 0.00 C ATOM 295 CG GLU A 39 -13.593 -4.851 -3.157 1.00 0.00 C ATOM 296 CD GLU A 39 -15.060 -5.022 -2.782 1.00 0.00 C ATOM 297 OE1 GLU A 39 -15.616 -4.391 -1.891 1.00 0.00 O ATOM 298 OE2 GLU A 39 -15.687 -5.953 -3.549 1.00 0.00 O ATOM 0 H GLU A 39 -11.634 -5.373 -4.640 1.00 0.00 H new ATOM 0 HA GLU A 39 -10.736 -4.568 -2.244 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -12.821 -6.829 -2.827 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -12.873 -5.832 -1.386 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -13.290 -3.829 -2.927 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -13.490 -4.979 -4.235 1.00 0.00 H new ATOM 306 N GLY A 40 -10.493 -7.765 -1.637 1.00 0.00 N ATOM 307 CA GLY A 40 -9.931 -8.753 -0.686 1.00 0.00 C ATOM 308 C GLY A 40 -10.446 -10.202 -0.878 1.00 0.00 C ATOM 309 O GLY A 40 -11.474 -10.421 -1.526 1.00 0.00 O ATOM 0 H GLY A 40 -11.076 -8.195 -2.354 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -8.845 -8.752 -0.782 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -10.162 -8.431 0.330 1.00 0.00 H new ATOM 313 N THR A 41 -9.763 -11.209 -0.301 1.00 0.00 N ATOM 314 CA THR A 41 -10.200 -12.643 -0.447 1.00 0.00 C ATOM 315 C THR A 41 -9.940 -13.589 0.776 1.00 0.00 C ATOM 316 O THR A 41 -10.884 -13.959 1.481 1.00 0.00 O ATOM 317 CB THR A 41 -9.819 -13.246 -1.847 1.00 0.00 C ATOM 318 OG1 THR A 41 -10.362 -14.552 -1.985 1.00 0.00 O ATOM 319 CG2 THR A 41 -8.334 -13.358 -2.233 1.00 0.00 C ATOM 0 H THR A 41 -8.922 -11.079 0.262 1.00 0.00 H new ATOM 0 HA THR A 41 -11.288 -12.588 -0.425 1.00 0.00 H new ATOM 0 HB THR A 41 -10.239 -12.496 -2.517 1.00 0.00 H new ATOM 0 HG1 THR A 41 -10.119 -14.916 -2.862 1.00 0.00 H new ATOM 0 HG21 THR A 41 -8.249 -13.794 -3.228 1.00 0.00 H new ATOM 0 HG22 THR A 41 -7.882 -12.366 -2.231 1.00 0.00 H new ATOM 0 HG23 THR A 41 -7.818 -13.993 -1.513 1.00 0.00 H new ATOM 327 N GLY A 42 -8.687 -13.977 1.060 1.00 0.00 N ATOM 328 CA GLY A 42 -8.364 -14.978 2.114 1.00 0.00 C ATOM 329 C GLY A 42 -8.368 -14.583 3.604 1.00 0.00 C ATOM 330 O GLY A 42 -7.322 -14.605 4.250 1.00 0.00 O ATOM 0 H GLY A 42 -7.867 -13.614 0.574 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -9.068 -15.803 1.999 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.373 -15.371 1.889 1.00 0.00 H new ATOM 334 N THR A 43 -9.549 -14.311 4.167 1.00 0.00 N ATOM 335 CA THR A 43 -9.729 -13.906 5.603 1.00 0.00 C ATOM 336 C THR A 43 -9.184 -12.472 5.944 1.00 0.00 C ATOM 337 O THR A 43 -8.294 -12.283 6.774 1.00 0.00 O ATOM 338 CB THR A 43 -9.289 -14.994 6.632 1.00 0.00 C ATOM 339 OG1 THR A 43 -7.964 -15.498 6.670 1.00 0.00 O ATOM 340 CG2 THR A 43 -10.149 -16.274 6.543 1.00 0.00 C ATOM 0 H THR A 43 -10.428 -14.360 3.651 1.00 0.00 H new ATOM 0 HA THR A 43 -10.810 -13.828 5.718 1.00 0.00 H new ATOM 0 HB THR A 43 -9.412 -14.370 7.517 1.00 0.00 H new ATOM 0 HG1 THR A 43 -7.457 -15.144 5.910 1.00 0.00 H new ATOM 0 HG21 THR A 43 -9.801 -16.998 7.280 1.00 0.00 H new ATOM 0 HG22 THR A 43 -11.192 -16.026 6.742 1.00 0.00 H new ATOM 0 HG23 THR A 43 -10.062 -16.702 5.544 1.00 0.00 H new ATOM 348 N GLU A 44 -9.782 -11.465 5.280 1.00 0.00 N ATOM 349 CA GLU A 44 -9.497 -10.007 5.449 1.00 0.00 C ATOM 350 C GLU A 44 -8.052 -9.509 5.858 1.00 0.00 C ATOM 351 O GLU A 44 -7.122 -9.644 5.063 1.00 0.00 O ATOM 352 CB GLU A 44 -10.715 -9.365 6.189 1.00 0.00 C ATOM 353 CG GLU A 44 -11.080 -9.991 7.562 1.00 0.00 C ATOM 354 CD GLU A 44 -11.886 -9.090 8.488 1.00 0.00 C ATOM 355 OE1 GLU A 44 -13.095 -9.189 8.661 1.00 0.00 O ATOM 356 OE2 GLU A 44 -11.107 -8.162 9.103 1.00 0.00 O ATOM 0 H GLU A 44 -10.506 -11.639 4.583 1.00 0.00 H new ATOM 0 HA GLU A 44 -9.405 -9.601 4.442 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -10.508 -8.305 6.338 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -11.587 -9.431 5.538 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -11.646 -10.906 7.388 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -10.159 -10.277 8.070 1.00 0.00 H new ATOM 364 N THR A 45 -7.864 -8.929 7.053 1.00 0.00 N ATOM 365 CA THR A 45 -6.584 -8.330 7.510 1.00 0.00 C ATOM 366 C THR A 45 -6.412 -8.493 9.062 1.00 0.00 C ATOM 367 O THR A 45 -7.293 -7.969 9.764 1.00 0.00 O ATOM 368 CB THR A 45 -6.663 -6.799 7.253 1.00 0.00 C ATOM 369 OG1 THR A 45 -7.081 -6.462 5.937 1.00 0.00 O ATOM 370 CG2 THR A 45 -5.337 -6.066 7.439 1.00 0.00 C ATOM 0 H THR A 45 -8.607 -8.858 7.748 1.00 0.00 H new ATOM 0 HA THR A 45 -5.764 -8.818 6.983 1.00 0.00 H new ATOM 0 HB THR A 45 -7.394 -6.486 7.999 1.00 0.00 H new ATOM 0 HG1 THR A 45 -6.306 -6.461 5.338 1.00 0.00 H new ATOM 0 HG21 THR A 45 -5.478 -5.003 7.241 1.00 0.00 H new ATOM 0 HG22 THR A 45 -4.987 -6.201 8.462 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.598 -6.469 6.746 1.00 0.00 H new ATOM 378 N PRO A 46 -5.351 -9.130 9.655 1.00 0.00 N ATOM 379 CA PRO A 46 -5.297 -9.158 11.152 1.00 0.00 C ATOM 380 C PRO A 46 -4.217 -8.450 12.044 1.00 0.00 C ATOM 381 O PRO A 46 -4.683 -7.910 13.060 1.00 0.00 O ATOM 382 CB PRO A 46 -5.624 -10.620 11.406 1.00 0.00 C ATOM 383 CG PRO A 46 -4.757 -11.341 10.385 1.00 0.00 C ATOM 384 CD PRO A 46 -4.960 -10.476 9.141 1.00 0.00 C ATOM 0 HA PRO A 46 -5.969 -8.401 11.557 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -5.380 -10.918 12.426 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -6.683 -10.829 11.257 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.711 -11.380 10.690 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -5.081 -12.369 10.226 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.047 -10.420 8.548 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.735 -10.891 8.496 1.00 0.00 H new ATOM 392 N MET A 47 -2.870 -8.364 11.828 1.00 0.00 N ATOM 393 CA MET A 47 -2.023 -7.728 12.927 1.00 0.00 C ATOM 394 C MET A 47 -0.612 -7.040 12.776 1.00 0.00 C ATOM 395 O MET A 47 0.161 -7.253 11.845 1.00 0.00 O ATOM 396 CB MET A 47 -1.918 -8.783 14.097 1.00 0.00 C ATOM 397 CG MET A 47 -1.288 -10.141 13.711 1.00 0.00 C ATOM 398 SD MET A 47 -0.618 -10.962 15.171 1.00 0.00 S ATOM 399 CE MET A 47 0.959 -11.531 14.515 1.00 0.00 C ATOM 0 H MET A 47 -2.371 -8.686 10.998 1.00 0.00 H new ATOM 0 HA MET A 47 -2.599 -6.809 13.033 1.00 0.00 H new ATOM 0 HB2 MET A 47 -1.332 -8.346 14.905 1.00 0.00 H new ATOM 0 HB3 MET A 47 -2.918 -8.964 14.491 1.00 0.00 H new ATOM 0 HG2 MET A 47 -2.038 -10.777 13.241 1.00 0.00 H new ATOM 0 HG3 MET A 47 -0.497 -9.986 12.978 1.00 0.00 H new ATOM 0 HE1 MET A 47 1.506 -12.063 15.293 1.00 0.00 H new ATOM 0 HE2 MET A 47 0.783 -12.200 13.673 1.00 0.00 H new ATOM 0 HE3 MET A 47 1.545 -10.674 14.181 1.00 0.00 H new ATOM 409 N ILE A 48 -0.247 -6.201 13.791 1.00 0.00 N ATOM 410 CA ILE A 48 1.122 -5.620 13.945 1.00 0.00 C ATOM 411 C ILE A 48 2.095 -6.839 14.241 1.00 0.00 C ATOM 412 O ILE A 48 1.748 -7.787 14.959 1.00 0.00 O ATOM 413 CB ILE A 48 1.150 -4.437 14.991 1.00 0.00 C ATOM 414 CG1 ILE A 48 2.157 -3.274 14.722 1.00 0.00 C ATOM 415 CG2 ILE A 48 1.427 -4.914 16.434 1.00 0.00 C ATOM 416 CD1 ILE A 48 2.103 -2.600 13.340 1.00 0.00 C ATOM 0 H ILE A 48 -0.893 -5.909 14.524 1.00 0.00 H new ATOM 0 HA ILE A 48 1.469 -5.125 13.038 1.00 0.00 H new ATOM 0 HB ILE A 48 0.141 -4.045 14.866 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.995 -2.506 15.478 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.166 -3.660 14.870 1.00 0.00 H new ATOM 0 HG21 ILE A 48 1.434 -4.056 17.106 1.00 0.00 H new ATOM 0 HG22 ILE A 48 0.648 -5.610 16.743 1.00 0.00 H new ATOM 0 HG23 ILE A 48 2.395 -5.413 16.473 1.00 0.00 H new ATOM 0 HD11 ILE A 48 2.854 -1.812 13.290 1.00 0.00 H new ATOM 0 HD12 ILE A 48 2.302 -3.341 12.566 1.00 0.00 H new ATOM 0 HD13 ILE A 48 1.114 -2.169 13.184 1.00 0.00 H new ATOM 428 N GLY A 49 3.298 -6.828 13.683 1.00 0.00 N ATOM 429 CA GLY A 49 4.221 -8.004 13.764 1.00 0.00 C ATOM 430 C GLY A 49 3.913 -9.203 12.803 1.00 0.00 C ATOM 431 O GLY A 49 4.616 -10.214 12.877 1.00 0.00 O ATOM 0 H GLY A 49 3.676 -6.033 13.167 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.234 -7.657 13.562 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.210 -8.376 14.788 1.00 0.00 H new ATOM 435 N ASP A 50 2.899 -9.135 11.908 1.00 0.00 N ATOM 436 CA ASP A 50 2.553 -10.220 10.947 1.00 0.00 C ATOM 437 C ASP A 50 3.619 -10.307 9.808 1.00 0.00 C ATOM 438 O ASP A 50 4.079 -9.271 9.319 1.00 0.00 O ATOM 439 CB ASP A 50 1.155 -9.837 10.385 1.00 0.00 C ATOM 440 CG ASP A 50 0.138 -10.887 10.022 1.00 0.00 C ATOM 441 OD1 ASP A 50 -1.072 -10.726 10.200 1.00 0.00 O ATOM 442 OD2 ASP A 50 0.703 -11.980 9.442 1.00 0.00 O ATOM 0 H ASP A 50 2.290 -8.320 11.829 1.00 0.00 H new ATOM 0 HA ASP A 50 2.537 -11.201 11.423 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.686 -9.183 11.120 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.326 -9.239 9.490 1.00 0.00 H new ATOM 448 N ARG A 51 3.985 -11.513 9.355 1.00 0.00 N ATOM 449 CA ARG A 51 5.032 -11.665 8.291 1.00 0.00 C ATOM 450 C ARG A 51 4.344 -11.539 6.900 1.00 0.00 C ATOM 451 O ARG A 51 3.704 -12.483 6.438 1.00 0.00 O ATOM 452 CB ARG A 51 5.788 -12.998 8.537 1.00 0.00 C ATOM 453 CG ARG A 51 7.053 -13.217 7.672 1.00 0.00 C ATOM 454 CD ARG A 51 8.247 -12.321 8.055 1.00 0.00 C ATOM 455 NE ARG A 51 9.426 -12.665 7.217 1.00 0.00 N ATOM 456 CZ ARG A 51 9.737 -12.117 6.047 1.00 0.00 C ATOM 457 NH1 ARG A 51 9.042 -11.194 5.460 1.00 0.00 N ATOM 458 NH2 ARG A 51 10.797 -12.537 5.455 1.00 0.00 N ATOM 0 H ARG A 51 3.591 -12.392 9.690 1.00 0.00 H new ATOM 0 HA ARG A 51 5.788 -10.881 8.321 1.00 0.00 H new ATOM 0 HB2 ARG A 51 6.075 -13.044 9.587 1.00 0.00 H new ATOM 0 HB3 ARG A 51 5.100 -13.824 8.358 1.00 0.00 H new ATOM 0 HG2 ARG A 51 7.357 -14.261 7.752 1.00 0.00 H new ATOM 0 HG3 ARG A 51 6.800 -13.038 6.627 1.00 0.00 H new ATOM 0 HD2 ARG A 51 7.985 -11.272 7.917 1.00 0.00 H new ATOM 0 HD3 ARG A 51 8.488 -12.453 9.110 1.00 0.00 H new ATOM 0 HE ARG A 51 10.053 -13.387 7.572 1.00 0.00 H new ATOM 0 HH11 ARG A 51 8.191 -10.840 5.898 1.00 0.00 H new ATOM 0 HH12 ARG A 51 9.346 -10.822 4.560 1.00 0.00 H new ATOM 0 HH21 ARG A 51 11.366 -13.266 5.885 1.00 0.00 H new ATOM 0 HH22 ARG A 51 11.069 -12.141 4.555 1.00 0.00 H new ATOM 471 N VAL A 52 4.458 -10.364 6.266 1.00 0.00 N ATOM 472 CA VAL A 52 3.683 -10.015 5.042 1.00 0.00 C ATOM 473 C VAL A 52 4.540 -10.135 3.739 1.00 0.00 C ATOM 474 O VAL A 52 5.686 -9.669 3.691 1.00 0.00 O ATOM 475 CB VAL A 52 2.968 -8.613 5.264 1.00 0.00 C ATOM 476 CG1 VAL A 52 2.373 -8.358 6.675 1.00 0.00 C ATOM 477 CG2 VAL A 52 3.808 -7.373 4.922 1.00 0.00 C ATOM 0 H VAL A 52 5.085 -9.622 6.577 1.00 0.00 H new ATOM 0 HA VAL A 52 2.892 -10.746 4.878 1.00 0.00 H new ATOM 0 HB VAL A 52 2.159 -8.731 4.543 1.00 0.00 H new ATOM 0 HG11 VAL A 52 1.913 -7.370 6.703 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.620 -9.115 6.895 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.167 -8.409 7.420 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.222 -6.473 5.111 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.705 -7.359 5.541 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.094 -7.406 3.871 1.00 0.00 H new ATOM 487 N PHE A 53 3.971 -10.707 2.661 1.00 0.00 N ATOM 488 CA PHE A 53 4.698 -10.924 1.389 1.00 0.00 C ATOM 489 C PHE A 53 4.033 -10.020 0.303 1.00 0.00 C ATOM 490 O PHE A 53 2.928 -10.279 -0.186 1.00 0.00 O ATOM 491 CB PHE A 53 4.703 -12.450 1.098 1.00 0.00 C ATOM 492 CG PHE A 53 5.208 -13.385 2.228 1.00 0.00 C ATOM 493 CD1 PHE A 53 6.558 -13.392 2.591 1.00 0.00 C ATOM 494 CD2 PHE A 53 4.291 -14.121 2.991 1.00 0.00 C ATOM 495 CE1 PHE A 53 6.991 -14.139 3.684 1.00 0.00 C ATOM 496 CE2 PHE A 53 4.725 -14.869 4.084 1.00 0.00 C ATOM 497 CZ PHE A 53 6.075 -14.881 4.425 1.00 0.00 C ATOM 0 H PHE A 53 3.004 -11.030 2.643 1.00 0.00 H new ATOM 0 HA PHE A 53 5.747 -10.629 1.416 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.687 -12.748 0.842 1.00 0.00 H new ATOM 0 HB3 PHE A 53 5.319 -12.624 0.215 1.00 0.00 H new ATOM 0 HD1 PHE A 53 7.270 -12.814 2.020 1.00 0.00 H new ATOM 0 HD2 PHE A 53 3.243 -14.108 2.731 1.00 0.00 H new ATOM 0 HE1 PHE A 53 8.036 -14.143 3.956 1.00 0.00 H new ATOM 0 HE2 PHE A 53 4.015 -15.439 4.666 1.00 0.00 H new ATOM 0 HZ PHE A 53 6.413 -15.468 5.267 1.00 0.00 H new ATOM 507 N VAL A 54 4.729 -8.925 -0.024 1.00 0.00 N ATOM 508 CA VAL A 54 4.221 -7.845 -0.918 1.00 0.00 C ATOM 509 C VAL A 54 4.903 -7.784 -2.318 1.00 0.00 C ATOM 510 O VAL A 54 6.033 -8.218 -2.594 1.00 0.00 O ATOM 511 CB VAL A 54 4.402 -6.423 -0.215 1.00 0.00 C ATOM 512 CG1 VAL A 54 3.439 -6.212 0.940 1.00 0.00 C ATOM 513 CG2 VAL A 54 5.845 -6.049 0.126 1.00 0.00 C ATOM 0 H VAL A 54 5.672 -8.750 0.322 1.00 0.00 H new ATOM 0 HA VAL A 54 3.171 -8.087 -1.085 1.00 0.00 H new ATOM 0 HB VAL A 54 4.124 -5.704 -0.985 1.00 0.00 H new ATOM 0 HG11 VAL A 54 3.608 -5.229 1.380 1.00 0.00 H new ATOM 0 HG12 VAL A 54 2.414 -6.275 0.575 1.00 0.00 H new ATOM 0 HG13 VAL A 54 3.603 -6.980 1.696 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.864 -5.067 0.599 1.00 0.00 H new ATOM 0 HG22 VAL A 54 6.261 -6.790 0.809 1.00 0.00 H new ATOM 0 HG23 VAL A 54 6.440 -6.023 -0.787 1.00 0.00 H new ATOM 523 N HIS A 55 4.146 -7.117 -3.180 1.00 0.00 N ATOM 524 CA HIS A 55 4.654 -6.666 -4.501 1.00 0.00 C ATOM 525 C HIS A 55 4.391 -5.158 -4.536 1.00 0.00 C ATOM 526 O HIS A 55 3.231 -4.742 -4.498 1.00 0.00 O ATOM 527 CB HIS A 55 4.038 -7.411 -5.727 1.00 0.00 C ATOM 528 CG HIS A 55 4.323 -6.919 -7.146 1.00 0.00 C ATOM 529 ND1 HIS A 55 5.417 -6.161 -7.542 1.00 0.00 N ATOM 530 CD2 HIS A 55 3.635 -7.425 -8.261 1.00 0.00 C ATOM 531 CE1 HIS A 55 5.321 -6.307 -8.899 1.00 0.00 C ATOM 532 NE2 HIS A 55 4.245 -6.980 -9.429 1.00 0.00 N ATOM 0 H HIS A 55 3.173 -6.868 -3.002 1.00 0.00 H new ATOM 0 HA HIS A 55 5.713 -6.904 -4.596 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.365 -8.449 -5.673 1.00 0.00 H new ATOM 0 HB3 HIS A 55 2.956 -7.411 -5.596 1.00 0.00 H new ATOM 0 HD2 HIS A 55 2.764 -8.063 -8.218 1.00 0.00 H new ATOM 0 HE1 HIS A 55 6.082 -5.898 -9.547 1.00 0.00 H new ATOM 0 HE2 HIS A 55 3.972 -7.115 -10.402 1.00 0.00 H new ATOM 540 N TYR A 56 5.460 -4.353 -4.590 1.00 0.00 N ATOM 541 CA TYR A 56 5.259 -2.868 -4.627 1.00 0.00 C ATOM 542 C TYR A 56 5.710 -2.189 -5.968 1.00 0.00 C ATOM 543 O TYR A 56 6.727 -2.526 -6.576 1.00 0.00 O ATOM 544 CB TYR A 56 5.747 -2.012 -3.414 1.00 0.00 C ATOM 545 CG TYR A 56 7.205 -1.569 -3.395 1.00 0.00 C ATOM 546 CD1 TYR A 56 8.200 -2.485 -3.093 1.00 0.00 C ATOM 547 CD2 TYR A 56 7.547 -0.252 -3.704 1.00 0.00 C ATOM 548 CE1 TYR A 56 9.526 -2.073 -3.013 1.00 0.00 C ATOM 549 CE2 TYR A 56 8.865 0.171 -3.577 1.00 0.00 C ATOM 550 CZ TYR A 56 9.856 -0.738 -3.223 1.00 0.00 C ATOM 551 OH TYR A 56 11.153 -0.323 -3.102 1.00 0.00 O ATOM 0 H TYR A 56 6.431 -4.666 -4.609 1.00 0.00 H new ATOM 0 HA TYR A 56 4.172 -2.853 -4.548 1.00 0.00 H new ATOM 0 HB2 TYR A 56 5.125 -1.118 -3.364 1.00 0.00 H new ATOM 0 HB3 TYR A 56 5.559 -2.583 -2.505 1.00 0.00 H new ATOM 0 HD1 TYR A 56 7.945 -3.520 -2.920 1.00 0.00 H new ATOM 0 HD2 TYR A 56 6.788 0.438 -4.042 1.00 0.00 H new ATOM 0 HE1 TYR A 56 10.301 -2.791 -2.787 1.00 0.00 H new ATOM 0 HE2 TYR A 56 9.119 1.206 -3.753 1.00 0.00 H new ATOM 0 HH TYR A 56 11.207 0.639 -3.283 1.00 0.00 H new ATOM 561 N THR A 57 4.949 -1.173 -6.362 1.00 0.00 N ATOM 562 CA THR A 57 5.357 -0.173 -7.398 1.00 0.00 C ATOM 563 C THR A 57 5.368 1.183 -6.620 1.00 0.00 C ATOM 564 O THR A 57 4.591 1.382 -5.680 1.00 0.00 O ATOM 565 CB THR A 57 4.459 -0.107 -8.669 1.00 0.00 C ATOM 566 OG1 THR A 57 4.158 -1.417 -9.132 1.00 0.00 O ATOM 567 CG2 THR A 57 5.148 0.619 -9.837 1.00 0.00 C ATOM 0 H THR A 57 4.019 -1.001 -5.980 1.00 0.00 H new ATOM 0 HA THR A 57 6.321 -0.449 -7.826 1.00 0.00 H new ATOM 0 HB THR A 57 3.562 0.436 -8.372 1.00 0.00 H new ATOM 0 HG1 THR A 57 3.592 -1.360 -9.930 1.00 0.00 H new ATOM 0 HG21 THR A 57 4.480 0.638 -10.698 1.00 0.00 H new ATOM 0 HG22 THR A 57 5.387 1.640 -9.541 1.00 0.00 H new ATOM 0 HG23 THR A 57 6.066 0.094 -10.101 1.00 0.00 H new ATOM 575 N GLY A 58 6.238 2.133 -6.946 1.00 0.00 N ATOM 576 CA GLY A 58 6.272 3.420 -6.218 1.00 0.00 C ATOM 577 C GLY A 58 6.950 4.581 -6.967 1.00 0.00 C ATOM 578 O GLY A 58 8.009 4.476 -7.590 1.00 0.00 O ATOM 0 H GLY A 58 6.924 2.050 -7.696 1.00 0.00 H new ATOM 0 HA2 GLY A 58 5.249 3.711 -5.980 1.00 0.00 H new ATOM 0 HA3 GLY A 58 6.789 3.269 -5.270 1.00 0.00 H new ATOM 582 N TRP A 59 6.260 5.710 -6.857 1.00 0.00 N ATOM 583 CA TRP A 59 6.570 6.972 -7.517 1.00 0.00 C ATOM 584 C TRP A 59 6.284 8.243 -6.668 1.00 0.00 C ATOM 585 O TRP A 59 5.515 8.235 -5.700 1.00 0.00 O ATOM 586 CB TRP A 59 5.823 7.119 -8.881 1.00 0.00 C ATOM 587 CG TRP A 59 5.062 6.048 -9.687 1.00 0.00 C ATOM 588 CD1 TRP A 59 5.227 5.943 -11.078 1.00 0.00 C ATOM 589 CD2 TRP A 59 4.145 5.056 -9.370 1.00 0.00 C ATOM 590 NE1 TRP A 59 4.631 4.801 -11.609 1.00 0.00 N ATOM 591 CE2 TRP A 59 3.945 4.277 -10.539 1.00 0.00 C ATOM 592 CE3 TRP A 59 3.406 4.765 -8.193 1.00 0.00 C ATOM 593 CZ2 TRP A 59 3.097 3.161 -10.509 1.00 0.00 C ATOM 594 CZ3 TRP A 59 2.516 3.692 -8.211 1.00 0.00 C ATOM 595 CH2 TRP A 59 2.369 2.898 -9.354 1.00 0.00 C ATOM 0 H TRP A 59 5.425 5.773 -6.274 1.00 0.00 H new ATOM 0 HA TRP A 59 7.648 6.916 -7.672 1.00 0.00 H new ATOM 0 HB2 TRP A 59 5.097 7.915 -8.718 1.00 0.00 H new ATOM 0 HB3 TRP A 59 6.573 7.508 -9.570 1.00 0.00 H new ATOM 0 HD1 TRP A 59 5.759 6.670 -11.673 1.00 0.00 H new ATOM 0 HE1 TRP A 59 4.690 4.441 -12.561 1.00 0.00 H new ATOM 0 HE3 TRP A 59 3.531 5.363 -7.302 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 3.011 2.515 -11.370 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 1.932 3.470 -7.330 1.00 0.00 H new ATOM 0 HH2 TRP A 59 1.679 2.067 -9.339 1.00 0.00 H new ATOM 606 N LEU A 60 6.920 9.366 -7.057 1.00 0.00 N ATOM 607 CA LEU A 60 6.619 10.683 -6.439 1.00 0.00 C ATOM 608 C LEU A 60 5.338 11.350 -7.022 1.00 0.00 C ATOM 609 O LEU A 60 4.692 10.801 -7.920 1.00 0.00 O ATOM 610 CB LEU A 60 7.898 11.547 -6.451 1.00 0.00 C ATOM 611 CG LEU A 60 8.472 12.244 -7.715 1.00 0.00 C ATOM 612 CD1 LEU A 60 8.283 13.771 -7.664 1.00 0.00 C ATOM 613 CD2 LEU A 60 9.992 12.002 -7.803 1.00 0.00 C ATOM 0 H LEU A 60 7.635 9.394 -7.784 1.00 0.00 H new ATOM 0 HA LEU A 60 6.345 10.550 -5.392 1.00 0.00 H new ATOM 0 HB2 LEU A 60 7.737 12.336 -5.717 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.696 10.912 -6.067 1.00 0.00 H new ATOM 0 HG LEU A 60 7.938 11.826 -8.569 1.00 0.00 H new ATOM 0 HD11 LEU A 60 8.698 14.219 -8.567 1.00 0.00 H new ATOM 0 HD12 LEU A 60 7.220 14.004 -7.599 1.00 0.00 H new ATOM 0 HD13 LEU A 60 8.797 14.172 -6.790 1.00 0.00 H new ATOM 0 HD21 LEU A 60 10.388 12.494 -8.692 1.00 0.00 H new ATOM 0 HD22 LEU A 60 10.477 12.410 -6.916 1.00 0.00 H new ATOM 0 HD23 LEU A 60 10.187 10.931 -7.863 1.00 0.00 H new ATOM 625 N LEU A 61 4.944 12.535 -6.529 1.00 0.00 N ATOM 626 CA LEU A 61 3.740 13.247 -7.042 1.00 0.00 C ATOM 627 C LEU A 61 3.801 13.739 -8.522 1.00 0.00 C ATOM 628 O LEU A 61 2.750 13.920 -9.140 1.00 0.00 O ATOM 629 CB LEU A 61 3.180 14.251 -5.991 1.00 0.00 C ATOM 630 CG LEU A 61 3.804 15.658 -5.753 1.00 0.00 C ATOM 631 CD1 LEU A 61 5.321 15.655 -5.520 1.00 0.00 C ATOM 632 CD2 LEU A 61 3.452 16.670 -6.856 1.00 0.00 C ATOM 0 H LEU A 61 5.432 13.026 -5.780 1.00 0.00 H new ATOM 0 HA LEU A 61 2.969 12.485 -7.154 1.00 0.00 H new ATOM 0 HB2 LEU A 61 2.133 14.415 -6.245 1.00 0.00 H new ATOM 0 HB3 LEU A 61 3.198 13.737 -5.030 1.00 0.00 H new ATOM 0 HG LEU A 61 3.338 15.979 -4.821 1.00 0.00 H new ATOM 0 HD11 LEU A 61 5.667 16.677 -5.364 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.553 15.055 -4.640 1.00 0.00 H new ATOM 0 HD13 LEU A 61 5.822 15.231 -6.390 1.00 0.00 H new ATOM 0 HD21 LEU A 61 3.917 17.630 -6.631 1.00 0.00 H new ATOM 0 HD22 LEU A 61 3.819 16.305 -7.815 1.00 0.00 H new ATOM 0 HD23 LEU A 61 2.370 16.794 -6.905 1.00 0.00 H new ATOM 644 N ASP A 62 5.007 13.931 -9.102 1.00 0.00 N ATOM 645 CA ASP A 62 5.117 14.094 -10.589 1.00 0.00 C ATOM 646 C ASP A 62 4.903 12.718 -11.379 1.00 0.00 C ATOM 647 O ASP A 62 4.831 12.708 -12.608 1.00 0.00 O ATOM 648 CB ASP A 62 6.518 14.720 -10.833 1.00 0.00 C ATOM 649 CG ASP A 62 6.838 15.098 -12.273 1.00 0.00 C ATOM 650 OD1 ASP A 62 7.703 14.549 -12.946 1.00 0.00 O ATOM 651 OD2 ASP A 62 6.061 16.117 -12.727 1.00 0.00 O ATOM 0 H ASP A 62 5.892 13.977 -8.597 1.00 0.00 H new ATOM 0 HA ASP A 62 4.327 14.737 -10.977 1.00 0.00 H new ATOM 0 HB2 ASP A 62 6.608 15.613 -10.215 1.00 0.00 H new ATOM 0 HB3 ASP A 62 7.274 14.016 -10.486 1.00 0.00 H new ATOM 657 N GLY A 63 4.788 11.574 -10.666 1.00 0.00 N ATOM 658 CA GLY A 63 4.707 10.197 -11.239 1.00 0.00 C ATOM 659 C GLY A 63 6.059 9.652 -11.727 1.00 0.00 C ATOM 660 O GLY A 63 6.114 8.905 -12.705 1.00 0.00 O ATOM 0 H GLY A 63 4.747 11.576 -9.647 1.00 0.00 H new ATOM 0 HA2 GLY A 63 4.304 9.522 -10.484 1.00 0.00 H new ATOM 0 HA3 GLY A 63 4.004 10.200 -12.072 1.00 0.00 H new ATOM 664 N THR A 64 7.151 10.021 -11.044 1.00 0.00 N ATOM 665 CA THR A 64 8.517 9.599 -11.444 1.00 0.00 C ATOM 666 C THR A 64 8.786 8.244 -10.736 1.00 0.00 C ATOM 667 O THR A 64 8.906 8.196 -9.500 1.00 0.00 O ATOM 668 CB THR A 64 9.557 10.696 -11.105 1.00 0.00 C ATOM 669 OG1 THR A 64 9.113 12.014 -11.429 1.00 0.00 O ATOM 670 CG2 THR A 64 10.861 10.479 -11.862 1.00 0.00 C ATOM 0 H THR A 64 7.124 10.610 -10.212 1.00 0.00 H new ATOM 0 HA THR A 64 8.603 9.463 -12.522 1.00 0.00 H new ATOM 0 HB THR A 64 9.701 10.613 -10.028 1.00 0.00 H new ATOM 0 HG1 THR A 64 9.809 12.661 -11.192 1.00 0.00 H new ATOM 0 HG21 THR A 64 11.568 11.266 -11.601 1.00 0.00 H new ATOM 0 HG22 THR A 64 11.281 9.510 -11.593 1.00 0.00 H new ATOM 0 HG23 THR A 64 10.668 10.506 -12.934 1.00 0.00 H new ATOM 678 N LYS A 65 8.809 7.158 -11.532 1.00 0.00 N ATOM 679 CA LYS A 65 8.895 5.783 -10.992 1.00 0.00 C ATOM 680 C LYS A 65 10.328 5.404 -10.453 1.00 0.00 C ATOM 681 O LYS A 65 11.173 4.921 -11.217 1.00 0.00 O ATOM 682 CB LYS A 65 8.418 4.727 -12.027 1.00 0.00 C ATOM 683 CG LYS A 65 8.263 3.306 -11.405 1.00 0.00 C ATOM 684 CD LYS A 65 7.458 2.313 -12.263 1.00 0.00 C ATOM 685 CE LYS A 65 8.207 1.816 -13.509 1.00 0.00 C ATOM 686 NZ LYS A 65 7.406 0.773 -14.180 1.00 0.00 N ATOM 0 H LYS A 65 8.769 7.204 -12.550 1.00 0.00 H new ATOM 0 HA LYS A 65 8.220 5.772 -10.136 1.00 0.00 H new ATOM 0 HB2 LYS A 65 7.463 5.042 -12.448 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.130 4.683 -12.851 1.00 0.00 H new ATOM 0 HG2 LYS A 65 9.255 2.891 -11.228 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.779 3.400 -10.433 1.00 0.00 H new ATOM 0 HD2 LYS A 65 7.186 1.455 -11.649 1.00 0.00 H new ATOM 0 HD3 LYS A 65 6.529 2.789 -12.576 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.389 2.646 -14.192 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.181 1.416 -13.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 7.912 0.436 -15.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.254 -0.022 -13.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 6.487 1.169 -14.463 1.00 0.00 H new ATOM 699 N PHE A 66 10.633 5.604 -9.162 1.00 0.00 N ATOM 700 CA PHE A 66 11.888 5.112 -8.549 1.00 0.00 C ATOM 701 C PHE A 66 11.911 3.562 -8.326 1.00 0.00 C ATOM 702 O PHE A 66 13.020 3.021 -8.271 1.00 0.00 O ATOM 703 CB PHE A 66 12.186 5.909 -7.248 1.00 0.00 C ATOM 704 CG PHE A 66 11.092 5.947 -6.164 1.00 0.00 C ATOM 705 CD1 PHE A 66 10.855 4.850 -5.325 1.00 0.00 C ATOM 706 CD2 PHE A 66 10.268 7.070 -6.074 1.00 0.00 C ATOM 707 CE1 PHE A 66 9.812 4.881 -4.403 1.00 0.00 C ATOM 708 CE2 PHE A 66 9.246 7.108 -5.137 1.00 0.00 C ATOM 709 CZ PHE A 66 9.011 6.019 -4.310 1.00 0.00 C ATOM 0 H PHE A 66 10.026 6.106 -8.514 1.00 0.00 H new ATOM 0 HA PHE A 66 12.694 5.294 -9.260 1.00 0.00 H new ATOM 0 HB2 PHE A 66 13.088 5.493 -6.799 1.00 0.00 H new ATOM 0 HB3 PHE A 66 12.415 6.937 -7.530 1.00 0.00 H new ATOM 0 HD1 PHE A 66 11.485 3.975 -5.394 1.00 0.00 H new ATOM 0 HD2 PHE A 66 10.426 7.910 -6.734 1.00 0.00 H new ATOM 0 HE1 PHE A 66 9.625 4.030 -3.765 1.00 0.00 H new ATOM 0 HE2 PHE A 66 8.629 7.991 -5.051 1.00 0.00 H new ATOM 0 HZ PHE A 66 8.205 6.053 -3.592 1.00 0.00 H new ATOM 719 N ASP A 67 10.763 2.846 -8.169 1.00 0.00 N ATOM 720 CA ASP A 67 10.811 1.364 -7.996 1.00 0.00 C ATOM 721 C ASP A 67 9.546 0.589 -8.502 1.00 0.00 C ATOM 722 O ASP A 67 8.415 1.074 -8.593 1.00 0.00 O ATOM 723 CB ASP A 67 11.218 0.975 -6.539 1.00 0.00 C ATOM 724 CG ASP A 67 11.820 -0.420 -6.354 1.00 0.00 C ATOM 725 OD1 ASP A 67 11.167 -1.427 -6.109 1.00 0.00 O ATOM 726 OD2 ASP A 67 13.169 -0.430 -6.521 1.00 0.00 O ATOM 0 H ASP A 67 9.827 3.250 -8.158 1.00 0.00 H new ATOM 0 HA ASP A 67 11.599 1.025 -8.669 1.00 0.00 H new ATOM 0 HB2 ASP A 67 11.938 1.709 -6.177 1.00 0.00 H new ATOM 0 HB3 ASP A 67 10.335 1.054 -5.904 1.00 0.00 H new ATOM 732 N SER A 68 9.831 -0.667 -8.837 1.00 0.00 N ATOM 733 CA SER A 68 8.860 -1.702 -9.266 1.00 0.00 C ATOM 734 C SER A 68 9.528 -3.057 -8.882 1.00 0.00 C ATOM 735 O SER A 68 10.460 -3.515 -9.552 1.00 0.00 O ATOM 736 CB SER A 68 8.476 -1.544 -10.754 1.00 0.00 C ATOM 737 OG SER A 68 9.579 -1.644 -11.659 1.00 0.00 O ATOM 0 H SER A 68 10.788 -1.020 -8.820 1.00 0.00 H new ATOM 0 HA SER A 68 7.892 -1.622 -8.771 1.00 0.00 H new ATOM 0 HB2 SER A 68 7.740 -2.306 -11.010 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.994 -0.576 -10.892 1.00 0.00 H new ATOM 0 HG SER A 68 9.258 -1.536 -12.579 1.00 0.00 H new ATOM 743 N SER A 69 9.091 -3.689 -7.774 1.00 0.00 N ATOM 744 CA SER A 69 9.742 -4.918 -7.243 1.00 0.00 C ATOM 745 C SER A 69 9.798 -6.143 -8.209 1.00 0.00 C ATOM 746 O SER A 69 10.896 -6.471 -8.666 1.00 0.00 O ATOM 747 CB SER A 69 9.253 -5.217 -5.804 1.00 0.00 C ATOM 748 OG SER A 69 7.951 -5.802 -5.744 1.00 0.00 O ATOM 0 H SER A 69 8.291 -3.374 -7.225 1.00 0.00 H new ATOM 0 HA SER A 69 10.806 -4.692 -7.174 1.00 0.00 H new ATOM 0 HB2 SER A 69 9.964 -5.887 -5.321 1.00 0.00 H new ATOM 0 HB3 SER A 69 9.250 -4.289 -5.232 1.00 0.00 H new ATOM 0 HG SER A 69 7.446 -5.559 -6.548 1.00 0.00 H new ATOM 754 N LEU A 70 8.666 -6.785 -8.580 1.00 0.00 N ATOM 755 CA LEU A 70 8.692 -7.955 -9.516 1.00 0.00 C ATOM 756 C LEU A 70 9.252 -7.690 -10.953 1.00 0.00 C ATOM 757 O LEU A 70 10.062 -8.453 -11.483 1.00 0.00 O ATOM 758 CB LEU A 70 7.434 -8.846 -9.512 1.00 0.00 C ATOM 759 CG LEU A 70 6.908 -9.297 -8.122 1.00 0.00 C ATOM 760 CD1 LEU A 70 5.621 -10.083 -8.268 1.00 0.00 C ATOM 761 CD2 LEU A 70 7.858 -10.123 -7.264 1.00 0.00 C ATOM 0 H LEU A 70 7.734 -6.526 -8.257 1.00 0.00 H new ATOM 0 HA LEU A 70 9.465 -8.560 -9.043 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.634 -8.309 -10.022 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.646 -9.738 -10.102 1.00 0.00 H new ATOM 0 HG LEU A 70 6.770 -8.352 -7.597 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.268 -10.390 -7.283 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.866 -9.459 -8.745 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.802 -10.966 -8.880 1.00 0.00 H new ATOM 0 HD21 LEU A 70 7.372 -10.373 -6.321 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.121 -11.040 -7.792 1.00 0.00 H new ATOM 0 HD23 LEU A 70 8.762 -9.547 -7.065 1.00 0.00 H new ATOM 773 N ASP A 71 8.810 -6.582 -11.550 1.00 0.00 N ATOM 774 CA ASP A 71 9.296 -6.053 -12.863 1.00 0.00 C ATOM 775 C ASP A 71 10.862 -5.971 -13.043 1.00 0.00 C ATOM 776 O ASP A 71 11.379 -6.281 -14.117 1.00 0.00 O ATOM 777 CB ASP A 71 8.695 -4.626 -13.008 1.00 0.00 C ATOM 778 CG ASP A 71 7.175 -4.535 -13.133 1.00 0.00 C ATOM 779 OD1 ASP A 71 6.407 -4.675 -12.186 1.00 0.00 O ATOM 780 OD2 ASP A 71 6.769 -4.286 -14.405 1.00 0.00 O ATOM 0 H ASP A 71 8.083 -5.998 -11.136 1.00 0.00 H new ATOM 0 HA ASP A 71 8.975 -6.758 -13.630 1.00 0.00 H new ATOM 0 HB2 ASP A 71 9.002 -4.037 -12.143 1.00 0.00 H new ATOM 0 HB3 ASP A 71 9.138 -4.157 -13.887 1.00 0.00 H new ATOM 786 N ARG A 72 11.595 -5.547 -11.998 1.00 0.00 N ATOM 787 CA ARG A 72 13.073 -5.426 -11.991 1.00 0.00 C ATOM 788 C ARG A 72 13.844 -6.688 -11.424 1.00 0.00 C ATOM 789 O ARG A 72 14.968 -6.558 -10.932 1.00 0.00 O ATOM 790 CB ARG A 72 13.414 -4.114 -11.217 1.00 0.00 C ATOM 791 CG ARG A 72 12.848 -2.789 -11.797 1.00 0.00 C ATOM 792 CD ARG A 72 13.095 -1.584 -10.878 1.00 0.00 C ATOM 793 NE ARG A 72 12.296 -0.430 -11.371 1.00 0.00 N ATOM 794 CZ ARG A 72 12.638 0.849 -11.285 1.00 0.00 C ATOM 795 NH1 ARG A 72 13.736 1.283 -10.746 1.00 0.00 N ATOM 796 NH2 ARG A 72 11.810 1.715 -11.752 1.00 0.00 N ATOM 0 H ARG A 72 11.171 -5.271 -11.112 1.00 0.00 H new ATOM 0 HA ARG A 72 13.427 -5.380 -13.021 1.00 0.00 H new ATOM 0 HB2 ARG A 72 13.051 -4.219 -10.195 1.00 0.00 H new ATOM 0 HB3 ARG A 72 14.499 -4.024 -11.163 1.00 0.00 H new ATOM 0 HG2 ARG A 72 13.304 -2.599 -12.769 1.00 0.00 H new ATOM 0 HG3 ARG A 72 11.777 -2.899 -11.964 1.00 0.00 H new ATOM 0 HD2 ARG A 72 12.813 -1.827 -9.854 1.00 0.00 H new ATOM 0 HD3 ARG A 72 14.155 -1.331 -10.865 1.00 0.00 H new ATOM 0 HE ARG A 72 11.403 -0.642 -11.816 1.00 0.00 H new ATOM 0 HH11 ARG A 72 14.406 0.623 -10.351 1.00 0.00 H new ATOM 0 HH12 ARG A 72 13.929 2.284 -10.717 1.00 0.00 H new ATOM 0 HH21 ARG A 72 10.931 1.407 -12.168 1.00 0.00 H new ATOM 0 HH22 ARG A 72 12.032 2.709 -11.707 1.00 0.00 H new ATOM 809 N LYS A 73 13.262 -7.904 -11.510 1.00 0.00 N ATOM 810 CA LYS A 73 13.840 -9.201 -11.028 1.00 0.00 C ATOM 811 C LYS A 73 13.673 -9.535 -9.499 1.00 0.00 C ATOM 812 O LYS A 73 13.589 -10.708 -9.125 1.00 0.00 O ATOM 813 CB LYS A 73 15.266 -9.486 -11.594 1.00 0.00 C ATOM 814 CG LYS A 73 15.690 -10.972 -11.623 1.00 0.00 C ATOM 815 CD LYS A 73 17.095 -11.169 -12.232 1.00 0.00 C ATOM 816 CE LYS A 73 17.561 -12.635 -12.282 1.00 0.00 C ATOM 817 NZ LYS A 73 16.845 -13.399 -13.327 1.00 0.00 N ATOM 0 H LYS A 73 12.341 -8.026 -11.931 1.00 0.00 H new ATOM 0 HA LYS A 73 13.177 -9.939 -11.479 1.00 0.00 H new ATOM 0 HB2 LYS A 73 15.320 -9.092 -12.609 1.00 0.00 H new ATOM 0 HB3 LYS A 73 15.991 -8.932 -10.998 1.00 0.00 H new ATOM 0 HG2 LYS A 73 15.677 -11.371 -10.609 1.00 0.00 H new ATOM 0 HG3 LYS A 73 14.963 -11.544 -12.200 1.00 0.00 H new ATOM 0 HD2 LYS A 73 17.100 -10.763 -13.244 1.00 0.00 H new ATOM 0 HD3 LYS A 73 17.814 -10.590 -11.652 1.00 0.00 H new ATOM 0 HE2 LYS A 73 18.633 -12.670 -12.475 1.00 0.00 H new ATOM 0 HE3 LYS A 73 17.397 -13.103 -11.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 17.184 -14.382 -13.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 15.824 -13.386 -13.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 17.023 -12.967 -14.256 1.00 0.00 H new ATOM 830 N ASP A 74 13.626 -8.530 -8.617 1.00 0.00 N ATOM 831 CA ASP A 74 13.453 -8.703 -7.156 1.00 0.00 C ATOM 832 C ASP A 74 11.967 -8.892 -6.688 1.00 0.00 C ATOM 833 O ASP A 74 11.047 -9.111 -7.471 1.00 0.00 O ATOM 834 CB ASP A 74 14.162 -7.469 -6.522 1.00 0.00 C ATOM 835 CG ASP A 74 13.548 -6.077 -6.729 1.00 0.00 C ATOM 836 OD1 ASP A 74 12.894 -5.487 -5.876 1.00 0.00 O ATOM 837 OD2 ASP A 74 13.797 -5.576 -7.967 1.00 0.00 O ATOM 0 H ASP A 74 13.708 -7.552 -8.896 1.00 0.00 H new ATOM 0 HA ASP A 74 13.899 -9.640 -6.822 1.00 0.00 H new ATOM 0 HB2 ASP A 74 14.231 -7.643 -5.448 1.00 0.00 H new ATOM 0 HB3 ASP A 74 15.182 -7.441 -6.906 1.00 0.00 H new ATOM 843 N LYS A 75 11.749 -8.850 -5.370 1.00 0.00 N ATOM 844 CA LYS A 75 10.441 -8.914 -4.709 1.00 0.00 C ATOM 845 C LYS A 75 10.448 -8.010 -3.422 1.00 0.00 C ATOM 846 O LYS A 75 11.489 -7.438 -3.068 1.00 0.00 O ATOM 847 CB LYS A 75 10.103 -10.374 -4.306 1.00 0.00 C ATOM 848 CG LYS A 75 10.496 -11.590 -5.187 1.00 0.00 C ATOM 849 CD LYS A 75 9.831 -12.920 -4.775 1.00 0.00 C ATOM 850 CE LYS A 75 10.351 -13.501 -3.450 1.00 0.00 C ATOM 851 NZ LYS A 75 9.698 -14.799 -3.192 1.00 0.00 N ATOM 0 H LYS A 75 12.516 -8.766 -4.703 1.00 0.00 H new ATOM 0 HA LYS A 75 9.685 -8.555 -5.408 1.00 0.00 H new ATOM 0 HB2 LYS A 75 10.551 -10.540 -3.326 1.00 0.00 H new ATOM 0 HB3 LYS A 75 9.022 -10.420 -4.174 1.00 0.00 H new ATOM 0 HG2 LYS A 75 10.233 -11.372 -6.222 1.00 0.00 H new ATOM 0 HG3 LYS A 75 11.578 -11.713 -5.152 1.00 0.00 H new ATOM 0 HD2 LYS A 75 8.755 -12.765 -4.693 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.989 -13.653 -5.567 1.00 0.00 H new ATOM 0 HE2 LYS A 75 11.433 -13.629 -3.496 1.00 0.00 H new ATOM 0 HE3 LYS A 75 10.146 -12.810 -2.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 10.050 -15.192 -2.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 8.669 -14.664 -3.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 9.915 -15.457 -3.968 1.00 0.00 H new ATOM 864 N PHE A 76 9.321 -7.859 -2.683 1.00 0.00 N ATOM 865 CA PHE A 76 9.347 -7.123 -1.394 1.00 0.00 C ATOM 866 C PHE A 76 8.604 -7.914 -0.252 1.00 0.00 C ATOM 867 O PHE A 76 7.669 -8.683 -0.481 1.00 0.00 O ATOM 868 CB PHE A 76 9.078 -5.589 -1.635 1.00 0.00 C ATOM 869 CG PHE A 76 10.104 -4.776 -0.813 1.00 0.00 C ATOM 870 CD1 PHE A 76 11.408 -4.541 -1.267 1.00 0.00 C ATOM 871 CD2 PHE A 76 9.770 -4.420 0.497 1.00 0.00 C ATOM 872 CE1 PHE A 76 12.323 -3.872 -0.455 1.00 0.00 C ATOM 873 CE2 PHE A 76 10.684 -3.758 1.312 1.00 0.00 C ATOM 874 CZ PHE A 76 11.958 -3.476 0.830 1.00 0.00 C ATOM 0 H PHE A 76 8.407 -8.226 -2.947 1.00 0.00 H new ATOM 0 HA PHE A 76 10.341 -7.086 -0.948 1.00 0.00 H new ATOM 0 HB2 PHE A 76 9.168 -5.351 -2.695 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.062 -5.331 -1.335 1.00 0.00 H new ATOM 0 HD1 PHE A 76 11.706 -4.879 -2.249 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.790 -4.662 0.882 1.00 0.00 H new ATOM 0 HE1 PHE A 76 13.316 -3.660 -0.823 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.405 -3.465 2.313 1.00 0.00 H new ATOM 0 HZ PHE A 76 12.666 -2.949 1.453 1.00 0.00 H new ATOM 884 N SER A 77 9.078 -7.810 1.001 1.00 0.00 N ATOM 885 CA SER A 77 8.510 -8.538 2.168 1.00 0.00 C ATOM 886 C SER A 77 9.043 -7.919 3.474 1.00 0.00 C ATOM 887 O SER A 77 10.154 -7.377 3.552 1.00 0.00 O ATOM 888 CB SER A 77 8.807 -10.057 2.151 1.00 0.00 C ATOM 889 OG SER A 77 10.188 -10.370 2.349 1.00 0.00 O ATOM 0 H SER A 77 9.871 -7.216 1.243 1.00 0.00 H new ATOM 0 HA SER A 77 7.427 -8.432 2.106 1.00 0.00 H new ATOM 0 HB2 SER A 77 8.217 -10.543 2.928 1.00 0.00 H new ATOM 0 HB3 SER A 77 8.482 -10.472 1.197 1.00 0.00 H new ATOM 0 HG SER A 77 10.309 -11.342 2.329 1.00 0.00 H new ATOM 895 N PHE A 78 8.214 -8.016 4.505 1.00 0.00 N ATOM 896 CA PHE A 78 8.564 -7.471 5.845 1.00 0.00 C ATOM 897 C PHE A 78 7.732 -8.099 7.017 1.00 0.00 C ATOM 898 O PHE A 78 6.987 -9.069 6.848 1.00 0.00 O ATOM 899 CB PHE A 78 8.484 -5.918 5.795 1.00 0.00 C ATOM 900 CG PHE A 78 7.103 -5.238 5.790 1.00 0.00 C ATOM 901 CD1 PHE A 78 6.364 -5.039 4.617 1.00 0.00 C ATOM 902 CD2 PHE A 78 6.695 -4.619 6.971 1.00 0.00 C ATOM 903 CE1 PHE A 78 5.219 -4.237 4.645 1.00 0.00 C ATOM 904 CE2 PHE A 78 5.567 -3.817 6.994 1.00 0.00 C ATOM 905 CZ PHE A 78 4.828 -3.629 5.841 1.00 0.00 C ATOM 0 H PHE A 78 7.297 -8.460 4.458 1.00 0.00 H new ATOM 0 HA PHE A 78 9.589 -7.761 6.077 1.00 0.00 H new ATOM 0 HB2 PHE A 78 9.036 -5.533 6.652 1.00 0.00 H new ATOM 0 HB3 PHE A 78 9.014 -5.591 4.901 1.00 0.00 H new ATOM 0 HD1 PHE A 78 6.678 -5.504 3.694 1.00 0.00 H new ATOM 0 HD2 PHE A 78 7.265 -4.767 7.877 1.00 0.00 H new ATOM 0 HE1 PHE A 78 4.639 -4.088 3.746 1.00 0.00 H new ATOM 0 HE2 PHE A 78 5.264 -3.338 7.913 1.00 0.00 H new ATOM 0 HZ PHE A 78 3.944 -3.009 5.865 1.00 0.00 H new ATOM 915 N ASP A 79 7.875 -7.535 8.227 1.00 0.00 N ATOM 916 CA ASP A 79 7.094 -7.922 9.415 1.00 0.00 C ATOM 917 C ASP A 79 6.408 -6.592 9.884 1.00 0.00 C ATOM 918 O ASP A 79 7.092 -5.630 10.249 1.00 0.00 O ATOM 919 CB ASP A 79 8.105 -8.606 10.349 1.00 0.00 C ATOM 920 CG ASP A 79 7.459 -9.290 11.544 1.00 0.00 C ATOM 921 OD1 ASP A 79 7.581 -8.906 12.700 1.00 0.00 O ATOM 922 OD2 ASP A 79 6.705 -10.360 11.178 1.00 0.00 O ATOM 0 H ASP A 79 8.545 -6.788 8.411 1.00 0.00 H new ATOM 0 HA ASP A 79 6.283 -8.642 9.306 1.00 0.00 H new ATOM 0 HB2 ASP A 79 8.672 -9.343 9.781 1.00 0.00 H new ATOM 0 HB3 ASP A 79 8.818 -7.863 10.707 1.00 0.00 H new ATOM 928 N LEU A 80 5.065 -6.527 9.791 1.00 0.00 N ATOM 929 CA LEU A 80 4.239 -5.299 10.037 1.00 0.00 C ATOM 930 C LEU A 80 4.685 -4.339 11.211 1.00 0.00 C ATOM 931 O LEU A 80 4.511 -4.637 12.393 1.00 0.00 O ATOM 932 CB LEU A 80 2.734 -5.702 10.123 1.00 0.00 C ATOM 933 CG LEU A 80 1.727 -4.816 9.338 1.00 0.00 C ATOM 934 CD1 LEU A 80 0.305 -5.392 9.468 1.00 0.00 C ATOM 935 CD2 LEU A 80 1.677 -3.346 9.747 1.00 0.00 C ATOM 0 H LEU A 80 4.500 -7.337 9.538 1.00 0.00 H new ATOM 0 HA LEU A 80 4.419 -4.659 9.173 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.636 -6.727 9.766 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.441 -5.701 11.173 1.00 0.00 H new ATOM 0 HG LEU A 80 2.096 -4.838 8.313 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.394 -4.764 8.915 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.284 -6.404 9.063 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.017 -5.416 10.519 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.942 -2.823 9.135 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.395 -3.270 10.797 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.658 -2.894 9.601 1.00 0.00 H new ATOM 947 N GLY A 81 5.265 -3.175 10.868 1.00 0.00 N ATOM 948 CA GLY A 81 5.752 -2.172 11.868 1.00 0.00 C ATOM 949 C GLY A 81 6.952 -2.551 12.751 1.00 0.00 C ATOM 950 O GLY A 81 6.860 -2.393 13.969 1.00 0.00 O ATOM 0 H GLY A 81 5.415 -2.892 9.900 1.00 0.00 H new ATOM 0 HA2 GLY A 81 6.011 -1.261 11.328 1.00 0.00 H new ATOM 0 HA3 GLY A 81 4.919 -1.926 12.526 1.00 0.00 H new ATOM 954 N LYS A 82 8.083 -2.976 12.164 1.00 0.00 N ATOM 955 CA LYS A 82 9.273 -3.372 12.973 1.00 0.00 C ATOM 956 C LYS A 82 10.444 -2.349 13.107 1.00 0.00 C ATOM 957 O LYS A 82 11.355 -2.598 13.900 1.00 0.00 O ATOM 958 CB LYS A 82 9.765 -4.705 12.324 1.00 0.00 C ATOM 959 CG LYS A 82 9.171 -5.956 13.011 1.00 0.00 C ATOM 960 CD LYS A 82 10.146 -6.772 13.894 1.00 0.00 C ATOM 961 CE LYS A 82 11.412 -7.368 13.240 1.00 0.00 C ATOM 962 NZ LYS A 82 11.091 -8.383 12.216 1.00 0.00 N ATOM 0 H LYS A 82 8.209 -3.057 11.155 1.00 0.00 H new ATOM 0 HA LYS A 82 8.954 -3.452 14.012 1.00 0.00 H new ATOM 0 HB2 LYS A 82 9.494 -4.712 11.268 1.00 0.00 H new ATOM 0 HB3 LYS A 82 10.853 -4.749 12.375 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.329 -5.642 13.628 1.00 0.00 H new ATOM 0 HG3 LYS A 82 8.772 -6.615 12.240 1.00 0.00 H new ATOM 0 HD2 LYS A 82 10.468 -6.129 14.713 1.00 0.00 H new ATOM 0 HD3 LYS A 82 9.583 -7.594 14.336 1.00 0.00 H new ATOM 0 HE2 LYS A 82 11.994 -6.567 12.784 1.00 0.00 H new ATOM 0 HE3 LYS A 82 12.038 -7.818 14.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.674 -9.230 12.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.085 -8.638 12.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 11.288 -7.997 11.271 1.00 0.00 H new ATOM 975 N GLY A 83 10.442 -1.205 12.392 1.00 0.00 N ATOM 976 CA GLY A 83 11.684 -0.348 12.304 1.00 0.00 C ATOM 977 C GLY A 83 12.589 -1.061 11.258 1.00 0.00 C ATOM 978 O GLY A 83 13.641 -1.630 11.543 1.00 0.00 O ATOM 0 H GLY A 83 9.637 -0.847 11.879 1.00 0.00 H new ATOM 0 HA2 GLY A 83 11.442 0.667 11.990 1.00 0.00 H new ATOM 0 HA3 GLY A 83 12.181 -0.273 13.271 1.00 0.00 H new ATOM 982 N GLU A 84 12.025 -1.096 10.049 1.00 0.00 N ATOM 983 CA GLU A 84 12.437 -1.974 8.939 1.00 0.00 C ATOM 984 C GLU A 84 12.048 -1.336 7.572 1.00 0.00 C ATOM 985 O GLU A 84 12.896 -1.128 6.704 1.00 0.00 O ATOM 986 CB GLU A 84 11.681 -3.317 9.273 1.00 0.00 C ATOM 987 CG GLU A 84 11.999 -4.537 8.377 1.00 0.00 C ATOM 988 CD GLU A 84 11.466 -5.843 8.966 1.00 0.00 C ATOM 989 OE1 GLU A 84 10.513 -6.454 8.504 1.00 0.00 O ATOM 990 OE2 GLU A 84 12.143 -6.227 10.084 1.00 0.00 O ATOM 0 H GLU A 84 11.240 -0.494 9.802 1.00 0.00 H new ATOM 0 HA GLU A 84 13.511 -2.137 8.846 1.00 0.00 H new ATOM 0 HB2 GLU A 84 11.906 -3.586 10.305 1.00 0.00 H new ATOM 0 HB3 GLU A 84 10.609 -3.126 9.219 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.565 -4.383 7.389 1.00 0.00 H new ATOM 0 HG3 GLU A 84 13.078 -4.615 8.243 1.00 0.00 H new ATOM 998 N VAL A 85 10.754 -1.011 7.407 1.00 0.00 N ATOM 999 CA VAL A 85 10.199 -0.372 6.209 1.00 0.00 C ATOM 1000 C VAL A 85 10.112 1.149 6.537 1.00 0.00 C ATOM 1001 O VAL A 85 11.045 1.804 7.014 1.00 0.00 O ATOM 1002 CB VAL A 85 8.901 -1.209 5.823 1.00 0.00 C ATOM 1003 CG1 VAL A 85 9.228 -2.714 5.657 1.00 0.00 C ATOM 1004 CG2 VAL A 85 7.627 -1.139 6.698 1.00 0.00 C ATOM 0 H VAL A 85 10.050 -1.191 8.123 1.00 0.00 H new ATOM 0 HA VAL A 85 10.779 -0.389 5.286 1.00 0.00 H new ATOM 0 HB VAL A 85 8.635 -0.684 4.905 1.00 0.00 H new ATOM 0 HG11 VAL A 85 8.320 -3.257 5.394 1.00 0.00 H new ATOM 0 HG12 VAL A 85 9.968 -2.840 4.867 1.00 0.00 H new ATOM 0 HG13 VAL A 85 9.626 -3.105 6.593 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.855 -1.778 6.269 1.00 0.00 H new ATOM 0 HG22 VAL A 85 7.860 -1.478 7.707 1.00 0.00 H new ATOM 0 HG23 VAL A 85 7.267 -0.111 6.735 1.00 0.00 H new ATOM 1014 N ILE A 86 8.959 1.692 6.237 1.00 0.00 N ATOM 1015 CA ILE A 86 8.544 3.058 6.583 1.00 0.00 C ATOM 1016 C ILE A 86 7.194 3.005 7.346 1.00 0.00 C ATOM 1017 O ILE A 86 6.390 2.064 7.284 1.00 0.00 O ATOM 1018 CB ILE A 86 8.499 4.030 5.362 1.00 0.00 C ATOM 1019 CG1 ILE A 86 7.511 3.559 4.255 1.00 0.00 C ATOM 1020 CG2 ILE A 86 9.936 4.366 4.921 1.00 0.00 C ATOM 1021 CD1 ILE A 86 7.695 4.205 2.892 1.00 0.00 C ATOM 0 H ILE A 86 8.241 1.183 5.722 1.00 0.00 H new ATOM 0 HA ILE A 86 9.308 3.481 7.235 1.00 0.00 H new ATOM 0 HB ILE A 86 8.058 4.983 5.652 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.609 2.479 4.142 1.00 0.00 H new ATOM 0 HG13 ILE A 86 6.494 3.753 4.595 1.00 0.00 H new ATOM 0 HG21 ILE A 86 9.906 5.045 4.069 1.00 0.00 H new ATOM 0 HG22 ILE A 86 10.468 4.842 5.745 1.00 0.00 H new ATOM 0 HG23 ILE A 86 10.453 3.449 4.637 1.00 0.00 H new ATOM 0 HD11 ILE A 86 6.956 3.805 2.197 1.00 0.00 H new ATOM 0 HD12 ILE A 86 7.564 5.284 2.980 1.00 0.00 H new ATOM 0 HD13 ILE A 86 8.697 3.990 2.520 1.00 0.00 H new ATOM 1033 N LYS A 87 6.918 4.127 8.000 1.00 0.00 N ATOM 1034 CA LYS A 87 5.659 4.291 8.773 1.00 0.00 C ATOM 1035 C LYS A 87 4.382 4.349 7.900 1.00 0.00 C ATOM 1036 O LYS A 87 3.333 3.844 8.314 1.00 0.00 O ATOM 1037 CB LYS A 87 5.698 5.424 9.845 1.00 0.00 C ATOM 1038 CG LYS A 87 7.030 5.760 10.570 1.00 0.00 C ATOM 1039 CD LYS A 87 7.816 6.885 9.862 1.00 0.00 C ATOM 1040 CE LYS A 87 9.159 7.205 10.528 1.00 0.00 C ATOM 1041 NZ LYS A 87 9.789 8.338 9.818 1.00 0.00 N ATOM 0 H LYS A 87 7.534 4.940 8.021 1.00 0.00 H new ATOM 0 HA LYS A 87 5.592 3.361 9.338 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.351 6.338 9.363 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.966 5.170 10.612 1.00 0.00 H new ATOM 0 HG2 LYS A 87 6.817 6.059 11.596 1.00 0.00 H new ATOM 0 HG3 LYS A 87 7.649 4.864 10.621 1.00 0.00 H new ATOM 0 HD2 LYS A 87 7.993 6.597 8.826 1.00 0.00 H new ATOM 0 HD3 LYS A 87 7.205 7.787 9.842 1.00 0.00 H new ATOM 0 HE2 LYS A 87 9.009 7.455 11.578 1.00 0.00 H new ATOM 0 HE3 LYS A 87 9.811 6.332 10.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 10.702 8.562 10.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 9.944 8.081 8.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 9.166 9.169 9.868 1.00 0.00 H new ATOM 1054 N ALA A 88 4.447 4.939 6.687 1.00 0.00 N ATOM 1055 CA ALA A 88 3.339 4.845 5.728 1.00 0.00 C ATOM 1056 C ALA A 88 3.029 3.384 5.318 1.00 0.00 C ATOM 1057 O ALA A 88 1.852 3.118 5.055 1.00 0.00 O ATOM 1058 CB ALA A 88 3.715 5.646 4.487 1.00 0.00 C ATOM 0 H ALA A 88 5.247 5.478 6.357 1.00 0.00 H new ATOM 0 HA ALA A 88 2.442 5.241 6.205 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.906 5.591 3.759 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.884 6.687 4.763 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.625 5.234 4.050 1.00 0.00 H new ATOM 1064 N TRP A 89 4.016 2.440 5.266 1.00 0.00 N ATOM 1065 CA TRP A 89 3.643 1.048 4.992 1.00 0.00 C ATOM 1066 C TRP A 89 2.958 0.382 6.193 1.00 0.00 C ATOM 1067 O TRP A 89 1.933 -0.252 5.978 1.00 0.00 O ATOM 1068 CB TRP A 89 4.811 0.221 4.518 1.00 0.00 C ATOM 1069 CG TRP A 89 5.502 0.592 3.214 1.00 0.00 C ATOM 1070 CD1 TRP A 89 5.170 1.625 2.335 1.00 0.00 C ATOM 1071 CD2 TRP A 89 6.255 -0.269 2.496 1.00 0.00 C ATOM 1072 NE1 TRP A 89 5.644 1.390 1.039 1.00 0.00 N ATOM 1073 CE2 TRP A 89 6.288 0.175 1.156 1.00 0.00 C ATOM 1074 CE3 TRP A 89 6.800 -1.500 2.877 1.00 0.00 C ATOM 1075 CZ2 TRP A 89 6.783 -0.679 0.151 1.00 0.00 C ATOM 1076 CZ3 TRP A 89 7.366 -2.295 1.892 1.00 0.00 C ATOM 1077 CH2 TRP A 89 7.327 -1.910 0.536 1.00 0.00 C ATOM 0 H TRP A 89 5.011 2.615 5.403 1.00 0.00 H new ATOM 0 HA TRP A 89 2.919 1.090 4.178 1.00 0.00 H new ATOM 0 HB2 TRP A 89 5.565 0.237 5.305 1.00 0.00 H new ATOM 0 HB3 TRP A 89 4.468 -0.809 4.426 1.00 0.00 H new ATOM 0 HD1 TRP A 89 4.612 2.504 2.622 1.00 0.00 H new ATOM 0 HE1 TRP A 89 5.539 1.975 0.210 1.00 0.00 H new ATOM 0 HE3 TRP A 89 6.780 -1.822 3.908 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 6.744 -0.392 -0.889 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 7.844 -3.223 2.168 1.00 0.00 H new ATOM 0 HH2 TRP A 89 7.723 -2.575 -0.217 1.00 0.00 H new ATOM 1088 N ASP A 90 3.457 0.498 7.436 1.00 0.00 N ATOM 1089 CA ASP A 90 2.667 -0.061 8.577 1.00 0.00 C ATOM 1090 C ASP A 90 1.204 0.496 8.727 1.00 0.00 C ATOM 1091 O ASP A 90 0.312 -0.276 9.071 1.00 0.00 O ATOM 1092 CB ASP A 90 3.453 -0.062 9.898 1.00 0.00 C ATOM 1093 CG ASP A 90 4.146 1.189 10.416 1.00 0.00 C ATOM 1094 OD1 ASP A 90 5.358 1.253 10.588 1.00 0.00 O ATOM 1095 OD2 ASP A 90 3.275 2.193 10.699 1.00 0.00 O ATOM 0 H ASP A 90 4.343 0.941 7.681 1.00 0.00 H new ATOM 0 HA ASP A 90 2.511 -1.104 8.301 1.00 0.00 H new ATOM 0 HB2 ASP A 90 2.762 -0.386 10.676 1.00 0.00 H new ATOM 0 HB3 ASP A 90 4.218 -0.833 9.810 1.00 0.00 H new ATOM 1101 N ILE A 91 0.945 1.785 8.439 1.00 0.00 N ATOM 1102 CA ILE A 91 -0.445 2.341 8.418 1.00 0.00 C ATOM 1103 C ILE A 91 -1.315 1.693 7.266 1.00 0.00 C ATOM 1104 O ILE A 91 -2.324 1.008 7.511 1.00 0.00 O ATOM 1105 CB ILE A 91 -0.435 3.926 8.523 1.00 0.00 C ATOM 1106 CG1 ILE A 91 -0.457 4.440 9.995 1.00 0.00 C ATOM 1107 CG2 ILE A 91 -1.637 4.629 7.836 1.00 0.00 C ATOM 1108 CD1 ILE A 91 0.707 3.995 10.894 1.00 0.00 C ATOM 0 H ILE A 91 1.669 2.469 8.217 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.980 2.039 9.319 1.00 0.00 H new ATOM 0 HB ILE A 91 0.495 4.178 8.013 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.476 5.530 9.976 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.389 4.113 10.457 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -1.546 5.708 7.959 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -1.643 4.384 6.774 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -2.567 4.289 8.292 1.00 0.00 H new ATOM 0 HD11 ILE A 91 0.578 4.416 11.891 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.721 2.907 10.959 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.648 4.345 10.471 1.00 0.00 H new ATOM 1120 N ALA A 92 -0.896 1.877 6.005 1.00 0.00 N ATOM 1121 CA ALA A 92 -1.621 1.325 4.843 1.00 0.00 C ATOM 1122 C ALA A 92 -1.649 -0.232 4.682 1.00 0.00 C ATOM 1123 O ALA A 92 -2.656 -0.779 4.236 1.00 0.00 O ATOM 1124 CB ALA A 92 -1.021 2.037 3.644 1.00 0.00 C ATOM 0 H ALA A 92 -0.058 2.404 5.760 1.00 0.00 H new ATOM 0 HA ALA A 92 -2.687 1.511 4.973 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -1.504 1.685 2.733 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -1.174 3.111 3.745 1.00 0.00 H new ATOM 0 HB3 ALA A 92 0.047 1.826 3.593 1.00 0.00 H new ATOM 1130 N VAL A 93 -0.567 -0.945 5.033 1.00 0.00 N ATOM 1131 CA VAL A 93 -0.506 -2.435 5.001 1.00 0.00 C ATOM 1132 C VAL A 93 -1.327 -3.064 6.198 1.00 0.00 C ATOM 1133 O VAL A 93 -1.936 -4.118 6.012 1.00 0.00 O ATOM 1134 CB VAL A 93 0.967 -2.920 4.764 1.00 0.00 C ATOM 1135 CG1 VAL A 93 1.047 -4.401 4.389 1.00 0.00 C ATOM 1136 CG2 VAL A 93 1.705 -2.258 3.570 1.00 0.00 C ATOM 0 H VAL A 93 0.300 -0.512 5.350 1.00 0.00 H new ATOM 0 HA VAL A 93 -1.030 -2.839 4.135 1.00 0.00 H new ATOM 0 HB VAL A 93 1.422 -2.663 5.720 1.00 0.00 H new ATOM 0 HG11 VAL A 93 2.089 -4.682 4.237 1.00 0.00 H new ATOM 0 HG12 VAL A 93 0.622 -5.003 5.192 1.00 0.00 H new ATOM 0 HG13 VAL A 93 0.487 -4.575 3.470 1.00 0.00 H new ATOM 0 HG21 VAL A 93 2.714 -2.664 3.495 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.162 -2.464 2.647 1.00 0.00 H new ATOM 0 HG23 VAL A 93 1.758 -1.181 3.727 1.00 0.00 H new ATOM 1146 N ALA A 94 -1.407 -2.426 7.396 1.00 0.00 N ATOM 1147 CA ALA A 94 -2.384 -2.804 8.456 1.00 0.00 C ATOM 1148 C ALA A 94 -3.891 -2.619 8.029 1.00 0.00 C ATOM 1149 O ALA A 94 -4.770 -3.256 8.608 1.00 0.00 O ATOM 1150 CB ALA A 94 -2.065 -2.032 9.746 1.00 0.00 C ATOM 0 H ALA A 94 -0.804 -1.644 7.654 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.271 -3.874 8.631 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -2.779 -2.308 10.521 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -1.056 -2.278 10.077 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -2.133 -0.961 9.555 1.00 0.00 H new ATOM 1156 N THR A 95 -4.187 -1.726 7.062 1.00 0.00 N ATOM 1157 CA THR A 95 -5.539 -1.608 6.422 1.00 0.00 C ATOM 1158 C THR A 95 -5.682 -2.377 5.031 1.00 0.00 C ATOM 1159 O THR A 95 -6.729 -2.270 4.387 1.00 0.00 O ATOM 1160 CB THR A 95 -5.960 -0.102 6.350 1.00 0.00 C ATOM 1161 OG1 THR A 95 -4.941 0.722 5.791 1.00 0.00 O ATOM 1162 CG2 THR A 95 -6.305 0.512 7.716 1.00 0.00 C ATOM 0 H THR A 95 -3.506 -1.062 6.695 1.00 0.00 H new ATOM 0 HA THR A 95 -6.247 -2.132 7.063 1.00 0.00 H new ATOM 0 HB THR A 95 -6.847 -0.120 5.717 1.00 0.00 H new ATOM 0 HG1 THR A 95 -4.192 0.788 6.419 1.00 0.00 H new ATOM 0 HG21 THR A 95 -6.587 1.557 7.585 1.00 0.00 H new ATOM 0 HG22 THR A 95 -7.136 -0.035 8.161 1.00 0.00 H new ATOM 0 HG23 THR A 95 -5.437 0.450 8.372 1.00 0.00 H new ATOM 1170 N MET A 96 -4.702 -3.199 4.581 1.00 0.00 N ATOM 1171 CA MET A 96 -4.750 -3.967 3.294 1.00 0.00 C ATOM 1172 C MET A 96 -5.302 -5.433 3.462 1.00 0.00 C ATOM 1173 O MET A 96 -4.943 -6.130 4.415 1.00 0.00 O ATOM 1174 CB MET A 96 -3.280 -3.947 2.798 1.00 0.00 C ATOM 1175 CG MET A 96 -2.970 -4.660 1.476 1.00 0.00 C ATOM 1176 SD MET A 96 -3.837 -3.895 0.116 1.00 0.00 S ATOM 1177 CE MET A 96 -2.827 -4.542 -1.216 1.00 0.00 C ATOM 0 H MET A 96 -3.840 -3.355 5.103 1.00 0.00 H new ATOM 0 HA MET A 96 -5.444 -3.520 2.582 1.00 0.00 H new ATOM 0 HB2 MET A 96 -2.972 -2.906 2.699 1.00 0.00 H new ATOM 0 HB3 MET A 96 -2.657 -4.391 3.574 1.00 0.00 H new ATOM 0 HG2 MET A 96 -1.897 -4.634 1.288 1.00 0.00 H new ATOM 0 HG3 MET A 96 -3.255 -5.709 1.549 1.00 0.00 H new ATOM 0 HE1 MET A 96 -3.127 -4.081 -2.157 1.00 0.00 H new ATOM 0 HE2 MET A 96 -1.779 -4.317 -1.020 1.00 0.00 H new ATOM 0 HE3 MET A 96 -2.960 -5.622 -1.282 1.00 0.00 H new ATOM 1187 N LYS A 97 -6.127 -5.948 2.526 1.00 0.00 N ATOM 1188 CA LYS A 97 -6.734 -7.315 2.640 1.00 0.00 C ATOM 1189 C LYS A 97 -5.973 -8.429 1.828 1.00 0.00 C ATOM 1190 O LYS A 97 -5.490 -8.228 0.702 1.00 0.00 O ATOM 1191 CB LYS A 97 -8.229 -7.240 2.226 1.00 0.00 C ATOM 1192 CG LYS A 97 -9.159 -6.429 3.166 1.00 0.00 C ATOM 1193 CD LYS A 97 -10.610 -6.315 2.656 1.00 0.00 C ATOM 1194 CE LYS A 97 -11.461 -7.576 2.872 1.00 0.00 C ATOM 1195 NZ LYS A 97 -12.766 -7.408 2.203 1.00 0.00 N ATOM 0 H LYS A 97 -6.395 -5.447 1.679 1.00 0.00 H new ATOM 0 HA LYS A 97 -6.643 -7.621 3.682 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -8.287 -6.805 1.228 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -8.616 -8.256 2.154 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -9.165 -6.898 4.150 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.748 -5.427 3.293 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -11.093 -5.476 3.156 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -10.591 -6.083 1.591 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.945 -8.449 2.472 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -11.606 -7.752 3.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -13.343 -8.261 2.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -13.258 -6.584 2.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -12.617 -7.260 1.184 1.00 0.00 H new ATOM 1208 N VAL A 98 -5.964 -9.653 2.397 1.00 0.00 N ATOM 1209 CA VAL A 98 -5.230 -10.837 1.859 1.00 0.00 C ATOM 1210 C VAL A 98 -5.478 -11.138 0.329 1.00 0.00 C ATOM 1211 O VAL A 98 -6.633 -11.346 -0.068 1.00 0.00 O ATOM 1212 CB VAL A 98 -5.587 -12.130 2.661 1.00 0.00 C ATOM 1213 CG1 VAL A 98 -5.048 -13.467 2.092 1.00 0.00 C ATOM 1214 CG2 VAL A 98 -5.034 -12.151 4.106 1.00 0.00 C ATOM 0 H VAL A 98 -6.472 -9.858 3.257 1.00 0.00 H new ATOM 0 HA VAL A 98 -4.180 -10.567 1.973 1.00 0.00 H new ATOM 0 HB VAL A 98 -6.674 -12.073 2.599 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -5.362 -14.289 2.735 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -5.443 -13.621 1.088 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -3.959 -13.433 2.052 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -5.326 -13.081 4.594 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -3.947 -12.080 4.080 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -5.440 -11.307 4.663 1.00 0.00 H new ATOM 1224 N GLY A 99 -4.426 -11.232 -0.503 1.00 0.00 N ATOM 1225 CA GLY A 99 -4.611 -11.652 -1.927 1.00 0.00 C ATOM 1226 C GLY A 99 -5.001 -10.573 -2.950 1.00 0.00 C ATOM 1227 O GLY A 99 -4.885 -10.909 -4.131 1.00 0.00 O ATOM 0 H GLY A 99 -3.462 -11.032 -0.237 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -3.682 -12.112 -2.264 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -5.377 -12.427 -1.950 1.00 0.00 H new ATOM 1231 N GLU A 100 -5.429 -9.333 -2.587 1.00 0.00 N ATOM 1232 CA GLU A 100 -5.856 -8.358 -3.644 1.00 0.00 C ATOM 1233 C GLU A 100 -4.963 -7.067 -3.849 1.00 0.00 C ATOM 1234 O GLU A 100 -3.761 -7.080 -3.546 1.00 0.00 O ATOM 1235 CB GLU A 100 -7.413 -8.289 -3.626 1.00 0.00 C ATOM 1236 CG GLU A 100 -8.138 -9.641 -3.920 1.00 0.00 C ATOM 1237 CD GLU A 100 -9.617 -9.636 -4.297 1.00 0.00 C ATOM 1238 OE1 GLU A 100 -10.310 -8.633 -4.428 1.00 0.00 O ATOM 1239 OE2 GLU A 100 -10.097 -10.894 -4.466 1.00 0.00 O ATOM 0 H GLU A 100 -5.489 -8.992 -1.628 1.00 0.00 H new ATOM 0 HA GLU A 100 -5.601 -8.715 -4.642 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -7.734 -7.927 -2.649 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -7.737 -7.553 -4.361 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -7.597 -10.132 -4.729 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -8.029 -10.269 -3.036 1.00 0.00 H new ATOM 1247 N LEU A 101 -5.508 -5.984 -4.463 1.00 0.00 N ATOM 1248 CA LEU A 101 -4.718 -4.795 -4.911 1.00 0.00 C ATOM 1249 C LEU A 101 -5.327 -3.355 -4.720 1.00 0.00 C ATOM 1250 O LEU A 101 -6.510 -3.072 -4.979 1.00 0.00 O ATOM 1251 CB LEU A 101 -4.330 -5.091 -6.401 1.00 0.00 C ATOM 1252 CG LEU A 101 -3.566 -4.052 -7.266 1.00 0.00 C ATOM 1253 CD1 LEU A 101 -2.243 -3.575 -6.653 1.00 0.00 C ATOM 1254 CD2 LEU A 101 -3.276 -4.660 -8.649 1.00 0.00 C ATOM 0 H LEU A 101 -6.505 -5.906 -4.663 1.00 0.00 H new ATOM 0 HA LEU A 101 -3.867 -4.707 -4.236 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -3.730 -6.001 -6.396 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -5.255 -5.322 -6.929 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.214 -3.178 -7.333 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -1.773 -2.852 -7.319 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.437 -3.107 -5.688 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -1.578 -4.427 -6.515 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -2.740 -3.934 -9.260 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -2.667 -5.556 -8.532 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -4.216 -4.921 -9.136 1.00 0.00 H new ATOM 1266 N CYS A 102 -4.440 -2.422 -4.297 1.00 0.00 N ATOM 1267 CA CYS A 102 -4.797 -0.989 -4.098 1.00 0.00 C ATOM 1268 C CYS A 102 -3.552 -0.047 -4.097 1.00 0.00 C ATOM 1269 O CYS A 102 -2.425 -0.491 -3.835 1.00 0.00 O ATOM 1270 CB CYS A 102 -5.601 -0.831 -2.796 1.00 0.00 C ATOM 1271 SG CYS A 102 -5.134 -1.985 -1.470 1.00 0.00 S ATOM 0 H CYS A 102 -3.465 -2.635 -4.085 1.00 0.00 H new ATOM 0 HA CYS A 102 -5.409 -0.685 -4.947 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -5.479 0.189 -2.431 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -6.659 -0.965 -3.020 1.00 0.00 H new ATOM 0 HG CYS A 102 -5.314 -3.207 -1.875 1.00 0.00 H new ATOM 1277 N ARG A 103 -3.726 1.267 -4.381 1.00 0.00 N ATOM 1278 CA ARG A 103 -2.624 2.232 -4.345 1.00 0.00 C ATOM 1279 C ARG A 103 -2.660 3.152 -3.100 1.00 0.00 C ATOM 1280 O ARG A 103 -3.639 3.829 -2.791 1.00 0.00 O ATOM 1281 CB ARG A 103 -2.427 3.018 -5.647 1.00 0.00 C ATOM 1282 CG ARG A 103 -3.594 3.762 -6.312 1.00 0.00 C ATOM 1283 CD ARG A 103 -3.159 4.537 -7.563 1.00 0.00 C ATOM 1284 NE ARG A 103 -4.350 5.233 -8.111 1.00 0.00 N ATOM 1285 CZ ARG A 103 -4.352 6.061 -9.146 1.00 0.00 C ATOM 1286 NH1 ARG A 103 -3.297 6.376 -9.838 1.00 0.00 N ATOM 1287 NH2 ARG A 103 -5.477 6.583 -9.482 1.00 0.00 N ATOM 0 H ARG A 103 -4.626 1.674 -4.637 1.00 0.00 H new ATOM 0 HA ARG A 103 -1.731 1.614 -4.249 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -1.646 3.755 -5.459 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -2.034 2.318 -6.385 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -4.370 3.046 -6.583 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -4.036 4.454 -5.595 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -2.379 5.256 -7.313 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -2.740 3.858 -8.305 1.00 0.00 H new ATOM 0 HE ARG A 103 -5.244 5.059 -7.652 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -2.390 5.977 -9.595 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -3.376 7.022 -10.623 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -6.322 6.355 -8.958 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -5.525 7.226 -10.272 1.00 0.00 H new ATOM 1300 N ILE A 104 -1.515 3.201 -2.430 1.00 0.00 N ATOM 1301 CA ILE A 104 -1.304 4.045 -1.226 1.00 0.00 C ATOM 1302 C ILE A 104 -1.228 5.568 -1.651 1.00 0.00 C ATOM 1303 O ILE A 104 -0.465 5.908 -2.562 1.00 0.00 O ATOM 1304 CB ILE A 104 0.004 3.559 -0.469 1.00 0.00 C ATOM 1305 CG1 ILE A 104 -0.082 2.112 0.107 1.00 0.00 C ATOM 1306 CG2 ILE A 104 0.380 4.510 0.673 1.00 0.00 C ATOM 1307 CD1 ILE A 104 0.986 1.612 1.115 1.00 0.00 C ATOM 0 H ILE A 104 -0.693 2.659 -2.696 1.00 0.00 H new ATOM 0 HA ILE A 104 -2.141 3.944 -0.535 1.00 0.00 H new ATOM 0 HB ILE A 104 0.773 3.560 -1.242 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -1.054 2.013 0.590 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -0.075 1.425 -0.740 1.00 0.00 H new ATOM 0 HG21 ILE A 104 1.280 4.146 1.168 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.565 5.506 0.271 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.437 4.555 1.393 1.00 0.00 H new ATOM 0 HD11 ILE A 104 0.762 0.585 1.403 1.00 0.00 H new ATOM 0 HD12 ILE A 104 1.971 1.651 0.651 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.977 2.248 2.000 1.00 0.00 H new ATOM 1319 N THR A 105 -1.969 6.466 -0.965 1.00 0.00 N ATOM 1320 CA THR A 105 -1.915 7.953 -1.228 1.00 0.00 C ATOM 1321 C THR A 105 -1.303 8.521 0.085 1.00 0.00 C ATOM 1322 O THR A 105 -1.930 8.436 1.157 1.00 0.00 O ATOM 1323 CB THR A 105 -3.314 8.506 -1.604 1.00 0.00 C ATOM 1324 OG1 THR A 105 -3.812 7.818 -2.747 1.00 0.00 O ATOM 1325 CG2 THR A 105 -3.319 9.996 -1.966 1.00 0.00 C ATOM 0 H THR A 105 -2.617 6.204 -0.222 1.00 0.00 H new ATOM 0 HA THR A 105 -1.311 8.244 -2.088 1.00 0.00 H new ATOM 0 HB THR A 105 -3.927 8.359 -0.715 1.00 0.00 H new ATOM 0 HG1 THR A 105 -4.697 8.169 -2.980 1.00 0.00 H new ATOM 0 HG21 THR A 105 -4.333 10.306 -2.217 1.00 0.00 H new ATOM 0 HG22 THR A 105 -2.961 10.578 -1.117 1.00 0.00 H new ATOM 0 HG23 THR A 105 -2.666 10.165 -2.822 1.00 0.00 H new ATOM 1333 N CYS A 106 -0.031 8.991 0.022 1.00 0.00 N ATOM 1334 CA CYS A 106 0.745 9.203 1.274 1.00 0.00 C ATOM 1335 C CYS A 106 1.991 10.150 1.274 1.00 0.00 C ATOM 1336 O CYS A 106 2.640 10.474 0.282 1.00 0.00 O ATOM 1337 CB CYS A 106 1.275 7.767 1.486 1.00 0.00 C ATOM 1338 SG CYS A 106 2.131 7.033 0.026 1.00 0.00 S ATOM 0 H CYS A 106 0.463 9.222 -0.840 1.00 0.00 H new ATOM 0 HA CYS A 106 0.102 9.689 2.007 1.00 0.00 H new ATOM 0 HB2 CYS A 106 1.965 7.771 2.330 1.00 0.00 H new ATOM 0 HB3 CYS A 106 0.439 7.123 1.761 1.00 0.00 H new ATOM 0 HG CYS A 106 1.272 6.844 -0.931 1.00 0.00 H new ATOM 1344 N LYS A 107 2.323 10.499 2.507 1.00 0.00 N ATOM 1345 CA LYS A 107 3.667 10.963 2.908 1.00 0.00 C ATOM 1346 C LYS A 107 4.533 12.013 3.713 1.00 0.00 C ATOM 1347 O LYS A 107 4.281 12.290 4.901 1.00 0.00 O ATOM 1348 CB LYS A 107 4.148 9.632 3.624 1.00 0.00 C ATOM 1349 CG LYS A 107 5.133 8.740 2.851 1.00 0.00 C ATOM 1350 CD LYS A 107 4.549 7.681 1.919 1.00 0.00 C ATOM 1351 CE LYS A 107 5.399 6.457 1.570 1.00 0.00 C ATOM 1352 NZ LYS A 107 4.550 5.362 1.061 1.00 0.00 N ATOM 0 H LYS A 107 1.661 10.471 3.282 1.00 0.00 H new ATOM 0 HA LYS A 107 3.743 11.593 2.021 1.00 0.00 H new ATOM 0 HB2 LYS A 107 4.611 9.906 4.572 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.266 9.037 3.860 1.00 0.00 H new ATOM 0 HG2 LYS A 107 5.779 9.388 2.259 1.00 0.00 H new ATOM 0 HG3 LYS A 107 5.769 8.234 3.578 1.00 0.00 H new ATOM 0 HD2 LYS A 107 3.622 7.322 2.366 1.00 0.00 H new ATOM 0 HD3 LYS A 107 4.282 8.175 0.985 1.00 0.00 H new ATOM 0 HE2 LYS A 107 6.143 6.726 0.820 1.00 0.00 H new ATOM 0 HE3 LYS A 107 5.943 6.122 2.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 4.544 4.580 1.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 3.579 5.710 0.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 4.927 5.024 0.153 1.00 0.00 H new ATOM 1365 N PRO A 108 5.726 12.265 3.120 1.00 0.00 N ATOM 1366 CA PRO A 108 6.913 12.889 3.764 1.00 0.00 C ATOM 1367 C PRO A 108 7.254 12.611 5.278 1.00 0.00 C ATOM 1368 O PRO A 108 8.238 11.925 5.563 1.00 0.00 O ATOM 1369 CB PRO A 108 7.222 14.160 2.963 1.00 0.00 C ATOM 1370 CG PRO A 108 6.855 13.668 1.562 1.00 0.00 C ATOM 1371 CD PRO A 108 5.698 12.668 1.710 1.00 0.00 C ATOM 0 HA PRO A 108 7.842 12.320 3.751 1.00 0.00 H new ATOM 0 HB2 PRO A 108 6.620 15.012 3.279 1.00 0.00 H new ATOM 0 HB3 PRO A 108 8.267 14.461 3.041 1.00 0.00 H new ATOM 0 HG2 PRO A 108 6.560 14.504 0.928 1.00 0.00 H new ATOM 0 HG3 PRO A 108 7.713 13.193 1.086 1.00 0.00 H new ATOM 0 HD2 PRO A 108 4.744 13.126 1.449 1.00 0.00 H new ATOM 0 HD3 PRO A 108 5.831 11.810 1.051 1.00 0.00 H new ATOM 1379 N GLU A 109 6.427 12.989 6.257 1.00 0.00 N ATOM 1380 CA GLU A 109 6.650 12.593 7.681 1.00 0.00 C ATOM 1381 C GLU A 109 6.554 11.042 7.960 1.00 0.00 C ATOM 1382 O GLU A 109 7.283 10.508 8.798 1.00 0.00 O ATOM 1383 CB GLU A 109 5.807 13.493 8.625 1.00 0.00 C ATOM 1384 CG GLU A 109 4.279 13.209 8.671 1.00 0.00 C ATOM 1385 CD GLU A 109 3.438 14.253 9.393 1.00 0.00 C ATOM 1386 OE1 GLU A 109 2.677 15.024 8.817 1.00 0.00 O ATOM 1387 OE2 GLU A 109 3.629 14.222 10.742 1.00 0.00 O ATOM 0 H GLU A 109 5.598 13.565 6.108 1.00 0.00 H new ATOM 0 HA GLU A 109 7.697 12.785 7.915 1.00 0.00 H new ATOM 0 HB2 GLU A 109 6.203 13.393 9.636 1.00 0.00 H new ATOM 0 HB3 GLU A 109 5.952 14.531 8.327 1.00 0.00 H new ATOM 0 HG2 GLU A 109 3.913 13.118 7.648 1.00 0.00 H new ATOM 0 HG3 GLU A 109 4.121 12.244 9.153 1.00 0.00 H new ATOM 1395 N TYR A 110 5.682 10.329 7.224 1.00 0.00 N ATOM 1396 CA TYR A 110 5.587 8.849 7.246 1.00 0.00 C ATOM 1397 C TYR A 110 6.680 8.105 6.348 1.00 0.00 C ATOM 1398 O TYR A 110 6.666 6.874 6.297 1.00 0.00 O ATOM 1399 CB TYR A 110 4.092 8.527 6.943 1.00 0.00 C ATOM 1400 CG TYR A 110 3.106 8.568 8.133 1.00 0.00 C ATOM 1401 CD1 TYR A 110 2.648 9.782 8.649 1.00 0.00 C ATOM 1402 CD2 TYR A 110 2.690 7.381 8.745 1.00 0.00 C ATOM 1403 CE1 TYR A 110 1.919 9.812 9.839 1.00 0.00 C ATOM 1404 CE2 TYR A 110 1.969 7.407 9.930 1.00 0.00 C ATOM 1405 CZ TYR A 110 1.612 8.623 10.497 1.00 0.00 C ATOM 1406 OH TYR A 110 0.908 8.636 11.670 1.00 0.00 O ATOM 0 H TYR A 110 5.014 10.765 6.588 1.00 0.00 H new ATOM 0 HA TYR A 110 5.853 8.438 8.220 1.00 0.00 H new ATOM 0 HB2 TYR A 110 3.741 9.231 6.189 1.00 0.00 H new ATOM 0 HB3 TYR A 110 4.044 7.533 6.498 1.00 0.00 H new ATOM 0 HD1 TYR A 110 2.859 10.702 8.125 1.00 0.00 H new ATOM 0 HD2 TYR A 110 2.933 6.432 8.289 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.593 10.756 10.249 1.00 0.00 H new ATOM 0 HE2 TYR A 110 1.686 6.482 10.411 1.00 0.00 H new ATOM 0 HH TYR A 110 0.784 7.717 11.987 1.00 0.00 H new ATOM 1416 N ALA A 111 7.613 8.814 5.656 1.00 0.00 N ATOM 1417 CA ALA A 111 8.719 8.189 4.830 1.00 0.00 C ATOM 1418 C ALA A 111 10.095 9.006 4.768 1.00 0.00 C ATOM 1419 O ALA A 111 10.866 8.988 5.727 1.00 0.00 O ATOM 1420 CB ALA A 111 8.210 7.910 3.412 1.00 0.00 C ATOM 0 H ALA A 111 7.632 9.834 5.646 1.00 0.00 H new ATOM 0 HA ALA A 111 8.972 7.266 5.352 1.00 0.00 H new ATOM 0 HB1 ALA A 111 9.008 7.461 2.821 1.00 0.00 H new ATOM 0 HB2 ALA A 111 7.363 7.226 3.458 1.00 0.00 H new ATOM 0 HB3 ALA A 111 7.897 8.845 2.947 1.00 0.00 H new ATOM 1426 N TYR A 112 10.413 9.695 3.631 1.00 0.00 N ATOM 1427 CA TYR A 112 11.706 10.447 3.389 1.00 0.00 C ATOM 1428 C TYR A 112 11.719 11.960 3.829 1.00 0.00 C ATOM 1429 O TYR A 112 12.782 12.577 3.769 1.00 0.00 O ATOM 1430 CB TYR A 112 12.228 10.351 1.892 1.00 0.00 C ATOM 1431 CG TYR A 112 11.960 9.037 1.118 1.00 0.00 C ATOM 1432 CD1 TYR A 112 12.654 7.885 1.502 1.00 0.00 C ATOM 1433 CD2 TYR A 112 11.039 8.953 0.068 1.00 0.00 C ATOM 1434 CE1 TYR A 112 12.413 6.665 0.875 1.00 0.00 C ATOM 1435 CE2 TYR A 112 10.799 7.728 -0.560 1.00 0.00 C ATOM 1436 CZ TYR A 112 11.481 6.589 -0.154 1.00 0.00 C ATOM 1437 OH TYR A 112 11.255 5.400 -0.792 1.00 0.00 O ATOM 0 H TYR A 112 9.774 9.751 2.838 1.00 0.00 H new ATOM 0 HA TYR A 112 12.387 9.915 4.053 1.00 0.00 H new ATOM 0 HB2 TYR A 112 11.781 11.169 1.328 1.00 0.00 H new ATOM 0 HB3 TYR A 112 13.305 10.521 1.901 1.00 0.00 H new ATOM 0 HD1 TYR A 112 13.386 7.942 2.294 1.00 0.00 H new ATOM 0 HD2 TYR A 112 10.512 9.838 -0.258 1.00 0.00 H new ATOM 0 HE1 TYR A 112 12.948 5.781 1.187 1.00 0.00 H new ATOM 0 HE2 TYR A 112 10.080 7.667 -1.364 1.00 0.00 H new ATOM 0 HH TYR A 112 10.572 5.525 -1.484 1.00 0.00 H new ATOM 1447 N GLY A 113 10.597 12.581 4.247 1.00 0.00 N ATOM 1448 CA GLY A 113 10.531 14.016 4.688 1.00 0.00 C ATOM 1449 C GLY A 113 11.553 14.671 5.646 1.00 0.00 C ATOM 1450 O GLY A 113 11.628 15.899 5.680 1.00 0.00 O ATOM 0 H GLY A 113 9.695 12.108 4.294 1.00 0.00 H new ATOM 0 HA2 GLY A 113 10.539 14.616 3.778 1.00 0.00 H new ATOM 0 HA3 GLY A 113 9.552 14.149 5.149 1.00 0.00 H new ATOM 1454 N SER A 114 12.288 13.901 6.454 1.00 0.00 N ATOM 1455 CA SER A 114 13.376 14.446 7.315 1.00 0.00 C ATOM 1456 C SER A 114 14.645 14.880 6.492 1.00 0.00 C ATOM 1457 O SER A 114 15.060 16.038 6.577 1.00 0.00 O ATOM 1458 CB SER A 114 13.677 13.423 8.441 1.00 0.00 C ATOM 1459 OG SER A 114 14.154 12.170 7.934 1.00 0.00 O ATOM 0 H SER A 114 12.159 12.893 6.540 1.00 0.00 H new ATOM 0 HA SER A 114 13.041 15.374 7.779 1.00 0.00 H new ATOM 0 HB2 SER A 114 14.420 13.843 9.119 1.00 0.00 H new ATOM 0 HB3 SER A 114 12.772 13.254 9.025 1.00 0.00 H new ATOM 0 HG SER A 114 14.331 11.561 8.681 1.00 0.00 H new ATOM 1465 N ALA A 115 15.238 13.968 5.697 1.00 0.00 N ATOM 1466 CA ALA A 115 16.433 14.267 4.857 1.00 0.00 C ATOM 1467 C ALA A 115 16.420 13.817 3.346 1.00 0.00 C ATOM 1468 O ALA A 115 17.413 14.104 2.669 1.00 0.00 O ATOM 1469 CB ALA A 115 17.627 13.649 5.618 1.00 0.00 C ATOM 0 H ALA A 115 14.910 13.006 5.613 1.00 0.00 H new ATOM 0 HA ALA A 115 16.478 15.350 4.738 1.00 0.00 H new ATOM 0 HB1 ALA A 115 18.546 13.828 5.060 1.00 0.00 H new ATOM 0 HB2 ALA A 115 17.706 14.106 6.604 1.00 0.00 H new ATOM 0 HB3 ALA A 115 17.473 12.576 5.727 1.00 0.00 H new ATOM 1475 N GLY A 116 15.380 13.166 2.766 1.00 0.00 N ATOM 1476 CA GLY A 116 15.408 12.705 1.359 1.00 0.00 C ATOM 1477 C GLY A 116 15.991 11.286 1.143 1.00 0.00 C ATOM 1478 O GLY A 116 16.788 10.774 1.935 1.00 0.00 O ATOM 0 H GLY A 116 14.511 12.949 3.254 1.00 0.00 H new ATOM 0 HA2 GLY A 116 14.392 12.727 0.966 1.00 0.00 H new ATOM 0 HA3 GLY A 116 15.992 13.414 0.772 1.00 0.00 H new ATOM 1482 N SER A 117 15.566 10.622 0.059 1.00 0.00 N ATOM 1483 CA SER A 117 16.079 9.274 -0.294 1.00 0.00 C ATOM 1484 C SER A 117 17.445 9.386 -1.075 1.00 0.00 C ATOM 1485 O SER A 117 17.472 10.119 -2.072 1.00 0.00 O ATOM 1486 CB SER A 117 15.063 8.486 -1.148 1.00 0.00 C ATOM 1487 OG SER A 117 15.384 7.094 -1.164 1.00 0.00 O ATOM 0 H SER A 117 14.871 10.988 -0.592 1.00 0.00 H new ATOM 0 HA SER A 117 16.238 8.735 0.640 1.00 0.00 H new ATOM 0 HB2 SER A 117 14.059 8.627 -0.749 1.00 0.00 H new ATOM 0 HB3 SER A 117 15.059 8.874 -2.166 1.00 0.00 H new ATOM 0 HG SER A 117 14.727 6.613 -1.709 1.00 0.00 H new ATOM 1493 N PRO A 118 18.544 8.651 -0.726 1.00 0.00 N ATOM 1494 CA PRO A 118 19.864 8.717 -1.426 1.00 0.00 C ATOM 1495 C PRO A 118 19.993 8.958 -2.983 1.00 0.00 C ATOM 1496 O PRO A 118 20.808 9.820 -3.323 1.00 0.00 O ATOM 1497 CB PRO A 118 20.552 7.439 -0.916 1.00 0.00 C ATOM 1498 CG PRO A 118 20.026 7.266 0.512 1.00 0.00 C ATOM 1499 CD PRO A 118 18.605 7.840 0.503 1.00 0.00 C ATOM 0 HA PRO A 118 20.331 9.671 -1.181 1.00 0.00 H new ATOM 0 HB2 PRO A 118 20.303 6.579 -1.538 1.00 0.00 H new ATOM 0 HB3 PRO A 118 21.637 7.539 -0.930 1.00 0.00 H new ATOM 0 HG2 PRO A 118 20.022 6.216 0.803 1.00 0.00 H new ATOM 0 HG3 PRO A 118 20.657 7.793 1.228 1.00 0.00 H new ATOM 0 HD2 PRO A 118 17.857 7.048 0.493 1.00 0.00 H new ATOM 0 HD3 PRO A 118 18.416 8.446 1.389 1.00 0.00 H new ATOM 1507 N PRO A 119 19.282 8.302 -3.956 1.00 0.00 N ATOM 1508 CA PRO A 119 19.441 8.613 -5.408 1.00 0.00 C ATOM 1509 C PRO A 119 18.948 10.026 -5.886 1.00 0.00 C ATOM 1510 O PRO A 119 19.726 10.745 -6.516 1.00 0.00 O ATOM 1511 CB PRO A 119 18.748 7.412 -6.086 1.00 0.00 C ATOM 1512 CG PRO A 119 17.742 6.896 -5.053 1.00 0.00 C ATOM 1513 CD PRO A 119 18.435 7.120 -3.709 1.00 0.00 C ATOM 0 HA PRO A 119 20.490 8.718 -5.684 1.00 0.00 H new ATOM 0 HB2 PRO A 119 18.248 7.714 -7.006 1.00 0.00 H new ATOM 0 HB3 PRO A 119 19.470 6.640 -6.353 1.00 0.00 H new ATOM 0 HG2 PRO A 119 16.799 7.439 -5.110 1.00 0.00 H new ATOM 0 HG3 PRO A 119 17.513 5.842 -5.212 1.00 0.00 H new ATOM 0 HD2 PRO A 119 17.715 7.301 -2.911 1.00 0.00 H new ATOM 0 HD3 PRO A 119 19.028 6.255 -3.413 1.00 0.00 H new ATOM 1521 N LYS A 120 17.681 10.407 -5.625 1.00 0.00 N ATOM 1522 CA LYS A 120 17.123 11.738 -6.021 1.00 0.00 C ATOM 1523 C LYS A 120 15.674 12.011 -5.449 1.00 0.00 C ATOM 1524 O LYS A 120 14.668 11.912 -6.160 1.00 0.00 O ATOM 1525 CB LYS A 120 17.159 12.065 -7.526 1.00 0.00 C ATOM 1526 CG LYS A 120 16.599 11.035 -8.541 1.00 0.00 C ATOM 1527 CD LYS A 120 16.618 11.520 -10.005 1.00 0.00 C ATOM 1528 CE LYS A 120 18.025 11.583 -10.622 1.00 0.00 C ATOM 1529 NZ LYS A 120 17.934 12.013 -12.030 1.00 0.00 N ATOM 0 H LYS A 120 17.011 9.813 -5.137 1.00 0.00 H new ATOM 0 HA LYS A 120 17.827 12.421 -5.546 1.00 0.00 H new ATOM 0 HB2 LYS A 120 16.614 12.998 -7.672 1.00 0.00 H new ATOM 0 HB3 LYS A 120 18.198 12.258 -7.794 1.00 0.00 H new ATOM 0 HG2 LYS A 120 17.179 10.115 -8.467 1.00 0.00 H new ATOM 0 HG3 LYS A 120 15.574 10.789 -8.264 1.00 0.00 H new ATOM 0 HD2 LYS A 120 15.998 10.855 -10.606 1.00 0.00 H new ATOM 0 HD3 LYS A 120 16.165 12.510 -10.055 1.00 0.00 H new ATOM 0 HE2 LYS A 120 18.648 12.278 -10.059 1.00 0.00 H new ATOM 0 HE3 LYS A 120 18.503 10.605 -10.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 18.888 12.054 -12.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 17.355 11.334 -12.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 17.495 12.955 -12.078 1.00 0.00 H new ATOM 1542 N ILE A 121 15.547 12.382 -4.169 1.00 0.00 N ATOM 1543 CA ILE A 121 14.233 12.735 -3.530 1.00 0.00 C ATOM 1544 C ILE A 121 14.438 13.957 -2.551 1.00 0.00 C ATOM 1545 O ILE A 121 15.261 13.823 -1.637 1.00 0.00 O ATOM 1546 CB ILE A 121 13.540 11.514 -2.802 1.00 0.00 C ATOM 1547 CG1 ILE A 121 13.019 10.446 -3.808 1.00 0.00 C ATOM 1548 CG2 ILE A 121 12.417 11.926 -1.801 1.00 0.00 C ATOM 1549 CD1 ILE A 121 12.134 9.303 -3.297 1.00 0.00 C ATOM 0 H ILE A 121 16.340 12.452 -3.531 1.00 0.00 H new ATOM 0 HA ILE A 121 13.545 13.018 -4.327 1.00 0.00 H new ATOM 0 HB ILE A 121 14.333 11.064 -2.204 1.00 0.00 H new ATOM 0 HG12 ILE A 121 12.461 10.971 -4.583 1.00 0.00 H new ATOM 0 HG13 ILE A 121 13.888 9.997 -4.289 1.00 0.00 H new ATOM 0 HG21 ILE A 121 11.992 11.033 -1.344 1.00 0.00 H new ATOM 0 HG22 ILE A 121 12.838 12.566 -1.025 1.00 0.00 H new ATOM 0 HG23 ILE A 121 11.636 12.468 -2.334 1.00 0.00 H new ATOM 0 HD11 ILE A 121 11.862 8.653 -4.129 1.00 0.00 H new ATOM 0 HD12 ILE A 121 12.679 8.727 -2.550 1.00 0.00 H new ATOM 0 HD13 ILE A 121 11.230 9.715 -2.849 1.00 0.00 H new ATOM 1561 N PRO A 122 13.708 15.113 -2.624 1.00 0.00 N ATOM 1562 CA PRO A 122 13.827 16.198 -1.615 1.00 0.00 C ATOM 1563 C PRO A 122 12.802 16.017 -0.414 1.00 0.00 C ATOM 1564 O PRO A 122 11.816 15.281 -0.562 1.00 0.00 O ATOM 1565 CB PRO A 122 13.558 17.424 -2.506 1.00 0.00 C ATOM 1566 CG PRO A 122 12.559 16.958 -3.573 1.00 0.00 C ATOM 1567 CD PRO A 122 12.729 15.437 -3.684 1.00 0.00 C ATOM 0 HA PRO A 122 14.778 16.248 -1.085 1.00 0.00 H new ATOM 0 HB2 PRO A 122 13.149 18.249 -1.922 1.00 0.00 H new ATOM 0 HB3 PRO A 122 14.479 17.783 -2.964 1.00 0.00 H new ATOM 0 HG2 PRO A 122 11.539 17.216 -3.290 1.00 0.00 H new ATOM 0 HG3 PRO A 122 12.757 17.443 -4.529 1.00 0.00 H new ATOM 0 HD2 PRO A 122 11.784 14.916 -3.528 1.00 0.00 H new ATOM 0 HD3 PRO A 122 13.095 15.146 -4.669 1.00 0.00 H new ATOM 1575 N PRO A 123 12.949 16.668 0.776 1.00 0.00 N ATOM 1576 CA PRO A 123 11.983 16.503 1.910 1.00 0.00 C ATOM 1577 C PRO A 123 10.493 16.972 1.691 1.00 0.00 C ATOM 1578 O PRO A 123 9.561 16.356 2.209 1.00 0.00 O ATOM 1579 CB PRO A 123 12.714 17.235 3.054 1.00 0.00 C ATOM 1580 CG PRO A 123 13.641 18.244 2.373 1.00 0.00 C ATOM 1581 CD PRO A 123 14.101 17.531 1.104 1.00 0.00 C ATOM 0 HA PRO A 123 11.775 15.449 2.094 1.00 0.00 H new ATOM 0 HB2 PRO A 123 12.006 17.737 3.714 1.00 0.00 H new ATOM 0 HB3 PRO A 123 13.281 16.535 3.668 1.00 0.00 H new ATOM 0 HG2 PRO A 123 13.118 19.172 2.141 1.00 0.00 H new ATOM 0 HG3 PRO A 123 14.485 18.504 3.012 1.00 0.00 H new ATOM 0 HD2 PRO A 123 14.320 18.235 0.301 1.00 0.00 H new ATOM 0 HD3 PRO A 123 15.007 16.949 1.273 1.00 0.00 H new ATOM 1589 N ASN A 124 10.252 18.043 0.927 1.00 0.00 N ATOM 1590 CA ASN A 124 8.923 18.602 0.612 1.00 0.00 C ATOM 1591 C ASN A 124 8.276 17.977 -0.690 1.00 0.00 C ATOM 1592 O ASN A 124 7.906 18.716 -1.609 1.00 0.00 O ATOM 1593 CB ASN A 124 9.140 20.147 0.559 1.00 0.00 C ATOM 1594 CG ASN A 124 10.153 20.736 -0.441 1.00 0.00 C ATOM 1595 OD1 ASN A 124 11.343 20.836 -0.172 1.00 0.00 O ATOM 1596 ND2 ASN A 124 9.734 21.117 -1.617 1.00 0.00 N ATOM 0 H ASN A 124 11.008 18.570 0.490 1.00 0.00 H new ATOM 0 HA ASN A 124 8.181 18.348 1.369 1.00 0.00 H new ATOM 0 HB2 ASN A 124 8.173 20.606 0.353 1.00 0.00 H new ATOM 0 HB3 ASN A 124 9.440 20.469 1.556 1.00 0.00 H new ATOM 0 HD21 ASN A 124 10.395 21.492 -2.297 1.00 0.00 H new ATOM 0 HD22 ASN A 124 8.745 21.040 -1.856 1.00 0.00 H new ATOM 1603 N ALA A 125 8.094 16.640 -0.782 1.00 0.00 N ATOM 1604 CA ALA A 125 7.576 15.989 -2.032 1.00 0.00 C ATOM 1605 C ALA A 125 6.651 14.763 -1.762 1.00 0.00 C ATOM 1606 O ALA A 125 7.141 13.688 -1.403 1.00 0.00 O ATOM 1607 CB ALA A 125 8.806 15.588 -2.877 1.00 0.00 C ATOM 0 H ALA A 125 8.292 15.988 -0.023 1.00 0.00 H new ATOM 0 HA ALA A 125 6.941 16.698 -2.563 1.00 0.00 H new ATOM 0 HB1 ALA A 125 8.474 15.109 -3.798 1.00 0.00 H new ATOM 0 HB2 ALA A 125 9.387 16.478 -3.119 1.00 0.00 H new ATOM 0 HB3 ALA A 125 9.426 14.893 -2.310 1.00 0.00 H new ATOM 1613 N THR A 126 5.322 14.883 -1.969 1.00 0.00 N ATOM 1614 CA THR A 126 4.353 13.779 -1.678 1.00 0.00 C ATOM 1615 C THR A 126 4.613 12.448 -2.502 1.00 0.00 C ATOM 1616 O THR A 126 5.220 12.482 -3.578 1.00 0.00 O ATOM 1617 CB THR A 126 2.882 14.306 -1.728 1.00 0.00 C ATOM 1618 OG1 THR A 126 2.761 15.578 -1.097 1.00 0.00 O ATOM 1619 CG2 THR A 126 1.877 13.424 -0.961 1.00 0.00 C ATOM 0 H THR A 126 4.886 15.729 -2.336 1.00 0.00 H new ATOM 0 HA THR A 126 4.532 13.455 -0.653 1.00 0.00 H new ATOM 0 HB THR A 126 2.658 14.324 -2.795 1.00 0.00 H new ATOM 0 HG1 THR A 126 1.830 15.881 -1.147 1.00 0.00 H new ATOM 0 HG21 THR A 126 0.879 13.855 -1.042 1.00 0.00 H new ATOM 0 HG22 THR A 126 1.875 12.421 -1.387 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.166 13.372 0.089 1.00 0.00 H new ATOM 1627 N LEU A 127 4.198 11.272 -1.993 1.00 0.00 N ATOM 1628 CA LEU A 127 4.492 9.954 -2.615 1.00 0.00 C ATOM 1629 C LEU A 127 3.185 9.141 -2.902 1.00 0.00 C ATOM 1630 O LEU A 127 2.077 9.469 -2.457 1.00 0.00 O ATOM 1631 CB LEU A 127 5.387 9.204 -1.573 1.00 0.00 C ATOM 1632 CG LEU A 127 6.898 9.540 -1.478 1.00 0.00 C ATOM 1633 CD1 LEU A 127 7.518 8.738 -0.332 1.00 0.00 C ATOM 1634 CD2 LEU A 127 7.609 9.205 -2.791 1.00 0.00 C ATOM 0 H LEU A 127 3.648 11.203 -1.137 1.00 0.00 H new ATOM 0 HA LEU A 127 4.985 10.074 -3.580 1.00 0.00 H new ATOM 0 HB2 LEU A 127 4.953 9.374 -0.588 1.00 0.00 H new ATOM 0 HB3 LEU A 127 5.303 8.137 -1.779 1.00 0.00 H new ATOM 0 HG LEU A 127 7.014 10.607 -1.289 1.00 0.00 H new ATOM 0 HD11 LEU A 127 8.581 8.969 -0.259 1.00 0.00 H new ATOM 0 HD12 LEU A 127 7.025 9.000 0.604 1.00 0.00 H new ATOM 0 HD13 LEU A 127 7.391 7.672 -0.523 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.668 9.448 -2.704 1.00 0.00 H new ATOM 0 HD22 LEU A 127 7.497 8.142 -3.004 1.00 0.00 H new ATOM 0 HD23 LEU A 127 7.169 9.786 -3.602 1.00 0.00 H new ATOM 1646 N VAL A 128 3.349 8.015 -3.605 1.00 0.00 N ATOM 1647 CA VAL A 128 2.259 7.074 -3.932 1.00 0.00 C ATOM 1648 C VAL A 128 2.909 5.666 -4.117 1.00 0.00 C ATOM 1649 O VAL A 128 3.839 5.529 -4.922 1.00 0.00 O ATOM 1650 CB VAL A 128 1.452 7.469 -5.215 1.00 0.00 C ATOM 1651 CG1 VAL A 128 0.283 8.443 -4.968 1.00 0.00 C ATOM 1652 CG2 VAL A 128 2.247 7.943 -6.446 1.00 0.00 C ATOM 0 H VAL A 128 4.255 7.722 -3.971 1.00 0.00 H new ATOM 0 HA VAL A 128 1.533 7.088 -3.119 1.00 0.00 H new ATOM 0 HB VAL A 128 1.061 6.485 -5.473 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -0.217 8.659 -5.912 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -0.428 7.990 -4.277 1.00 0.00 H new ATOM 0 HG13 VAL A 128 0.666 9.370 -4.540 1.00 0.00 H new ATOM 0 HG21 VAL A 128 1.557 8.181 -7.255 1.00 0.00 H new ATOM 0 HG22 VAL A 128 2.823 8.831 -6.187 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.925 7.152 -6.768 1.00 0.00 H new ATOM 1662 N PHE A 129 2.484 4.627 -3.374 1.00 0.00 N ATOM 1663 CA PHE A 129 3.050 3.246 -3.604 1.00 0.00 C ATOM 1664 C PHE A 129 1.868 2.279 -3.902 1.00 0.00 C ATOM 1665 O PHE A 129 0.962 2.075 -3.097 1.00 0.00 O ATOM 1666 CB PHE A 129 4.018 2.596 -2.581 1.00 0.00 C ATOM 1667 CG PHE A 129 5.335 3.270 -2.148 1.00 0.00 C ATOM 1668 CD1 PHE A 129 5.459 4.647 -1.987 1.00 0.00 C ATOM 1669 CD2 PHE A 129 6.455 2.467 -1.901 1.00 0.00 C ATOM 1670 CE1 PHE A 129 6.666 5.215 -1.624 1.00 0.00 C ATOM 1671 CE2 PHE A 129 7.667 3.031 -1.511 1.00 0.00 C ATOM 1672 CZ PHE A 129 7.771 4.410 -1.368 1.00 0.00 C ATOM 0 H PHE A 129 1.783 4.690 -2.636 1.00 0.00 H new ATOM 0 HA PHE A 129 3.734 3.415 -4.436 1.00 0.00 H new ATOM 0 HB2 PHE A 129 3.442 2.423 -1.672 1.00 0.00 H new ATOM 0 HB3 PHE A 129 4.284 1.618 -2.981 1.00 0.00 H new ATOM 0 HD1 PHE A 129 4.600 5.281 -2.148 1.00 0.00 H new ATOM 0 HD2 PHE A 129 6.378 1.396 -2.014 1.00 0.00 H new ATOM 0 HE1 PHE A 129 6.751 6.288 -1.539 1.00 0.00 H new ATOM 0 HE2 PHE A 129 8.522 2.400 -1.320 1.00 0.00 H new ATOM 0 HZ PHE A 129 8.706 4.854 -1.059 1.00 0.00 H new ATOM 1682 N GLU A 130 1.897 1.653 -5.067 1.00 0.00 N ATOM 1683 CA GLU A 130 0.857 0.690 -5.507 1.00 0.00 C ATOM 1684 C GLU A 130 1.265 -0.715 -5.054 1.00 0.00 C ATOM 1685 O GLU A 130 2.241 -1.284 -5.551 1.00 0.00 O ATOM 1686 CB GLU A 130 0.698 0.959 -7.010 1.00 0.00 C ATOM 1687 CG GLU A 130 -0.442 0.350 -7.833 1.00 0.00 C ATOM 1688 CD GLU A 130 -0.274 -1.014 -8.510 1.00 0.00 C ATOM 1689 OE1 GLU A 130 -1.073 -1.446 -9.331 1.00 0.00 O ATOM 1690 OE2 GLU A 130 0.845 -1.688 -8.132 1.00 0.00 O ATOM 0 H GLU A 130 2.641 1.788 -5.751 1.00 0.00 H new ATOM 0 HA GLU A 130 -0.133 0.797 -5.064 1.00 0.00 H new ATOM 0 HB2 GLU A 130 0.627 2.040 -7.129 1.00 0.00 H new ATOM 0 HB3 GLU A 130 1.628 0.646 -7.484 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -1.309 0.278 -7.176 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -0.693 1.067 -8.614 1.00 0.00 H new ATOM 1698 N VAL A 131 0.553 -1.232 -4.046 1.00 0.00 N ATOM 1699 CA VAL A 131 0.959 -2.497 -3.405 1.00 0.00 C ATOM 1700 C VAL A 131 -0.068 -3.621 -3.700 1.00 0.00 C ATOM 1701 O VAL A 131 -1.291 -3.430 -3.639 1.00 0.00 O ATOM 1702 CB VAL A 131 1.197 -2.282 -1.869 1.00 0.00 C ATOM 1703 CG1 VAL A 131 1.975 -3.476 -1.273 1.00 0.00 C ATOM 1704 CG2 VAL A 131 2.004 -1.023 -1.462 1.00 0.00 C ATOM 0 H VAL A 131 -0.290 -0.808 -3.660 1.00 0.00 H new ATOM 0 HA VAL A 131 1.907 -2.823 -3.832 1.00 0.00 H new ATOM 0 HB VAL A 131 0.183 -2.169 -1.485 1.00 0.00 H new ATOM 0 HG11 VAL A 131 2.132 -3.312 -0.207 1.00 0.00 H new ATOM 0 HG12 VAL A 131 1.403 -4.392 -1.419 1.00 0.00 H new ATOM 0 HG13 VAL A 131 2.940 -3.567 -1.772 1.00 0.00 H new ATOM 0 HG21 VAL A 131 2.100 -0.987 -0.377 1.00 0.00 H new ATOM 0 HG22 VAL A 131 2.995 -1.065 -1.913 1.00 0.00 H new ATOM 0 HG23 VAL A 131 1.485 -0.130 -1.810 1.00 0.00 H new ATOM 1714 N GLU A 132 0.480 -4.796 -4.032 1.00 0.00 N ATOM 1715 CA GLU A 132 -0.322 -6.031 -4.193 1.00 0.00 C ATOM 1716 C GLU A 132 0.161 -6.959 -3.056 1.00 0.00 C ATOM 1717 O GLU A 132 1.314 -7.398 -3.005 1.00 0.00 O ATOM 1718 CB GLU A 132 -0.174 -6.679 -5.581 1.00 0.00 C ATOM 1719 CG GLU A 132 -1.175 -7.829 -5.873 1.00 0.00 C ATOM 1720 CD GLU A 132 -1.317 -8.209 -7.343 1.00 0.00 C ATOM 1721 OE1 GLU A 132 -2.381 -8.179 -7.952 1.00 0.00 O ATOM 1722 OE2 GLU A 132 -0.141 -8.592 -7.909 1.00 0.00 O ATOM 0 H GLU A 132 1.478 -4.925 -4.196 1.00 0.00 H new ATOM 0 HA GLU A 132 -1.389 -5.820 -4.129 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -0.297 -5.908 -6.341 1.00 0.00 H new ATOM 0 HB3 GLU A 132 0.840 -7.065 -5.680 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -0.863 -8.712 -5.315 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -2.155 -7.541 -5.492 1.00 0.00 H new ATOM 1730 N LEU A 133 -0.736 -7.204 -2.117 1.00 0.00 N ATOM 1731 CA LEU A 133 -0.416 -8.051 -0.940 1.00 0.00 C ATOM 1732 C LEU A 133 -0.979 -9.473 -1.178 1.00 0.00 C ATOM 1733 O LEU A 133 -2.188 -9.680 -1.255 1.00 0.00 O ATOM 1734 CB LEU A 133 -0.895 -7.352 0.352 1.00 0.00 C ATOM 1735 CG LEU A 133 -0.559 -8.069 1.681 1.00 0.00 C ATOM 1736 CD1 LEU A 133 0.925 -8.332 1.956 1.00 0.00 C ATOM 1737 CD2 LEU A 133 -1.092 -7.241 2.863 1.00 0.00 C ATOM 0 H LEU A 133 -1.689 -6.840 -2.129 1.00 0.00 H new ATOM 0 HA LEU A 133 0.659 -8.177 -0.807 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -0.460 -6.353 0.382 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -1.976 -7.228 0.294 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.035 -9.044 1.577 1.00 0.00 H new ATOM 0 HD11 LEU A 133 1.033 -8.839 2.915 1.00 0.00 H new ATOM 0 HD12 LEU A 133 1.336 -8.960 1.166 1.00 0.00 H new ATOM 0 HD13 LEU A 133 1.463 -7.385 1.983 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -0.854 -7.748 3.798 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -0.627 -6.255 2.856 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -2.173 -7.133 2.773 1.00 0.00 H new ATOM 1749 N PHE A 134 -0.073 -10.442 -1.279 1.00 0.00 N ATOM 1750 CA PHE A 134 -0.409 -11.853 -1.591 1.00 0.00 C ATOM 1751 C PHE A 134 -0.960 -12.683 -0.374 1.00 0.00 C ATOM 1752 O PHE A 134 -1.988 -13.353 -0.489 1.00 0.00 O ATOM 1753 CB PHE A 134 0.839 -12.472 -2.292 1.00 0.00 C ATOM 1754 CG PHE A 134 1.394 -11.787 -3.576 1.00 0.00 C ATOM 1755 CD1 PHE A 134 0.598 -11.581 -4.715 1.00 0.00 C ATOM 1756 CD2 PHE A 134 2.725 -11.344 -3.599 1.00 0.00 C ATOM 1757 CE1 PHE A 134 1.132 -10.980 -5.850 1.00 0.00 C ATOM 1758 CE2 PHE A 134 3.259 -10.762 -4.740 1.00 0.00 C ATOM 1759 CZ PHE A 134 2.462 -10.585 -5.867 1.00 0.00 C ATOM 0 H PHE A 134 0.926 -10.282 -1.148 1.00 0.00 H new ATOM 0 HA PHE A 134 -1.264 -11.886 -2.267 1.00 0.00 H new ATOM 0 HB2 PHE A 134 1.646 -12.505 -1.560 1.00 0.00 H new ATOM 0 HB3 PHE A 134 0.597 -13.504 -2.547 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -0.436 -11.892 -4.709 1.00 0.00 H new ATOM 0 HD2 PHE A 134 3.341 -11.457 -2.719 1.00 0.00 H new ATOM 0 HE1 PHE A 134 0.511 -10.821 -6.719 1.00 0.00 H new ATOM 0 HE2 PHE A 134 4.292 -10.447 -4.753 1.00 0.00 H new ATOM 0 HZ PHE A 134 2.880 -10.139 -6.757 1.00 0.00 H new ATOM 1769 N GLU A 135 -0.253 -12.644 0.765 1.00 0.00 N ATOM 1770 CA GLU A 135 -0.631 -13.301 2.052 1.00 0.00 C ATOM 1771 C GLU A 135 0.315 -12.815 3.215 1.00 0.00 C ATOM 1772 O GLU A 135 1.408 -12.268 3.030 1.00 0.00 O ATOM 1773 CB GLU A 135 -0.751 -14.857 1.972 1.00 0.00 C ATOM 1774 CG GLU A 135 0.541 -15.714 1.923 1.00 0.00 C ATOM 1775 CD GLU A 135 0.247 -17.211 1.999 1.00 0.00 C ATOM 1776 OE1 GLU A 135 0.319 -17.974 1.043 1.00 0.00 O ATOM 1777 OE2 GLU A 135 -0.142 -17.594 3.247 1.00 0.00 O ATOM 0 H GLU A 135 0.631 -12.140 0.831 1.00 0.00 H new ATOM 0 HA GLU A 135 -1.646 -12.977 2.281 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -1.331 -15.186 2.835 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -1.337 -15.096 1.084 1.00 0.00 H new ATOM 0 HG2 GLU A 135 1.082 -15.499 1.002 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.193 -15.432 2.749 1.00 0.00 H new ATOM 1785 N PHE A 136 -0.173 -12.989 4.444 1.00 0.00 N ATOM 1786 CA PHE A 136 0.502 -12.567 5.710 1.00 0.00 C ATOM 1787 C PHE A 136 0.013 -13.638 6.735 1.00 0.00 C ATOM 1788 O PHE A 136 0.631 -14.688 6.914 1.00 0.00 O ATOM 1789 CB PHE A 136 0.257 -11.064 6.098 1.00 0.00 C ATOM 1790 CG PHE A 136 -1.062 -10.355 5.798 1.00 0.00 C ATOM 1791 CD1 PHE A 136 -1.390 -10.192 4.455 1.00 0.00 C ATOM 1792 CD2 PHE A 136 -1.904 -9.814 6.772 1.00 0.00 C ATOM 1793 CE1 PHE A 136 -2.610 -9.682 4.086 1.00 0.00 C ATOM 1794 CE2 PHE A 136 -3.111 -9.229 6.386 1.00 0.00 C ATOM 1795 CZ PHE A 136 -3.493 -9.229 5.039 1.00 0.00 C ATOM 0 H PHE A 136 -1.073 -13.439 4.610 1.00 0.00 H new ATOM 0 HA PHE A 136 1.590 -12.553 5.643 1.00 0.00 H new ATOM 0 HB2 PHE A 136 0.418 -10.987 7.173 1.00 0.00 H new ATOM 0 HB3 PHE A 136 1.043 -10.483 5.616 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -0.676 -10.470 3.694 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -1.624 -9.848 7.814 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -2.878 -9.636 3.041 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -3.752 -8.775 7.128 1.00 0.00 H new ATOM 0 HZ PHE A 136 -4.472 -8.876 4.751 1.00 0.00 H new ATOM 1805 N LYS A 137 -1.139 -13.378 7.370 1.00 0.00 N ATOM 1806 CA LYS A 137 -1.860 -14.355 8.219 1.00 0.00 C ATOM 1807 C LYS A 137 -3.298 -14.522 7.611 1.00 0.00 C ATOM 1808 O LYS A 137 -4.210 -13.734 7.875 1.00 0.00 O ATOM 1809 CB LYS A 137 -1.846 -13.888 9.691 1.00 0.00 C ATOM 1810 CG LYS A 137 -2.632 -14.778 10.670 1.00 0.00 C ATOM 1811 CD LYS A 137 -1.923 -16.093 11.048 1.00 0.00 C ATOM 1812 CE LYS A 137 -2.748 -16.912 12.051 1.00 0.00 C ATOM 1813 NZ LYS A 137 -2.030 -18.155 12.388 1.00 0.00 N ATOM 0 H LYS A 137 -1.607 -12.474 7.312 1.00 0.00 H new ATOM 0 HA LYS A 137 -1.380 -15.333 8.227 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -0.811 -13.832 10.028 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -2.252 -12.877 9.738 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -2.828 -14.211 11.580 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -3.600 -15.016 10.228 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -1.750 -16.685 10.149 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -0.946 -15.870 11.476 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -2.926 -16.327 12.954 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -3.724 -17.148 11.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -2.592 -18.707 13.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -1.882 -18.716 11.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -1.109 -17.920 12.810 1.00 0.00 H new ATOM 1826 N GLY A 138 -3.470 -15.551 6.774 1.00 0.00 N ATOM 1827 CA GLY A 138 -4.786 -15.877 6.158 1.00 0.00 C ATOM 1828 C GLY A 138 -4.911 -17.000 5.088 1.00 0.00 C ATOM 1829 O GLY A 138 -6.045 -17.407 4.833 1.00 0.00 O ATOM 0 H GLY A 138 -2.718 -16.182 6.499 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -5.465 -16.133 6.971 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -5.163 -14.960 5.705 1.00 0.00 H new