USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 498 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 114 THR OG1 : rot -67:sc= 0.61 USER MOD Set 1.2: A 126 GLN : amide:sc= -0.632 K(o=-0.022,f=-2.6) USER MOD Single : A 81 HIS : no HE2:sc= -3.54! C(o=-3.5!,f=-4.2!) USER MOD Single : A 85 SER OG : rot 102:sc= -0.253 USER MOD Single : A 87 MET CE :methyl -136:sc= -0.273 (180deg=-0.961) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 117:sc= 0.902 USER MOD Single : A 96 SER OG : rot 180:sc= -0.878 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= -2.21 K(o=-2.2,f=-3.2!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -2.39 K(o=-2.4,f=-3.5) USER MOD Single : A 116 CYS SG : rot 171:sc= -2.22! USER MOD Single : A 121 MET CE :methyl 163:sc= -0.867 (180deg=-2.07!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN :FLIP amide:sc= -0.465 F(o=-2!,f=-0.47) USER MOD Single : A 131 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0312) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0231) USER MOD Single : A 142 SER OG : rot -11:sc= 0.914 USER MOD Single : A 144 GLN : amide:sc= -2.79! C(o=-2.8!,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.295 8.021 2.769 1.00 1.00 N ATOM 131 CA HIS A 81 -5.328 6.895 3.687 1.00 1.00 C ATOM 132 C HIS A 81 -3.901 6.419 3.967 1.00 1.00 C ATOM 133 O HIS A 81 -2.949 6.914 3.366 1.00 1.00 O ATOM 134 CB HIS A 81 -6.229 5.782 3.148 1.00 1.00 C ATOM 135 CG HIS A 81 -7.456 6.281 2.423 1.00 1.00 C ATOM 136 ND1 HIS A 81 -8.467 6.982 3.057 1.00 1.00 N ATOM 137 CD2 HIS A 81 -7.823 6.175 1.114 1.00 1.00 C ATOM 138 CE1 HIS A 81 -9.396 7.279 2.160 1.00 1.00 C ATOM 139 NE2 HIS A 81 -8.995 6.776 0.956 1.00 1.00 N ATOM 0 HA HIS A 81 -5.762 7.208 4.637 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -5.649 5.155 2.470 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -6.543 5.149 3.978 1.00 1.00 H new ATOM 0 HD1 HIS A 81 -8.493 7.228 4.047 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -7.255 5.685 0.337 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -10.310 7.823 2.348 1.00 1.00 H new ATOM 146 N ILE A 82 -3.798 5.465 4.881 1.00 1.00 N ATOM 147 CA ILE A 82 -2.503 4.917 5.248 1.00 1.00 C ATOM 148 C ILE A 82 -2.644 3.415 5.504 1.00 1.00 C ATOM 149 O ILE A 82 -3.350 3.002 6.423 1.00 1.00 O ATOM 150 CB ILE A 82 -1.911 5.690 6.428 1.00 1.00 C ATOM 151 CG1 ILE A 82 -1.630 7.144 6.047 1.00 1.00 C ATOM 152 CG2 ILE A 82 -0.663 4.989 6.971 1.00 1.00 C ATOM 153 CD1 ILE A 82 -2.788 8.054 6.464 1.00 1.00 C ATOM 0 H ILE A 82 -4.590 5.058 5.378 1.00 1.00 H new ATOM 0 HA ILE A 82 -1.792 5.035 4.430 1.00 1.00 H new ATOM 0 HB ILE A 82 -2.649 5.705 7.230 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -0.710 7.478 6.526 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -1.474 7.218 4.971 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -0.261 5.559 7.809 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -0.926 3.986 7.307 1.00 1.00 H new ATOM 0 HG23 ILE A 82 0.088 4.923 6.184 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -2.563 9.082 6.181 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -3.702 7.732 5.964 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -2.925 7.996 7.544 1.00 1.00 H new ATOM 164 N VAL A 83 -1.961 2.640 4.676 1.00 1.00 N ATOM 165 CA VAL A 83 -2.001 1.193 4.801 1.00 1.00 C ATOM 166 C VAL A 83 -1.227 0.772 6.052 1.00 1.00 C ATOM 167 O VAL A 83 -0.025 1.013 6.153 1.00 1.00 O ATOM 168 CB VAL A 83 -1.470 0.542 3.522 1.00 1.00 C ATOM 169 CG1 VAL A 83 -1.150 -0.937 3.752 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.458 0.716 2.367 1.00 1.00 C ATOM 0 H VAL A 83 -1.376 2.986 3.915 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.028 0.848 4.923 1.00 1.00 H new ATOM 0 HB VAL A 83 -0.543 1.047 3.249 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -0.774 -1.376 2.828 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -0.393 -1.029 4.531 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -2.054 -1.461 4.061 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -2.056 0.244 1.470 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.408 0.250 2.628 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.615 1.778 2.179 1.00 1.00 H new ATOM 180 N ARG A 84 -1.948 0.150 6.973 1.00 1.00 N ATOM 181 CA ARG A 84 -1.345 -0.307 8.213 1.00 1.00 C ATOM 182 C ARG A 84 -1.258 -1.834 8.231 1.00 1.00 C ATOM 183 O ARG A 84 -2.272 -2.515 8.375 1.00 1.00 O ATOM 184 CB ARG A 84 -2.151 0.165 9.425 1.00 1.00 C ATOM 185 CG ARG A 84 -2.215 1.693 9.480 1.00 1.00 C ATOM 186 CD ARG A 84 -3.444 2.162 10.261 1.00 1.00 C ATOM 187 NE ARG A 84 -4.338 2.944 9.378 1.00 1.00 N ATOM 188 CZ ARG A 84 -5.214 3.872 9.817 1.00 1.00 C ATOM 189 NH1 ARG A 84 -5.322 4.142 11.135 1.00 1.00 N ATOM 190 NH2 ARG A 84 -5.965 4.510 8.939 1.00 1.00 N ATOM 0 H ARG A 84 -2.945 -0.048 6.885 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.343 0.118 8.269 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -3.160 -0.243 9.376 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.697 -0.217 10.339 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -1.311 2.082 9.949 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.247 2.096 8.468 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -3.979 1.302 10.664 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -3.135 2.771 11.110 1.00 1.00 H new ATOM 0 HE ARG A 84 -4.289 2.771 8.374 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -4.739 3.643 11.807 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -5.986 4.845 11.459 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -5.878 4.299 7.945 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -6.632 5.214 9.255 1.00 1.00 H new ATOM 199 N SER A 85 -0.037 -2.328 8.082 1.00 1.00 N ATOM 200 CA SER A 85 0.195 -3.762 8.078 1.00 1.00 C ATOM 201 C SER A 85 -0.682 -4.436 9.136 1.00 1.00 C ATOM 202 O SER A 85 -0.410 -4.332 10.331 1.00 1.00 O ATOM 203 CB SER A 85 1.670 -4.082 8.329 1.00 1.00 C ATOM 204 OG SER A 85 2.266 -3.169 9.247 1.00 1.00 O ATOM 0 H SER A 85 0.802 -1.760 7.963 1.00 1.00 H new ATOM 0 HA SER A 85 -0.070 -4.149 7.094 1.00 1.00 H new ATOM 0 HB2 SER A 85 1.760 -5.097 8.717 1.00 1.00 H new ATOM 0 HB3 SER A 85 2.213 -4.053 7.384 1.00 1.00 H new ATOM 0 HG SER A 85 2.328 -3.588 10.131 1.00 1.00 H new ATOM 209 N PRO A 86 -1.743 -5.131 8.644 1.00 1.00 N ATOM 210 CA PRO A 86 -2.661 -5.823 9.534 1.00 1.00 C ATOM 211 C PRO A 86 -2.031 -7.105 10.083 1.00 1.00 C ATOM 212 O PRO A 86 -2.664 -7.833 10.845 1.00 1.00 O ATOM 213 CB PRO A 86 -3.901 -6.083 8.694 1.00 1.00 C ATOM 214 CG PRO A 86 -3.460 -5.946 7.246 1.00 1.00 C ATOM 215 CD PRO A 86 -2.095 -5.277 7.235 1.00 1.00 C ATOM 0 HA PRO A 86 -2.911 -5.238 10.419 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.302 -7.078 8.888 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.690 -5.369 8.931 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -3.409 -6.924 6.768 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -4.180 -5.353 6.682 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -1.361 -5.883 6.704 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -2.132 -4.310 6.734 1.00 1.00 H new ATOM 220 N MET A 87 -0.793 -7.340 9.673 1.00 1.00 N ATOM 221 CA MET A 87 -0.071 -8.521 10.115 1.00 1.00 C ATOM 222 C MET A 87 1.441 -8.302 10.033 1.00 1.00 C ATOM 223 O MET A 87 1.974 -8.026 8.960 1.00 1.00 O ATOM 224 CB MET A 87 -0.463 -9.715 9.242 1.00 1.00 C ATOM 225 CG MET A 87 -0.169 -9.435 7.767 1.00 1.00 C ATOM 226 SD MET A 87 -1.536 -9.983 6.758 1.00 1.00 S ATOM 227 CE MET A 87 -1.484 -8.748 5.469 1.00 1.00 C ATOM 0 H MET A 87 -0.272 -6.733 9.040 1.00 1.00 H new ATOM 0 HA MET A 87 -0.334 -8.718 11.154 1.00 1.00 H new ATOM 0 HB2 MET A 87 0.084 -10.601 9.564 1.00 1.00 H new ATOM 0 HB3 MET A 87 -1.524 -9.932 9.371 1.00 1.00 H new ATOM 0 HG2 MET A 87 -0.000 -8.369 7.617 1.00 1.00 H new ATOM 0 HG3 MET A 87 0.745 -9.948 7.466 1.00 1.00 H new ATOM 0 HE1 MET A 87 -2.496 -8.404 5.253 1.00 1.00 H new ATOM 0 HE2 MET A 87 -0.876 -7.905 5.797 1.00 1.00 H new ATOM 0 HE3 MET A 87 -1.048 -9.180 4.568 1.00 1.00 H new ATOM 235 N VAL A 88 2.089 -8.434 11.181 1.00 1.00 N ATOM 236 CA VAL A 88 3.529 -8.253 11.253 1.00 1.00 C ATOM 237 C VAL A 88 4.205 -9.179 10.240 1.00 1.00 C ATOM 238 O VAL A 88 3.709 -10.271 9.963 1.00 1.00 O ATOM 239 CB VAL A 88 4.014 -8.479 12.686 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.530 -8.302 12.786 1.00 1.00 C ATOM 241 CG2 VAL A 88 3.287 -7.553 13.663 1.00 1.00 C ATOM 0 H VAL A 88 1.643 -8.664 12.069 1.00 1.00 H new ATOM 0 HA VAL A 88 3.799 -7.230 10.991 1.00 1.00 H new ATOM 0 HB VAL A 88 3.779 -9.507 12.962 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.849 -8.468 13.815 1.00 1.00 H new ATOM 0 HG12 VAL A 88 6.024 -9.021 12.133 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.799 -7.291 12.482 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.650 -7.734 14.675 1.00 1.00 H new ATOM 0 HG22 VAL A 88 3.476 -6.515 13.390 1.00 1.00 H new ATOM 0 HG23 VAL A 88 2.216 -7.749 13.622 1.00 1.00 H new ATOM 251 N GLY A 89 5.327 -8.710 9.714 1.00 1.00 N ATOM 252 CA GLY A 89 6.077 -9.482 8.738 1.00 1.00 C ATOM 253 C GLY A 89 6.934 -8.570 7.858 1.00 1.00 C ATOM 254 O GLY A 89 7.713 -7.766 8.366 1.00 1.00 O ATOM 0 H GLY A 89 5.735 -7.804 9.946 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.715 -10.202 9.251 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.389 -10.053 8.114 1.00 1.00 H new ATOM 258 N THR A 90 6.760 -8.725 6.554 1.00 1.00 N ATOM 259 CA THR A 90 7.507 -7.926 5.598 1.00 1.00 C ATOM 260 C THR A 90 6.556 -7.245 4.613 1.00 1.00 C ATOM 261 O THR A 90 5.372 -7.573 4.560 1.00 1.00 O ATOM 262 CB THR A 90 8.535 -8.835 4.922 1.00 1.00 C ATOM 263 OG1 THR A 90 9.323 -9.331 6.000 1.00 1.00 O ATOM 264 CG2 THR A 90 9.530 -8.056 4.060 1.00 1.00 C ATOM 0 H THR A 90 6.112 -9.393 6.137 1.00 1.00 H new ATOM 0 HA THR A 90 8.044 -7.117 6.093 1.00 1.00 H new ATOM 0 HB THR A 90 8.018 -9.569 4.304 1.00 1.00 H new ATOM 0 HG1 THR A 90 10.014 -9.931 5.651 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.237 -8.749 3.604 1.00 1.00 H new ATOM 0 HG22 THR A 90 8.992 -7.519 3.278 1.00 1.00 H new ATOM 0 HG23 THR A 90 10.071 -7.344 4.683 1.00 1.00 H new ATOM 272 N PHE A 91 7.110 -6.309 3.856 1.00 1.00 N ATOM 273 CA PHE A 91 6.325 -5.579 2.874 1.00 1.00 C ATOM 274 C PHE A 91 7.093 -5.431 1.559 1.00 1.00 C ATOM 275 O PHE A 91 8.295 -5.171 1.564 1.00 1.00 O ATOM 276 CB PHE A 91 6.062 -4.189 3.457 1.00 1.00 C ATOM 277 CG PHE A 91 5.403 -3.218 2.475 1.00 1.00 C ATOM 278 CD1 PHE A 91 6.130 -2.679 1.460 1.00 1.00 C ATOM 279 CD2 PHE A 91 4.090 -2.893 2.617 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.519 -1.777 0.549 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.479 -1.992 1.706 1.00 1.00 C ATOM 282 CZ PHE A 91 4.206 -1.453 0.692 1.00 1.00 C ATOM 0 H PHE A 91 8.093 -6.039 3.903 1.00 1.00 H new ATOM 0 HA PHE A 91 5.399 -6.114 2.664 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.425 -4.289 4.336 1.00 1.00 H new ATOM 0 HB3 PHE A 91 7.007 -3.763 3.795 1.00 1.00 H new ATOM 0 HD1 PHE A 91 7.173 -2.937 1.347 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.512 -3.321 3.423 1.00 1.00 H new ATOM 0 HE1 PHE A 91 6.097 -1.349 -0.257 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.436 -1.735 1.819 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.741 -0.767 -0.000 1.00 1.00 H new ATOM 291 N TYR A 92 6.366 -5.603 0.464 1.00 1.00 N ATOM 292 CA TYR A 92 6.963 -5.491 -0.855 1.00 1.00 C ATOM 293 C TYR A 92 6.101 -4.625 -1.776 1.00 1.00 C ATOM 294 O TYR A 92 4.909 -4.447 -1.530 1.00 1.00 O ATOM 295 CB TYR A 92 7.017 -6.914 -1.415 1.00 1.00 C ATOM 296 CG TYR A 92 8.047 -7.814 -0.730 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.392 -7.637 -0.979 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.630 -8.804 0.137 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.362 -8.484 -0.334 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.599 -9.651 0.782 1.00 1.00 C ATOM 301 CZ TYR A 92 9.917 -9.450 0.514 1.00 1.00 C ATOM 302 OH TYR A 92 10.833 -10.250 1.123 1.00 1.00 O ATOM 0 H TYR A 92 5.369 -5.819 0.464 1.00 1.00 H new ATOM 0 HA TYR A 92 7.948 -5.028 -0.793 1.00 1.00 H new ATOM 0 HB2 TYR A 92 6.031 -7.369 -1.319 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.243 -6.866 -2.480 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.718 -6.863 -1.658 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.577 -8.943 0.331 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.418 -8.355 -0.519 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.286 -10.428 1.463 1.00 1.00 H new ATOM 0 HH TYR A 92 10.372 -10.893 1.701 1.00 1.00 H new ATOM 311 N ARG A 93 6.738 -4.110 -2.818 1.00 1.00 N ATOM 312 CA ARG A 93 6.044 -3.267 -3.777 1.00 1.00 C ATOM 313 C ARG A 93 5.993 -3.951 -5.145 1.00 1.00 C ATOM 314 O ARG A 93 5.193 -3.575 -6.001 1.00 1.00 O ATOM 315 CB ARG A 93 6.735 -1.910 -3.918 1.00 1.00 C ATOM 316 CG ARG A 93 6.234 -0.927 -2.858 1.00 1.00 C ATOM 317 CD ARG A 93 7.403 -0.296 -2.099 1.00 1.00 C ATOM 318 NE ARG A 93 8.510 0.007 -3.034 1.00 1.00 N ATOM 319 CZ ARG A 93 8.504 1.039 -3.904 1.00 1.00 C ATOM 320 NH1 ARG A 93 7.448 1.878 -3.965 1.00 1.00 N ATOM 321 NH2 ARG A 93 9.546 1.216 -4.694 1.00 1.00 N ATOM 0 H ARG A 93 7.727 -4.260 -3.019 1.00 1.00 H new ATOM 0 HA ARG A 93 5.031 -3.109 -3.408 1.00 1.00 H new ATOM 0 HB2 ARG A 93 7.814 -2.035 -3.822 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.548 -1.504 -4.912 1.00 1.00 H new ATOM 0 HG2 ARG A 93 5.640 -0.146 -3.333 1.00 1.00 H new ATOM 0 HG3 ARG A 93 5.578 -1.445 -2.158 1.00 1.00 H new ATOM 0 HD2 ARG A 93 7.075 0.617 -1.603 1.00 1.00 H new ATOM 0 HD3 ARG A 93 7.750 -0.975 -1.320 1.00 1.00 H new ATOM 0 HE ARG A 93 9.328 -0.602 -3.020 1.00 1.00 H new ATOM 0 HH11 ARG A 93 6.646 1.735 -3.351 1.00 1.00 H new ATOM 0 HH12 ARG A 93 7.452 2.655 -4.625 1.00 1.00 H new ATOM 0 HH21 ARG A 93 10.340 0.578 -4.642 1.00 1.00 H new ATOM 0 HH22 ARG A 93 9.557 1.991 -5.357 1.00 1.00 H new ATOM 330 N THR A 94 6.857 -4.942 -5.308 1.00 1.00 N ATOM 331 CA THR A 94 6.920 -5.681 -6.558 1.00 1.00 C ATOM 332 C THR A 94 7.031 -7.182 -6.284 1.00 1.00 C ATOM 333 O THR A 94 7.492 -7.591 -5.219 1.00 1.00 O ATOM 334 CB THR A 94 8.086 -5.125 -7.377 1.00 1.00 C ATOM 335 OG1 THR A 94 9.207 -5.232 -6.504 1.00 1.00 O ATOM 336 CG2 THR A 94 7.957 -3.622 -7.635 1.00 1.00 C ATOM 0 H THR A 94 7.519 -5.251 -4.596 1.00 1.00 H new ATOM 0 HA THR A 94 6.007 -5.555 -7.139 1.00 1.00 H new ATOM 0 HB THR A 94 8.144 -5.653 -8.329 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.864 -5.848 -6.890 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.810 -3.279 -8.220 1.00 1.00 H new ATOM 0 HG22 THR A 94 7.037 -3.425 -8.185 1.00 1.00 H new ATOM 0 HG23 THR A 94 7.932 -3.090 -6.684 1.00 1.00 H new ATOM 344 N PRO A 95 6.589 -7.984 -7.290 1.00 1.00 N ATOM 345 CA PRO A 95 6.634 -9.431 -7.168 1.00 1.00 C ATOM 346 C PRO A 95 8.063 -9.951 -7.335 1.00 1.00 C ATOM 347 O PRO A 95 8.341 -11.116 -7.055 1.00 1.00 O ATOM 348 CB PRO A 95 5.686 -9.946 -8.239 1.00 1.00 C ATOM 349 CG PRO A 95 5.503 -8.799 -9.220 1.00 1.00 C ATOM 350 CD PRO A 95 6.036 -7.536 -8.565 1.00 1.00 C ATOM 0 HA PRO A 95 6.327 -9.780 -6.182 1.00 1.00 H new ATOM 0 HB2 PRO A 95 6.099 -10.824 -8.737 1.00 1.00 H new ATOM 0 HB3 PRO A 95 4.732 -10.245 -7.805 1.00 1.00 H new ATOM 0 HG2 PRO A 95 6.037 -9.002 -10.148 1.00 1.00 H new ATOM 0 HG3 PRO A 95 4.450 -8.681 -9.477 1.00 1.00 H new ATOM 0 HD2 PRO A 95 6.799 -7.061 -9.182 1.00 1.00 H new ATOM 0 HD3 PRO A 95 5.244 -6.802 -8.417 1.00 1.00 H new ATOM 355 N SER A 96 8.933 -9.062 -7.792 1.00 1.00 N ATOM 356 CA SER A 96 10.327 -9.416 -7.999 1.00 1.00 C ATOM 357 C SER A 96 11.173 -8.150 -8.145 1.00 1.00 C ATOM 358 O SER A 96 10.646 -7.039 -8.105 1.00 1.00 O ATOM 359 CB SER A 96 10.490 -10.308 -9.231 1.00 1.00 C ATOM 360 OG SER A 96 9.239 -10.801 -9.704 1.00 1.00 O ATOM 0 H SER A 96 8.699 -8.097 -8.025 1.00 1.00 H new ATOM 0 HA SER A 96 10.671 -9.976 -7.129 1.00 1.00 H new ATOM 0 HB2 SER A 96 10.980 -9.744 -10.024 1.00 1.00 H new ATOM 0 HB3 SER A 96 11.141 -11.147 -8.987 1.00 1.00 H new ATOM 0 HG SER A 96 9.386 -11.365 -10.492 1.00 1.00 H new ATOM 365 N PRO A 97 12.504 -8.365 -8.317 1.00 1.00 N ATOM 366 CA PRO A 97 13.428 -7.254 -8.469 1.00 1.00 C ATOM 367 C PRO A 97 13.314 -6.632 -9.863 1.00 1.00 C ATOM 368 O PRO A 97 13.244 -5.412 -9.998 1.00 1.00 O ATOM 369 CB PRO A 97 14.802 -7.843 -8.193 1.00 1.00 C ATOM 370 CG PRO A 97 14.650 -9.347 -8.353 1.00 1.00 C ATOM 371 CD PRO A 97 13.164 -9.666 -8.370 1.00 1.00 C ATOM 0 HA PRO A 97 13.215 -6.434 -7.783 1.00 1.00 H new ATOM 0 HB2 PRO A 97 15.543 -7.449 -8.889 1.00 1.00 H new ATOM 0 HB3 PRO A 97 15.141 -7.589 -7.189 1.00 1.00 H new ATOM 0 HG2 PRO A 97 15.123 -9.682 -9.276 1.00 1.00 H new ATOM 0 HG3 PRO A 97 15.143 -9.870 -7.534 1.00 1.00 H new ATOM 0 HD2 PRO A 97 12.887 -10.214 -9.271 1.00 1.00 H new ATOM 0 HD3 PRO A 97 12.883 -10.287 -7.520 1.00 1.00 H new ATOM 376 N ASP A 98 13.299 -7.501 -10.863 1.00 1.00 N ATOM 377 CA ASP A 98 13.194 -7.053 -12.241 1.00 1.00 C ATOM 378 C ASP A 98 11.748 -7.212 -12.716 1.00 1.00 C ATOM 379 O ASP A 98 11.505 -7.534 -13.878 1.00 1.00 O ATOM 380 CB ASP A 98 14.088 -7.887 -13.161 1.00 1.00 C ATOM 381 CG ASP A 98 14.889 -7.083 -14.187 1.00 1.00 C ATOM 382 OD1 ASP A 98 14.720 -7.252 -15.404 1.00 1.00 O ATOM 383 OD2 ASP A 98 15.728 -6.241 -13.686 1.00 1.00 O ATOM 0 H ASP A 98 13.358 -8.513 -10.746 1.00 1.00 H new ATOM 0 HA ASP A 98 13.508 -6.010 -12.281 1.00 1.00 H new ATOM 0 HB2 ASP A 98 14.784 -8.458 -12.546 1.00 1.00 H new ATOM 0 HB3 ASP A 98 13.466 -8.607 -13.692 1.00 1.00 H new ATOM 388 N ALA A 99 10.827 -6.978 -11.793 1.00 1.00 N ATOM 389 CA ALA A 99 9.412 -7.091 -12.103 1.00 1.00 C ATOM 390 C ALA A 99 8.756 -5.714 -11.982 1.00 1.00 C ATOM 391 O ALA A 99 9.310 -4.812 -11.357 1.00 1.00 O ATOM 392 CB ALA A 99 8.768 -8.127 -11.179 1.00 1.00 C ATOM 0 H ALA A 99 11.033 -6.711 -10.830 1.00 1.00 H new ATOM 0 HA ALA A 99 9.270 -7.435 -13.128 1.00 1.00 H new ATOM 0 HB1 ALA A 99 7.706 -8.212 -11.411 1.00 1.00 H new ATOM 0 HB2 ALA A 99 9.250 -9.094 -11.325 1.00 1.00 H new ATOM 0 HB3 ALA A 99 8.888 -7.814 -10.142 1.00 1.00 H new ATOM 398 N LYS A 100 7.585 -5.597 -12.591 1.00 1.00 N ATOM 399 CA LYS A 100 6.848 -4.345 -12.559 1.00 1.00 C ATOM 400 C LYS A 100 6.432 -4.039 -11.119 1.00 1.00 C ATOM 401 O LYS A 100 6.517 -4.903 -10.248 1.00 1.00 O ATOM 402 CB LYS A 100 5.675 -4.388 -13.541 1.00 1.00 C ATOM 403 CG LYS A 100 6.052 -5.153 -14.812 1.00 1.00 C ATOM 404 CD LYS A 100 5.511 -6.584 -14.772 1.00 1.00 C ATOM 405 CE LYS A 100 4.477 -6.810 -15.877 1.00 1.00 C ATOM 406 NZ LYS A 100 3.111 -6.844 -15.309 1.00 1.00 N ATOM 0 H LYS A 100 7.129 -6.348 -13.109 1.00 1.00 H new ATOM 0 HA LYS A 100 7.482 -3.522 -12.890 1.00 1.00 H new ATOM 0 HB2 LYS A 100 4.816 -4.864 -13.067 1.00 1.00 H new ATOM 0 HB3 LYS A 100 5.375 -3.372 -13.799 1.00 1.00 H new ATOM 0 HG2 LYS A 100 5.654 -4.634 -15.684 1.00 1.00 H new ATOM 0 HG3 LYS A 100 7.136 -5.173 -14.920 1.00 1.00 H new ATOM 0 HD2 LYS A 100 6.333 -7.291 -14.888 1.00 1.00 H new ATOM 0 HD3 LYS A 100 5.058 -6.778 -13.800 1.00 1.00 H new ATOM 0 HE2 LYS A 100 4.549 -6.015 -16.619 1.00 1.00 H new ATOM 0 HE3 LYS A 100 4.686 -7.747 -16.393 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 2.421 -6.998 -16.072 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 3.042 -7.618 -14.618 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 2.909 -5.940 -14.837 1.00 1.00 H new ATOM 415 N ALA A 101 5.991 -2.806 -10.913 1.00 1.00 N ATOM 416 CA ALA A 101 5.562 -2.376 -9.593 1.00 1.00 C ATOM 417 C ALA A 101 4.035 -2.426 -9.517 1.00 1.00 C ATOM 418 O ALA A 101 3.349 -1.971 -10.430 1.00 1.00 O ATOM 419 CB ALA A 101 6.115 -0.978 -9.308 1.00 1.00 C ATOM 0 H ALA A 101 5.922 -2.092 -11.638 1.00 1.00 H new ATOM 0 HA ALA A 101 5.952 -3.044 -8.825 1.00 1.00 H new ATOM 0 HB1 ALA A 101 5.794 -0.654 -8.318 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.204 -1.003 -9.346 1.00 1.00 H new ATOM 0 HB3 ALA A 101 5.742 -0.279 -10.057 1.00 1.00 H new ATOM 425 N PHE A 102 3.548 -2.983 -8.417 1.00 1.00 N ATOM 426 CA PHE A 102 2.115 -3.098 -8.210 1.00 1.00 C ATOM 427 C PHE A 102 1.431 -1.735 -8.330 1.00 1.00 C ATOM 428 O PHE A 102 0.349 -1.627 -8.905 1.00 1.00 O ATOM 429 CB PHE A 102 1.910 -3.634 -6.791 1.00 1.00 C ATOM 430 CG PHE A 102 1.887 -5.161 -6.700 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.801 -5.852 -7.140 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.952 -5.828 -6.179 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.780 -7.270 -7.055 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.931 -7.245 -6.095 1.00 1.00 C ATOM 435 CZ PHE A 102 1.845 -7.936 -6.535 1.00 1.00 C ATOM 0 H PHE A 102 4.120 -3.359 -7.661 1.00 1.00 H new ATOM 0 HA PHE A 102 1.683 -3.758 -8.962 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.707 -3.254 -6.152 1.00 1.00 H new ATOM 0 HB3 PHE A 102 0.972 -3.243 -6.398 1.00 1.00 H new ATOM 0 HD1 PHE A 102 -0.045 -5.323 -7.554 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.814 -5.279 -5.829 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.082 -7.819 -7.404 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.777 -7.774 -5.682 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.829 -9.014 -6.471 1.00 1.00 H new ATOM 444 N ILE A 103 2.091 -0.727 -7.779 1.00 1.00 N ATOM 445 CA ILE A 103 1.561 0.625 -7.817 1.00 1.00 C ATOM 446 C ILE A 103 2.665 1.589 -8.258 1.00 1.00 C ATOM 447 O ILE A 103 3.646 1.784 -7.543 1.00 1.00 O ATOM 448 CB ILE A 103 0.926 0.991 -6.474 1.00 1.00 C ATOM 449 CG1 ILE A 103 0.802 2.508 -6.321 1.00 1.00 C ATOM 450 CG2 ILE A 103 1.698 0.359 -5.314 1.00 1.00 C ATOM 451 CD1 ILE A 103 -0.083 2.868 -5.126 1.00 1.00 C ATOM 0 H ILE A 103 2.989 -0.820 -7.304 1.00 1.00 H new ATOM 0 HA ILE A 103 0.760 0.699 -8.552 1.00 1.00 H new ATOM 0 HB ILE A 103 -0.084 0.582 -6.450 1.00 1.00 H new ATOM 0 HG12 ILE A 103 1.792 2.946 -6.190 1.00 1.00 H new ATOM 0 HG13 ILE A 103 0.382 2.936 -7.231 1.00 1.00 H new ATOM 0 HG21 ILE A 103 1.227 0.634 -4.370 1.00 1.00 H new ATOM 0 HG22 ILE A 103 1.691 -0.726 -5.420 1.00 1.00 H new ATOM 0 HG23 ILE A 103 2.727 0.718 -5.324 1.00 1.00 H new ATOM 0 HD11 ILE A 103 -0.155 3.952 -5.040 1.00 1.00 H new ATOM 0 HD12 ILE A 103 -1.079 2.449 -5.271 1.00 1.00 H new ATOM 0 HD13 ILE A 103 0.353 2.460 -4.214 1.00 1.00 H new ATOM 462 N GLU A 104 2.467 2.166 -9.435 1.00 1.00 N ATOM 463 CA GLU A 104 3.434 3.104 -9.980 1.00 1.00 C ATOM 464 C GLU A 104 3.157 4.515 -9.456 1.00 1.00 C ATOM 465 O GLU A 104 2.149 5.126 -9.808 1.00 1.00 O ATOM 466 CB GLU A 104 3.423 3.076 -11.509 1.00 1.00 C ATOM 467 CG GLU A 104 4.584 3.892 -12.081 1.00 1.00 C ATOM 468 CD GLU A 104 5.731 2.980 -12.522 1.00 1.00 C ATOM 469 OE1 GLU A 104 6.091 2.966 -13.708 1.00 1.00 O ATOM 470 OE2 GLU A 104 6.253 2.268 -11.582 1.00 1.00 O ATOM 0 H GLU A 104 1.652 2.002 -10.026 1.00 1.00 H new ATOM 0 HA GLU A 104 4.429 2.803 -9.651 1.00 1.00 H new ATOM 0 HB2 GLU A 104 3.491 2.046 -11.858 1.00 1.00 H new ATOM 0 HB3 GLU A 104 2.478 3.475 -11.877 1.00 1.00 H new ATOM 0 HG2 GLU A 104 4.236 4.481 -12.930 1.00 1.00 H new ATOM 0 HG3 GLU A 104 4.943 4.596 -11.330 1.00 1.00 H new ATOM 476 N VAL A 105 4.071 4.991 -8.622 1.00 1.00 N ATOM 477 CA VAL A 105 3.938 6.319 -8.046 1.00 1.00 C ATOM 478 C VAL A 105 3.414 7.283 -9.112 1.00 1.00 C ATOM 479 O VAL A 105 4.078 7.521 -10.120 1.00 1.00 O ATOM 480 CB VAL A 105 5.272 6.763 -7.443 1.00 1.00 C ATOM 481 CG1 VAL A 105 5.225 8.237 -7.034 1.00 1.00 C ATOM 482 CG2 VAL A 105 5.660 5.877 -6.257 1.00 1.00 C ATOM 0 H VAL A 105 4.906 4.481 -8.332 1.00 1.00 H new ATOM 0 HA VAL A 105 3.214 6.311 -7.231 1.00 1.00 H new ATOM 0 HB VAL A 105 6.039 6.652 -8.209 1.00 1.00 H new ATOM 0 HG11 VAL A 105 6.186 8.527 -6.608 1.00 1.00 H new ATOM 0 HG12 VAL A 105 5.016 8.851 -7.910 1.00 1.00 H new ATOM 0 HG13 VAL A 105 4.440 8.384 -6.292 1.00 1.00 H new ATOM 0 HG21 VAL A 105 6.612 6.214 -5.847 1.00 1.00 H new ATOM 0 HG22 VAL A 105 4.890 5.941 -5.488 1.00 1.00 H new ATOM 0 HG23 VAL A 105 5.754 4.844 -6.590 1.00 1.00 H new ATOM 492 N GLY A 106 2.226 7.811 -8.853 1.00 1.00 N ATOM 493 CA GLY A 106 1.605 8.744 -9.778 1.00 1.00 C ATOM 494 C GLY A 106 0.443 8.085 -10.523 1.00 1.00 C ATOM 495 O GLY A 106 0.024 8.564 -11.576 1.00 1.00 O ATOM 0 H GLY A 106 1.678 7.610 -8.017 1.00 1.00 H new ATOM 0 HA2 GLY A 106 1.244 9.616 -9.233 1.00 1.00 H new ATOM 0 HA3 GLY A 106 2.346 9.099 -10.494 1.00 1.00 H new ATOM 499 N GLN A 107 -0.046 6.996 -9.948 1.00 1.00 N ATOM 500 CA GLN A 107 -1.152 6.267 -10.544 1.00 1.00 C ATOM 501 C GLN A 107 -2.346 6.237 -9.587 1.00 1.00 C ATOM 502 O GLN A 107 -2.204 6.539 -8.403 1.00 1.00 O ATOM 503 CB GLN A 107 -0.727 4.850 -10.934 1.00 1.00 C ATOM 504 CG GLN A 107 -1.589 4.315 -12.080 1.00 1.00 C ATOM 505 CD GLN A 107 -2.396 3.094 -11.635 1.00 1.00 C ATOM 506 OE1 GLN A 107 -3.580 2.969 -11.903 1.00 1.00 O ATOM 507 NE2 GLN A 107 -1.692 2.203 -10.942 1.00 1.00 N ATOM 0 H GLN A 107 0.304 6.601 -9.075 1.00 1.00 H new ATOM 0 HA GLN A 107 -1.454 6.785 -11.454 1.00 1.00 H new ATOM 0 HB2 GLN A 107 0.321 4.850 -11.232 1.00 1.00 H new ATOM 0 HB3 GLN A 107 -0.813 4.190 -10.071 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -2.266 5.096 -12.426 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -0.953 4.047 -12.924 1.00 1.00 H new ATOM 0 HE21 GLN A 107 -0.704 2.370 -10.753 1.00 1.00 H new ATOM 0 HE22 GLN A 107 -2.141 1.353 -10.600 1.00 1.00 H new ATOM 514 N LYS A 108 -3.494 5.870 -10.136 1.00 1.00 N ATOM 515 CA LYS A 108 -4.712 5.797 -9.346 1.00 1.00 C ATOM 516 C LYS A 108 -5.036 4.332 -9.051 1.00 1.00 C ATOM 517 O LYS A 108 -4.703 3.448 -9.839 1.00 1.00 O ATOM 518 CB LYS A 108 -5.848 6.550 -10.042 1.00 1.00 C ATOM 519 CG LYS A 108 -6.290 5.823 -11.313 1.00 1.00 C ATOM 520 CD LYS A 108 -7.798 5.566 -11.301 1.00 1.00 C ATOM 521 CE LYS A 108 -8.540 6.612 -12.135 1.00 1.00 C ATOM 522 NZ LYS A 108 -9.404 5.956 -13.142 1.00 1.00 N ATOM 0 H LYS A 108 -3.607 5.620 -11.118 1.00 1.00 H new ATOM 0 HA LYS A 108 -4.573 6.293 -8.385 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -6.694 6.648 -9.362 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -5.521 7.559 -10.291 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -6.026 6.418 -12.187 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -5.757 4.876 -11.399 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -8.004 4.570 -11.694 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -8.166 5.586 -10.275 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -9.145 7.242 -11.483 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -7.822 7.264 -12.633 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -9.900 6.681 -13.699 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -8.819 5.373 -13.775 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -10.101 5.352 -12.661 1.00 1.00 H new ATOM 531 N VAL A 109 -5.682 4.119 -7.914 1.00 1.00 N ATOM 532 CA VAL A 109 -6.055 2.776 -7.505 1.00 1.00 C ATOM 533 C VAL A 109 -7.531 2.761 -7.102 1.00 1.00 C ATOM 534 O VAL A 109 -8.002 3.674 -6.425 1.00 1.00 O ATOM 535 CB VAL A 109 -5.126 2.291 -6.390 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.701 2.092 -6.911 1.00 1.00 C ATOM 537 CG2 VAL A 109 -5.145 3.255 -5.202 1.00 1.00 C ATOM 0 H VAL A 109 -5.957 4.855 -7.263 1.00 1.00 H new ATOM 0 HA VAL A 109 -5.937 2.078 -8.334 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.494 1.325 -6.044 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -3.061 1.747 -6.099 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.706 1.350 -7.709 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.319 3.037 -7.297 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.476 2.887 -4.424 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.814 4.241 -5.528 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -6.158 3.325 -4.806 1.00 1.00 H new ATOM 547 N ASN A 110 -8.219 1.715 -7.534 1.00 1.00 N ATOM 548 CA ASN A 110 -9.632 1.570 -7.227 1.00 1.00 C ATOM 549 C ASN A 110 -9.838 0.314 -6.378 1.00 1.00 C ATOM 550 O ASN A 110 -9.155 -0.690 -6.573 1.00 1.00 O ATOM 551 CB ASN A 110 -10.461 1.419 -8.504 1.00 1.00 C ATOM 552 CG ASN A 110 -9.681 0.657 -9.577 1.00 1.00 C ATOM 553 OD1 ASN A 110 -8.714 1.142 -10.141 1.00 1.00 O ATOM 554 ND2 ASN A 110 -10.154 -0.561 -9.827 1.00 1.00 N ATOM 0 H ASN A 110 -7.825 0.959 -8.094 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.954 2.463 -6.692 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -11.388 0.891 -8.280 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -10.738 2.404 -8.881 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -9.703 -1.150 -10.527 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -10.968 -0.906 -9.318 1.00 1.00 H new ATOM 560 N VAL A 111 -10.783 0.411 -5.454 1.00 1.00 N ATOM 561 CA VAL A 111 -11.087 -0.705 -4.575 1.00 1.00 C ATOM 562 C VAL A 111 -11.044 -2.007 -5.377 1.00 1.00 C ATOM 563 O VAL A 111 -11.924 -2.266 -6.196 1.00 1.00 O ATOM 564 CB VAL A 111 -12.432 -0.474 -3.883 1.00 1.00 C ATOM 565 CG1 VAL A 111 -13.064 -1.800 -3.455 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.280 0.471 -2.690 1.00 1.00 C ATOM 0 H VAL A 111 -11.348 1.245 -5.295 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.339 -0.784 -3.786 1.00 1.00 H new ATOM 0 HB VAL A 111 -13.101 -0.001 -4.602 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -14.019 -1.607 -2.966 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.226 -2.426 -4.333 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -12.398 -2.313 -2.761 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.251 0.618 -2.216 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -11.586 0.038 -1.969 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -11.895 1.431 -3.033 1.00 1.00 H new ATOM 576 N GLY A 112 -10.010 -2.793 -5.114 1.00 1.00 N ATOM 577 CA GLY A 112 -9.840 -4.062 -5.801 1.00 1.00 C ATOM 578 C GLY A 112 -8.478 -4.131 -6.495 1.00 1.00 C ATOM 579 O GLY A 112 -8.066 -5.195 -6.956 1.00 1.00 O ATOM 0 H GLY A 112 -9.281 -2.575 -4.434 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -9.931 -4.881 -5.087 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.634 -4.191 -6.537 1.00 1.00 H new ATOM 583 N ASP A 113 -7.817 -2.984 -6.547 1.00 1.00 N ATOM 584 CA ASP A 113 -6.510 -2.902 -7.177 1.00 1.00 C ATOM 585 C ASP A 113 -5.425 -3.108 -6.118 1.00 1.00 C ATOM 586 O ASP A 113 -5.500 -2.543 -5.028 1.00 1.00 O ATOM 587 CB ASP A 113 -6.292 -1.529 -7.815 1.00 1.00 C ATOM 588 CG ASP A 113 -6.505 -1.479 -9.330 1.00 1.00 C ATOM 589 OD1 ASP A 113 -7.594 -1.133 -9.811 1.00 1.00 O ATOM 590 OD2 ASP A 113 -5.479 -1.819 -10.035 1.00 1.00 O ATOM 0 H ASP A 113 -8.162 -2.104 -6.163 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.458 -3.671 -7.948 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.968 -0.815 -7.344 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.277 -1.200 -7.595 1.00 1.00 H new ATOM 595 N THR A 114 -4.440 -3.920 -6.477 1.00 1.00 N ATOM 596 CA THR A 114 -3.341 -4.208 -5.571 1.00 1.00 C ATOM 597 C THR A 114 -2.572 -2.927 -5.242 1.00 1.00 C ATOM 598 O THR A 114 -2.399 -2.064 -6.101 1.00 1.00 O ATOM 599 CB THR A 114 -2.471 -5.290 -6.213 1.00 1.00 C ATOM 600 OG1 THR A 114 -3.391 -6.331 -6.533 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.510 -5.938 -5.215 1.00 1.00 C ATOM 0 H THR A 114 -4.381 -4.387 -7.382 1.00 1.00 H new ATOM 0 HA THR A 114 -3.705 -4.587 -4.616 1.00 1.00 H new ATOM 0 HB THR A 114 -1.902 -4.857 -7.036 1.00 1.00 H new ATOM 0 HG1 THR A 114 -3.737 -6.727 -5.706 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.917 -6.698 -5.723 1.00 1.00 H new ATOM 0 HG22 THR A 114 -0.848 -5.177 -4.801 1.00 1.00 H new ATOM 0 HG23 THR A 114 -2.080 -6.401 -4.409 1.00 1.00 H new ATOM 609 N LEU A 115 -2.131 -2.844 -3.995 1.00 1.00 N ATOM 610 CA LEU A 115 -1.384 -1.683 -3.541 1.00 1.00 C ATOM 611 C LEU A 115 0.057 -2.096 -3.235 1.00 1.00 C ATOM 612 O LEU A 115 0.982 -1.302 -3.396 1.00 1.00 O ATOM 613 CB LEU A 115 -2.096 -1.016 -2.362 1.00 1.00 C ATOM 614 CG LEU A 115 -2.977 0.187 -2.705 1.00 1.00 C ATOM 615 CD1 LEU A 115 -3.620 0.772 -1.446 1.00 1.00 C ATOM 616 CD2 LEU A 115 -2.189 1.239 -3.488 1.00 1.00 C ATOM 0 H LEU A 115 -2.277 -3.562 -3.285 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.339 -0.928 -4.326 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -2.714 -1.764 -1.866 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -1.343 -0.696 -1.642 1.00 1.00 H new ATOM 0 HG LEU A 115 -3.786 -0.155 -3.351 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -4.241 1.626 -1.718 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -4.237 0.012 -0.966 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -2.841 1.095 -0.756 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -2.839 2.083 -3.719 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -1.346 1.583 -2.888 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -1.820 0.801 -4.415 1.00 1.00 H new ATOM 627 N CYS A 116 0.202 -3.339 -2.799 1.00 1.00 N ATOM 628 CA CYS A 116 1.515 -3.868 -2.469 1.00 1.00 C ATOM 629 C CYS A 116 1.337 -5.278 -1.904 1.00 1.00 C ATOM 630 O CYS A 116 0.234 -5.822 -1.920 1.00 1.00 O ATOM 631 CB CYS A 116 2.265 -2.954 -1.497 1.00 1.00 C ATOM 632 SG CYS A 116 1.084 -2.164 -0.344 1.00 1.00 S ATOM 0 H CYS A 116 -0.568 -3.995 -2.667 1.00 1.00 H new ATOM 0 HA CYS A 116 2.128 -3.913 -3.369 1.00 1.00 H new ATOM 0 HB2 CYS A 116 3.002 -3.531 -0.938 1.00 1.00 H new ATOM 0 HB3 CYS A 116 2.811 -2.191 -2.051 1.00 1.00 H new ATOM 0 HG CYS A 116 1.740 -1.549 0.595 1.00 1.00 H new ATOM 637 N ILE A 117 2.439 -5.830 -1.417 1.00 1.00 N ATOM 638 CA ILE A 117 2.418 -7.167 -0.848 1.00 1.00 C ATOM 639 C ILE A 117 3.005 -7.124 0.564 1.00 1.00 C ATOM 640 O ILE A 117 3.608 -6.128 0.960 1.00 1.00 O ATOM 641 CB ILE A 117 3.124 -8.156 -1.778 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.655 -7.980 -3.223 1.00 1.00 C ATOM 643 CG2 ILE A 117 2.944 -9.594 -1.287 1.00 1.00 C ATOM 644 CD1 ILE A 117 1.214 -8.464 -3.395 1.00 1.00 C ATOM 0 H ILE A 117 3.352 -5.376 -1.405 1.00 1.00 H new ATOM 0 HA ILE A 117 1.393 -7.527 -0.757 1.00 1.00 H new ATOM 0 HB ILE A 117 4.192 -7.941 -1.758 1.00 1.00 H new ATOM 0 HG12 ILE A 117 2.726 -6.930 -3.507 1.00 1.00 H new ATOM 0 HG13 ILE A 117 3.311 -8.536 -3.892 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.455 -10.277 -1.966 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.366 -9.693 -0.287 1.00 1.00 H new ATOM 0 HG23 ILE A 117 1.882 -9.838 -1.258 1.00 1.00 H new ATOM 0 HD11 ILE A 117 0.906 -8.328 -4.432 1.00 1.00 H new ATOM 0 HD12 ILE A 117 1.151 -9.520 -3.134 1.00 1.00 H new ATOM 0 HD13 ILE A 117 0.557 -7.889 -2.742 1.00 1.00 H new ATOM 655 N VAL A 118 2.807 -8.217 1.286 1.00 1.00 N ATOM 656 CA VAL A 118 3.309 -8.317 2.646 1.00 1.00 C ATOM 657 C VAL A 118 3.582 -9.786 2.977 1.00 1.00 C ATOM 658 O VAL A 118 2.717 -10.640 2.788 1.00 1.00 O ATOM 659 CB VAL A 118 2.327 -7.658 3.616 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.510 -8.200 5.035 1.00 1.00 C ATOM 661 CG2 VAL A 118 2.468 -6.135 3.589 1.00 1.00 C ATOM 0 H VAL A 118 2.306 -9.041 0.955 1.00 1.00 H new ATOM 0 HA VAL A 118 4.252 -7.780 2.746 1.00 1.00 H new ATOM 0 HB VAL A 118 1.317 -7.907 3.290 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.800 -7.715 5.704 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.335 -9.276 5.039 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.526 -7.996 5.374 1.00 1.00 H new ATOM 0 HG21 VAL A 118 1.758 -5.691 4.288 1.00 1.00 H new ATOM 0 HG22 VAL A 118 3.482 -5.858 3.877 1.00 1.00 H new ATOM 0 HG23 VAL A 118 2.264 -5.768 2.583 1.00 1.00 H new ATOM 671 N GLU A 119 4.788 -10.035 3.466 1.00 1.00 N ATOM 672 CA GLU A 119 5.185 -11.385 3.826 1.00 1.00 C ATOM 673 C GLU A 119 4.684 -11.730 5.230 1.00 1.00 C ATOM 674 O GLU A 119 4.914 -10.979 6.177 1.00 1.00 O ATOM 675 CB GLU A 119 6.703 -11.555 3.728 1.00 1.00 C ATOM 676 CG GLU A 119 7.068 -12.960 3.247 1.00 1.00 C ATOM 677 CD GLU A 119 8.484 -12.991 2.669 1.00 1.00 C ATOM 678 OE1 GLU A 119 8.665 -13.320 1.488 1.00 1.00 O ATOM 679 OE2 GLU A 119 9.417 -12.658 3.495 1.00 1.00 O ATOM 0 H GLU A 119 5.503 -9.324 3.621 1.00 1.00 H new ATOM 0 HA GLU A 119 4.728 -12.077 3.119 1.00 1.00 H new ATOM 0 HB2 GLU A 119 7.112 -10.814 3.041 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.157 -11.371 4.702 1.00 1.00 H new ATOM 0 HG2 GLU A 119 6.995 -13.663 4.077 1.00 1.00 H new ATOM 0 HG3 GLU A 119 6.355 -13.286 2.490 1.00 1.00 H new ATOM 685 N ALA A 120 4.010 -12.866 5.321 1.00 1.00 N ATOM 686 CA ALA A 120 3.474 -13.320 6.593 1.00 1.00 C ATOM 687 C ALA A 120 3.012 -14.772 6.459 1.00 1.00 C ATOM 688 O ALA A 120 2.893 -15.289 5.349 1.00 1.00 O ATOM 689 CB ALA A 120 2.345 -12.386 7.034 1.00 1.00 C ATOM 0 H ALA A 120 3.822 -13.487 4.534 1.00 1.00 H new ATOM 0 HA ALA A 120 4.242 -13.290 7.366 1.00 1.00 H new ATOM 0 HB1 ALA A 120 1.943 -12.727 7.988 1.00 1.00 H new ATOM 0 HB2 ALA A 120 2.733 -11.373 7.144 1.00 1.00 H new ATOM 0 HB3 ALA A 120 1.554 -12.392 6.284 1.00 1.00 H new ATOM 695 N MET A 121 2.764 -15.389 7.605 1.00 1.00 N ATOM 696 CA MET A 121 2.317 -16.771 7.629 1.00 1.00 C ATOM 697 C MET A 121 3.103 -17.619 6.627 1.00 1.00 C ATOM 698 O MET A 121 2.520 -18.405 5.882 1.00 1.00 O ATOM 699 CB MET A 121 0.826 -16.832 7.292 1.00 1.00 C ATOM 700 CG MET A 121 0.560 -16.297 5.883 1.00 1.00 C ATOM 701 SD MET A 121 -1.119 -16.659 5.399 1.00 1.00 S ATOM 702 CE MET A 121 -0.819 -17.560 3.888 1.00 1.00 C ATOM 0 H MET A 121 2.864 -14.957 8.524 1.00 1.00 H new ATOM 0 HA MET A 121 2.489 -17.171 8.628 1.00 1.00 H new ATOM 0 HB2 MET A 121 0.474 -17.861 7.367 1.00 1.00 H new ATOM 0 HB3 MET A 121 0.261 -16.249 8.019 1.00 1.00 H new ATOM 0 HG2 MET A 121 0.731 -15.221 5.856 1.00 1.00 H new ATOM 0 HG3 MET A 121 1.256 -16.749 5.176 1.00 1.00 H new ATOM 0 HE1 MET A 121 -1.715 -18.115 3.612 1.00 1.00 H new ATOM 0 HE2 MET A 121 -0.565 -16.860 3.091 1.00 1.00 H new ATOM 0 HE3 MET A 121 0.007 -18.255 4.037 1.00 1.00 H new ATOM 710 N LYS A 122 4.414 -17.430 6.641 1.00 1.00 N ATOM 711 CA LYS A 122 5.286 -18.168 5.742 1.00 1.00 C ATOM 712 C LYS A 122 4.644 -18.231 4.354 1.00 1.00 C ATOM 713 O LYS A 122 4.514 -19.309 3.776 1.00 1.00 O ATOM 714 CB LYS A 122 5.621 -19.541 6.328 1.00 1.00 C ATOM 715 CG LYS A 122 6.496 -20.348 5.367 1.00 1.00 C ATOM 716 CD LYS A 122 7.384 -21.333 6.131 1.00 1.00 C ATOM 717 CE LYS A 122 7.437 -22.687 5.421 1.00 1.00 C ATOM 718 NZ LYS A 122 7.289 -23.790 6.398 1.00 1.00 N ATOM 0 H LYS A 122 4.894 -16.777 7.260 1.00 1.00 H new ATOM 0 HA LYS A 122 6.241 -17.654 5.629 1.00 1.00 H new ATOM 0 HB2 LYS A 122 6.138 -19.418 7.280 1.00 1.00 H new ATOM 0 HB3 LYS A 122 4.700 -20.087 6.533 1.00 1.00 H new ATOM 0 HG2 LYS A 122 5.865 -20.892 4.664 1.00 1.00 H new ATOM 0 HG3 LYS A 122 7.118 -19.672 4.780 1.00 1.00 H new ATOM 0 HD2 LYS A 122 8.391 -20.926 6.221 1.00 1.00 H new ATOM 0 HD3 LYS A 122 7.001 -21.464 7.143 1.00 1.00 H new ATOM 0 HE2 LYS A 122 6.644 -22.745 4.675 1.00 1.00 H new ATOM 0 HE3 LYS A 122 8.383 -22.789 4.889 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 7.327 -24.702 5.900 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 8.060 -23.743 7.094 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 6.375 -23.700 6.887 1.00 1.00 H new ATOM 727 N MET A 123 4.261 -17.063 3.861 1.00 1.00 N ATOM 728 CA MET A 123 3.637 -16.972 2.552 1.00 1.00 C ATOM 729 C MET A 123 3.352 -15.515 2.180 1.00 1.00 C ATOM 730 O MET A 123 3.220 -14.662 3.056 1.00 1.00 O ATOM 731 CB MET A 123 2.328 -17.764 2.554 1.00 1.00 C ATOM 732 CG MET A 123 2.115 -18.475 1.216 1.00 1.00 C ATOM 733 SD MET A 123 0.466 -18.155 0.611 1.00 1.00 S ATOM 734 CE MET A 123 -0.264 -19.769 0.833 1.00 1.00 C ATOM 0 H MET A 123 4.371 -16.171 4.344 1.00 1.00 H new ATOM 0 HA MET A 123 4.323 -17.388 1.814 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.343 -18.497 3.361 1.00 1.00 H new ATOM 0 HB3 MET A 123 1.492 -17.092 2.750 1.00 1.00 H new ATOM 0 HG2 MET A 123 2.851 -18.130 0.490 1.00 1.00 H new ATOM 0 HG3 MET A 123 2.265 -19.548 1.337 1.00 1.00 H new ATOM 0 HE1 MET A 123 -1.302 -19.747 0.502 1.00 1.00 H new ATOM 0 HE2 MET A 123 0.289 -20.502 0.246 1.00 1.00 H new ATOM 0 HE3 MET A 123 -0.225 -20.044 1.887 1.00 1.00 H new ATOM 742 N MET A 124 3.266 -15.276 0.880 1.00 1.00 N ATOM 743 CA MET A 124 3.000 -13.937 0.382 1.00 1.00 C ATOM 744 C MET A 124 1.549 -13.532 0.649 1.00 1.00 C ATOM 745 O MET A 124 0.637 -14.344 0.505 1.00 1.00 O ATOM 746 CB MET A 124 3.275 -13.888 -1.123 1.00 1.00 C ATOM 747 CG MET A 124 4.689 -13.375 -1.405 1.00 1.00 C ATOM 748 SD MET A 124 4.915 -13.142 -3.160 1.00 1.00 S ATOM 749 CE MET A 124 6.636 -13.590 -3.312 1.00 1.00 C ATOM 0 H MET A 124 3.376 -15.987 0.156 1.00 1.00 H new ATOM 0 HA MET A 124 3.655 -13.239 0.903 1.00 1.00 H new ATOM 0 HB2 MET A 124 3.153 -14.883 -1.551 1.00 1.00 H new ATOM 0 HB3 MET A 124 2.545 -13.240 -1.609 1.00 1.00 H new ATOM 0 HG2 MET A 124 4.855 -12.434 -0.881 1.00 1.00 H new ATOM 0 HG3 MET A 124 5.425 -14.085 -1.026 1.00 1.00 H new ATOM 0 HE1 MET A 124 6.945 -13.500 -4.353 1.00 1.00 H new ATOM 0 HE2 MET A 124 7.241 -12.925 -2.695 1.00 1.00 H new ATOM 0 HE3 MET A 124 6.775 -14.619 -2.980 1.00 1.00 H new ATOM 757 N ASN A 125 1.380 -12.275 1.033 1.00 1.00 N ATOM 758 CA ASN A 125 0.056 -11.752 1.321 1.00 1.00 C ATOM 759 C ASN A 125 -0.124 -10.409 0.610 1.00 1.00 C ATOM 760 O ASN A 125 0.385 -9.387 1.068 1.00 1.00 O ATOM 761 CB ASN A 125 -0.131 -11.520 2.822 1.00 1.00 C ATOM 762 CG ASN A 125 0.123 -12.807 3.611 1.00 1.00 C ATOM 763 OD1 ASN A 125 1.365 -12.923 4.072 1.00 1.00 O flip ATOM 764 ND2 ASN A 125 -0.752 -13.639 3.788 1.00 1.00 N flip ATOM 0 H ASN A 125 2.139 -11.604 1.151 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.676 -12.481 0.974 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.551 -10.741 3.161 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.143 -11.164 3.015 1.00 1.00 H new ATOM 0 HD21 ASN A 125 -1.685 -13.487 3.406 1.00 1.00 H new ATOM 0 HD22 ASN A 125 -0.550 -14.487 4.318 1.00 1.00 H new ATOM 770 N GLN A 126 -0.848 -10.455 -0.499 1.00 1.00 N ATOM 771 CA GLN A 126 -1.101 -9.254 -1.277 1.00 1.00 C ATOM 772 C GLN A 126 -2.063 -8.329 -0.529 1.00 1.00 C ATOM 773 O GLN A 126 -2.874 -8.788 0.273 1.00 1.00 O ATOM 774 CB GLN A 126 -1.645 -9.605 -2.664 1.00 1.00 C ATOM 775 CG GLN A 126 -2.200 -8.363 -3.365 1.00 1.00 C ATOM 776 CD GLN A 126 -2.855 -8.733 -4.698 1.00 1.00 C ATOM 777 OE1 GLN A 126 -4.001 -8.414 -4.965 1.00 1.00 O ATOM 778 NE2 GLN A 126 -2.064 -9.422 -5.516 1.00 1.00 N ATOM 0 H GLN A 126 -1.267 -11.305 -0.877 1.00 1.00 H new ATOM 0 HA GLN A 126 -0.156 -8.728 -1.415 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -0.852 -10.045 -3.269 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -2.429 -10.356 -2.572 1.00 1.00 H new ATOM 0 HG2 GLN A 126 -2.930 -7.873 -2.721 1.00 1.00 H new ATOM 0 HG3 GLN A 126 -1.396 -7.648 -3.537 1.00 1.00 H new ATOM 0 HE21 GLN A 126 -1.114 -9.656 -5.229 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -2.408 -9.716 -6.430 1.00 1.00 H new ATOM 785 N ILE A 127 -1.940 -7.042 -0.819 1.00 1.00 N ATOM 786 CA ILE A 127 -2.788 -6.047 -0.183 1.00 1.00 C ATOM 787 C ILE A 127 -3.556 -5.276 -1.259 1.00 1.00 C ATOM 788 O ILE A 127 -2.955 -4.581 -2.077 1.00 1.00 O ATOM 789 CB ILE A 127 -1.963 -5.153 0.744 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.002 -5.985 1.596 1.00 1.00 C ATOM 791 CG2 ILE A 127 -2.869 -4.268 1.602 1.00 1.00 C ATOM 792 CD1 ILE A 127 -0.543 -5.202 2.828 1.00 1.00 C ATOM 0 H ILE A 127 -1.266 -6.665 -1.486 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.529 -6.529 0.455 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.356 -4.490 0.127 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -1.493 -6.907 1.909 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.136 -6.271 0.999 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.257 -3.643 2.252 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.477 -3.634 0.956 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.520 -4.896 2.211 1.00 1.00 H new ATOM 0 HD11 ILE A 127 0.139 -5.816 3.416 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -0.032 -4.293 2.512 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -1.409 -4.938 3.435 1.00 1.00 H new ATOM 803 N GLU A 128 -4.872 -5.425 -1.223 1.00 1.00 N ATOM 804 CA GLU A 128 -5.728 -4.751 -2.184 1.00 1.00 C ATOM 805 C GLU A 128 -6.288 -3.461 -1.583 1.00 1.00 C ATOM 806 O GLU A 128 -6.803 -3.464 -0.466 1.00 1.00 O ATOM 807 CB GLU A 128 -6.856 -5.672 -2.654 1.00 1.00 C ATOM 808 CG GLU A 128 -7.200 -5.412 -4.121 1.00 1.00 C ATOM 809 CD GLU A 128 -8.032 -6.558 -4.701 1.00 1.00 C ATOM 810 OE1 GLU A 128 -9.133 -6.838 -4.203 1.00 1.00 O ATOM 811 OE2 GLU A 128 -7.498 -7.166 -5.705 1.00 1.00 O ATOM 0 H GLU A 128 -5.366 -6.003 -0.543 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.128 -4.492 -3.056 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.558 -6.713 -2.525 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.740 -5.515 -2.036 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -7.752 -4.476 -4.208 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -6.283 -5.296 -4.698 1.00 1.00 H new ATOM 817 N ALA A 129 -6.168 -2.387 -2.350 1.00 1.00 N ATOM 818 CA ALA A 129 -6.656 -1.092 -1.907 1.00 1.00 C ATOM 819 C ALA A 129 -7.996 -1.274 -1.191 1.00 1.00 C ATOM 820 O ALA A 129 -8.879 -1.972 -1.688 1.00 1.00 O ATOM 821 CB ALA A 129 -6.759 -0.148 -3.106 1.00 1.00 C ATOM 0 H ALA A 129 -5.740 -2.387 -3.276 1.00 1.00 H new ATOM 0 HA ALA A 129 -5.962 -0.643 -1.197 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -7.125 0.823 -2.774 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.776 -0.029 -3.561 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.450 -0.565 -3.839 1.00 1.00 H new ATOM 827 N ASP A 130 -8.105 -0.635 -0.036 1.00 1.00 N ATOM 828 CA ASP A 130 -9.323 -0.718 0.753 1.00 1.00 C ATOM 829 C ASP A 130 -10.106 0.588 0.613 1.00 1.00 C ATOM 830 O ASP A 130 -11.043 0.839 1.370 1.00 1.00 O ATOM 831 CB ASP A 130 -9.005 -0.922 2.236 1.00 1.00 C ATOM 832 CG ASP A 130 -8.960 -2.382 2.693 1.00 1.00 C ATOM 833 OD1 ASP A 130 -7.908 -3.036 2.635 1.00 1.00 O ATOM 834 OD2 ASP A 130 -10.079 -2.852 3.128 1.00 1.00 O ATOM 0 H ASP A 130 -7.370 -0.058 0.373 1.00 1.00 H new ATOM 0 HA ASP A 130 -9.904 -1.565 0.389 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -8.042 -0.459 2.453 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -9.753 -0.394 2.828 1.00 1.00 H new ATOM 839 N LYS A 131 -9.694 1.386 -0.361 1.00 1.00 N ATOM 840 CA LYS A 131 -10.346 2.661 -0.611 1.00 1.00 C ATOM 841 C LYS A 131 -9.625 3.383 -1.750 1.00 1.00 C ATOM 842 O LYS A 131 -8.548 3.944 -1.551 1.00 1.00 O ATOM 843 CB LYS A 131 -10.434 3.479 0.679 1.00 1.00 C ATOM 844 CG LYS A 131 -11.841 4.050 0.872 1.00 1.00 C ATOM 845 CD LYS A 131 -11.787 5.546 1.188 1.00 1.00 C ATOM 846 CE LYS A 131 -13.195 6.126 1.332 1.00 1.00 C ATOM 847 NZ LYS A 131 -13.812 5.679 2.601 1.00 1.00 N ATOM 0 H LYS A 131 -8.917 1.175 -0.987 1.00 1.00 H new ATOM 0 HA LYS A 131 -11.376 2.506 -0.934 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -10.173 2.851 1.531 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -9.709 4.292 0.648 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -12.431 3.886 -0.030 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -12.344 3.522 1.682 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -11.227 5.707 2.109 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -11.253 6.070 0.395 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -13.151 7.215 1.306 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -13.812 5.812 0.490 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -14.732 6.148 2.724 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -13.949 4.648 2.576 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -13.189 5.926 3.396 1.00 1.00 H new ATOM 856 N SER A 132 -10.247 3.347 -2.919 1.00 1.00 N ATOM 857 CA SER A 132 -9.677 3.992 -4.090 1.00 1.00 C ATOM 858 C SER A 132 -9.036 5.323 -3.695 1.00 1.00 C ATOM 859 O SER A 132 -9.551 6.032 -2.831 1.00 1.00 O ATOM 860 CB SER A 132 -10.740 4.213 -5.169 1.00 1.00 C ATOM 861 OG SER A 132 -11.669 5.229 -4.801 1.00 1.00 O ATOM 0 H SER A 132 -11.140 2.881 -3.081 1.00 1.00 H new ATOM 0 HA SER A 132 -8.910 3.336 -4.503 1.00 1.00 H new ATOM 0 HB2 SER A 132 -10.255 4.487 -6.106 1.00 1.00 H new ATOM 0 HB3 SER A 132 -11.275 3.280 -5.348 1.00 1.00 H new ATOM 0 HG SER A 132 -12.330 5.342 -5.515 1.00 1.00 H new ATOM 866 N GLY A 133 -7.922 5.624 -4.346 1.00 1.00 N ATOM 867 CA GLY A 133 -7.206 6.859 -4.074 1.00 1.00 C ATOM 868 C GLY A 133 -5.935 6.953 -4.920 1.00 1.00 C ATOM 869 O GLY A 133 -5.650 6.064 -5.721 1.00 1.00 O ATOM 0 H GLY A 133 -7.497 5.034 -5.061 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.851 7.712 -4.285 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -6.948 6.908 -3.016 1.00 1.00 H new ATOM 873 N THR A 134 -5.204 8.039 -4.713 1.00 1.00 N ATOM 874 CA THR A 134 -3.970 8.261 -5.447 1.00 1.00 C ATOM 875 C THR A 134 -2.767 8.183 -4.504 1.00 1.00 C ATOM 876 O THR A 134 -2.857 8.581 -3.343 1.00 1.00 O ATOM 877 CB THR A 134 -4.086 9.602 -6.173 1.00 1.00 C ATOM 878 OG1 THR A 134 -5.290 9.485 -6.928 1.00 1.00 O ATOM 879 CG2 THR A 134 -2.999 9.791 -7.233 1.00 1.00 C ATOM 0 H THR A 134 -5.443 8.774 -4.048 1.00 1.00 H new ATOM 0 HA THR A 134 -3.809 7.484 -6.194 1.00 1.00 H new ATOM 0 HB THR A 134 -4.030 10.413 -5.447 1.00 1.00 H new ATOM 0 HG1 THR A 134 -5.444 10.313 -7.429 1.00 1.00 H new ATOM 0 HG21 THR A 134 -3.128 10.759 -7.718 1.00 1.00 H new ATOM 0 HG22 THR A 134 -2.018 9.750 -6.760 1.00 1.00 H new ATOM 0 HG23 THR A 134 -3.076 8.999 -7.978 1.00 1.00 H new ATOM 887 N VAL A 135 -1.669 7.668 -5.038 1.00 1.00 N ATOM 888 CA VAL A 135 -0.451 7.534 -4.258 1.00 1.00 C ATOM 889 C VAL A 135 -0.257 8.786 -3.401 1.00 1.00 C ATOM 890 O VAL A 135 -0.839 9.833 -3.684 1.00 1.00 O ATOM 891 CB VAL A 135 0.735 7.255 -5.184 1.00 1.00 C ATOM 892 CG1 VAL A 135 1.140 8.515 -5.951 1.00 1.00 C ATOM 893 CG2 VAL A 135 1.919 6.683 -4.402 1.00 1.00 C ATOM 0 H VAL A 135 -1.598 7.339 -6.001 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.525 6.684 -3.579 1.00 1.00 H new ATOM 0 HB VAL A 135 0.423 6.506 -5.912 1.00 1.00 H new ATOM 0 HG11 VAL A 135 1.985 8.289 -6.602 1.00 1.00 H new ATOM 0 HG12 VAL A 135 0.300 8.860 -6.554 1.00 1.00 H new ATOM 0 HG13 VAL A 135 1.424 9.295 -5.245 1.00 1.00 H new ATOM 0 HG21 VAL A 135 2.748 6.494 -5.084 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.231 7.397 -3.640 1.00 1.00 H new ATOM 0 HG23 VAL A 135 1.622 5.749 -3.924 1.00 1.00 H new ATOM 903 N LYS A 136 0.562 8.638 -2.370 1.00 1.00 N ATOM 904 CA LYS A 136 0.838 9.745 -1.469 1.00 1.00 C ATOM 905 C LYS A 136 2.312 9.706 -1.059 1.00 1.00 C ATOM 906 O LYS A 136 3.006 10.719 -1.127 1.00 1.00 O ATOM 907 CB LYS A 136 -0.130 9.727 -0.285 1.00 1.00 C ATOM 908 CG LYS A 136 -0.788 11.095 -0.095 1.00 1.00 C ATOM 909 CD LYS A 136 -0.047 11.917 0.962 1.00 1.00 C ATOM 910 CE LYS A 136 -0.007 13.397 0.577 1.00 1.00 C ATOM 911 NZ LYS A 136 -1.100 14.137 1.247 1.00 1.00 N ATOM 0 H LYS A 136 1.043 7.769 -2.138 1.00 1.00 H new ATOM 0 HA LYS A 136 0.671 10.697 -1.972 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -0.897 8.970 -0.449 1.00 1.00 H new ATOM 0 HB3 LYS A 136 0.405 9.447 0.623 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -0.794 11.634 -1.042 1.00 1.00 H new ATOM 0 HG3 LYS A 136 -1.828 10.964 0.204 1.00 1.00 H new ATOM 0 HD2 LYS A 136 -0.539 11.802 1.928 1.00 1.00 H new ATOM 0 HD3 LYS A 136 0.969 11.539 1.075 1.00 1.00 H new ATOM 0 HE2 LYS A 136 0.955 13.826 0.857 1.00 1.00 H new ATOM 0 HE3 LYS A 136 -0.099 13.500 -0.504 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -1.111 15.121 0.910 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 -2.011 13.686 1.027 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 -0.948 14.125 2.276 1.00 1.00 H new ATOM 920 N ALA A 137 2.746 8.526 -0.642 1.00 1.00 N ATOM 921 CA ALA A 137 4.125 8.342 -0.221 1.00 1.00 C ATOM 922 C ALA A 137 4.293 6.936 0.359 1.00 1.00 C ATOM 923 O ALA A 137 3.429 6.455 1.090 1.00 1.00 O ATOM 924 CB ALA A 137 4.503 9.435 0.781 1.00 1.00 C ATOM 0 H ALA A 137 2.168 7.688 -0.587 1.00 1.00 H new ATOM 0 HA ALA A 137 4.801 8.431 -1.071 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.537 9.297 1.097 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.394 10.413 0.311 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.847 9.375 1.650 1.00 1.00 H new ATOM 930 N ILE A 138 5.411 6.316 0.010 1.00 1.00 N ATOM 931 CA ILE A 138 5.704 4.975 0.486 1.00 1.00 C ATOM 932 C ILE A 138 6.682 5.058 1.659 1.00 1.00 C ATOM 933 O ILE A 138 7.842 5.427 1.480 1.00 1.00 O ATOM 934 CB ILE A 138 6.194 4.093 -0.664 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.449 4.418 -1.960 1.00 1.00 C ATOM 936 CG2 ILE A 138 6.093 2.611 -0.300 1.00 1.00 C ATOM 937 CD1 ILE A 138 3.935 4.375 -1.748 1.00 1.00 C ATOM 0 H ILE A 138 6.125 6.718 -0.597 1.00 1.00 H new ATOM 0 HA ILE A 138 4.799 4.496 0.859 1.00 1.00 H new ATOM 0 HB ILE A 138 7.248 4.310 -0.836 1.00 1.00 H new ATOM 0 HG12 ILE A 138 5.742 5.406 -2.314 1.00 1.00 H new ATOM 0 HG13 ILE A 138 5.732 3.705 -2.735 1.00 1.00 H new ATOM 0 HG21 ILE A 138 6.448 2.006 -1.135 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.705 2.410 0.579 1.00 1.00 H new ATOM 0 HG23 ILE A 138 5.055 2.359 -0.085 1.00 1.00 H new ATOM 0 HD11 ILE A 138 3.430 4.610 -2.685 1.00 1.00 H new ATOM 0 HD12 ILE A 138 3.642 3.379 -1.417 1.00 1.00 H new ATOM 0 HD13 ILE A 138 3.653 5.106 -0.990 1.00 1.00 H new ATOM 948 N LEU A 139 6.180 4.707 2.834 1.00 1.00 N ATOM 949 CA LEU A 139 6.995 4.737 4.036 1.00 1.00 C ATOM 950 C LEU A 139 7.874 3.485 4.081 1.00 1.00 C ATOM 951 O LEU A 139 9.071 3.572 4.354 1.00 1.00 O ATOM 952 CB LEU A 139 6.117 4.916 5.275 1.00 1.00 C ATOM 953 CG LEU A 139 4.693 5.415 5.021 1.00 1.00 C ATOM 954 CD1 LEU A 139 3.988 5.754 6.336 1.00 1.00 C ATOM 955 CD2 LEU A 139 4.691 6.597 4.049 1.00 1.00 C ATOM 0 H LEU A 139 5.218 4.400 2.979 1.00 1.00 H new ATOM 0 HA LEU A 139 7.664 5.598 4.021 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.058 3.960 5.796 1.00 1.00 H new ATOM 0 HB3 LEU A 139 6.611 5.616 5.948 1.00 1.00 H new ATOM 0 HG LEU A 139 4.128 4.610 4.551 1.00 1.00 H new ATOM 0 HD11 LEU A 139 2.978 6.106 6.127 1.00 1.00 H new ATOM 0 HD12 LEU A 139 3.939 4.864 6.963 1.00 1.00 H new ATOM 0 HD13 LEU A 139 4.544 6.534 6.856 1.00 1.00 H new ATOM 0 HD21 LEU A 139 3.667 6.932 3.886 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.278 7.414 4.469 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.127 6.288 3.099 1.00 1.00 H new ATOM 966 N VAL A 140 7.247 2.350 3.810 1.00 1.00 N ATOM 967 CA VAL A 140 7.957 1.082 3.816 1.00 1.00 C ATOM 968 C VAL A 140 8.579 0.844 2.439 1.00 1.00 C ATOM 969 O VAL A 140 8.069 1.331 1.431 1.00 1.00 O ATOM 970 CB VAL A 140 7.016 -0.043 4.251 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.877 -0.224 3.244 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.782 -1.351 4.453 1.00 1.00 C ATOM 0 H VAL A 140 6.255 2.282 3.585 1.00 1.00 H new ATOM 0 HA VAL A 140 8.771 1.104 4.540 1.00 1.00 H new ATOM 0 HB VAL A 140 6.576 0.238 5.208 1.00 1.00 H new ATOM 0 HG11 VAL A 140 5.222 -1.030 3.576 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.306 0.701 3.171 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.291 -0.473 2.267 1.00 1.00 H new ATOM 0 HG21 VAL A 140 7.090 -2.134 4.762 1.00 1.00 H new ATOM 0 HG22 VAL A 140 8.262 -1.639 3.518 1.00 1.00 H new ATOM 0 HG23 VAL A 140 8.541 -1.213 5.223 1.00 1.00 H new ATOM 982 N GLU A 141 9.671 0.093 2.439 1.00 1.00 N ATOM 983 CA GLU A 141 10.367 -0.216 1.202 1.00 1.00 C ATOM 984 C GLU A 141 10.105 -1.667 0.794 1.00 1.00 C ATOM 985 O GLU A 141 9.510 -2.431 1.553 1.00 1.00 O ATOM 986 CB GLU A 141 11.867 0.054 1.335 1.00 1.00 C ATOM 987 CG GLU A 141 12.444 0.599 0.026 1.00 1.00 C ATOM 988 CD GLU A 141 12.847 2.067 0.173 1.00 1.00 C ATOM 989 OE1 GLU A 141 14.045 2.387 0.146 1.00 1.00 O ATOM 990 OE2 GLU A 141 11.865 2.890 0.320 1.00 1.00 O ATOM 0 H GLU A 141 10.091 -0.310 3.277 1.00 1.00 H new ATOM 0 HA GLU A 141 9.982 0.436 0.418 1.00 1.00 H new ATOM 0 HB2 GLU A 141 12.042 0.769 2.139 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.383 -0.866 1.609 1.00 1.00 H new ATOM 0 HG2 GLU A 141 13.312 0.008 -0.267 1.00 1.00 H new ATOM 0 HG3 GLU A 141 11.706 0.499 -0.770 1.00 1.00 H new ATOM 996 N SER A 142 10.564 -2.004 -0.402 1.00 1.00 N ATOM 997 CA SER A 142 10.387 -3.350 -0.920 1.00 1.00 C ATOM 998 C SER A 142 11.280 -4.327 -0.153 1.00 1.00 C ATOM 999 O SER A 142 12.493 -4.356 -0.357 1.00 1.00 O ATOM 1000 CB SER A 142 10.697 -3.410 -2.417 1.00 1.00 C ATOM 1001 OG SER A 142 12.097 -3.502 -2.668 1.00 1.00 O ATOM 0 H SER A 142 11.058 -1.368 -1.028 1.00 1.00 H new ATOM 0 HA SER A 142 9.344 -3.635 -0.782 1.00 1.00 H new ATOM 0 HB2 SER A 142 10.192 -4.270 -2.858 1.00 1.00 H new ATOM 0 HB3 SER A 142 10.298 -2.521 -2.906 1.00 1.00 H new ATOM 0 HG SER A 142 12.590 -3.330 -1.839 1.00 1.00 H new ATOM 1006 N GLY A 143 10.646 -5.104 0.713 1.00 1.00 N ATOM 1007 CA GLY A 143 11.368 -6.080 1.511 1.00 1.00 C ATOM 1008 C GLY A 143 11.451 -5.638 2.974 1.00 1.00 C ATOM 1009 O GLY A 143 11.681 -6.458 3.862 1.00 1.00 O ATOM 0 H GLY A 143 9.640 -5.077 0.879 1.00 1.00 H new ATOM 0 HA2 GLY A 143 10.870 -7.047 1.447 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.373 -6.212 1.110 1.00 1.00 H new ATOM 1013 N GLN A 144 11.260 -4.343 3.180 1.00 1.00 N ATOM 1014 CA GLN A 144 11.310 -3.783 4.519 1.00 1.00 C ATOM 1015 C GLN A 144 10.292 -4.479 5.425 1.00 1.00 C ATOM 1016 O GLN A 144 9.173 -4.766 5.001 1.00 1.00 O ATOM 1017 CB GLN A 144 11.075 -2.271 4.490 1.00 1.00 C ATOM 1018 CG GLN A 144 11.202 -1.670 5.892 1.00 1.00 C ATOM 1019 CD GLN A 144 10.678 -0.233 5.921 1.00 1.00 C ATOM 1020 OE1 GLN A 144 9.813 0.124 6.704 1.00 1.00 O ATOM 1021 NE2 GLN A 144 11.247 0.569 5.026 1.00 1.00 N ATOM 0 H GLN A 144 11.070 -3.666 2.441 1.00 1.00 H new ATOM 0 HA GLN A 144 12.306 -3.955 4.926 1.00 1.00 H new ATOM 0 HB2 GLN A 144 11.796 -1.800 3.822 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.084 -2.061 4.089 1.00 1.00 H new ATOM 0 HG2 GLN A 144 10.645 -2.279 6.604 1.00 1.00 H new ATOM 0 HG3 GLN A 144 12.246 -1.687 6.206 1.00 1.00 H new ATOM 0 HE21 GLN A 144 11.966 0.206 4.400 1.00 1.00 H new ATOM 0 HE22 GLN A 144 10.965 1.547 4.966 1.00 1.00 H new ATOM 1028 N PRO A 145 10.727 -4.737 6.687 1.00 1.00 N ATOM 1029 CA PRO A 145 9.866 -5.394 7.656 1.00 1.00 C ATOM 1030 C PRO A 145 8.799 -4.432 8.183 1.00 1.00 C ATOM 1031 O PRO A 145 9.023 -3.223 8.243 1.00 1.00 O ATOM 1032 CB PRO A 145 10.805 -5.892 8.742 1.00 1.00 C ATOM 1033 CG PRO A 145 12.091 -5.098 8.579 1.00 1.00 C ATOM 1034 CD PRO A 145 12.045 -4.411 7.224 1.00 1.00 C ATOM 0 HA PRO A 145 9.302 -6.221 7.225 1.00 1.00 H new ATOM 0 HB2 PRO A 145 10.374 -5.738 9.731 1.00 1.00 H new ATOM 0 HB3 PRO A 145 10.990 -6.961 8.638 1.00 1.00 H new ATOM 0 HG2 PRO A 145 12.189 -4.362 9.377 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.957 -5.756 8.644 1.00 1.00 H new ATOM 0 HD2 PRO A 145 12.177 -3.333 7.322 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.839 -4.772 6.570 1.00 1.00 H new ATOM 1039 N VAL A 146 7.662 -5.003 8.551 1.00 1.00 N ATOM 1040 CA VAL A 146 6.561 -4.211 9.071 1.00 1.00 C ATOM 1041 C VAL A 146 6.043 -4.850 10.361 1.00 1.00 C ATOM 1042 O VAL A 146 6.305 -6.023 10.626 1.00 1.00 O ATOM 1043 CB VAL A 146 5.476 -4.059 8.003 1.00 1.00 C ATOM 1044 CG1 VAL A 146 6.093 -3.932 6.609 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.484 -5.222 8.059 1.00 1.00 C ATOM 0 H VAL A 146 7.479 -6.005 8.499 1.00 1.00 H new ATOM 0 HA VAL A 146 6.899 -3.205 9.319 1.00 1.00 H new ATOM 0 HB VAL A 146 4.927 -3.141 8.212 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.300 -3.825 5.869 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.741 -3.056 6.576 1.00 1.00 H new ATOM 0 HG13 VAL A 146 6.678 -4.824 6.388 1.00 1.00 H new ATOM 0 HG21 VAL A 146 3.724 -5.089 7.289 1.00 1.00 H new ATOM 0 HG22 VAL A 146 5.013 -6.160 7.888 1.00 1.00 H new ATOM 0 HG23 VAL A 146 4.008 -5.247 9.039 1.00 1.00 H new ATOM 1055 N GLU A 147 5.318 -4.051 11.130 1.00 1.00 N ATOM 1056 CA GLU A 147 4.762 -4.524 12.387 1.00 1.00 C ATOM 1057 C GLU A 147 3.272 -4.186 12.468 1.00 1.00 C ATOM 1058 O GLU A 147 2.735 -3.516 11.587 1.00 1.00 O ATOM 1059 CB GLU A 147 5.523 -3.938 13.578 1.00 1.00 C ATOM 1060 CG GLU A 147 6.988 -3.680 13.220 1.00 1.00 C ATOM 1061 CD GLU A 147 7.783 -3.236 14.449 1.00 1.00 C ATOM 1062 OE1 GLU A 147 7.309 -2.391 15.223 1.00 1.00 O ATOM 1063 OE2 GLU A 147 8.933 -3.804 14.589 1.00 1.00 O ATOM 0 H GLU A 147 5.103 -3.079 10.907 1.00 1.00 H new ATOM 0 HA GLU A 147 4.872 -5.608 12.426 1.00 1.00 H new ATOM 0 HB2 GLU A 147 5.052 -3.006 13.892 1.00 1.00 H new ATOM 0 HB3 GLU A 147 5.467 -4.624 14.423 1.00 1.00 H new ATOM 0 HG2 GLU A 147 7.430 -4.586 12.805 1.00 1.00 H new ATOM 0 HG3 GLU A 147 7.048 -2.913 12.447 1.00 1.00 H new ATOM 1069 N PHE A 148 2.646 -4.665 13.533 1.00 1.00 N ATOM 1070 CA PHE A 148 1.229 -4.423 13.741 1.00 1.00 C ATOM 1071 C PHE A 148 0.939 -2.924 13.846 1.00 1.00 C ATOM 1072 O PHE A 148 1.700 -2.183 14.468 1.00 1.00 O ATOM 1073 CB PHE A 148 0.848 -5.098 15.059 1.00 1.00 C ATOM 1074 CG PHE A 148 -0.660 -5.240 15.273 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.372 -6.127 14.528 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -1.289 -4.479 16.208 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.772 -6.259 14.726 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -2.689 -4.610 16.406 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.401 -5.498 15.661 1.00 1.00 C ATOM 0 H PHE A 148 3.095 -5.220 14.262 1.00 1.00 H new ATOM 0 HA PHE A 148 0.657 -4.819 12.902 1.00 1.00 H new ATOM 0 HB2 PHE A 148 1.304 -6.087 15.094 1.00 1.00 H new ATOM 0 HB3 PHE A 148 1.269 -4.524 15.884 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -0.873 -6.731 13.785 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -0.724 -3.775 16.800 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -3.337 -6.964 14.134 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -3.188 -4.005 17.148 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.466 -5.599 15.812 1.00 1.00 H new ATOM 1088 N ASP A 149 -0.162 -2.522 13.230 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.562 -1.125 13.247 1.00 1.00 C ATOM 1090 C ASP A 149 0.557 -0.271 12.647 1.00 1.00 C ATOM 1091 O ASP A 149 0.575 0.946 12.821 1.00 1.00 O ATOM 1092 CB ASP A 149 -0.812 -0.641 14.676 1.00 1.00 C ATOM 1093 CG ASP A 149 0.436 -0.174 15.428 1.00 1.00 C ATOM 1094 OD1 ASP A 149 0.981 0.905 15.153 1.00 1.00 O ATOM 1095 OD2 ASP A 149 0.854 -0.980 16.344 1.00 1.00 O ATOM 0 H ASP A 149 -0.790 -3.139 12.716 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.481 -1.030 12.669 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -1.528 0.180 14.645 1.00 1.00 H new ATOM 0 HB3 ASP A 149 -1.277 -1.449 15.241 1.00 1.00 H new ATOM 1100 N GLU A 150 1.465 -0.944 11.955 1.00 1.00 N ATOM 1101 CA GLU A 150 2.585 -0.262 11.329 1.00 1.00 C ATOM 1102 C GLU A 150 2.181 0.268 9.952 1.00 1.00 C ATOM 1103 O GLU A 150 1.543 -0.439 9.173 1.00 1.00 O ATOM 1104 CB GLU A 150 3.801 -1.186 11.227 1.00 1.00 C ATOM 1105 CG GLU A 150 5.078 -0.384 10.968 1.00 1.00 C ATOM 1106 CD GLU A 150 5.437 0.481 12.178 1.00 1.00 C ATOM 1107 OE1 GLU A 150 4.722 0.457 13.190 1.00 1.00 O ATOM 1108 OE2 GLU A 150 6.503 1.194 12.041 1.00 1.00 O ATOM 0 H GLU A 150 1.448 -1.954 11.814 1.00 1.00 H new ATOM 0 HA GLU A 150 2.865 0.586 11.954 1.00 1.00 H new ATOM 0 HB2 GLU A 150 3.907 -1.757 12.149 1.00 1.00 H new ATOM 0 HB3 GLU A 150 3.649 -1.905 10.422 1.00 1.00 H new ATOM 0 HG2 GLU A 150 5.900 -1.064 10.746 1.00 1.00 H new ATOM 0 HG3 GLU A 150 4.943 0.249 10.091 1.00 1.00 H new ATOM 1114 N PRO A 151 2.581 1.541 9.686 1.00 1.00 N ATOM 1115 CA PRO A 151 2.268 2.174 8.417 1.00 1.00 C ATOM 1116 C PRO A 151 3.154 1.625 7.297 1.00 1.00 C ATOM 1117 O PRO A 151 4.354 1.431 7.489 1.00 1.00 O ATOM 1118 CB PRO A 151 2.469 3.661 8.659 1.00 1.00 C ATOM 1119 CG PRO A 151 3.330 3.768 9.907 1.00 1.00 C ATOM 1120 CD PRO A 151 3.338 2.407 10.584 1.00 1.00 C ATOM 0 HA PRO A 151 1.249 1.972 8.086 1.00 1.00 H new ATOM 0 HB2 PRO A 151 2.957 4.133 7.806 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.514 4.166 8.799 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.344 4.071 9.647 1.00 1.00 H new ATOM 0 HG3 PRO A 151 2.933 4.528 10.581 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.355 2.040 10.724 1.00 1.00 H new ATOM 0 HD3 PRO A 151 2.878 2.453 11.571 1.00 1.00 H new ATOM 1125 N LEU A 152 2.530 1.391 6.152 1.00 1.00 N ATOM 1126 CA LEU A 152 3.247 0.868 5.002 1.00 1.00 C ATOM 1127 C LEU A 152 3.288 1.934 3.905 1.00 1.00 C ATOM 1128 O LEU A 152 4.310 2.590 3.709 1.00 1.00 O ATOM 1129 CB LEU A 152 2.636 -0.459 4.547 1.00 1.00 C ATOM 1130 CG LEU A 152 2.362 -1.484 5.649 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.737 -2.756 5.073 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.632 -1.780 6.450 1.00 1.00 C ATOM 0 H LEU A 152 1.535 1.554 5.996 1.00 1.00 H new ATOM 0 HA LEU A 152 4.280 0.642 5.267 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.698 -0.247 4.034 1.00 1.00 H new ATOM 0 HB3 LEU A 152 3.305 -0.912 3.815 1.00 1.00 H new ATOM 0 HG LEU A 152 1.637 -1.056 6.341 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.553 -3.468 5.878 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.795 -2.509 4.584 1.00 1.00 H new ATOM 0 HD13 LEU A 152 2.418 -3.199 4.346 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.410 -2.511 7.227 1.00 1.00 H new ATOM 0 HD22 LEU A 152 4.397 -2.179 5.784 1.00 1.00 H new ATOM 0 HD23 LEU A 152 3.995 -0.861 6.910 1.00 1.00 H new ATOM 1143 N VAL A 153 2.164 2.074 3.217 1.00 1.00 N ATOM 1144 CA VAL A 153 2.059 3.049 2.145 1.00 1.00 C ATOM 1145 C VAL A 153 0.997 4.089 2.510 1.00 1.00 C ATOM 1146 O VAL A 153 0.032 3.779 3.206 1.00 1.00 O ATOM 1147 CB VAL A 153 1.771 2.341 0.820 1.00 1.00 C ATOM 1148 CG1 VAL A 153 1.418 3.349 -0.275 1.00 1.00 C ATOM 1149 CG2 VAL A 153 2.952 1.464 0.399 1.00 1.00 C ATOM 0 H VAL A 153 1.318 1.528 3.381 1.00 1.00 H new ATOM 0 HA VAL A 153 3.003 3.579 2.017 1.00 1.00 H new ATOM 0 HB VAL A 153 0.908 1.692 0.968 1.00 1.00 H new ATOM 0 HG11 VAL A 153 1.218 2.819 -1.206 1.00 1.00 H new ATOM 0 HG12 VAL A 153 0.532 3.911 0.020 1.00 1.00 H new ATOM 0 HG13 VAL A 153 2.252 4.036 -0.420 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.721 0.972 -0.546 1.00 1.00 H new ATOM 0 HG22 VAL A 153 3.840 2.084 0.278 1.00 1.00 H new ATOM 0 HG23 VAL A 153 3.137 0.711 1.165 1.00 1.00 H new ATOM 1159 N VAL A 154 1.212 5.303 2.023 1.00 1.00 N ATOM 1160 CA VAL A 154 0.286 6.390 2.289 1.00 1.00 C ATOM 1161 C VAL A 154 -0.379 6.819 0.980 1.00 1.00 C ATOM 1162 O VAL A 154 0.302 7.192 0.026 1.00 1.00 O ATOM 1163 CB VAL A 154 1.014 7.537 2.994 1.00 1.00 C ATOM 1164 CG1 VAL A 154 0.110 8.765 3.119 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.534 7.097 4.363 1.00 1.00 C ATOM 0 H VAL A 154 2.014 5.557 1.446 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.505 6.062 2.963 1.00 1.00 H new ATOM 0 HB VAL A 154 1.873 7.814 2.383 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.651 9.565 3.623 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.189 9.099 2.126 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -0.777 8.506 3.697 1.00 1.00 H new ATOM 0 HG21 VAL A 154 2.047 7.931 4.842 1.00 1.00 H new ATOM 0 HG22 VAL A 154 0.697 6.780 4.985 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.229 6.267 4.239 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.703 6.753 0.977 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.468 7.130 -0.200 1.00 1.00 C ATOM 1177 C ILE A 155 -3.173 8.462 0.061 1.00 1.00 C ATOM 1178 O ILE A 155 -3.283 8.897 1.207 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.418 6.001 -0.605 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.642 4.800 -1.150 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.471 6.500 -1.596 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -2.243 3.847 -0.022 1.00 1.00 C ATOM 0 H ILE A 155 -2.265 6.444 1.770 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.806 7.281 -1.053 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.948 5.664 0.286 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -3.253 4.269 -1.880 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -1.749 5.146 -1.672 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.133 5.678 -1.868 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.053 7.299 -1.137 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -3.978 6.879 -2.491 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.693 3.002 -0.437 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -1.613 4.374 0.694 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -3.139 3.484 0.482 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.632 9.074 -1.021 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.323 10.349 -0.923 1.00 1.00 C ATOM 1195 C GLU A 156 -5.789 10.190 -1.331 1.00 1.00 C ATOM 1196 O GLU A 156 -6.344 11.050 -2.012 1.00 1.00 O ATOM 1197 CB GLU A 156 -3.629 11.415 -1.774 1.00 1.00 C ATOM 1198 CG GLU A 156 -3.762 12.798 -1.135 1.00 1.00 C ATOM 1199 CD GLU A 156 -4.549 13.748 -2.042 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -4.016 14.785 -2.464 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -5.755 13.375 -2.306 1.00 1.00 O ATOM 0 H GLU A 156 -3.539 8.711 -1.970 1.00 1.00 H new ATOM 0 HA GLU A 156 -4.289 10.681 0.115 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -2.575 11.164 -1.890 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -4.065 11.429 -2.773 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -4.264 12.711 -0.171 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -2.772 13.210 -0.942 1.00 1.00 H new