USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=13 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 81 HIS : no HE2:sc= -2.33! C(o=-7.3!,f=-8.7!) USER MOD Set 1.2: A 131 LYS NZ :NH3+ -132:sc= -4.93! (180deg=-10.5!) USER MOD Single : A 85 SER OG : rot -77:sc= -1.87! USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.228 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 117:sc= 0.882 USER MOD Single : A 96 SER OG : rot 180:sc= -0.043 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.167 K(o=-0.17,f=-0.95) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 163:sc= -3.07! USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) 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 : amide:sc= -0.843 X(o=-0.84,f=-0.69) USER MOD Single : A 126 GLN :FLIP amide:sc= -1.62 F(o=-2.9!,f=-1.6) USER MOD Single : A 132 SER OG : rot -150:sc= 0.0123 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 45:sc= 0.22 USER MOD Single : A 144 GLN : amide:sc= -1.5 K(o=-1.5,f=-2.7!) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.376 8.304 2.920 1.00 1.00 N ATOM 131 CA HIS A 81 -5.435 7.060 3.669 1.00 1.00 C ATOM 132 C HIS A 81 -4.020 6.625 4.055 1.00 1.00 C ATOM 133 O HIS A 81 -3.040 7.188 3.568 1.00 1.00 O ATOM 134 CB HIS A 81 -6.192 5.989 2.883 1.00 1.00 C ATOM 135 CG HIS A 81 -7.130 6.541 1.835 1.00 1.00 C ATOM 136 ND1 HIS A 81 -7.806 7.738 1.992 1.00 1.00 N ATOM 137 CD2 HIS A 81 -7.494 6.049 0.617 1.00 1.00 C ATOM 138 CE1 HIS A 81 -8.542 7.948 0.910 1.00 1.00 C ATOM 139 NE2 HIS A 81 -8.348 6.898 0.060 1.00 1.00 N ATOM 0 HA HIS A 81 -5.994 7.213 4.592 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -5.471 5.331 2.399 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -6.764 5.377 3.581 1.00 1.00 H new ATOM 0 HD1 HIS A 81 -7.748 8.354 2.803 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -7.146 5.125 0.180 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -9.182 8.800 0.732 1.00 1.00 H new ATOM 146 N ILE A 82 -3.958 5.627 4.924 1.00 1.00 N ATOM 147 CA ILE A 82 -2.680 5.109 5.379 1.00 1.00 C ATOM 148 C ILE A 82 -2.763 3.587 5.498 1.00 1.00 C ATOM 149 O ILE A 82 -3.526 3.065 6.309 1.00 1.00 O ATOM 150 CB ILE A 82 -2.251 5.804 6.674 1.00 1.00 C ATOM 151 CG1 ILE A 82 -2.200 7.322 6.491 1.00 1.00 C ATOM 152 CG2 ILE A 82 -0.922 5.243 7.184 1.00 1.00 C ATOM 153 CD1 ILE A 82 -0.998 7.731 5.637 1.00 1.00 C ATOM 0 H ILE A 82 -4.773 5.163 5.325 1.00 1.00 H new ATOM 0 HA ILE A 82 -1.899 5.330 4.651 1.00 1.00 H new ATOM 0 HB ILE A 82 -3.001 5.597 7.437 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -3.120 7.666 6.019 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -2.141 7.808 7.465 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -0.641 5.754 8.105 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -1.029 4.176 7.379 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -0.149 5.399 6.432 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -0.985 8.815 5.522 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -0.078 7.407 6.124 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -1.073 7.263 4.655 1.00 1.00 H new ATOM 164 N VAL A 83 -1.968 2.917 4.676 1.00 1.00 N ATOM 165 CA VAL A 83 -1.943 1.464 4.678 1.00 1.00 C ATOM 166 C VAL A 83 -1.093 0.974 5.852 1.00 1.00 C ATOM 167 O VAL A 83 0.108 1.236 5.904 1.00 1.00 O ATOM 168 CB VAL A 83 -1.449 0.948 3.325 1.00 1.00 C ATOM 169 CG1 VAL A 83 -1.412 -0.582 3.303 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.308 1.492 2.182 1.00 1.00 C ATOM 0 H VAL A 83 -1.337 3.354 4.004 1.00 1.00 H new ATOM 0 HA VAL A 83 -2.948 1.065 4.816 1.00 1.00 H new ATOM 0 HB VAL A 83 -0.431 1.311 3.180 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -1.057 -0.923 2.330 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -0.738 -0.941 4.081 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -2.414 -0.973 3.482 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -1.935 1.109 1.232 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.341 1.174 2.320 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.261 2.581 2.178 1.00 1.00 H new ATOM 180 N ARG A 84 -1.749 0.274 6.766 1.00 1.00 N ATOM 181 CA ARG A 84 -1.069 -0.254 7.935 1.00 1.00 C ATOM 182 C ARG A 84 -1.049 -1.782 7.892 1.00 1.00 C ATOM 183 O ARG A 84 -2.100 -2.420 7.834 1.00 1.00 O ATOM 184 CB ARG A 84 -1.753 0.205 9.224 1.00 1.00 C ATOM 185 CG ARG A 84 -1.579 1.711 9.431 1.00 1.00 C ATOM 186 CD ARG A 84 -2.085 2.136 10.812 1.00 1.00 C ATOM 187 NE ARG A 84 -0.943 2.502 11.679 1.00 1.00 N ATOM 188 CZ ARG A 84 -0.409 3.740 11.745 1.00 1.00 C ATOM 189 NH1 ARG A 84 -0.911 4.744 10.995 1.00 1.00 N ATOM 190 NH2 ARG A 84 0.611 3.954 12.555 1.00 1.00 N ATOM 0 H ARG A 84 -2.745 0.060 6.720 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.047 0.126 7.924 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -2.814 -0.040 9.184 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.334 -0.333 10.074 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -0.527 1.977 9.327 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.123 2.253 8.658 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -2.764 2.983 10.715 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -2.652 1.323 11.267 1.00 1.00 H new ATOM 0 HE ARG A 84 -0.534 1.773 12.263 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -1.700 4.570 10.372 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -0.501 5.676 11.051 1.00 1.00 H new ATOM 0 HH21 ARG A 84 0.984 3.190 13.119 1.00 1.00 H new ATOM 0 HH22 ARG A 84 1.027 4.883 12.617 1.00 1.00 H new ATOM 199 N SER A 85 0.158 -2.329 7.923 1.00 1.00 N ATOM 200 CA SER A 85 0.329 -3.771 7.888 1.00 1.00 C ATOM 201 C SER A 85 -0.519 -4.424 8.982 1.00 1.00 C ATOM 202 O SER A 85 -0.197 -4.325 10.165 1.00 1.00 O ATOM 203 CB SER A 85 1.800 -4.156 8.057 1.00 1.00 C ATOM 204 OG SER A 85 2.317 -4.807 6.900 1.00 1.00 O ATOM 0 H SER A 85 1.028 -1.798 7.972 1.00 1.00 H new ATOM 0 HA SER A 85 -0.003 -4.131 6.914 1.00 1.00 H new ATOM 0 HB2 SER A 85 2.388 -3.261 8.263 1.00 1.00 H new ATOM 0 HB3 SER A 85 1.906 -4.813 8.920 1.00 1.00 H new ATOM 0 HG SER A 85 2.005 -5.736 6.880 1.00 1.00 H new ATOM 209 N PRO A 86 -1.615 -5.095 8.536 1.00 1.00 N ATOM 210 CA PRO A 86 -2.511 -5.765 9.462 1.00 1.00 C ATOM 211 C PRO A 86 -1.890 -7.060 9.988 1.00 1.00 C ATOM 212 O PRO A 86 -2.507 -7.773 10.777 1.00 1.00 O ATOM 213 CB PRO A 86 -3.790 -5.997 8.674 1.00 1.00 C ATOM 214 CG PRO A 86 -3.406 -5.871 7.209 1.00 1.00 C ATOM 215 CD PRO A 86 -2.028 -5.233 7.142 1.00 1.00 C ATOM 0 HA PRO A 86 -2.711 -5.173 10.355 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.206 -6.982 8.885 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.552 -5.265 8.942 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -3.397 -6.851 6.731 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -4.135 -5.262 6.674 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -1.330 -5.856 6.582 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -2.064 -4.265 6.642 1.00 1.00 H new ATOM 220 N MET A 87 -0.676 -7.325 9.527 1.00 1.00 N ATOM 221 CA MET A 87 0.036 -8.523 9.941 1.00 1.00 C ATOM 222 C MET A 87 1.550 -8.316 9.856 1.00 1.00 C ATOM 223 O MET A 87 2.066 -7.897 8.822 1.00 1.00 O ATOM 224 CB MET A 87 -0.371 -9.694 9.046 1.00 1.00 C ATOM 225 CG MET A 87 -1.192 -10.722 9.827 1.00 1.00 C ATOM 226 SD MET A 87 -2.659 -11.157 8.909 1.00 1.00 S ATOM 227 CE MET A 87 -3.585 -11.996 10.184 1.00 1.00 C ATOM 0 H MET A 87 -0.168 -6.731 8.871 1.00 1.00 H new ATOM 0 HA MET A 87 -0.225 -8.739 10.977 1.00 1.00 H new ATOM 0 HB2 MET A 87 -0.952 -9.325 8.201 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.520 -10.170 8.637 1.00 1.00 H new ATOM 0 HG2 MET A 87 -0.592 -11.613 10.013 1.00 1.00 H new ATOM 0 HG3 MET A 87 -1.469 -10.315 10.800 1.00 1.00 H new ATOM 0 HE1 MET A 87 -4.538 -12.336 9.778 1.00 1.00 H new ATOM 0 HE2 MET A 87 -3.016 -12.854 10.542 1.00 1.00 H new ATOM 0 HE3 MET A 87 -3.768 -11.311 11.012 1.00 1.00 H new ATOM 235 N VAL A 88 2.220 -8.623 10.958 1.00 1.00 N ATOM 236 CA VAL A 88 3.664 -8.477 11.020 1.00 1.00 C ATOM 237 C VAL A 88 4.308 -9.362 9.952 1.00 1.00 C ATOM 238 O VAL A 88 3.751 -10.390 9.574 1.00 1.00 O ATOM 239 CB VAL A 88 4.159 -8.789 12.434 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.666 -8.546 12.552 1.00 1.00 C ATOM 241 CG2 VAL A 88 3.390 -7.977 13.477 1.00 1.00 C ATOM 0 H VAL A 88 1.789 -8.972 11.814 1.00 1.00 H new ATOM 0 HA VAL A 88 3.955 -7.448 10.807 1.00 1.00 H new ATOM 0 HB VAL A 88 3.972 -9.845 12.629 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.993 -8.775 13.566 1.00 1.00 H new ATOM 0 HG12 VAL A 88 6.194 -9.188 11.847 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.885 -7.502 12.327 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.762 -8.218 14.473 1.00 1.00 H new ATOM 0 HG22 VAL A 88 3.530 -6.913 13.285 1.00 1.00 H new ATOM 0 HG23 VAL A 88 2.329 -8.220 13.417 1.00 1.00 H new ATOM 251 N GLY A 89 5.475 -8.928 9.495 1.00 1.00 N ATOM 252 CA GLY A 89 6.200 -9.669 8.477 1.00 1.00 C ATOM 253 C GLY A 89 7.099 -8.738 7.659 1.00 1.00 C ATOM 254 O GLY A 89 8.059 -8.176 8.184 1.00 1.00 O ATOM 0 H GLY A 89 5.935 -8.074 9.811 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.805 -10.444 8.947 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.494 -10.172 7.816 1.00 1.00 H new ATOM 258 N THR A 90 6.755 -8.603 6.387 1.00 1.00 N ATOM 259 CA THR A 90 7.518 -7.751 5.492 1.00 1.00 C ATOM 260 C THR A 90 6.597 -7.110 4.452 1.00 1.00 C ATOM 261 O THR A 90 5.475 -7.570 4.243 1.00 1.00 O ATOM 262 CB THR A 90 8.636 -8.593 4.875 1.00 1.00 C ATOM 263 OG1 THR A 90 9.511 -8.863 5.968 1.00 1.00 O ATOM 264 CG2 THR A 90 9.499 -7.795 3.895 1.00 1.00 C ATOM 0 H THR A 90 5.958 -9.070 5.955 1.00 1.00 H new ATOM 0 HA THR A 90 7.976 -6.922 6.031 1.00 1.00 H new ATOM 0 HB THR A 90 8.202 -9.450 4.361 1.00 1.00 H new ATOM 0 HG1 THR A 90 10.265 -9.407 5.657 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.277 -8.440 3.486 1.00 1.00 H new ATOM 0 HG22 THR A 90 8.876 -7.420 3.084 1.00 1.00 H new ATOM 0 HG23 THR A 90 9.960 -6.956 4.416 1.00 1.00 H new ATOM 272 N PHE A 91 7.104 -6.058 3.827 1.00 1.00 N ATOM 273 CA PHE A 91 6.342 -5.348 2.814 1.00 1.00 C ATOM 274 C PHE A 91 7.140 -5.221 1.515 1.00 1.00 C ATOM 275 O PHE A 91 8.337 -4.944 1.543 1.00 1.00 O ATOM 276 CB PHE A 91 6.059 -3.949 3.364 1.00 1.00 C ATOM 277 CG PHE A 91 5.457 -2.987 2.338 1.00 1.00 C ATOM 278 CD1 PHE A 91 6.225 -2.508 1.323 1.00 1.00 C ATOM 279 CD2 PHE A 91 4.155 -2.609 2.442 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.666 -1.615 0.371 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.596 -1.715 1.491 1.00 1.00 C ATOM 282 CZ PHE A 91 4.364 -1.237 0.474 1.00 1.00 C ATOM 0 H PHE A 91 8.035 -5.680 4.003 1.00 1.00 H new ATOM 0 HA PHE A 91 5.423 -5.891 2.592 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.378 -4.034 4.211 1.00 1.00 H new ATOM 0 HB3 PHE A 91 6.988 -3.524 3.744 1.00 1.00 H new ATOM 0 HD1 PHE A 91 7.260 -2.807 1.241 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.546 -2.989 3.249 1.00 1.00 H new ATOM 0 HE1 PHE A 91 6.276 -1.236 -0.436 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.562 -1.414 1.575 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.939 -0.558 -0.251 1.00 1.00 H new ATOM 291 N TYR A 92 6.443 -5.430 0.407 1.00 1.00 N ATOM 292 CA TYR A 92 7.072 -5.342 -0.900 1.00 1.00 C ATOM 293 C TYR A 92 6.209 -4.534 -1.870 1.00 1.00 C ATOM 294 O TYR A 92 4.983 -4.549 -1.776 1.00 1.00 O ATOM 295 CB TYR A 92 7.184 -6.780 -1.411 1.00 1.00 C ATOM 296 CG TYR A 92 8.260 -7.610 -0.708 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.588 -7.248 -0.814 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.903 -8.717 0.033 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.602 -8.029 -0.152 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.917 -9.498 0.695 1.00 1.00 C ATOM 301 CZ TYR A 92 10.216 -9.115 0.569 1.00 1.00 C ATOM 302 OH TYR A 92 11.173 -9.851 1.195 1.00 1.00 O ATOM 0 H TYR A 92 5.449 -5.660 0.388 1.00 1.00 H new ATOM 0 HA TYR A 92 8.041 -4.847 -0.828 1.00 1.00 H new ATOM 0 HB2 TYR A 92 6.220 -7.274 -1.288 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.397 -6.759 -2.480 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.867 -6.380 -1.393 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.864 -8.998 0.117 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.645 -7.758 -0.227 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.652 -10.368 1.278 1.00 1.00 H new ATOM 0 HH TYR A 92 10.752 -10.596 1.673 1.00 1.00 H new ATOM 311 N ARG A 93 6.883 -3.848 -2.782 1.00 1.00 N ATOM 312 CA ARG A 93 6.194 -3.035 -3.768 1.00 1.00 C ATOM 313 C ARG A 93 5.992 -3.828 -5.061 1.00 1.00 C ATOM 314 O ARG A 93 5.168 -3.460 -5.897 1.00 1.00 O ATOM 315 CB ARG A 93 6.980 -1.759 -4.077 1.00 1.00 C ATOM 316 CG ARG A 93 7.407 -1.053 -2.789 1.00 1.00 C ATOM 317 CD ARG A 93 6.444 0.083 -2.441 1.00 1.00 C ATOM 318 NE ARG A 93 6.234 0.950 -3.622 1.00 1.00 N ATOM 319 CZ ARG A 93 7.177 1.767 -4.138 1.00 1.00 C ATOM 320 NH1 ARG A 93 8.404 1.835 -3.579 1.00 1.00 N ATOM 321 NH2 ARG A 93 6.881 2.497 -5.197 1.00 1.00 N ATOM 0 H ARG A 93 7.900 -3.839 -2.858 1.00 1.00 H new ATOM 0 HA ARG A 93 5.225 -2.759 -3.352 1.00 1.00 H new ATOM 0 HB2 ARG A 93 7.861 -2.005 -4.670 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.368 -1.087 -4.678 1.00 1.00 H new ATOM 0 HG2 ARG A 93 7.439 -1.771 -1.970 1.00 1.00 H new ATOM 0 HG3 ARG A 93 8.416 -0.657 -2.905 1.00 1.00 H new ATOM 0 HD2 ARG A 93 5.491 -0.327 -2.107 1.00 1.00 H new ATOM 0 HD3 ARG A 93 6.845 0.671 -1.615 1.00 1.00 H new ATOM 0 HE ARG A 93 5.320 0.929 -4.074 1.00 1.00 H new ATOM 0 HH11 ARG A 93 8.624 1.267 -2.761 1.00 1.00 H new ATOM 0 HH12 ARG A 93 9.111 2.455 -3.975 1.00 1.00 H new ATOM 0 HH21 ARG A 93 5.952 2.439 -5.613 1.00 1.00 H new ATOM 0 HH22 ARG A 93 7.582 3.119 -5.599 1.00 1.00 H new ATOM 330 N THR A 94 6.759 -4.901 -5.185 1.00 1.00 N ATOM 331 CA THR A 94 6.675 -5.748 -6.364 1.00 1.00 C ATOM 332 C THR A 94 6.688 -7.225 -5.960 1.00 1.00 C ATOM 333 O THR A 94 7.192 -7.576 -4.895 1.00 1.00 O ATOM 334 CB THR A 94 7.820 -5.366 -7.303 1.00 1.00 C ATOM 335 OG1 THR A 94 8.989 -5.498 -6.499 1.00 1.00 O ATOM 336 CG2 THR A 94 7.795 -3.885 -7.684 1.00 1.00 C ATOM 0 H THR A 94 7.441 -5.204 -4.490 1.00 1.00 H new ATOM 0 HA THR A 94 5.735 -5.596 -6.895 1.00 1.00 H new ATOM 0 HB THR A 94 7.766 -5.974 -8.206 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.567 -6.196 -6.874 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.629 -3.667 -8.351 1.00 1.00 H new ATOM 0 HG22 THR A 94 6.857 -3.655 -8.188 1.00 1.00 H new ATOM 0 HG23 THR A 94 7.882 -3.276 -6.784 1.00 1.00 H new ATOM 344 N PRO A 95 6.110 -8.069 -6.856 1.00 1.00 N ATOM 345 CA PRO A 95 6.050 -9.500 -6.603 1.00 1.00 C ATOM 346 C PRO A 95 7.418 -10.152 -6.816 1.00 1.00 C ATOM 347 O PRO A 95 7.618 -11.313 -6.463 1.00 1.00 O ATOM 348 CB PRO A 95 4.987 -10.022 -7.556 1.00 1.00 C ATOM 349 CG PRO A 95 4.824 -8.954 -8.625 1.00 1.00 C ATOM 350 CD PRO A 95 5.502 -7.688 -8.127 1.00 1.00 C ATOM 0 HA PRO A 95 5.791 -9.735 -5.571 1.00 1.00 H new ATOM 0 HB2 PRO A 95 5.290 -10.972 -7.996 1.00 1.00 H new ATOM 0 HB3 PRO A 95 4.047 -10.198 -7.034 1.00 1.00 H new ATOM 0 HG2 PRO A 95 5.271 -9.282 -9.564 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.768 -8.769 -8.822 1.00 1.00 H new ATOM 0 HD2 PRO A 95 6.252 -7.336 -8.835 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.783 -6.879 -7.996 1.00 1.00 H new ATOM 355 N SER A 96 8.324 -9.376 -7.395 1.00 1.00 N ATOM 356 CA SER A 96 9.667 -9.865 -7.659 1.00 1.00 C ATOM 357 C SER A 96 10.603 -8.690 -7.947 1.00 1.00 C ATOM 358 O SER A 96 10.160 -7.545 -8.040 1.00 1.00 O ATOM 359 CB SER A 96 9.674 -10.848 -8.831 1.00 1.00 C ATOM 360 OG SER A 96 10.020 -12.167 -8.419 1.00 1.00 O ATOM 0 H SER A 96 8.154 -8.414 -7.688 1.00 1.00 H new ATOM 0 HA SER A 96 10.019 -10.394 -6.774 1.00 1.00 H new ATOM 0 HB2 SER A 96 8.690 -10.861 -9.299 1.00 1.00 H new ATOM 0 HB3 SER A 96 10.382 -10.507 -9.586 1.00 1.00 H new ATOM 0 HG SER A 96 10.012 -12.765 -9.195 1.00 1.00 H new ATOM 365 N PRO A 97 11.916 -9.020 -8.082 1.00 1.00 N ATOM 366 CA PRO A 97 12.918 -8.005 -8.357 1.00 1.00 C ATOM 367 C PRO A 97 12.848 -7.545 -9.815 1.00 1.00 C ATOM 368 O PRO A 97 13.078 -6.373 -10.112 1.00 1.00 O ATOM 369 CB PRO A 97 14.245 -8.658 -8.003 1.00 1.00 C ATOM 370 CG PRO A 97 13.983 -10.155 -7.988 1.00 1.00 C ATOM 371 CD PRO A 97 12.477 -10.363 -7.978 1.00 1.00 C ATOM 0 HA PRO A 97 12.768 -7.096 -7.774 1.00 1.00 H new ATOM 0 HB2 PRO A 97 15.013 -8.403 -8.734 1.00 1.00 H new ATOM 0 HB3 PRO A 97 14.602 -8.314 -7.032 1.00 1.00 H new ATOM 0 HG2 PRO A 97 14.428 -10.630 -8.862 1.00 1.00 H new ATOM 0 HG3 PRO A 97 14.438 -10.614 -7.110 1.00 1.00 H new ATOM 0 HD2 PRO A 97 12.159 -10.991 -8.810 1.00 1.00 H new ATOM 0 HD3 PRO A 97 12.152 -10.858 -7.063 1.00 1.00 H new ATOM 376 N ASP A 98 12.529 -8.491 -10.685 1.00 1.00 N ATOM 377 CA ASP A 98 12.425 -8.198 -12.105 1.00 1.00 C ATOM 378 C ASP A 98 10.952 -8.218 -12.520 1.00 1.00 C ATOM 379 O ASP A 98 10.623 -8.613 -13.636 1.00 1.00 O ATOM 380 CB ASP A 98 13.165 -9.245 -12.939 1.00 1.00 C ATOM 381 CG ASP A 98 14.665 -8.994 -13.109 1.00 1.00 C ATOM 382 OD1 ASP A 98 15.428 -9.005 -12.133 1.00 1.00 O ATOM 383 OD2 ASP A 98 15.047 -8.779 -14.322 1.00 1.00 O ATOM 0 H ASP A 98 12.339 -9.461 -10.435 1.00 1.00 H new ATOM 0 HA ASP A 98 12.869 -7.218 -12.280 1.00 1.00 H new ATOM 0 HB2 ASP A 98 13.026 -10.222 -12.476 1.00 1.00 H new ATOM 0 HB3 ASP A 98 12.706 -9.292 -13.926 1.00 1.00 H new ATOM 388 N ALA A 99 10.105 -7.786 -11.596 1.00 1.00 N ATOM 389 CA ALA A 99 8.675 -7.748 -11.852 1.00 1.00 C ATOM 390 C ALA A 99 8.180 -6.305 -11.745 1.00 1.00 C ATOM 391 O ALA A 99 8.766 -5.495 -11.029 1.00 1.00 O ATOM 392 CB ALA A 99 7.958 -8.685 -10.877 1.00 1.00 C ATOM 0 H ALA A 99 10.382 -7.460 -10.670 1.00 1.00 H new ATOM 0 HA ALA A 99 8.456 -8.097 -12.861 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.885 -8.657 -11.068 1.00 1.00 H new ATOM 0 HB2 ALA A 99 8.325 -9.702 -11.014 1.00 1.00 H new ATOM 0 HB3 ALA A 99 8.153 -8.364 -9.854 1.00 1.00 H new ATOM 398 N LYS A 100 7.104 -6.028 -12.467 1.00 1.00 N ATOM 399 CA LYS A 100 6.523 -4.695 -12.463 1.00 1.00 C ATOM 400 C LYS A 100 6.229 -4.278 -11.021 1.00 1.00 C ATOM 401 O LYS A 100 6.474 -5.039 -10.088 1.00 1.00 O ATOM 402 CB LYS A 100 5.300 -4.642 -13.380 1.00 1.00 C ATOM 403 CG LYS A 100 5.665 -5.057 -14.807 1.00 1.00 C ATOM 404 CD LYS A 100 4.443 -5.597 -15.551 1.00 1.00 C ATOM 405 CE LYS A 100 4.633 -7.069 -15.923 1.00 1.00 C ATOM 406 NZ LYS A 100 5.377 -7.190 -17.197 1.00 1.00 N ATOM 0 H LYS A 100 6.619 -6.703 -13.058 1.00 1.00 H new ATOM 0 HA LYS A 100 7.228 -3.969 -12.868 1.00 1.00 H new ATOM 0 HB2 LYS A 100 4.523 -5.301 -12.994 1.00 1.00 H new ATOM 0 HB3 LYS A 100 4.889 -3.633 -13.385 1.00 1.00 H new ATOM 0 HG2 LYS A 100 6.074 -4.202 -15.345 1.00 1.00 H new ATOM 0 HG3 LYS A 100 6.444 -5.819 -14.780 1.00 1.00 H new ATOM 0 HD2 LYS A 100 3.556 -5.488 -14.928 1.00 1.00 H new ATOM 0 HD3 LYS A 100 4.273 -5.009 -16.453 1.00 1.00 H new ATOM 0 HE2 LYS A 100 5.174 -7.584 -15.129 1.00 1.00 H new ATOM 0 HE3 LYS A 100 3.662 -7.555 -16.015 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 5.497 -8.195 -17.435 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 4.846 -6.716 -17.955 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 6.311 -6.744 -17.097 1.00 1.00 H new ATOM 415 N ALA A 101 5.708 -3.067 -10.885 1.00 1.00 N ATOM 416 CA ALA A 101 5.378 -2.538 -9.572 1.00 1.00 C ATOM 417 C ALA A 101 3.857 -2.497 -9.411 1.00 1.00 C ATOM 418 O ALA A 101 3.145 -2.067 -10.317 1.00 1.00 O ATOM 419 CB ALA A 101 6.020 -1.160 -9.401 1.00 1.00 C ATOM 0 H ALA A 101 5.506 -2.437 -11.662 1.00 1.00 H new ATOM 0 HA ALA A 101 5.775 -3.182 -8.788 1.00 1.00 H new ATOM 0 HB1 ALA A 101 5.773 -0.763 -8.416 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.102 -1.249 -9.495 1.00 1.00 H new ATOM 0 HB3 ALA A 101 5.643 -0.485 -10.169 1.00 1.00 H new ATOM 425 N PHE A 102 3.404 -2.951 -8.251 1.00 1.00 N ATOM 426 CA PHE A 102 1.981 -2.972 -7.960 1.00 1.00 C ATOM 427 C PHE A 102 1.417 -1.552 -7.882 1.00 1.00 C ATOM 428 O PHE A 102 0.282 -1.309 -8.292 1.00 1.00 O ATOM 429 CB PHE A 102 1.813 -3.649 -6.598 1.00 1.00 C ATOM 430 CG PHE A 102 1.892 -5.176 -6.649 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.826 -5.897 -7.089 1.00 1.00 C ATOM 432 CD2 PHE A 102 3.026 -5.813 -6.254 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.897 -7.315 -7.137 1.00 1.00 C ATOM 434 CE2 PHE A 102 3.099 -7.230 -6.302 1.00 1.00 C ATOM 435 CZ PHE A 102 2.033 -7.951 -6.742 1.00 1.00 C ATOM 0 H PHE A 102 3.998 -3.307 -7.502 1.00 1.00 H new ATOM 0 HA PHE A 102 1.448 -3.504 -8.748 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.583 -3.278 -5.922 1.00 1.00 H new ATOM 0 HB3 PHE A 102 0.851 -3.359 -6.176 1.00 1.00 H new ATOM 0 HD1 PHE A 102 -0.075 -5.391 -7.402 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.872 -5.241 -5.903 1.00 1.00 H new ATOM 0 HE1 PHE A 102 0.050 -7.887 -7.487 1.00 1.00 H new ATOM 0 HE2 PHE A 102 4.001 -7.735 -5.989 1.00 1.00 H new ATOM 0 HZ PHE A 102 2.088 -9.029 -6.778 1.00 1.00 H new ATOM 444 N ILE A 103 2.234 -0.652 -7.355 1.00 1.00 N ATOM 445 CA ILE A 103 1.831 0.737 -7.220 1.00 1.00 C ATOM 446 C ILE A 103 3.014 1.644 -7.562 1.00 1.00 C ATOM 447 O ILE A 103 3.943 1.784 -6.767 1.00 1.00 O ATOM 448 CB ILE A 103 1.243 0.991 -5.830 1.00 1.00 C ATOM 449 CG1 ILE A 103 0.606 2.380 -5.749 1.00 1.00 C ATOM 450 CG2 ILE A 103 2.297 0.780 -4.742 1.00 1.00 C ATOM 451 CD1 ILE A 103 -0.130 2.569 -4.421 1.00 1.00 C ATOM 0 H ILE A 103 3.174 -0.858 -7.016 1.00 1.00 H new ATOM 0 HA ILE A 103 1.035 0.972 -7.926 1.00 1.00 H new ATOM 0 HB ILE A 103 0.451 0.263 -5.656 1.00 1.00 H new ATOM 0 HG12 ILE A 103 1.376 3.144 -5.854 1.00 1.00 H new ATOM 0 HG13 ILE A 103 -0.090 2.514 -6.577 1.00 1.00 H new ATOM 0 HG21 ILE A 103 1.853 0.967 -3.764 1.00 1.00 H new ATOM 0 HG22 ILE A 103 2.663 -0.246 -4.784 1.00 1.00 H new ATOM 0 HG23 ILE A 103 3.127 1.468 -4.901 1.00 1.00 H new ATOM 0 HD11 ILE A 103 -0.573 3.564 -4.389 1.00 1.00 H new ATOM 0 HD12 ILE A 103 -0.915 1.819 -4.330 1.00 1.00 H new ATOM 0 HD13 ILE A 103 0.574 2.459 -3.596 1.00 1.00 H new ATOM 462 N GLU A 104 2.942 2.236 -8.745 1.00 1.00 N ATOM 463 CA GLU A 104 3.997 3.125 -9.202 1.00 1.00 C ATOM 464 C GLU A 104 3.645 4.577 -8.875 1.00 1.00 C ATOM 465 O GLU A 104 2.650 5.106 -9.369 1.00 1.00 O ATOM 466 CB GLU A 104 4.253 2.947 -10.700 1.00 1.00 C ATOM 467 CG GLU A 104 5.351 1.911 -10.949 1.00 1.00 C ATOM 468 CD GLU A 104 5.090 1.136 -12.242 1.00 1.00 C ATOM 469 OE1 GLU A 104 4.049 0.474 -12.368 1.00 1.00 O ATOM 470 OE2 GLU A 104 6.015 1.238 -13.136 1.00 1.00 O ATOM 0 H GLU A 104 2.170 2.118 -9.401 1.00 1.00 H new ATOM 0 HA GLU A 104 4.916 2.867 -8.677 1.00 1.00 H new ATOM 0 HB2 GLU A 104 3.334 2.634 -11.195 1.00 1.00 H new ATOM 0 HB3 GLU A 104 4.542 3.902 -11.139 1.00 1.00 H new ATOM 0 HG2 GLU A 104 6.319 2.409 -11.008 1.00 1.00 H new ATOM 0 HG3 GLU A 104 5.400 1.218 -10.109 1.00 1.00 H new ATOM 476 N VAL A 105 4.481 5.182 -8.043 1.00 1.00 N ATOM 477 CA VAL A 105 4.271 6.563 -7.643 1.00 1.00 C ATOM 478 C VAL A 105 3.804 7.374 -8.854 1.00 1.00 C ATOM 479 O VAL A 105 4.540 7.519 -9.830 1.00 1.00 O ATOM 480 CB VAL A 105 5.544 7.122 -7.004 1.00 1.00 C ATOM 481 CG1 VAL A 105 5.332 8.561 -6.529 1.00 1.00 C ATOM 482 CG2 VAL A 105 6.017 6.231 -5.854 1.00 1.00 C ATOM 0 H VAL A 105 5.305 4.741 -7.635 1.00 1.00 H new ATOM 0 HA VAL A 105 3.489 6.627 -6.887 1.00 1.00 H new ATOM 0 HB VAL A 105 6.325 7.131 -7.765 1.00 1.00 H new ATOM 0 HG11 VAL A 105 6.252 8.935 -6.079 1.00 1.00 H new ATOM 0 HG12 VAL A 105 5.063 9.189 -7.379 1.00 1.00 H new ATOM 0 HG13 VAL A 105 4.530 8.586 -5.791 1.00 1.00 H new ATOM 0 HG21 VAL A 105 6.923 6.651 -5.417 1.00 1.00 H new ATOM 0 HG22 VAL A 105 5.239 6.176 -5.093 1.00 1.00 H new ATOM 0 HG23 VAL A 105 6.226 5.230 -6.232 1.00 1.00 H new ATOM 492 N GLY A 106 2.585 7.883 -8.752 1.00 1.00 N ATOM 493 CA GLY A 106 2.012 8.675 -9.826 1.00 1.00 C ATOM 494 C GLY A 106 0.884 7.915 -10.527 1.00 1.00 C ATOM 495 O GLY A 106 0.545 8.215 -11.671 1.00 1.00 O ATOM 0 H GLY A 106 1.978 7.762 -7.941 1.00 1.00 H new ATOM 0 HA2 GLY A 106 1.629 9.614 -9.426 1.00 1.00 H new ATOM 0 HA3 GLY A 106 2.787 8.930 -10.548 1.00 1.00 H new ATOM 499 N GLN A 107 0.334 6.946 -9.811 1.00 1.00 N ATOM 500 CA GLN A 107 -0.749 6.140 -10.349 1.00 1.00 C ATOM 501 C GLN A 107 -1.920 6.098 -9.365 1.00 1.00 C ATOM 502 O GLN A 107 -1.747 6.368 -8.177 1.00 1.00 O ATOM 503 CB GLN A 107 -0.267 4.729 -10.688 1.00 1.00 C ATOM 504 CG GLN A 107 -0.985 4.185 -11.926 1.00 1.00 C ATOM 505 CD GLN A 107 -1.264 2.688 -11.784 1.00 1.00 C ATOM 506 OE1 GLN A 107 -2.398 2.240 -11.775 1.00 1.00 O ATOM 507 NE2 GLN A 107 -0.168 1.942 -11.675 1.00 1.00 N ATOM 0 H GLN A 107 0.618 6.700 -8.863 1.00 1.00 H new ATOM 0 HA GLN A 107 -1.094 6.602 -11.274 1.00 1.00 H new ATOM 0 HB2 GLN A 107 0.809 4.741 -10.863 1.00 1.00 H new ATOM 0 HB3 GLN A 107 -0.444 4.067 -9.840 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -1.923 4.721 -12.072 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -0.375 4.363 -12.812 1.00 1.00 H new ATOM 0 HE21 GLN A 107 0.752 2.382 -11.690 1.00 1.00 H new ATOM 0 HE22 GLN A 107 -0.248 0.930 -11.576 1.00 1.00 H new ATOM 514 N LYS A 108 -3.085 5.756 -9.895 1.00 1.00 N ATOM 515 CA LYS A 108 -4.284 5.675 -9.078 1.00 1.00 C ATOM 516 C LYS A 108 -4.673 4.207 -8.895 1.00 1.00 C ATOM 517 O LYS A 108 -4.248 3.347 -9.667 1.00 1.00 O ATOM 518 CB LYS A 108 -5.398 6.536 -9.675 1.00 1.00 C ATOM 519 CG LYS A 108 -5.881 5.962 -11.008 1.00 1.00 C ATOM 520 CD LYS A 108 -7.409 5.985 -11.095 1.00 1.00 C ATOM 521 CE LYS A 108 -7.878 6.802 -12.299 1.00 1.00 C ATOM 522 NZ LYS A 108 -8.346 8.138 -11.868 1.00 1.00 N ATOM 0 H LYS A 108 -3.224 5.532 -10.880 1.00 1.00 H new ATOM 0 HA LYS A 108 -4.096 6.082 -8.084 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -6.232 6.593 -8.976 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -5.036 7.553 -9.823 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -5.458 6.538 -11.831 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -5.522 4.939 -11.118 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -7.788 4.966 -11.173 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -7.822 6.409 -10.180 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -7.062 6.909 -13.013 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -8.683 6.276 -12.812 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -8.661 8.680 -12.698 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -9.139 8.030 -11.203 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -7.568 8.644 -11.399 1.00 1.00 H new ATOM 531 N VAL A 109 -5.475 3.963 -7.869 1.00 1.00 N ATOM 532 CA VAL A 109 -5.926 2.613 -7.576 1.00 1.00 C ATOM 533 C VAL A 109 -7.404 2.648 -7.180 1.00 1.00 C ATOM 534 O VAL A 109 -7.855 3.594 -6.537 1.00 1.00 O ATOM 535 CB VAL A 109 -5.035 1.986 -6.502 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.581 1.908 -6.973 1.00 1.00 C ATOM 537 CG2 VAL A 109 -5.143 2.753 -5.182 1.00 1.00 C ATOM 0 H VAL A 109 -5.824 4.677 -7.230 1.00 1.00 H new ATOM 0 HA VAL A 109 -5.841 1.982 -8.460 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.386 0.969 -6.328 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -2.969 1.459 -6.191 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.523 1.298 -7.875 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.214 2.911 -7.189 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.500 2.286 -4.436 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.831 3.786 -5.335 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -6.176 2.734 -4.833 1.00 1.00 H new ATOM 547 N ASN A 110 -8.115 1.605 -7.582 1.00 1.00 N ATOM 548 CA ASN A 110 -9.533 1.504 -7.278 1.00 1.00 C ATOM 549 C ASN A 110 -9.776 0.274 -6.403 1.00 1.00 C ATOM 550 O ASN A 110 -9.108 -0.747 -6.561 1.00 1.00 O ATOM 551 CB ASN A 110 -10.360 1.349 -8.555 1.00 1.00 C ATOM 552 CG ASN A 110 -9.984 2.413 -9.586 1.00 1.00 C ATOM 553 OD1 ASN A 110 -8.895 2.427 -10.135 1.00 1.00 O ATOM 554 ND2 ASN A 110 -10.944 3.305 -9.819 1.00 1.00 N ATOM 0 H ASN A 110 -7.736 0.822 -8.115 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.834 2.416 -6.763 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -10.201 0.357 -8.977 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -11.421 1.428 -8.317 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -10.790 4.057 -10.491 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -11.834 3.237 -9.325 1.00 1.00 H new ATOM 560 N VAL A 111 -10.734 0.411 -5.499 1.00 1.00 N ATOM 561 CA VAL A 111 -11.075 -0.679 -4.598 1.00 1.00 C ATOM 562 C VAL A 111 -11.040 -2.001 -5.368 1.00 1.00 C ATOM 563 O VAL A 111 -11.909 -2.263 -6.198 1.00 1.00 O ATOM 564 CB VAL A 111 -12.428 -0.408 -3.937 1.00 1.00 C ATOM 565 CG1 VAL A 111 -13.087 -1.712 -3.484 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.279 0.567 -2.766 1.00 1.00 C ATOM 0 H VAL A 111 -11.285 1.259 -5.370 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.344 -0.752 -3.793 1.00 1.00 H new ATOM 0 HB VAL A 111 -13.078 0.055 -4.679 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -14.047 -1.492 -3.017 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.243 -2.360 -4.347 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -12.441 -2.215 -2.765 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.255 0.743 -2.313 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -11.605 0.142 -2.022 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -11.871 1.511 -3.128 1.00 1.00 H new ATOM 576 N GLY A 112 -10.027 -2.799 -5.064 1.00 1.00 N ATOM 577 CA GLY A 112 -9.867 -4.087 -5.717 1.00 1.00 C ATOM 578 C GLY A 112 -8.522 -4.173 -6.441 1.00 1.00 C ATOM 579 O GLY A 112 -8.115 -5.248 -6.877 1.00 1.00 O ATOM 0 H GLY A 112 -9.309 -2.578 -4.374 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -9.937 -4.885 -4.977 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.678 -4.240 -6.429 1.00 1.00 H new ATOM 583 N ASP A 113 -7.869 -3.024 -6.547 1.00 1.00 N ATOM 584 CA ASP A 113 -6.578 -2.956 -7.209 1.00 1.00 C ATOM 585 C ASP A 113 -5.467 -3.156 -6.176 1.00 1.00 C ATOM 586 O ASP A 113 -5.539 -2.623 -5.071 1.00 1.00 O ATOM 587 CB ASP A 113 -6.369 -1.591 -7.868 1.00 1.00 C ATOM 588 CG ASP A 113 -6.452 -1.591 -9.396 1.00 1.00 C ATOM 589 OD1 ASP A 113 -5.461 -1.318 -10.090 1.00 1.00 O ATOM 590 OD2 ASP A 113 -7.610 -1.891 -9.880 1.00 1.00 O ATOM 0 H ASP A 113 -8.210 -2.133 -6.185 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.549 -3.734 -7.972 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -7.115 -0.898 -7.479 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.393 -1.207 -7.572 1.00 1.00 H new ATOM 595 N THR A 114 -4.466 -3.928 -6.574 1.00 1.00 N ATOM 596 CA THR A 114 -3.342 -4.207 -5.696 1.00 1.00 C ATOM 597 C THR A 114 -2.609 -2.911 -5.342 1.00 1.00 C ATOM 598 O THR A 114 -2.476 -2.020 -6.179 1.00 1.00 O ATOM 599 CB THR A 114 -2.449 -5.240 -6.385 1.00 1.00 C ATOM 600 OG1 THR A 114 -3.323 -6.335 -6.645 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.393 -5.822 -5.443 1.00 1.00 C ATOM 0 H THR A 114 -4.410 -4.369 -7.492 1.00 1.00 H new ATOM 0 HA THR A 114 -3.676 -4.626 -4.747 1.00 1.00 H new ATOM 0 HB THR A 114 -1.957 -4.781 -7.242 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.826 -7.051 -7.093 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.786 -6.550 -5.982 1.00 1.00 H new ATOM 0 HG22 THR A 114 -0.754 -5.020 -5.073 1.00 1.00 H new ATOM 0 HG23 THR A 114 -1.885 -6.311 -4.603 1.00 1.00 H new ATOM 609 N LEU A 115 -2.153 -2.848 -4.099 1.00 1.00 N ATOM 610 CA LEU A 115 -1.438 -1.676 -3.622 1.00 1.00 C ATOM 611 C LEU A 115 0.022 -2.050 -3.356 1.00 1.00 C ATOM 612 O LEU A 115 0.919 -1.227 -3.532 1.00 1.00 O ATOM 613 CB LEU A 115 -2.149 -1.069 -2.412 1.00 1.00 C ATOM 614 CG LEU A 115 -2.230 -1.955 -1.167 1.00 1.00 C ATOM 615 CD1 LEU A 115 -1.271 -1.465 -0.081 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.669 -2.056 -0.659 1.00 1.00 C ATOM 0 H LEU A 115 -2.265 -3.590 -3.408 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.434 -0.895 -4.383 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -1.639 -0.144 -2.143 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -3.163 -0.800 -2.709 1.00 1.00 H new ATOM 0 HG LEU A 115 -1.915 -2.961 -1.443 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -1.349 -2.112 0.792 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -0.249 -1.489 -0.460 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -1.530 -0.444 0.200 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -3.699 -2.691 0.226 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -4.036 -1.062 -0.405 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -4.300 -2.487 -1.436 1.00 1.00 H new ATOM 627 N CYS A 116 0.214 -3.291 -2.934 1.00 1.00 N ATOM 628 CA CYS A 116 1.549 -3.783 -2.641 1.00 1.00 C ATOM 629 C CYS A 116 1.437 -5.247 -2.207 1.00 1.00 C ATOM 630 O CYS A 116 0.463 -5.922 -2.536 1.00 1.00 O ATOM 631 CB CYS A 116 2.248 -2.927 -1.583 1.00 1.00 C ATOM 632 SG CYS A 116 1.547 -3.279 0.071 1.00 1.00 S ATOM 0 H CYS A 116 -0.533 -3.970 -2.788 1.00 1.00 H new ATOM 0 HA CYS A 116 2.168 -3.716 -3.536 1.00 1.00 H new ATOM 0 HB2 CYS A 116 3.318 -3.134 -1.585 1.00 1.00 H new ATOM 0 HB3 CYS A 116 2.127 -1.870 -1.821 1.00 1.00 H new ATOM 0 HG CYS A 116 2.358 -2.841 0.988 1.00 1.00 H new ATOM 637 N ILE A 117 2.449 -5.693 -1.477 1.00 1.00 N ATOM 638 CA ILE A 117 2.476 -7.064 -0.995 1.00 1.00 C ATOM 639 C ILE A 117 2.967 -7.081 0.454 1.00 1.00 C ATOM 640 O ILE A 117 3.596 -6.128 0.912 1.00 1.00 O ATOM 641 CB ILE A 117 3.300 -7.946 -1.935 1.00 1.00 C ATOM 642 CG1 ILE A 117 3.110 -7.522 -3.393 1.00 1.00 C ATOM 643 CG2 ILE A 117 2.980 -9.426 -1.722 1.00 1.00 C ATOM 644 CD1 ILE A 117 1.709 -7.884 -3.890 1.00 1.00 C ATOM 0 H ILE A 117 3.256 -5.130 -1.208 1.00 1.00 H new ATOM 0 HA ILE A 117 1.472 -7.489 -0.996 1.00 1.00 H new ATOM 0 HB ILE A 117 4.354 -7.808 -1.694 1.00 1.00 H new ATOM 0 HG12 ILE A 117 3.267 -6.447 -3.487 1.00 1.00 H new ATOM 0 HG13 ILE A 117 3.859 -8.009 -4.018 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.580 -10.030 -2.403 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.210 -9.703 -0.693 1.00 1.00 H new ATOM 0 HG23 ILE A 117 1.922 -9.601 -1.918 1.00 1.00 H new ATOM 0 HD11 ILE A 117 1.600 -7.572 -4.929 1.00 1.00 H new ATOM 0 HD12 ILE A 117 1.565 -8.962 -3.818 1.00 1.00 H new ATOM 0 HD13 ILE A 117 0.963 -7.376 -3.278 1.00 1.00 H new ATOM 655 N VAL A 118 2.662 -8.176 1.135 1.00 1.00 N ATOM 656 CA VAL A 118 3.064 -8.331 2.523 1.00 1.00 C ATOM 657 C VAL A 118 3.446 -9.789 2.780 1.00 1.00 C ATOM 658 O VAL A 118 2.609 -10.683 2.665 1.00 1.00 O ATOM 659 CB VAL A 118 1.953 -7.831 3.449 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.253 -8.187 4.906 1.00 1.00 C ATOM 661 CG2 VAL A 118 1.737 -6.326 3.285 1.00 1.00 C ATOM 0 H VAL A 118 2.141 -8.965 0.751 1.00 1.00 H new ATOM 0 HA VAL A 118 3.944 -7.723 2.735 1.00 1.00 H new ATOM 0 HB VAL A 118 1.029 -8.334 3.165 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.448 -7.820 5.543 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.332 -9.269 5.007 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.193 -7.725 5.207 1.00 1.00 H new ATOM 0 HG21 VAL A 118 0.942 -5.997 3.955 1.00 1.00 H new ATOM 0 HG22 VAL A 118 2.659 -5.797 3.529 1.00 1.00 H new ATOM 0 HG23 VAL A 118 1.456 -6.109 2.254 1.00 1.00 H new ATOM 671 N GLU A 119 4.711 -9.985 3.123 1.00 1.00 N ATOM 672 CA GLU A 119 5.214 -11.320 3.397 1.00 1.00 C ATOM 673 C GLU A 119 4.964 -11.691 4.860 1.00 1.00 C ATOM 674 O GLU A 119 5.355 -10.957 5.766 1.00 1.00 O ATOM 675 CB GLU A 119 6.700 -11.428 3.050 1.00 1.00 C ATOM 676 CG GLU A 119 7.031 -12.810 2.482 1.00 1.00 C ATOM 677 CD GLU A 119 8.317 -12.767 1.653 1.00 1.00 C ATOM 678 OE1 GLU A 119 9.394 -13.113 2.162 1.00 1.00 O ATOM 679 OE2 GLU A 119 8.169 -12.358 0.438 1.00 1.00 O ATOM 0 H GLU A 119 5.402 -9.241 3.217 1.00 1.00 H new ATOM 0 HA GLU A 119 4.675 -12.027 2.766 1.00 1.00 H new ATOM 0 HB2 GLU A 119 6.964 -10.659 2.324 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.300 -11.244 3.941 1.00 1.00 H new ATOM 0 HG2 GLU A 119 7.143 -13.525 3.297 1.00 1.00 H new ATOM 0 HG3 GLU A 119 6.206 -13.160 1.862 1.00 1.00 H new ATOM 685 N ALA A 120 4.316 -12.831 5.046 1.00 1.00 N ATOM 686 CA ALA A 120 4.010 -13.309 6.383 1.00 1.00 C ATOM 687 C ALA A 120 3.591 -14.779 6.312 1.00 1.00 C ATOM 688 O ALA A 120 3.243 -15.278 5.243 1.00 1.00 O ATOM 689 CB ALA A 120 2.928 -12.424 7.007 1.00 1.00 C ATOM 0 H ALA A 120 3.994 -13.438 4.292 1.00 1.00 H new ATOM 0 HA ALA A 120 4.891 -13.248 7.023 1.00 1.00 H new ATOM 0 HB1 ALA A 120 2.698 -12.783 8.010 1.00 1.00 H new ATOM 0 HB2 ALA A 120 3.286 -11.396 7.062 1.00 1.00 H new ATOM 0 HB3 ALA A 120 2.028 -12.462 6.393 1.00 1.00 H new ATOM 695 N MET A 121 3.638 -15.431 7.465 1.00 1.00 N ATOM 696 CA MET A 121 3.268 -16.834 7.547 1.00 1.00 C ATOM 697 C MET A 121 3.953 -17.647 6.446 1.00 1.00 C ATOM 698 O MET A 121 3.378 -18.601 5.925 1.00 1.00 O ATOM 699 CB MET A 121 1.750 -16.970 7.411 1.00 1.00 C ATOM 700 CG MET A 121 1.072 -16.930 8.783 1.00 1.00 C ATOM 701 SD MET A 121 0.663 -18.586 9.310 1.00 1.00 S ATOM 702 CE MET A 121 -1.107 -18.557 9.078 1.00 1.00 C ATOM 0 H MET A 121 3.927 -15.014 8.350 1.00 1.00 H new ATOM 0 HA MET A 121 3.592 -17.220 8.513 1.00 1.00 H new ATOM 0 HB2 MET A 121 1.363 -16.165 6.786 1.00 1.00 H new ATOM 0 HB3 MET A 121 1.508 -17.907 6.909 1.00 1.00 H new ATOM 0 HG2 MET A 121 1.733 -16.461 9.511 1.00 1.00 H new ATOM 0 HG3 MET A 121 0.169 -16.322 8.734 1.00 1.00 H new ATOM 0 HE1 MET A 121 -1.527 -19.522 9.362 1.00 1.00 H new ATOM 0 HE2 MET A 121 -1.543 -17.774 9.699 1.00 1.00 H new ATOM 0 HE3 MET A 121 -1.333 -18.357 8.031 1.00 1.00 H new ATOM 710 N LYS A 122 5.172 -17.239 6.125 1.00 1.00 N ATOM 711 CA LYS A 122 5.941 -17.917 5.095 1.00 1.00 C ATOM 712 C LYS A 122 5.107 -18.005 3.816 1.00 1.00 C ATOM 713 O LYS A 122 5.024 -19.065 3.197 1.00 1.00 O ATOM 714 CB LYS A 122 6.436 -19.273 5.603 1.00 1.00 C ATOM 715 CG LYS A 122 7.914 -19.479 5.264 1.00 1.00 C ATOM 716 CD LYS A 122 8.801 -19.165 6.470 1.00 1.00 C ATOM 717 CE LYS A 122 10.053 -20.045 6.473 1.00 1.00 C ATOM 718 NZ LYS A 122 10.079 -20.903 7.679 1.00 1.00 N ATOM 0 H LYS A 122 5.646 -16.448 6.560 1.00 1.00 H new ATOM 0 HA LYS A 122 6.838 -17.347 4.851 1.00 1.00 H new ATOM 0 HB2 LYS A 122 6.295 -19.335 6.682 1.00 1.00 H new ATOM 0 HB3 LYS A 122 5.842 -20.071 5.157 1.00 1.00 H new ATOM 0 HG2 LYS A 122 8.078 -20.508 4.946 1.00 1.00 H new ATOM 0 HG3 LYS A 122 8.192 -18.838 4.427 1.00 1.00 H new ATOM 0 HD2 LYS A 122 9.091 -18.114 6.449 1.00 1.00 H new ATOM 0 HD3 LYS A 122 8.239 -19.323 7.390 1.00 1.00 H new ATOM 0 HE2 LYS A 122 10.071 -20.666 5.577 1.00 1.00 H new ATOM 0 HE3 LYS A 122 10.945 -19.419 6.445 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 10.935 -21.494 7.666 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 10.084 -20.305 8.530 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 9.237 -21.513 7.689 1.00 1.00 H new ATOM 727 N MET A 123 4.511 -16.877 3.457 1.00 1.00 N ATOM 728 CA MET A 123 3.686 -16.815 2.263 1.00 1.00 C ATOM 729 C MET A 123 3.422 -15.364 1.854 1.00 1.00 C ATOM 730 O MET A 123 3.431 -14.467 2.696 1.00 1.00 O ATOM 731 CB MET A 123 2.355 -17.523 2.523 1.00 1.00 C ATOM 732 CG MET A 123 2.253 -18.818 1.714 1.00 1.00 C ATOM 733 SD MET A 123 0.967 -19.858 2.384 1.00 1.00 S ATOM 734 CE MET A 123 1.766 -21.450 2.274 1.00 1.00 C ATOM 0 H MET A 123 4.583 -16.000 3.972 1.00 1.00 H new ATOM 0 HA MET A 123 4.218 -17.311 1.451 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.260 -17.746 3.586 1.00 1.00 H new ATOM 0 HB3 MET A 123 1.530 -16.861 2.261 1.00 1.00 H new ATOM 0 HG2 MET A 123 2.039 -18.588 0.670 1.00 1.00 H new ATOM 0 HG3 MET A 123 3.207 -19.346 1.735 1.00 1.00 H new ATOM 0 HE1 MET A 123 1.096 -22.221 2.655 1.00 1.00 H new ATOM 0 HE2 MET A 123 2.010 -21.663 1.233 1.00 1.00 H new ATOM 0 HE3 MET A 123 2.681 -21.440 2.867 1.00 1.00 H new ATOM 742 N MET A 124 3.193 -15.179 0.562 1.00 1.00 N ATOM 743 CA MET A 124 2.927 -13.853 0.032 1.00 1.00 C ATOM 744 C MET A 124 1.480 -13.436 0.299 1.00 1.00 C ATOM 745 O MET A 124 0.549 -14.174 -0.018 1.00 1.00 O ATOM 746 CB MET A 124 3.193 -13.843 -1.475 1.00 1.00 C ATOM 747 CG MET A 124 2.982 -12.445 -2.059 1.00 1.00 C ATOM 748 SD MET A 124 2.245 -12.564 -3.680 1.00 1.00 S ATOM 749 CE MET A 124 3.702 -12.389 -4.697 1.00 1.00 C ATOM 0 H MET A 124 3.186 -15.925 -0.133 1.00 1.00 H new ATOM 0 HA MET A 124 3.587 -13.143 0.531 1.00 1.00 H new ATOM 0 HB2 MET A 124 4.214 -14.172 -1.670 1.00 1.00 H new ATOM 0 HB3 MET A 124 2.529 -14.552 -1.970 1.00 1.00 H new ATOM 0 HG2 MET A 124 2.339 -11.860 -1.401 1.00 1.00 H new ATOM 0 HG3 MET A 124 3.936 -11.921 -2.122 1.00 1.00 H new ATOM 0 HE1 MET A 124 3.420 -12.441 -5.749 1.00 1.00 H new ATOM 0 HE2 MET A 124 4.174 -11.427 -4.495 1.00 1.00 H new ATOM 0 HE3 MET A 124 4.403 -13.192 -4.469 1.00 1.00 H new ATOM 757 N ASN A 125 1.336 -12.253 0.879 1.00 1.00 N ATOM 758 CA ASN A 125 0.018 -11.729 1.192 1.00 1.00 C ATOM 759 C ASN A 125 -0.167 -10.378 0.497 1.00 1.00 C ATOM 760 O ASN A 125 0.230 -9.342 1.030 1.00 1.00 O ATOM 761 CB ASN A 125 -0.147 -11.514 2.697 1.00 1.00 C ATOM 762 CG ASN A 125 0.302 -12.749 3.481 1.00 1.00 C ATOM 763 OD1 ASN A 125 -0.347 -13.782 3.485 1.00 1.00 O ATOM 764 ND2 ASN A 125 1.445 -12.585 4.140 1.00 1.00 N ATOM 0 H ASN A 125 2.111 -11.643 1.140 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.722 -12.452 0.849 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.437 -10.648 3.010 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.190 -11.294 2.924 1.00 1.00 H new ATOM 0 HD21 ASN A 125 1.830 -13.351 4.692 1.00 1.00 H new ATOM 0 HD22 ASN A 125 1.937 -11.693 4.093 1.00 1.00 H new ATOM 770 N GLN A 126 -0.771 -10.431 -0.681 1.00 1.00 N ATOM 771 CA GLN A 126 -1.013 -9.225 -1.453 1.00 1.00 C ATOM 772 C GLN A 126 -1.999 -8.314 -0.719 1.00 1.00 C ATOM 773 O GLN A 126 -2.889 -8.793 -0.018 1.00 1.00 O ATOM 774 CB GLN A 126 -1.521 -9.564 -2.856 1.00 1.00 C ATOM 775 CG GLN A 126 -0.374 -10.034 -3.754 1.00 1.00 C ATOM 776 CD GLN A 126 -0.698 -11.386 -4.393 1.00 1.00 C ATOM 777 OE1 GLN A 126 -0.647 -12.411 -3.547 1.00 1.00 O flip ATOM 778 NE2 GLN A 126 -0.976 -11.491 -5.577 1.00 1.00 N flip ATOM 0 H GLN A 126 -1.100 -11.291 -1.120 1.00 1.00 H new ATOM 0 HA GLN A 126 -0.068 -8.692 -1.563 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -2.281 -10.342 -2.793 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -1.997 -8.688 -3.296 1.00 1.00 H new ATOM 0 HG2 GLN A 126 -0.190 -9.294 -4.533 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.542 -10.114 -3.168 1.00 1.00 H new ATOM 0 HE21 GLN A 126 -0.997 -10.662 -6.171 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -1.187 -12.407 -5.972 1.00 1.00 H new ATOM 785 N ILE A 127 -1.807 -7.016 -0.905 1.00 1.00 N ATOM 786 CA ILE A 127 -2.668 -6.034 -0.269 1.00 1.00 C ATOM 787 C ILE A 127 -3.546 -5.369 -1.330 1.00 1.00 C ATOM 788 O ILE A 127 -3.041 -4.692 -2.226 1.00 1.00 O ATOM 789 CB ILE A 127 -1.838 -5.043 0.550 1.00 1.00 C ATOM 790 CG1 ILE A 127 -0.748 -5.766 1.344 1.00 1.00 C ATOM 791 CG2 ILE A 127 -2.732 -4.191 1.452 1.00 1.00 C ATOM 792 CD1 ILE A 127 -1.336 -6.467 2.570 1.00 1.00 C ATOM 0 H ILE A 127 -1.068 -6.622 -1.487 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.337 -6.519 0.442 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.338 -4.364 -0.141 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -0.252 -6.497 0.705 1.00 1.00 H new ATOM 0 HG13 ILE A 127 0.012 -5.051 1.659 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.116 -3.496 2.023 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.439 -3.631 0.840 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.279 -4.838 2.138 1.00 1.00 H new ATOM 0 HD11 ILE A 127 -0.540 -6.973 3.116 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -1.809 -5.730 3.218 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -2.078 -7.198 2.250 1.00 1.00 H new ATOM 803 N GLU A 128 -4.847 -5.583 -1.196 1.00 1.00 N ATOM 804 CA GLU A 128 -5.800 -5.014 -2.133 1.00 1.00 C ATOM 805 C GLU A 128 -6.380 -3.713 -1.575 1.00 1.00 C ATOM 806 O GLU A 128 -6.901 -3.688 -0.461 1.00 1.00 O ATOM 807 CB GLU A 128 -6.913 -6.013 -2.459 1.00 1.00 C ATOM 808 CG GLU A 128 -7.624 -5.636 -3.760 1.00 1.00 C ATOM 809 CD GLU A 128 -8.496 -6.788 -4.262 1.00 1.00 C ATOM 810 OE1 GLU A 128 -8.216 -7.359 -5.327 1.00 1.00 O ATOM 811 OE2 GLU A 128 -9.496 -7.087 -3.503 1.00 1.00 O ATOM 0 H GLU A 128 -5.263 -6.143 -0.452 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.276 -4.788 -3.061 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.493 -7.015 -2.547 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.633 -6.040 -1.641 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -8.241 -4.752 -3.598 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -6.887 -5.376 -4.519 1.00 1.00 H new ATOM 817 N ALA A 129 -6.268 -2.662 -2.374 1.00 1.00 N ATOM 818 CA ALA A 129 -6.773 -1.359 -1.975 1.00 1.00 C ATOM 819 C ALA A 129 -8.229 -1.499 -1.521 1.00 1.00 C ATOM 820 O ALA A 129 -9.034 -2.138 -2.196 1.00 1.00 O ATOM 821 CB ALA A 129 -6.617 -0.372 -3.133 1.00 1.00 C ATOM 0 H ALA A 129 -5.834 -2.686 -3.297 1.00 1.00 H new ATOM 0 HA ALA A 129 -6.200 -0.967 -1.135 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -6.996 0.605 -2.832 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.563 -0.286 -3.398 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.180 -0.730 -3.995 1.00 1.00 H new ATOM 827 N ASP A 130 -8.520 -0.892 -0.380 1.00 1.00 N ATOM 828 CA ASP A 130 -9.863 -0.941 0.172 1.00 1.00 C ATOM 829 C ASP A 130 -10.452 0.471 0.195 1.00 1.00 C ATOM 830 O ASP A 130 -11.460 0.717 0.856 1.00 1.00 O ATOM 831 CB ASP A 130 -9.850 -1.471 1.607 1.00 1.00 C ATOM 832 CG ASP A 130 -9.999 -2.988 1.736 1.00 1.00 C ATOM 833 OD1 ASP A 130 -9.134 -3.668 2.308 1.00 1.00 O ATOM 834 OD2 ASP A 130 -11.071 -3.478 1.212 1.00 1.00 O ATOM 0 H ASP A 130 -7.849 -0.364 0.177 1.00 1.00 H new ATOM 0 HA ASP A 130 -10.460 -1.606 -0.452 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -8.915 -1.171 2.081 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -10.657 -0.993 2.162 1.00 1.00 H new ATOM 839 N LYS A 131 -9.797 1.363 -0.534 1.00 1.00 N ATOM 840 CA LYS A 131 -10.244 2.744 -0.606 1.00 1.00 C ATOM 841 C LYS A 131 -9.585 3.426 -1.807 1.00 1.00 C ATOM 842 O LYS A 131 -8.531 4.047 -1.673 1.00 1.00 O ATOM 843 CB LYS A 131 -9.989 3.459 0.723 1.00 1.00 C ATOM 844 CG LYS A 131 -8.761 2.881 1.430 1.00 1.00 C ATOM 845 CD LYS A 131 -8.589 3.497 2.820 1.00 1.00 C ATOM 846 CE LYS A 131 -7.455 2.812 3.586 1.00 1.00 C ATOM 847 NZ LYS A 131 -6.140 3.229 3.049 1.00 1.00 N ATOM 0 H LYS A 131 -8.960 1.156 -1.080 1.00 1.00 H new ATOM 0 HA LYS A 131 -11.322 2.789 -0.764 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -9.842 4.524 0.545 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -10.863 3.361 1.366 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -8.863 1.799 1.518 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -7.870 3.070 0.832 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -8.378 4.562 2.726 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -9.519 3.405 3.381 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -7.519 3.065 4.644 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -7.559 1.730 3.510 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -5.547 2.389 2.891 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -6.276 3.731 2.148 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -5.671 3.860 3.730 1.00 1.00 H new ATOM 856 N SER A 132 -10.235 3.290 -2.954 1.00 1.00 N ATOM 857 CA SER A 132 -9.726 3.886 -4.177 1.00 1.00 C ATOM 858 C SER A 132 -9.141 5.268 -3.883 1.00 1.00 C ATOM 859 O SER A 132 -9.748 6.062 -3.165 1.00 1.00 O ATOM 860 CB SER A 132 -10.824 3.988 -5.238 1.00 1.00 C ATOM 861 OG SER A 132 -11.549 2.770 -5.376 1.00 1.00 O ATOM 0 H SER A 132 -11.109 2.776 -3.062 1.00 1.00 H new ATOM 0 HA SER A 132 -8.938 3.242 -4.569 1.00 1.00 H new ATOM 0 HB2 SER A 132 -11.512 4.791 -4.972 1.00 1.00 H new ATOM 0 HB3 SER A 132 -10.378 4.255 -6.196 1.00 1.00 H new ATOM 0 HG SER A 132 -11.873 2.685 -6.297 1.00 1.00 H new ATOM 866 N GLY A 133 -7.970 5.513 -4.451 1.00 1.00 N ATOM 867 CA GLY A 133 -7.297 6.787 -4.258 1.00 1.00 C ATOM 868 C GLY A 133 -6.027 6.870 -5.107 1.00 1.00 C ATOM 869 O GLY A 133 -5.760 5.986 -5.921 1.00 1.00 O ATOM 0 H GLY A 133 -7.470 4.852 -5.045 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.970 7.602 -4.524 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -7.044 6.913 -3.205 1.00 1.00 H new ATOM 873 N THR A 134 -5.276 7.939 -4.889 1.00 1.00 N ATOM 874 CA THR A 134 -4.040 8.149 -5.623 1.00 1.00 C ATOM 875 C THR A 134 -2.850 8.202 -4.663 1.00 1.00 C ATOM 876 O THR A 134 -2.991 8.630 -3.518 1.00 1.00 O ATOM 877 CB THR A 134 -4.199 9.418 -6.464 1.00 1.00 C ATOM 878 OG1 THR A 134 -3.327 9.212 -7.572 1.00 1.00 O ATOM 879 CG2 THR A 134 -3.630 10.656 -5.768 1.00 1.00 C ATOM 0 H THR A 134 -5.500 8.670 -4.214 1.00 1.00 H new ATOM 0 HA THR A 134 -3.836 7.317 -6.297 1.00 1.00 H new ATOM 0 HB THR A 134 -5.255 9.578 -6.684 1.00 1.00 H new ATOM 0 HG1 THR A 134 -3.369 9.987 -8.170 1.00 1.00 H new ATOM 0 HG21 THR A 134 -3.768 11.528 -6.407 1.00 1.00 H new ATOM 0 HG22 THR A 134 -4.149 10.813 -4.822 1.00 1.00 H new ATOM 0 HG23 THR A 134 -2.567 10.510 -5.578 1.00 1.00 H new ATOM 887 N VAL A 135 -1.706 7.761 -5.164 1.00 1.00 N ATOM 888 CA VAL A 135 -0.492 7.753 -4.364 1.00 1.00 C ATOM 889 C VAL A 135 -0.425 9.036 -3.534 1.00 1.00 C ATOM 890 O VAL A 135 -1.053 10.036 -3.879 1.00 1.00 O ATOM 891 CB VAL A 135 0.727 7.559 -5.266 1.00 1.00 C ATOM 892 CG1 VAL A 135 0.984 8.805 -6.118 1.00 1.00 C ATOM 893 CG2 VAL A 135 1.965 7.193 -4.445 1.00 1.00 C ATOM 0 H VAL A 135 -1.593 7.407 -6.114 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.499 6.916 -3.666 1.00 1.00 H new ATOM 0 HB VAL A 135 0.514 6.729 -5.940 1.00 1.00 H new ATOM 0 HG11 VAL A 135 1.857 8.640 -6.750 1.00 1.00 H new ATOM 0 HG12 VAL A 135 0.114 9.003 -6.744 1.00 1.00 H new ATOM 0 HG13 VAL A 135 1.164 9.660 -5.467 1.00 1.00 H new ATOM 0 HG21 VAL A 135 2.817 7.061 -5.111 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.180 7.992 -3.735 1.00 1.00 H new ATOM 0 HG23 VAL A 135 1.781 6.265 -3.903 1.00 1.00 H new ATOM 903 N LYS A 136 0.343 8.966 -2.457 1.00 1.00 N ATOM 904 CA LYS A 136 0.501 10.111 -1.576 1.00 1.00 C ATOM 905 C LYS A 136 1.944 10.166 -1.070 1.00 1.00 C ATOM 906 O LYS A 136 2.574 11.221 -1.094 1.00 1.00 O ATOM 907 CB LYS A 136 -0.542 10.073 -0.456 1.00 1.00 C ATOM 908 CG LYS A 136 -0.628 11.423 0.258 1.00 1.00 C ATOM 909 CD LYS A 136 -0.925 12.550 -0.733 1.00 1.00 C ATOM 910 CE LYS A 136 0.318 13.406 -0.980 1.00 1.00 C ATOM 911 NZ LYS A 136 0.199 14.707 -0.286 1.00 1.00 N ATOM 0 H LYS A 136 0.862 8.135 -2.174 1.00 1.00 H new ATOM 0 HA LYS A 136 0.318 11.038 -2.120 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -1.516 9.814 -0.870 1.00 1.00 H new ATOM 0 HB3 LYS A 136 -0.283 9.294 0.261 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -1.409 11.387 1.018 1.00 1.00 H new ATOM 0 HG3 LYS A 136 0.310 11.626 0.774 1.00 1.00 H new ATOM 0 HD2 LYS A 136 -1.273 12.128 -1.676 1.00 1.00 H new ATOM 0 HD3 LYS A 136 -1.730 13.175 -0.347 1.00 1.00 H new ATOM 0 HE2 LYS A 136 1.205 12.879 -0.628 1.00 1.00 H new ATOM 0 HE3 LYS A 136 0.448 13.569 -2.050 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 1.052 15.275 -0.465 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 -0.636 15.215 -0.641 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 0.098 14.547 0.737 1.00 1.00 H new ATOM 920 N ALA A 137 2.425 9.014 -0.626 1.00 1.00 N ATOM 921 CA ALA A 137 3.783 8.917 -0.116 1.00 1.00 C ATOM 922 C ALA A 137 3.994 7.531 0.498 1.00 1.00 C ATOM 923 O ALA A 137 3.162 7.056 1.269 1.00 1.00 O ATOM 924 CB ALA A 137 4.033 10.044 0.888 1.00 1.00 C ATOM 0 H ALA A 137 1.899 8.140 -0.609 1.00 1.00 H new ATOM 0 HA ALA A 137 4.506 9.034 -0.923 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.051 9.971 1.270 1.00 1.00 H new ATOM 0 HB2 ALA A 137 3.898 11.007 0.395 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.328 9.958 1.715 1.00 1.00 H new ATOM 930 N ILE A 138 5.113 6.922 0.132 1.00 1.00 N ATOM 931 CA ILE A 138 5.444 5.600 0.638 1.00 1.00 C ATOM 932 C ILE A 138 6.509 5.729 1.729 1.00 1.00 C ATOM 933 O ILE A 138 7.484 6.461 1.566 1.00 1.00 O ATOM 934 CB ILE A 138 5.848 4.673 -0.510 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.099 5.033 -1.795 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.655 3.206 -0.124 1.00 1.00 C ATOM 937 CD1 ILE A 138 5.467 4.076 -2.931 1.00 1.00 C ATOM 0 H ILE A 138 5.801 7.319 -0.508 1.00 1.00 H new ATOM 0 HA ILE A 138 4.571 5.138 1.098 1.00 1.00 H new ATOM 0 HB ILE A 138 6.911 4.816 -0.707 1.00 1.00 H new ATOM 0 HG12 ILE A 138 4.024 4.995 -1.617 1.00 1.00 H new ATOM 0 HG13 ILE A 138 5.338 6.056 -2.085 1.00 1.00 H new ATOM 0 HG21 ILE A 138 5.950 2.569 -0.958 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.271 2.974 0.745 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.607 3.028 0.116 1.00 1.00 H new ATOM 0 HD11 ILE A 138 4.921 4.354 -3.832 1.00 1.00 H new ATOM 0 HD12 ILE A 138 6.538 4.134 -3.123 1.00 1.00 H new ATOM 0 HD13 ILE A 138 5.204 3.057 -2.648 1.00 1.00 H new ATOM 948 N LEU A 139 6.285 5.007 2.818 1.00 1.00 N ATOM 949 CA LEU A 139 7.213 5.031 3.935 1.00 1.00 C ATOM 950 C LEU A 139 7.987 3.711 3.979 1.00 1.00 C ATOM 951 O LEU A 139 9.206 3.706 4.135 1.00 1.00 O ATOM 952 CB LEU A 139 6.478 5.356 5.236 1.00 1.00 C ATOM 953 CG LEU A 139 5.070 5.938 5.083 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.307 5.881 6.407 1.00 1.00 C ATOM 955 CD2 LEU A 139 5.122 7.356 4.512 1.00 1.00 C ATOM 0 H LEU A 139 5.474 4.402 2.950 1.00 1.00 H new ATOM 0 HA LEU A 139 7.946 5.827 3.803 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.410 4.444 5.830 1.00 1.00 H new ATOM 0 HB3 LEU A 139 7.082 6.063 5.805 1.00 1.00 H new ATOM 0 HG LEU A 139 4.522 5.323 4.369 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.310 6.300 6.271 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.223 4.845 6.734 1.00 1.00 H new ATOM 0 HD13 LEU A 139 4.843 6.457 7.161 1.00 1.00 H new ATOM 0 HD21 LEU A 139 4.109 7.746 4.413 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.694 7.997 5.182 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.600 7.337 3.533 1.00 1.00 H new ATOM 966 N VAL A 140 7.244 2.622 3.838 1.00 1.00 N ATOM 967 CA VAL A 140 7.845 1.300 3.859 1.00 1.00 C ATOM 968 C VAL A 140 8.719 1.120 2.616 1.00 1.00 C ATOM 969 O VAL A 140 8.430 1.687 1.564 1.00 1.00 O ATOM 970 CB VAL A 140 6.755 0.232 3.983 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.820 0.261 2.772 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.367 -1.158 4.169 1.00 1.00 C ATOM 0 H VAL A 140 6.232 2.629 3.709 1.00 1.00 H new ATOM 0 HA VAL A 140 8.492 1.189 4.729 1.00 1.00 H new ATOM 0 HB VAL A 140 6.163 0.459 4.870 1.00 1.00 H new ATOM 0 HG11 VAL A 140 5.055 -0.507 2.885 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.345 1.239 2.703 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.394 0.071 1.865 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.571 -1.898 4.254 1.00 1.00 H new ATOM 0 HG22 VAL A 140 7.994 -1.397 3.310 1.00 1.00 H new ATOM 0 HG23 VAL A 140 7.973 -1.171 5.075 1.00 1.00 H new ATOM 982 N GLU A 141 9.769 0.330 2.779 1.00 1.00 N ATOM 983 CA GLU A 141 10.687 0.069 1.684 1.00 1.00 C ATOM 984 C GLU A 141 10.608 -1.400 1.262 1.00 1.00 C ATOM 985 O GLU A 141 10.848 -2.295 2.072 1.00 1.00 O ATOM 986 CB GLU A 141 12.118 0.454 2.063 1.00 1.00 C ATOM 987 CG GLU A 141 12.818 1.172 0.907 1.00 1.00 C ATOM 988 CD GLU A 141 14.176 1.725 1.347 1.00 1.00 C ATOM 989 OE1 GLU A 141 15.154 0.968 1.434 1.00 1.00 O ATOM 990 OE2 GLU A 141 14.194 2.988 1.601 1.00 1.00 O ATOM 0 H GLU A 141 10.005 -0.138 3.654 1.00 1.00 H new ATOM 0 HA GLU A 141 10.393 0.687 0.836 1.00 1.00 H new ATOM 0 HB2 GLU A 141 12.104 1.099 2.941 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.679 -0.440 2.333 1.00 1.00 H new ATOM 0 HG2 GLU A 141 12.955 0.482 0.075 1.00 1.00 H new ATOM 0 HG3 GLU A 141 12.190 1.986 0.546 1.00 1.00 H new ATOM 996 N SER A 142 10.270 -1.603 -0.002 1.00 1.00 N ATOM 997 CA SER A 142 10.157 -2.948 -0.540 1.00 1.00 C ATOM 998 C SER A 142 11.273 -3.831 0.019 1.00 1.00 C ATOM 999 O SER A 142 12.412 -3.765 -0.444 1.00 1.00 O ATOM 1000 CB SER A 142 10.203 -2.936 -2.069 1.00 1.00 C ATOM 1001 OG SER A 142 11.295 -2.166 -2.563 1.00 1.00 O ATOM 0 H SER A 142 10.070 -0.858 -0.670 1.00 1.00 H new ATOM 0 HA SER A 142 9.193 -3.357 -0.237 1.00 1.00 H new ATOM 0 HB2 SER A 142 10.284 -3.959 -2.437 1.00 1.00 H new ATOM 0 HB3 SER A 142 9.268 -2.531 -2.457 1.00 1.00 H new ATOM 0 HG SER A 142 12.105 -2.385 -2.057 1.00 1.00 H new ATOM 1006 N GLY A 143 10.910 -4.638 1.004 1.00 1.00 N ATOM 1007 CA GLY A 143 11.869 -5.533 1.630 1.00 1.00 C ATOM 1008 C GLY A 143 11.868 -5.361 3.151 1.00 1.00 C ATOM 1009 O GLY A 143 12.041 -6.329 3.889 1.00 1.00 O ATOM 0 H GLY A 143 9.965 -4.691 1.385 1.00 1.00 H new ATOM 0 HA2 GLY A 143 11.627 -6.565 1.377 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.867 -5.334 1.239 1.00 1.00 H new ATOM 1013 N GLN A 144 11.673 -4.119 3.573 1.00 1.00 N ATOM 1014 CA GLN A 144 11.648 -3.807 4.991 1.00 1.00 C ATOM 1015 C GLN A 144 10.550 -4.610 5.692 1.00 1.00 C ATOM 1016 O GLN A 144 9.542 -4.957 5.079 1.00 1.00 O ATOM 1017 CB GLN A 144 11.460 -2.306 5.219 1.00 1.00 C ATOM 1018 CG GLN A 144 12.737 -1.672 5.775 1.00 1.00 C ATOM 1019 CD GLN A 144 13.894 -1.809 4.782 1.00 1.00 C ATOM 1020 OE1 GLN A 144 14.478 -2.866 4.613 1.00 1.00 O ATOM 1021 NE2 GLN A 144 14.190 -0.683 4.139 1.00 1.00 N ATOM 0 H GLN A 144 11.531 -3.318 2.957 1.00 1.00 H new ATOM 0 HA GLN A 144 12.609 -4.089 5.422 1.00 1.00 H new ATOM 0 HB2 GLN A 144 11.189 -1.823 4.280 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.636 -2.140 5.913 1.00 1.00 H new ATOM 0 HG2 GLN A 144 12.560 -0.618 5.990 1.00 1.00 H new ATOM 0 HG3 GLN A 144 13.004 -2.149 6.718 1.00 1.00 H new ATOM 0 HE21 GLN A 144 13.660 0.167 4.329 1.00 1.00 H new ATOM 0 HE22 GLN A 144 14.947 -0.670 3.456 1.00 1.00 H new ATOM 1028 N PRO A 145 10.788 -4.887 7.002 1.00 1.00 N ATOM 1029 CA PRO A 145 9.831 -5.642 7.794 1.00 1.00 C ATOM 1030 C PRO A 145 8.622 -4.779 8.160 1.00 1.00 C ATOM 1031 O PRO A 145 8.679 -3.554 8.074 1.00 1.00 O ATOM 1032 CB PRO A 145 10.612 -6.116 9.008 1.00 1.00 C ATOM 1033 CG PRO A 145 11.843 -5.228 9.087 1.00 1.00 C ATOM 1034 CD PRO A 145 11.970 -4.491 7.762 1.00 1.00 C ATOM 0 HA PRO A 145 9.411 -6.489 7.252 1.00 1.00 H new ATOM 0 HB2 PRO A 145 10.012 -6.033 9.914 1.00 1.00 H new ATOM 0 HB3 PRO A 145 10.893 -7.164 8.906 1.00 1.00 H new ATOM 0 HG2 PRO A 145 11.751 -4.520 9.911 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.734 -5.826 9.278 1.00 1.00 H new ATOM 0 HD2 PRO A 145 12.002 -3.412 7.911 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.887 -4.768 7.241 1.00 1.00 H new ATOM 1039 N VAL A 146 7.554 -5.454 8.563 1.00 1.00 N ATOM 1040 CA VAL A 146 6.334 -4.764 8.944 1.00 1.00 C ATOM 1041 C VAL A 146 5.887 -5.251 10.324 1.00 1.00 C ATOM 1042 O VAL A 146 6.249 -6.349 10.745 1.00 1.00 O ATOM 1043 CB VAL A 146 5.266 -4.960 7.866 1.00 1.00 C ATOM 1044 CG1 VAL A 146 5.819 -4.629 6.480 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.699 -6.381 7.907 1.00 1.00 C ATOM 0 H VAL A 146 7.509 -6.471 8.634 1.00 1.00 H new ATOM 0 HA VAL A 146 6.509 -3.691 9.020 1.00 1.00 H new ATOM 0 HB VAL A 146 4.449 -4.268 8.074 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.040 -4.777 5.732 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.150 -3.591 6.459 1.00 1.00 H new ATOM 0 HG13 VAL A 146 6.662 -5.283 6.259 1.00 1.00 H new ATOM 0 HG21 VAL A 146 3.942 -6.493 7.131 1.00 1.00 H new ATOM 0 HG22 VAL A 146 5.502 -7.098 7.737 1.00 1.00 H new ATOM 0 HG23 VAL A 146 4.248 -6.565 8.882 1.00 1.00 H new ATOM 1055 N GLU A 147 5.108 -4.411 10.989 1.00 1.00 N ATOM 1056 CA GLU A 147 4.608 -4.743 12.313 1.00 1.00 C ATOM 1057 C GLU A 147 3.118 -4.409 12.417 1.00 1.00 C ATOM 1058 O GLU A 147 2.609 -3.584 11.659 1.00 1.00 O ATOM 1059 CB GLU A 147 5.408 -4.019 13.397 1.00 1.00 C ATOM 1060 CG GLU A 147 5.534 -4.883 14.654 1.00 1.00 C ATOM 1061 CD GLU A 147 5.932 -4.036 15.864 1.00 1.00 C ATOM 1062 OE1 GLU A 147 5.372 -2.949 16.072 1.00 1.00 O ATOM 1063 OE2 GLU A 147 6.860 -4.543 16.604 1.00 1.00 O ATOM 0 H GLU A 147 4.811 -3.501 10.636 1.00 1.00 H new ATOM 0 HA GLU A 147 4.732 -5.815 12.469 1.00 1.00 H new ATOM 0 HB2 GLU A 147 6.400 -3.774 13.019 1.00 1.00 H new ATOM 0 HB3 GLU A 147 4.920 -3.077 13.646 1.00 1.00 H new ATOM 0 HG2 GLU A 147 4.586 -5.384 14.852 1.00 1.00 H new ATOM 0 HG3 GLU A 147 6.278 -5.663 14.491 1.00 1.00 H new ATOM 1069 N PHE A 148 2.461 -5.068 13.360 1.00 1.00 N ATOM 1070 CA PHE A 148 1.040 -4.852 13.572 1.00 1.00 C ATOM 1071 C PHE A 148 0.763 -3.410 14.000 1.00 1.00 C ATOM 1072 O PHE A 148 1.324 -2.932 14.986 1.00 1.00 O ATOM 1073 CB PHE A 148 0.607 -5.798 14.694 1.00 1.00 C ATOM 1074 CG PHE A 148 -0.897 -5.782 14.976 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.444 -4.764 15.691 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -1.686 -6.786 14.509 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.840 -4.749 15.953 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -3.082 -6.772 14.770 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.629 -5.753 15.486 1.00 1.00 C ATOM 0 H PHE A 148 2.887 -5.752 13.986 1.00 1.00 H new ATOM 0 HA PHE A 148 0.493 -5.039 12.648 1.00 1.00 H new ATOM 0 HB2 PHE A 148 0.907 -6.813 14.435 1.00 1.00 H new ATOM 0 HB3 PHE A 148 1.140 -5.531 15.606 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -0.817 -3.966 16.060 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -1.251 -7.594 13.940 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -3.274 -3.941 16.523 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -3.709 -7.570 14.400 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.691 -5.741 15.684 1.00 1.00 H new ATOM 1088 N ASP A 149 -0.103 -2.757 13.239 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.462 -1.378 13.527 1.00 1.00 C ATOM 1090 C ASP A 149 0.615 -0.448 12.965 1.00 1.00 C ATOM 1091 O ASP A 149 0.654 0.735 13.300 1.00 1.00 O ATOM 1092 CB ASP A 149 -0.554 -1.138 15.035 1.00 1.00 C ATOM 1093 CG ASP A 149 -1.440 0.040 15.449 1.00 1.00 C ATOM 1094 OD1 ASP A 149 -2.670 -0.005 15.300 1.00 1.00 O ATOM 1095 OD2 ASP A 149 -0.810 1.047 15.951 1.00 1.00 O ATOM 0 H ASP A 149 -0.567 -3.157 12.423 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.431 -1.178 13.070 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -0.933 -2.043 15.509 1.00 1.00 H new ATOM 0 HB3 ASP A 149 0.451 -0.972 15.423 1.00 1.00 H new ATOM 1100 N GLU A 150 1.460 -1.017 12.118 1.00 1.00 N ATOM 1101 CA GLU A 150 2.533 -0.253 11.506 1.00 1.00 C ATOM 1102 C GLU A 150 2.105 0.254 10.127 1.00 1.00 C ATOM 1103 O GLU A 150 1.418 -0.451 9.389 1.00 1.00 O ATOM 1104 CB GLU A 150 3.815 -1.084 11.412 1.00 1.00 C ATOM 1105 CG GLU A 150 5.055 -0.197 11.535 1.00 1.00 C ATOM 1106 CD GLU A 150 6.245 -0.990 12.078 1.00 1.00 C ATOM 1107 OE1 GLU A 150 6.521 -2.100 11.599 1.00 1.00 O ATOM 1108 OE2 GLU A 150 6.894 -0.414 13.033 1.00 1.00 O ATOM 0 H GLU A 150 1.423 -1.998 11.841 1.00 1.00 H new ATOM 0 HA GLU A 150 2.744 0.609 12.139 1.00 1.00 H new ATOM 0 HB2 GLU A 150 3.823 -1.837 12.200 1.00 1.00 H new ATOM 0 HB3 GLU A 150 3.838 -1.617 10.462 1.00 1.00 H new ATOM 0 HG2 GLU A 150 5.306 0.220 10.560 1.00 1.00 H new ATOM 0 HG3 GLU A 150 4.841 0.643 12.196 1.00 1.00 H new ATOM 1114 N PRO A 151 2.540 1.502 9.812 1.00 1.00 N ATOM 1115 CA PRO A 151 2.209 2.110 8.534 1.00 1.00 C ATOM 1116 C PRO A 151 3.040 1.500 7.404 1.00 1.00 C ATOM 1117 O PRO A 151 4.073 0.880 7.653 1.00 1.00 O ATOM 1118 CB PRO A 151 2.469 3.596 8.726 1.00 1.00 C ATOM 1119 CG PRO A 151 3.373 3.707 9.944 1.00 1.00 C ATOM 1120 CD PRO A 151 3.356 2.366 10.660 1.00 1.00 C ATOM 0 HA PRO A 151 1.174 1.934 8.241 1.00 1.00 H new ATOM 0 HB2 PRO A 151 2.946 4.026 7.845 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.537 4.139 8.881 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.388 3.967 9.644 1.00 1.00 H new ATOM 0 HG3 PRO A 151 3.024 4.499 10.607 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.364 1.967 10.778 1.00 1.00 H new ATOM 0 HD3 PRO A 151 2.930 2.456 11.659 1.00 1.00 H new ATOM 1125 N LEU A 152 2.557 1.694 6.185 1.00 1.00 N ATOM 1126 CA LEU A 152 3.242 1.169 5.017 1.00 1.00 C ATOM 1127 C LEU A 152 3.346 2.267 3.956 1.00 1.00 C ATOM 1128 O LEU A 152 4.381 2.920 3.833 1.00 1.00 O ATOM 1129 CB LEU A 152 2.555 -0.104 4.520 1.00 1.00 C ATOM 1130 CG LEU A 152 2.489 -1.264 5.515 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.589 -2.384 4.991 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.890 -1.768 5.863 1.00 1.00 C ATOM 0 H LEU A 152 1.699 2.208 5.982 1.00 1.00 H new ATOM 0 HA LEU A 152 4.260 0.875 5.272 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.538 0.149 4.220 1.00 1.00 H new ATOM 0 HB3 LEU A 152 3.075 -0.448 3.626 1.00 1.00 H new ATOM 0 HG LEU A 152 2.041 -0.898 6.439 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.559 -3.197 5.717 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.581 -1.999 4.836 1.00 1.00 H new ATOM 0 HD13 LEU A 152 1.984 -2.756 4.046 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.814 -2.592 6.572 1.00 1.00 H new ATOM 0 HD22 LEU A 152 4.388 -2.113 4.957 1.00 1.00 H new ATOM 0 HD23 LEU A 152 4.468 -0.958 6.309 1.00 1.00 H new ATOM 1143 N VAL A 153 2.259 2.437 3.218 1.00 1.00 N ATOM 1144 CA VAL A 153 2.214 3.444 2.171 1.00 1.00 C ATOM 1145 C VAL A 153 1.051 4.401 2.440 1.00 1.00 C ATOM 1146 O VAL A 153 0.023 3.997 2.982 1.00 1.00 O ATOM 1147 CB VAL A 153 2.131 2.771 0.800 1.00 1.00 C ATOM 1148 CG1 VAL A 153 2.397 3.777 -0.321 1.00 1.00 C ATOM 1149 CG2 VAL A 153 3.093 1.584 0.711 1.00 1.00 C ATOM 0 H VAL A 153 1.402 1.894 3.324 1.00 1.00 H new ATOM 0 HA VAL A 153 3.129 4.036 2.171 1.00 1.00 H new ATOM 0 HB VAL A 153 1.117 2.390 0.675 1.00 1.00 H new ATOM 0 HG11 VAL A 153 2.332 3.273 -1.285 1.00 1.00 H new ATOM 0 HG12 VAL A 153 1.655 4.575 -0.278 1.00 1.00 H new ATOM 0 HG13 VAL A 153 3.394 4.202 -0.200 1.00 1.00 H new ATOM 0 HG21 VAL A 153 3.013 1.124 -0.274 1.00 1.00 H new ATOM 0 HG22 VAL A 153 4.114 1.931 0.868 1.00 1.00 H new ATOM 0 HG23 VAL A 153 2.837 0.850 1.476 1.00 1.00 H new ATOM 1159 N VAL A 154 1.252 5.650 2.049 1.00 1.00 N ATOM 1160 CA VAL A 154 0.233 6.668 2.241 1.00 1.00 C ATOM 1161 C VAL A 154 -0.451 6.957 0.903 1.00 1.00 C ATOM 1162 O VAL A 154 0.218 7.188 -0.103 1.00 1.00 O ATOM 1163 CB VAL A 154 0.851 7.914 2.878 1.00 1.00 C ATOM 1164 CG1 VAL A 154 -0.211 8.988 3.123 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.584 7.562 4.174 1.00 1.00 C ATOM 0 H VAL A 154 2.106 5.981 1.600 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.535 6.315 2.929 1.00 1.00 H new ATOM 0 HB VAL A 154 1.583 8.319 2.179 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.254 9.863 3.576 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.668 9.271 2.175 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -0.977 8.596 3.793 1.00 1.00 H new ATOM 0 HG21 VAL A 154 2.014 8.466 4.606 1.00 1.00 H new ATOM 0 HG22 VAL A 154 0.882 7.121 4.881 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.380 6.848 3.960 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.775 6.934 0.935 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.558 7.190 -0.262 1.00 1.00 C ATOM 1177 C ILE A 155 -3.352 8.486 -0.080 1.00 1.00 C ATOM 1178 O ILE A 155 -3.505 8.971 1.040 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.426 5.978 -0.604 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.579 4.840 -1.176 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.568 6.371 -1.545 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -1.942 4.015 -0.055 1.00 1.00 C ATOM 0 H ILE A 155 -2.326 6.742 1.772 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.904 7.336 -1.122 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.878 5.611 0.317 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -3.201 4.196 -1.798 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -1.800 5.249 -1.819 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.170 5.492 -1.773 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.193 7.124 -1.065 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -4.155 6.777 -2.468 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.345 3.212 -0.488 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -1.302 4.657 0.551 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -2.725 3.587 0.572 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.837 9.007 -1.197 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.611 10.236 -1.174 1.00 1.00 C ATOM 1195 C GLU A 156 -5.539 10.301 -2.389 1.00 1.00 C ATOM 1196 O GLU A 156 -6.758 10.230 -2.249 1.00 1.00 O ATOM 1197 CB GLU A 156 -3.696 11.461 -1.117 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.500 12.735 -0.853 1.00 1.00 C ATOM 1199 CD GLU A 156 -4.072 13.394 0.459 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -4.393 12.883 1.543 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -3.378 14.473 0.327 1.00 1.00 O ATOM 0 H GLU A 156 -3.709 8.601 -2.124 1.00 1.00 H new ATOM 0 HA GLU A 156 -5.223 10.239 -0.272 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -2.952 11.327 -0.332 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -3.153 11.558 -2.057 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -4.360 13.434 -1.677 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -5.563 12.496 -0.814 1.00 1.00 H new