USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=14 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 121 MET CE :methyl -173:sc= 0 (180deg=0) USER MOD Set 1.2: A 123 MET CE :methyl -135:sc= -0.138 (180deg=-0.082) USER MOD Set 1.3: A 125 ASN : amide:sc= -0.218 X(o=-0.36,f=-0.67) USER MOD Single : A 81 HIS : no HE2:sc= -4.45! C(o=-4.4!,f=-5.6!) USER MOD Single : A 85 SER OG : rot 101:sc= -0.942 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc=-0.00314 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 107:sc= 1.24 USER MOD Single : A 96 SER OG : rot 180:sc= 0 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= -0.0469 X(o=-0.047,f=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 157:sc= -1.6! USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= -0.0287 X(o=-0.029,f=0) USER MOD Single : A 131 LYS NZ :NH3+ -132:sc= 0.574 (180deg=-0.224) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= -0.791 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot -0:sc= 1.03 USER MOD Single : A 144 GLN : amide:sc= -1.64 X(o=-1.6,f=-2) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.700 7.815 2.372 1.00 1.00 N ATOM 131 CA HIS A 81 -5.739 6.716 3.321 1.00 1.00 C ATOM 132 C HIS A 81 -4.337 6.124 3.480 1.00 1.00 C ATOM 133 O HIS A 81 -3.648 5.879 2.492 1.00 1.00 O ATOM 134 CB HIS A 81 -6.778 5.674 2.904 1.00 1.00 C ATOM 135 CG HIS A 81 -6.399 4.254 3.252 1.00 1.00 C ATOM 136 ND1 HIS A 81 -6.620 3.703 4.502 1.00 1.00 N ATOM 137 CD2 HIS A 81 -5.811 3.278 2.500 1.00 1.00 C ATOM 138 CE1 HIS A 81 -6.181 2.453 4.493 1.00 1.00 C ATOM 139 NE2 HIS A 81 -5.679 2.193 3.251 1.00 1.00 N ATOM 0 HA HIS A 81 -6.052 7.086 4.297 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -7.728 5.913 3.381 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -6.935 5.744 1.828 1.00 1.00 H new ATOM 0 HD1 HIS A 81 -7.048 4.179 5.296 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -5.505 3.373 1.469 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -6.215 1.762 5.322 1.00 1.00 H new ATOM 146 N ILE A 82 -3.957 5.913 4.731 1.00 1.00 N ATOM 147 CA ILE A 82 -2.649 5.355 5.032 1.00 1.00 C ATOM 148 C ILE A 82 -2.794 3.863 5.341 1.00 1.00 C ATOM 149 O ILE A 82 -3.502 3.485 6.273 1.00 1.00 O ATOM 150 CB ILE A 82 -1.971 6.151 6.149 1.00 1.00 C ATOM 151 CG1 ILE A 82 -1.344 7.435 5.604 1.00 1.00 C ATOM 152 CG2 ILE A 82 -0.953 5.288 6.896 1.00 1.00 C ATOM 153 CD1 ILE A 82 -2.378 8.561 5.527 1.00 1.00 C ATOM 0 H ILE A 82 -4.532 6.118 5.548 1.00 1.00 H new ATOM 0 HA ILE A 82 -1.991 5.439 4.167 1.00 1.00 H new ATOM 0 HB ILE A 82 -2.733 6.446 6.870 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -0.516 7.740 6.244 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -0.929 7.249 4.613 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -0.485 5.877 7.685 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -1.458 4.428 7.336 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -0.189 4.942 6.200 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -1.906 9.462 5.136 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -3.192 8.263 4.867 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -2.773 8.761 6.523 1.00 1.00 H new ATOM 164 N VAL A 83 -2.114 3.057 4.539 1.00 1.00 N ATOM 165 CA VAL A 83 -2.158 1.616 4.716 1.00 1.00 C ATOM 166 C VAL A 83 -1.433 1.241 6.010 1.00 1.00 C ATOM 167 O VAL A 83 -0.299 1.660 6.233 1.00 1.00 O ATOM 168 CB VAL A 83 -1.578 0.920 3.483 1.00 1.00 C ATOM 169 CG1 VAL A 83 -1.587 -0.601 3.656 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.330 1.332 2.215 1.00 1.00 C ATOM 0 H VAL A 83 -1.530 3.374 3.765 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.189 1.275 4.812 1.00 1.00 H new ATOM 0 HB VAL A 83 -0.541 1.239 3.376 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -1.170 -1.071 2.765 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -0.987 -0.872 4.525 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -2.611 -0.945 3.801 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -1.897 0.823 1.354 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.380 1.057 2.309 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.248 2.410 2.078 1.00 1.00 H new ATOM 180 N ARG A 84 -2.118 0.456 6.829 1.00 1.00 N ATOM 181 CA ARG A 84 -1.554 0.021 8.095 1.00 1.00 C ATOM 182 C ARG A 84 -1.366 -1.497 8.098 1.00 1.00 C ATOM 183 O ARG A 84 -2.338 -2.246 8.011 1.00 1.00 O ATOM 184 CB ARG A 84 -2.455 0.419 9.265 1.00 1.00 C ATOM 185 CG ARG A 84 -2.468 1.937 9.456 1.00 1.00 C ATOM 186 CD ARG A 84 -3.471 2.346 10.536 1.00 1.00 C ATOM 187 NE ARG A 84 -4.129 3.617 10.161 1.00 1.00 N ATOM 188 CZ ARG A 84 -3.646 4.839 10.468 1.00 1.00 C ATOM 189 NH1 ARG A 84 -2.494 4.966 11.159 1.00 1.00 N ATOM 190 NH2 ARG A 84 -4.318 5.908 10.082 1.00 1.00 N ATOM 0 H ARG A 84 -3.059 0.110 6.640 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.587 0.511 8.213 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -3.469 0.063 9.085 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -2.105 -0.063 10.178 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -1.471 2.281 9.732 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.724 2.423 8.515 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -4.219 1.564 10.664 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -2.961 2.459 11.493 1.00 1.00 H new ATOM 0 HE ARG A 84 -5.003 3.566 9.637 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -1.981 4.135 11.453 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -2.136 5.893 11.387 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -5.188 5.803 9.560 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -3.967 6.839 10.306 1.00 1.00 H new ATOM 199 N SER A 85 -0.110 -1.906 8.200 1.00 1.00 N ATOM 200 CA SER A 85 0.217 -3.322 8.216 1.00 1.00 C ATOM 201 C SER A 85 -0.773 -4.078 9.104 1.00 1.00 C ATOM 202 O SER A 85 -0.664 -4.045 10.329 1.00 1.00 O ATOM 203 CB SER A 85 1.650 -3.550 8.703 1.00 1.00 C ATOM 204 OG SER A 85 2.165 -2.417 9.396 1.00 1.00 O ATOM 0 H SER A 85 0.693 -1.282 8.272 1.00 1.00 H new ATOM 0 HA SER A 85 0.143 -3.702 7.197 1.00 1.00 H new ATOM 0 HB2 SER A 85 1.676 -4.419 9.360 1.00 1.00 H new ATOM 0 HB3 SER A 85 2.291 -3.776 7.851 1.00 1.00 H new ATOM 0 HG SER A 85 2.122 -2.577 10.362 1.00 1.00 H new ATOM 209 N PRO A 86 -1.741 -4.759 8.435 1.00 1.00 N ATOM 210 CA PRO A 86 -2.749 -5.522 9.151 1.00 1.00 C ATOM 211 C PRO A 86 -2.164 -6.825 9.700 1.00 1.00 C ATOM 212 O PRO A 86 -2.871 -7.610 10.329 1.00 1.00 O ATOM 213 CB PRO A 86 -3.861 -5.750 8.140 1.00 1.00 C ATOM 214 CG PRO A 86 -3.237 -5.513 6.773 1.00 1.00 C ATOM 215 CD PRO A 86 -1.901 -4.820 6.986 1.00 1.00 C ATOM 0 HA PRO A 86 -3.128 -4.999 10.029 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.258 -6.762 8.218 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.693 -5.067 8.313 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -3.098 -6.458 6.248 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -3.892 -4.898 6.155 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -1.088 -5.377 6.521 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -1.897 -3.823 6.545 1.00 1.00 H new ATOM 220 N MET A 87 -0.879 -7.014 9.441 1.00 1.00 N ATOM 221 CA MET A 87 -0.190 -8.207 9.901 1.00 1.00 C ATOM 222 C MET A 87 1.325 -8.057 9.757 1.00 1.00 C ATOM 223 O MET A 87 1.814 -7.632 8.711 1.00 1.00 O ATOM 224 CB MET A 87 -0.664 -9.415 9.089 1.00 1.00 C ATOM 225 CG MET A 87 -1.380 -10.430 9.981 1.00 1.00 C ATOM 226 SD MET A 87 -0.215 -11.635 10.594 1.00 1.00 S ATOM 227 CE MET A 87 -0.682 -11.669 12.317 1.00 1.00 C ATOM 0 H MET A 87 -0.296 -6.360 8.918 1.00 1.00 H new ATOM 0 HA MET A 87 -0.422 -8.353 10.956 1.00 1.00 H new ATOM 0 HB2 MET A 87 -1.336 -9.084 8.297 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.190 -9.890 8.605 1.00 1.00 H new ATOM 0 HG2 MET A 87 -1.859 -9.918 10.816 1.00 1.00 H new ATOM 0 HG3 MET A 87 -2.169 -10.929 9.418 1.00 1.00 H new ATOM 0 HE1 MET A 87 -0.049 -12.377 12.852 1.00 1.00 H new ATOM 0 HE2 MET A 87 -0.559 -10.675 12.747 1.00 1.00 H new ATOM 0 HE3 MET A 87 -1.724 -11.976 12.406 1.00 1.00 H new ATOM 235 N VAL A 88 2.028 -8.413 10.823 1.00 1.00 N ATOM 236 CA VAL A 88 3.478 -8.323 10.827 1.00 1.00 C ATOM 237 C VAL A 88 4.047 -9.267 9.766 1.00 1.00 C ATOM 238 O VAL A 88 3.513 -10.352 9.545 1.00 1.00 O ATOM 239 CB VAL A 88 4.015 -8.608 12.231 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.532 -8.411 12.288 1.00 1.00 C ATOM 241 CG2 VAL A 88 3.309 -7.739 13.275 1.00 1.00 C ATOM 0 H VAL A 88 1.620 -8.764 11.689 1.00 1.00 H new ATOM 0 HA VAL A 88 3.799 -7.314 10.569 1.00 1.00 H new ATOM 0 HB VAL A 88 3.804 -9.651 12.466 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.888 -8.620 13.297 1.00 1.00 H new ATOM 0 HG12 VAL A 88 6.014 -9.090 11.585 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.776 -7.382 12.023 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.709 -7.961 14.264 1.00 1.00 H new ATOM 0 HG22 VAL A 88 3.475 -6.687 13.045 1.00 1.00 H new ATOM 0 HG23 VAL A 88 2.240 -7.950 13.261 1.00 1.00 H new ATOM 251 N GLY A 89 5.125 -8.818 9.138 1.00 1.00 N ATOM 252 CA GLY A 89 5.772 -9.610 8.106 1.00 1.00 C ATOM 253 C GLY A 89 6.712 -8.747 7.263 1.00 1.00 C ATOM 254 O GLY A 89 7.431 -7.903 7.795 1.00 1.00 O ATOM 0 H GLY A 89 5.566 -7.917 9.324 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.333 -10.424 8.565 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.017 -10.065 7.465 1.00 1.00 H new ATOM 258 N THR A 90 6.677 -8.989 5.960 1.00 1.00 N ATOM 259 CA THR A 90 7.517 -8.245 5.038 1.00 1.00 C ATOM 260 C THR A 90 6.664 -7.593 3.947 1.00 1.00 C ATOM 261 O THR A 90 5.946 -8.280 3.222 1.00 1.00 O ATOM 262 CB THR A 90 8.580 -9.199 4.490 1.00 1.00 C ATOM 263 OG1 THR A 90 9.045 -9.899 5.641 1.00 1.00 O ATOM 264 CG2 THR A 90 9.819 -8.464 3.975 1.00 1.00 C ATOM 0 H THR A 90 6.080 -9.690 5.522 1.00 1.00 H new ATOM 0 HA THR A 90 8.027 -7.424 5.542 1.00 1.00 H new ATOM 0 HB THR A 90 8.151 -9.795 3.684 1.00 1.00 H new ATOM 0 HG1 THR A 90 9.737 -10.541 5.376 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.541 -9.188 3.598 1.00 1.00 H new ATOM 0 HG22 THR A 90 9.532 -7.786 3.172 1.00 1.00 H new ATOM 0 HG23 THR A 90 10.268 -7.894 4.788 1.00 1.00 H new ATOM 272 N PHE A 91 6.773 -6.275 3.863 1.00 1.00 N ATOM 273 CA PHE A 91 6.021 -5.525 2.873 1.00 1.00 C ATOM 274 C PHE A 91 6.788 -5.438 1.552 1.00 1.00 C ATOM 275 O PHE A 91 7.983 -5.149 1.541 1.00 1.00 O ATOM 276 CB PHE A 91 5.831 -4.112 3.431 1.00 1.00 C ATOM 277 CG PHE A 91 5.152 -3.145 2.460 1.00 1.00 C ATOM 278 CD1 PHE A 91 5.833 -2.674 1.380 1.00 1.00 C ATOM 279 CD2 PHE A 91 3.867 -2.755 2.676 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.202 -1.776 0.480 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.236 -1.858 1.775 1.00 1.00 C ATOM 282 CZ PHE A 91 3.917 -1.387 0.696 1.00 1.00 C ATOM 0 H PHE A 91 7.371 -5.708 4.464 1.00 1.00 H new ATOM 0 HA PHE A 91 5.068 -6.018 2.678 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.238 -4.170 4.344 1.00 1.00 H new ATOM 0 HB3 PHE A 91 6.805 -3.708 3.708 1.00 1.00 H new ATOM 0 HD1 PHE A 91 6.853 -2.983 1.208 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.327 -3.128 3.533 1.00 1.00 H new ATOM 0 HE1 PHE A 91 5.743 -1.402 -0.377 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.215 -1.550 1.946 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.437 -0.704 0.011 1.00 1.00 H new ATOM 291 N TYR A 92 6.068 -5.695 0.469 1.00 1.00 N ATOM 292 CA TYR A 92 6.666 -5.651 -0.855 1.00 1.00 C ATOM 293 C TYR A 92 5.806 -4.828 -1.817 1.00 1.00 C ATOM 294 O TYR A 92 4.578 -4.870 -1.748 1.00 1.00 O ATOM 295 CB TYR A 92 6.714 -7.100 -1.344 1.00 1.00 C ATOM 296 CG TYR A 92 7.788 -7.951 -0.663 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.123 -7.706 -0.911 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.421 -8.963 0.200 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.133 -8.507 -0.270 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.430 -9.764 0.841 1.00 1.00 C ATOM 301 CZ TYR A 92 9.738 -9.497 0.574 1.00 1.00 C ATOM 302 OH TYR A 92 10.691 -10.253 1.179 1.00 1.00 O ATOM 0 H TYR A 92 5.077 -5.934 0.482 1.00 1.00 H new ATOM 0 HA TYR A 92 7.653 -5.190 -0.816 1.00 1.00 H new ATOM 0 HB2 TYR A 92 5.740 -7.561 -1.178 1.00 1.00 H new ATOM 0 HB3 TYR A 92 6.890 -7.104 -2.420 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.410 -6.913 -1.586 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.376 -9.154 0.395 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.181 -8.325 -0.455 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.156 -10.559 1.519 1.00 1.00 H new ATOM 0 HH TYR A 92 10.262 -10.920 1.755 1.00 1.00 H new ATOM 311 N ARG A 93 6.484 -4.100 -2.692 1.00 1.00 N ATOM 312 CA ARG A 93 5.798 -3.269 -3.666 1.00 1.00 C ATOM 313 C ARG A 93 5.737 -3.980 -5.020 1.00 1.00 C ATOM 314 O ARG A 93 4.917 -3.636 -5.869 1.00 1.00 O ATOM 315 CB ARG A 93 6.503 -1.923 -3.835 1.00 1.00 C ATOM 316 CG ARG A 93 5.918 -0.874 -2.888 1.00 1.00 C ATOM 317 CD ARG A 93 7.015 -0.231 -2.038 1.00 1.00 C ATOM 318 NE ARG A 93 8.083 0.307 -2.911 1.00 1.00 N ATOM 319 CZ ARG A 93 7.933 1.382 -3.715 1.00 1.00 C ATOM 320 NH1 ARG A 93 6.757 2.043 -3.764 1.00 1.00 N ATOM 321 NH2 ARG A 93 8.954 1.775 -4.454 1.00 1.00 N ATOM 0 H ARG A 93 7.502 -4.069 -2.747 1.00 1.00 H new ATOM 0 HA ARG A 93 4.787 -3.092 -3.299 1.00 1.00 H new ATOM 0 HB2 ARG A 93 7.569 -2.040 -3.640 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.403 -1.583 -4.866 1.00 1.00 H new ATOM 0 HG2 ARG A 93 5.402 -0.106 -3.464 1.00 1.00 H new ATOM 0 HG3 ARG A 93 5.175 -1.338 -2.239 1.00 1.00 H new ATOM 0 HD2 ARG A 93 6.593 0.570 -1.430 1.00 1.00 H new ATOM 0 HD3 ARG A 93 7.432 -0.967 -1.351 1.00 1.00 H new ATOM 0 HE ARG A 93 8.988 -0.163 -2.905 1.00 1.00 H new ATOM 0 HH11 ARG A 93 5.973 1.732 -3.191 1.00 1.00 H new ATOM 0 HH12 ARG A 93 6.653 2.854 -4.374 1.00 1.00 H new ATOM 0 HH21 ARG A 93 9.839 1.269 -4.412 1.00 1.00 H new ATOM 0 HH22 ARG A 93 8.858 2.585 -5.067 1.00 1.00 H new ATOM 330 N THR A 94 6.618 -4.957 -5.179 1.00 1.00 N ATOM 331 CA THR A 94 6.674 -5.720 -6.415 1.00 1.00 C ATOM 332 C THR A 94 6.739 -7.218 -6.115 1.00 1.00 C ATOM 333 O THR A 94 7.215 -7.623 -5.057 1.00 1.00 O ATOM 334 CB THR A 94 7.865 -5.211 -7.230 1.00 1.00 C ATOM 335 OG1 THR A 94 8.989 -5.447 -6.386 1.00 1.00 O ATOM 336 CG2 THR A 94 7.846 -3.691 -7.408 1.00 1.00 C ATOM 0 H THR A 94 7.299 -5.238 -4.473 1.00 1.00 H new ATOM 0 HA THR A 94 5.771 -5.579 -7.008 1.00 1.00 H new ATOM 0 HB THR A 94 7.867 -5.691 -8.209 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.510 -6.199 -6.738 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.712 -3.382 -7.993 1.00 1.00 H new ATOM 0 HG22 THR A 94 6.934 -3.397 -7.927 1.00 1.00 H new ATOM 0 HG23 THR A 94 7.878 -3.210 -6.431 1.00 1.00 H new ATOM 344 N PRO A 95 6.240 -8.022 -7.093 1.00 1.00 N ATOM 345 CA PRO A 95 6.237 -9.468 -6.944 1.00 1.00 C ATOM 346 C PRO A 95 7.641 -10.042 -7.141 1.00 1.00 C ATOM 347 O PRO A 95 7.910 -11.177 -6.754 1.00 1.00 O ATOM 348 CB PRO A 95 5.239 -9.967 -7.977 1.00 1.00 C ATOM 349 CG PRO A 95 5.071 -8.833 -8.975 1.00 1.00 C ATOM 350 CD PRO A 95 5.667 -7.577 -8.360 1.00 1.00 C ATOM 0 HA PRO A 95 5.947 -9.788 -5.943 1.00 1.00 H new ATOM 0 HB2 PRO A 95 5.603 -10.869 -8.468 1.00 1.00 H new ATOM 0 HB3 PRO A 95 4.287 -10.221 -7.510 1.00 1.00 H new ATOM 0 HG2 PRO A 95 5.572 -9.073 -9.913 1.00 1.00 H new ATOM 0 HG3 PRO A 95 4.017 -8.681 -9.206 1.00 1.00 H new ATOM 0 HD2 PRO A 95 6.428 -7.141 -9.008 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.906 -6.813 -8.204 1.00 1.00 H new ATOM 355 N SER A 96 8.498 -9.231 -7.743 1.00 1.00 N ATOM 356 CA SER A 96 9.868 -9.644 -7.995 1.00 1.00 C ATOM 357 C SER A 96 10.800 -8.433 -7.935 1.00 1.00 C ATOM 358 O SER A 96 10.340 -7.294 -7.869 1.00 1.00 O ATOM 359 CB SER A 96 9.991 -10.341 -9.352 1.00 1.00 C ATOM 360 OG SER A 96 10.186 -11.746 -9.216 1.00 1.00 O ATOM 0 H SER A 96 8.270 -8.290 -8.064 1.00 1.00 H new ATOM 0 HA SER A 96 10.158 -10.356 -7.222 1.00 1.00 H new ATOM 0 HB2 SER A 96 9.091 -10.155 -9.938 1.00 1.00 H new ATOM 0 HB3 SER A 96 10.826 -9.911 -9.906 1.00 1.00 H new ATOM 0 HG SER A 96 10.258 -12.154 -10.104 1.00 1.00 H new ATOM 365 N PRO A 97 12.127 -8.727 -7.958 1.00 1.00 N ATOM 366 CA PRO A 97 13.129 -7.675 -7.907 1.00 1.00 C ATOM 367 C PRO A 97 13.230 -6.949 -9.249 1.00 1.00 C ATOM 368 O PRO A 97 13.538 -5.759 -9.294 1.00 1.00 O ATOM 369 CB PRO A 97 14.418 -8.377 -7.512 1.00 1.00 C ATOM 370 CG PRO A 97 14.197 -9.852 -7.810 1.00 1.00 C ATOM 371 CD PRO A 97 12.709 -10.064 -8.034 1.00 1.00 C ATOM 0 HA PRO A 97 12.882 -6.893 -7.189 1.00 1.00 H new ATOM 0 HB2 PRO A 97 15.264 -7.987 -8.077 1.00 1.00 H new ATOM 0 HB3 PRO A 97 14.640 -8.221 -6.456 1.00 1.00 H new ATOM 0 HG2 PRO A 97 14.762 -10.152 -8.692 1.00 1.00 H new ATOM 0 HG3 PRO A 97 14.550 -10.466 -6.981 1.00 1.00 H new ATOM 0 HD2 PRO A 97 12.516 -10.525 -9.003 1.00 1.00 H new ATOM 0 HD3 PRO A 97 12.285 -10.724 -7.277 1.00 1.00 H new ATOM 376 N ASP A 98 12.966 -7.695 -10.311 1.00 1.00 N ATOM 377 CA ASP A 98 13.024 -7.137 -11.652 1.00 1.00 C ATOM 378 C ASP A 98 11.625 -7.162 -12.271 1.00 1.00 C ATOM 379 O ASP A 98 11.467 -7.498 -13.444 1.00 1.00 O ATOM 380 CB ASP A 98 13.953 -7.957 -12.550 1.00 1.00 C ATOM 381 CG ASP A 98 14.844 -7.134 -13.482 1.00 1.00 C ATOM 382 OD1 ASP A 98 14.705 -7.189 -14.712 1.00 1.00 O ATOM 383 OD2 ASP A 98 15.724 -6.401 -12.887 1.00 1.00 O ATOM 0 H ASP A 98 12.711 -8.682 -10.271 1.00 1.00 H new ATOM 0 HA ASP A 98 13.402 -6.117 -11.577 1.00 1.00 H new ATOM 0 HB2 ASP A 98 14.589 -8.578 -11.919 1.00 1.00 H new ATOM 0 HB3 ASP A 98 13.347 -8.632 -13.154 1.00 1.00 H new ATOM 388 N ALA A 99 10.646 -6.800 -11.455 1.00 1.00 N ATOM 389 CA ALA A 99 9.266 -6.776 -11.908 1.00 1.00 C ATOM 390 C ALA A 99 8.663 -5.399 -11.621 1.00 1.00 C ATOM 391 O ALA A 99 8.986 -4.775 -10.612 1.00 1.00 O ATOM 392 CB ALA A 99 8.486 -7.907 -11.230 1.00 1.00 C ATOM 0 H ALA A 99 10.781 -6.521 -10.483 1.00 1.00 H new ATOM 0 HA ALA A 99 9.212 -6.942 -12.984 1.00 1.00 H new ATOM 0 HB1 ALA A 99 7.450 -7.889 -11.570 1.00 1.00 H new ATOM 0 HB2 ALA A 99 8.936 -8.865 -11.488 1.00 1.00 H new ATOM 0 HB3 ALA A 99 8.516 -7.772 -10.149 1.00 1.00 H new ATOM 398 N LYS A 100 7.798 -4.968 -12.526 1.00 1.00 N ATOM 399 CA LYS A 100 7.147 -3.676 -12.383 1.00 1.00 C ATOM 400 C LYS A 100 6.617 -3.531 -10.956 1.00 1.00 C ATOM 401 O LYS A 100 6.643 -4.487 -10.181 1.00 1.00 O ATOM 402 CB LYS A 100 6.075 -3.494 -13.460 1.00 1.00 C ATOM 403 CG LYS A 100 6.595 -3.927 -14.831 1.00 1.00 C ATOM 404 CD LYS A 100 6.070 -5.316 -15.204 1.00 1.00 C ATOM 405 CE LYS A 100 5.254 -5.264 -16.497 1.00 1.00 C ATOM 406 NZ LYS A 100 3.905 -4.711 -16.236 1.00 1.00 N ATOM 0 H LYS A 100 7.532 -5.490 -13.361 1.00 1.00 H new ATOM 0 HA LYS A 100 7.863 -2.869 -12.540 1.00 1.00 H new ATOM 0 HB2 LYS A 100 5.192 -4.078 -13.201 1.00 1.00 H new ATOM 0 HB3 LYS A 100 5.766 -2.449 -13.498 1.00 1.00 H new ATOM 0 HG2 LYS A 100 6.287 -3.203 -15.586 1.00 1.00 H new ATOM 0 HG3 LYS A 100 7.685 -3.936 -14.824 1.00 1.00 H new ATOM 0 HD2 LYS A 100 6.906 -6.005 -15.325 1.00 1.00 H new ATOM 0 HD3 LYS A 100 5.452 -5.705 -14.395 1.00 1.00 H new ATOM 0 HE2 LYS A 100 5.769 -4.649 -17.235 1.00 1.00 H new ATOM 0 HE3 LYS A 100 5.168 -6.265 -16.920 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 3.364 -4.682 -17.124 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 3.410 -5.314 -15.548 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 3.993 -3.748 -15.853 1.00 1.00 H new ATOM 415 N ALA A 101 6.149 -2.330 -10.651 1.00 1.00 N ATOM 416 CA ALA A 101 5.613 -2.049 -9.330 1.00 1.00 C ATOM 417 C ALA A 101 4.086 -2.124 -9.377 1.00 1.00 C ATOM 418 O ALA A 101 3.463 -1.604 -10.302 1.00 1.00 O ATOM 419 CB ALA A 101 6.116 -0.684 -8.855 1.00 1.00 C ATOM 0 H ALA A 101 6.130 -1.540 -11.296 1.00 1.00 H new ATOM 0 HA ALA A 101 5.957 -2.792 -8.610 1.00 1.00 H new ATOM 0 HB1 ALA A 101 5.714 -0.473 -7.864 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.205 -0.693 -8.811 1.00 1.00 H new ATOM 0 HB3 ALA A 101 5.788 0.087 -9.552 1.00 1.00 H new ATOM 425 N PHE A 102 3.527 -2.777 -8.369 1.00 1.00 N ATOM 426 CA PHE A 102 2.084 -2.926 -8.283 1.00 1.00 C ATOM 427 C PHE A 102 1.380 -1.584 -8.490 1.00 1.00 C ATOM 428 O PHE A 102 0.384 -1.505 -9.209 1.00 1.00 O ATOM 429 CB PHE A 102 1.770 -3.442 -6.877 1.00 1.00 C ATOM 430 CG PHE A 102 1.617 -4.962 -6.792 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.545 -5.571 -7.365 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.554 -5.704 -6.143 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.403 -6.982 -7.285 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.412 -7.114 -6.062 1.00 1.00 C ATOM 435 CZ PHE A 102 1.340 -7.724 -6.635 1.00 1.00 C ATOM 0 H PHE A 102 4.047 -3.209 -7.605 1.00 1.00 H new ATOM 0 HA PHE A 102 1.735 -3.611 -9.055 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.565 -3.129 -6.200 1.00 1.00 H new ATOM 0 HB3 PHE A 102 0.850 -2.974 -6.526 1.00 1.00 H new ATOM 0 HD1 PHE A 102 -0.199 -4.982 -7.881 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.406 -5.220 -5.689 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.449 -7.466 -7.740 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.156 -7.703 -5.545 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.233 -8.797 -6.574 1.00 1.00 H new ATOM 444 N ILE A 103 1.924 -0.561 -7.847 1.00 1.00 N ATOM 445 CA ILE A 103 1.361 0.775 -7.952 1.00 1.00 C ATOM 446 C ILE A 103 2.481 1.775 -8.243 1.00 1.00 C ATOM 447 O ILE A 103 3.418 1.907 -7.457 1.00 1.00 O ATOM 448 CB ILE A 103 0.543 1.110 -6.703 1.00 1.00 C ATOM 449 CG1 ILE A 103 1.364 0.877 -5.433 1.00 1.00 C ATOM 450 CG2 ILE A 103 -0.775 0.334 -6.684 1.00 1.00 C ATOM 451 CD1 ILE A 103 0.766 1.637 -4.247 1.00 1.00 C ATOM 0 H ILE A 103 2.749 -0.630 -7.251 1.00 1.00 H new ATOM 0 HA ILE A 103 0.662 0.830 -8.786 1.00 1.00 H new ATOM 0 HB ILE A 103 0.290 2.170 -6.735 1.00 1.00 H new ATOM 0 HG12 ILE A 103 1.397 -0.189 -5.207 1.00 1.00 H new ATOM 0 HG13 ILE A 103 2.392 1.200 -5.596 1.00 1.00 H new ATOM 0 HG21 ILE A 103 -1.336 0.591 -5.786 1.00 1.00 H new ATOM 0 HG22 ILE A 103 -1.362 0.593 -7.565 1.00 1.00 H new ATOM 0 HG23 ILE A 103 -0.567 -0.736 -6.688 1.00 1.00 H new ATOM 0 HD11 ILE A 103 1.368 1.454 -3.357 1.00 1.00 H new ATOM 0 HD12 ILE A 103 0.757 2.705 -4.466 1.00 1.00 H new ATOM 0 HD13 ILE A 103 -0.254 1.294 -4.072 1.00 1.00 H new ATOM 462 N GLU A 104 2.347 2.453 -9.373 1.00 1.00 N ATOM 463 CA GLU A 104 3.337 3.436 -9.776 1.00 1.00 C ATOM 464 C GLU A 104 2.987 4.809 -9.197 1.00 1.00 C ATOM 465 O GLU A 104 1.992 5.417 -9.588 1.00 1.00 O ATOM 466 CB GLU A 104 3.459 3.500 -11.300 1.00 1.00 C ATOM 467 CG GLU A 104 3.848 2.137 -11.876 1.00 1.00 C ATOM 468 CD GLU A 104 3.298 1.962 -13.292 1.00 1.00 C ATOM 469 OE1 GLU A 104 3.564 2.798 -14.168 1.00 1.00 O ATOM 470 OE2 GLU A 104 2.571 0.911 -13.469 1.00 1.00 O ATOM 0 H GLU A 104 1.568 2.341 -10.022 1.00 1.00 H new ATOM 0 HA GLU A 104 4.305 3.131 -9.379 1.00 1.00 H new ATOM 0 HB2 GLU A 104 2.512 3.824 -11.731 1.00 1.00 H new ATOM 0 HB3 GLU A 104 4.206 4.243 -11.578 1.00 1.00 H new ATOM 0 HG2 GLU A 104 4.934 2.041 -11.889 1.00 1.00 H new ATOM 0 HG3 GLU A 104 3.466 1.344 -11.233 1.00 1.00 H new ATOM 476 N VAL A 105 3.825 5.258 -8.274 1.00 1.00 N ATOM 477 CA VAL A 105 3.617 6.546 -7.637 1.00 1.00 C ATOM 478 C VAL A 105 3.139 7.556 -8.683 1.00 1.00 C ATOM 479 O VAL A 105 3.871 7.881 -9.616 1.00 1.00 O ATOM 480 CB VAL A 105 4.895 6.989 -6.920 1.00 1.00 C ATOM 481 CG1 VAL A 105 4.711 8.359 -6.266 1.00 1.00 C ATOM 482 CG2 VAL A 105 5.335 5.945 -5.891 1.00 1.00 C ATOM 0 H VAL A 105 4.650 4.752 -7.952 1.00 1.00 H new ATOM 0 HA VAL A 105 2.841 6.474 -6.875 1.00 1.00 H new ATOM 0 HB VAL A 105 5.684 7.078 -7.667 1.00 1.00 H new ATOM 0 HG11 VAL A 105 5.634 8.649 -5.764 1.00 1.00 H new ATOM 0 HG12 VAL A 105 4.466 9.097 -7.030 1.00 1.00 H new ATOM 0 HG13 VAL A 105 3.902 8.309 -5.537 1.00 1.00 H new ATOM 0 HG21 VAL A 105 6.245 6.283 -5.396 1.00 1.00 H new ATOM 0 HG22 VAL A 105 4.547 5.810 -5.150 1.00 1.00 H new ATOM 0 HG23 VAL A 105 5.527 4.997 -6.394 1.00 1.00 H new ATOM 492 N GLY A 106 1.915 8.024 -8.491 1.00 1.00 N ATOM 493 CA GLY A 106 1.330 8.989 -9.406 1.00 1.00 C ATOM 494 C GLY A 106 0.277 8.330 -10.299 1.00 1.00 C ATOM 495 O GLY A 106 0.033 8.785 -11.416 1.00 1.00 O ATOM 0 H GLY A 106 1.312 7.753 -7.715 1.00 1.00 H new ATOM 0 HA2 GLY A 106 0.875 9.802 -8.840 1.00 1.00 H new ATOM 0 HA3 GLY A 106 2.112 9.430 -10.024 1.00 1.00 H new ATOM 499 N GLN A 107 -0.318 7.269 -9.774 1.00 1.00 N ATOM 500 CA GLN A 107 -1.339 6.544 -10.511 1.00 1.00 C ATOM 501 C GLN A 107 -2.647 6.519 -9.719 1.00 1.00 C ATOM 502 O GLN A 107 -2.682 6.921 -8.557 1.00 1.00 O ATOM 503 CB GLN A 107 -0.872 5.124 -10.842 1.00 1.00 C ATOM 504 CG GLN A 107 -1.741 4.503 -11.936 1.00 1.00 C ATOM 505 CD GLN A 107 -0.917 3.572 -12.828 1.00 1.00 C ATOM 506 OE1 GLN A 107 -0.304 3.983 -13.800 1.00 1.00 O ATOM 507 NE2 GLN A 107 -0.936 2.298 -12.446 1.00 1.00 N ATOM 0 H GLN A 107 -0.113 6.894 -8.848 1.00 1.00 H new ATOM 0 HA GLN A 107 -1.517 7.062 -11.453 1.00 1.00 H new ATOM 0 HB2 GLN A 107 0.168 5.146 -11.167 1.00 1.00 H new ATOM 0 HB3 GLN A 107 -0.913 4.506 -9.945 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -2.561 3.946 -11.482 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -2.188 5.291 -12.542 1.00 1.00 H new ATOM 0 HE21 GLN A 107 -1.470 2.020 -11.622 1.00 1.00 H new ATOM 0 HE22 GLN A 107 -0.417 1.599 -12.977 1.00 1.00 H new ATOM 514 N LYS A 108 -3.694 6.043 -10.380 1.00 1.00 N ATOM 515 CA LYS A 108 -5.001 5.961 -9.752 1.00 1.00 C ATOM 516 C LYS A 108 -5.293 4.506 -9.381 1.00 1.00 C ATOM 517 O LYS A 108 -5.103 3.604 -10.195 1.00 1.00 O ATOM 518 CB LYS A 108 -6.066 6.592 -10.650 1.00 1.00 C ATOM 519 CG LYS A 108 -7.400 6.723 -9.911 1.00 1.00 C ATOM 520 CD LYS A 108 -8.092 8.043 -10.256 1.00 1.00 C ATOM 521 CE LYS A 108 -9.179 7.832 -11.312 1.00 1.00 C ATOM 522 NZ LYS A 108 -8.841 8.562 -12.555 1.00 1.00 N ATOM 0 H LYS A 108 -3.662 5.711 -11.344 1.00 1.00 H new ATOM 0 HA LYS A 108 -5.016 6.536 -8.826 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -5.732 7.575 -10.981 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -6.200 5.983 -11.544 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -8.049 5.888 -10.175 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -7.231 6.667 -8.836 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -8.532 8.473 -9.356 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -7.356 8.758 -10.624 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -9.286 6.768 -11.525 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -10.139 8.178 -10.929 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -9.588 8.409 -13.262 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -8.762 9.578 -12.350 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -7.935 8.212 -12.928 1.00 1.00 H new ATOM 531 N VAL A 109 -5.750 4.322 -8.151 1.00 1.00 N ATOM 532 CA VAL A 109 -6.071 2.992 -7.662 1.00 1.00 C ATOM 533 C VAL A 109 -7.463 3.009 -7.026 1.00 1.00 C ATOM 534 O VAL A 109 -7.772 3.890 -6.225 1.00 1.00 O ATOM 535 CB VAL A 109 -4.981 2.511 -6.703 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.672 2.245 -7.449 1.00 1.00 C ATOM 537 CG2 VAL A 109 -4.770 3.512 -5.565 1.00 1.00 C ATOM 0 H VAL A 109 -5.906 5.073 -7.478 1.00 1.00 H new ATOM 0 HA VAL A 109 -6.099 2.278 -8.485 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.313 1.570 -6.264 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -2.914 1.904 -6.744 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.834 1.478 -8.206 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.334 3.163 -7.929 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -3.990 3.145 -4.898 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.471 4.475 -5.978 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -5.699 3.629 -5.007 1.00 1.00 H new ATOM 547 N ASN A 110 -8.264 2.025 -7.405 1.00 1.00 N ATOM 548 CA ASN A 110 -9.615 1.915 -6.882 1.00 1.00 C ATOM 549 C ASN A 110 -9.732 0.636 -6.051 1.00 1.00 C ATOM 550 O ASN A 110 -9.083 -0.365 -6.350 1.00 1.00 O ATOM 551 CB ASN A 110 -10.640 1.840 -8.015 1.00 1.00 C ATOM 552 CG ASN A 110 -12.038 2.211 -7.515 1.00 1.00 C ATOM 553 OD1 ASN A 110 -12.365 3.368 -7.309 1.00 1.00 O ATOM 554 ND2 ASN A 110 -12.841 1.166 -7.331 1.00 1.00 N ATOM 0 H ASN A 110 -8.003 1.296 -8.069 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.815 2.797 -6.274 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -10.347 2.514 -8.820 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -10.654 0.833 -8.431 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -13.795 1.308 -6.998 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -12.503 0.223 -7.523 1.00 1.00 H new ATOM 560 N VAL A 111 -10.567 0.710 -5.025 1.00 1.00 N ATOM 561 CA VAL A 111 -10.779 -0.430 -4.149 1.00 1.00 C ATOM 562 C VAL A 111 -10.835 -1.709 -4.986 1.00 1.00 C ATOM 563 O VAL A 111 -11.796 -1.933 -5.721 1.00 1.00 O ATOM 564 CB VAL A 111 -12.036 -0.214 -3.303 1.00 1.00 C ATOM 565 CG1 VAL A 111 -13.295 -0.572 -4.093 1.00 1.00 C ATOM 566 CG2 VAL A 111 -11.962 -1.009 -1.999 1.00 1.00 C ATOM 0 H VAL A 111 -11.105 1.542 -4.781 1.00 1.00 H new ATOM 0 HA VAL A 111 -9.948 -0.534 -3.452 1.00 1.00 H new ATOM 0 HB VAL A 111 -12.091 0.844 -3.047 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -14.174 -0.410 -3.469 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.359 0.057 -4.981 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -13.251 -1.619 -4.393 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -12.867 -0.838 -1.417 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -11.872 -2.071 -2.225 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -11.094 -0.685 -1.424 1.00 1.00 H new ATOM 576 N GLY A 112 -9.791 -2.514 -4.850 1.00 1.00 N ATOM 577 CA GLY A 112 -9.710 -3.764 -5.586 1.00 1.00 C ATOM 578 C GLY A 112 -8.324 -3.944 -6.209 1.00 1.00 C ATOM 579 O GLY A 112 -7.847 -5.068 -6.356 1.00 1.00 O ATOM 0 H GLY A 112 -8.995 -2.325 -4.241 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -9.923 -4.598 -4.918 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.469 -3.780 -6.368 1.00 1.00 H new ATOM 583 N ASP A 113 -7.718 -2.820 -6.560 1.00 1.00 N ATOM 584 CA ASP A 113 -6.397 -2.839 -7.164 1.00 1.00 C ATOM 585 C ASP A 113 -5.348 -3.090 -6.079 1.00 1.00 C ATOM 586 O ASP A 113 -5.405 -2.492 -5.005 1.00 1.00 O ATOM 587 CB ASP A 113 -6.076 -1.499 -7.831 1.00 1.00 C ATOM 588 CG ASP A 113 -6.262 -1.473 -9.349 1.00 1.00 C ATOM 589 OD1 ASP A 113 -5.295 -1.305 -10.108 1.00 1.00 O ATOM 590 OD2 ASP A 113 -7.476 -1.634 -9.753 1.00 1.00 O ATOM 0 H ASP A 113 -8.118 -1.890 -6.438 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.382 -3.629 -7.915 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.709 -0.729 -7.389 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.044 -1.234 -7.602 1.00 1.00 H new ATOM 595 N THR A 114 -4.414 -3.975 -6.397 1.00 1.00 N ATOM 596 CA THR A 114 -3.354 -4.312 -5.462 1.00 1.00 C ATOM 597 C THR A 114 -2.615 -3.049 -5.015 1.00 1.00 C ATOM 598 O THR A 114 -2.435 -2.119 -5.800 1.00 1.00 O ATOM 599 CB THR A 114 -2.443 -5.342 -6.132 1.00 1.00 C ATOM 600 OG1 THR A 114 -3.285 -6.475 -6.327 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.346 -5.852 -5.194 1.00 1.00 C ATOM 0 H THR A 114 -4.370 -4.469 -7.289 1.00 1.00 H new ATOM 0 HA THR A 114 -3.757 -4.755 -4.551 1.00 1.00 H new ATOM 0 HB THR A 114 -1.987 -4.901 -7.018 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.775 -7.191 -6.759 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.728 -6.580 -5.719 1.00 1.00 H new ATOM 0 HG22 THR A 114 -0.726 -5.016 -4.871 1.00 1.00 H new ATOM 0 HG23 THR A 114 -1.802 -6.324 -4.323 1.00 1.00 H new ATOM 609 N LEU A 115 -2.208 -3.056 -3.754 1.00 1.00 N ATOM 610 CA LEU A 115 -1.493 -1.921 -3.193 1.00 1.00 C ATOM 611 C LEU A 115 -0.064 -2.346 -2.847 1.00 1.00 C ATOM 612 O LEU A 115 0.870 -1.556 -2.978 1.00 1.00 O ATOM 613 CB LEU A 115 -2.263 -1.335 -2.009 1.00 1.00 C ATOM 614 CG LEU A 115 -2.627 0.147 -2.112 1.00 1.00 C ATOM 615 CD1 LEU A 115 -3.305 0.454 -3.449 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.482 0.588 -0.921 1.00 1.00 C ATOM 0 H LEU A 115 -2.359 -3.828 -3.105 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.420 -1.117 -3.925 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -3.182 -1.906 -1.881 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -1.669 -1.481 -1.107 1.00 1.00 H new ATOM 0 HG LEU A 115 -1.705 0.727 -2.078 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -3.553 1.514 -3.496 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -2.629 0.203 -4.266 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -4.217 -0.136 -3.539 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -3.726 1.646 -1.020 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -4.402 0.004 -0.897 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -2.927 0.429 0.004 1.00 1.00 H new ATOM 627 N CYS A 116 0.061 -3.591 -2.412 1.00 1.00 N ATOM 628 CA CYS A 116 1.360 -4.129 -2.047 1.00 1.00 C ATOM 629 C CYS A 116 1.176 -5.592 -1.638 1.00 1.00 C ATOM 630 O CYS A 116 0.151 -6.200 -1.940 1.00 1.00 O ATOM 631 CB CYS A 116 2.022 -3.306 -0.940 1.00 1.00 C ATOM 632 SG CYS A 116 1.044 -3.428 0.602 1.00 1.00 S ATOM 0 H CYS A 116 -0.716 -4.243 -2.304 1.00 1.00 H new ATOM 0 HA CYS A 116 2.033 -4.074 -2.903 1.00 1.00 H new ATOM 0 HB2 CYS A 116 3.036 -3.665 -0.766 1.00 1.00 H new ATOM 0 HB3 CYS A 116 2.101 -2.264 -1.249 1.00 1.00 H new ATOM 0 HG CYS A 116 1.806 -3.161 1.621 1.00 1.00 H new ATOM 637 N ILE A 117 2.187 -6.114 -0.960 1.00 1.00 N ATOM 638 CA ILE A 117 2.150 -7.495 -0.507 1.00 1.00 C ATOM 639 C ILE A 117 2.760 -7.585 0.894 1.00 1.00 C ATOM 640 O ILE A 117 3.551 -6.729 1.286 1.00 1.00 O ATOM 641 CB ILE A 117 2.823 -8.413 -1.530 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.253 -8.182 -2.931 1.00 1.00 C ATOM 643 CG2 ILE A 117 2.719 -9.878 -1.103 1.00 1.00 C ATOM 644 CD1 ILE A 117 2.543 -9.375 -3.844 1.00 1.00 C ATOM 0 H ILE A 117 3.037 -5.606 -0.713 1.00 1.00 H new ATOM 0 HA ILE A 117 1.120 -7.842 -0.430 1.00 1.00 H new ATOM 0 HB ILE A 117 3.883 -8.164 -1.569 1.00 1.00 H new ATOM 0 HG12 ILE A 117 1.177 -8.021 -2.868 1.00 1.00 H new ATOM 0 HG13 ILE A 117 2.686 -7.278 -3.359 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.205 -10.509 -1.847 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.209 -10.011 -0.138 1.00 1.00 H new ATOM 0 HG23 ILE A 117 1.669 -10.159 -1.019 1.00 1.00 H new ATOM 0 HD11 ILE A 117 2.127 -9.185 -4.834 1.00 1.00 H new ATOM 0 HD12 ILE A 117 3.621 -9.518 -3.924 1.00 1.00 H new ATOM 0 HD13 ILE A 117 2.088 -10.273 -3.425 1.00 1.00 H new ATOM 655 N VAL A 118 2.366 -8.628 1.610 1.00 1.00 N ATOM 656 CA VAL A 118 2.864 -8.840 2.958 1.00 1.00 C ATOM 657 C VAL A 118 3.203 -10.320 3.145 1.00 1.00 C ATOM 658 O VAL A 118 2.331 -11.180 3.022 1.00 1.00 O ATOM 659 CB VAL A 118 1.846 -8.326 3.979 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.300 -8.632 5.407 1.00 1.00 C ATOM 661 CG2 VAL A 118 1.592 -6.828 3.793 1.00 1.00 C ATOM 0 H VAL A 118 1.708 -9.335 1.282 1.00 1.00 H new ATOM 0 HA VAL A 118 3.781 -8.274 3.120 1.00 1.00 H new ATOM 0 HB VAL A 118 0.905 -8.849 3.807 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.559 -8.256 6.113 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.406 -9.710 5.532 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.258 -8.148 5.596 1.00 1.00 H new ATOM 0 HG21 VAL A 118 0.865 -6.488 4.531 1.00 1.00 H new ATOM 0 HG22 VAL A 118 2.526 -6.281 3.925 1.00 1.00 H new ATOM 0 HG23 VAL A 118 1.204 -6.646 2.791 1.00 1.00 H new ATOM 671 N GLU A 119 4.470 -10.572 3.439 1.00 1.00 N ATOM 672 CA GLU A 119 4.934 -11.934 3.644 1.00 1.00 C ATOM 673 C GLU A 119 4.934 -12.276 5.135 1.00 1.00 C ATOM 674 O GLU A 119 5.528 -11.560 5.940 1.00 1.00 O ATOM 675 CB GLU A 119 6.323 -12.136 3.035 1.00 1.00 C ATOM 676 CG GLU A 119 6.464 -13.542 2.447 1.00 1.00 C ATOM 677 CD GLU A 119 7.579 -13.589 1.400 1.00 1.00 C ATOM 678 OE1 GLU A 119 8.763 -13.651 1.758 1.00 1.00 O ATOM 679 OE2 GLU A 119 7.177 -13.562 0.175 1.00 1.00 O ATOM 0 H GLU A 119 5.190 -9.856 3.540 1.00 1.00 H new ATOM 0 HA GLU A 119 4.248 -12.612 3.136 1.00 1.00 H new ATOM 0 HB2 GLU A 119 6.494 -11.393 2.256 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.085 -11.979 3.798 1.00 1.00 H new ATOM 0 HG2 GLU A 119 6.679 -14.254 3.244 1.00 1.00 H new ATOM 0 HG3 GLU A 119 5.521 -13.847 1.993 1.00 1.00 H new ATOM 685 N ALA A 120 4.261 -13.370 5.459 1.00 1.00 N ATOM 686 CA ALA A 120 4.175 -13.816 6.839 1.00 1.00 C ATOM 687 C ALA A 120 3.920 -15.324 6.869 1.00 1.00 C ATOM 688 O ALA A 120 3.490 -15.904 5.872 1.00 1.00 O ATOM 689 CB ALA A 120 3.084 -13.026 7.564 1.00 1.00 C ATOM 0 H ALA A 120 3.770 -13.961 4.789 1.00 1.00 H new ATOM 0 HA ALA A 120 5.114 -13.630 7.361 1.00 1.00 H new ATOM 0 HB1 ALA A 120 3.020 -13.361 8.599 1.00 1.00 H new ATOM 0 HB2 ALA A 120 3.327 -11.964 7.540 1.00 1.00 H new ATOM 0 HB3 ALA A 120 2.127 -13.190 7.069 1.00 1.00 H new ATOM 695 N MET A 121 4.195 -15.916 8.021 1.00 1.00 N ATOM 696 CA MET A 121 4.000 -17.346 8.194 1.00 1.00 C ATOM 697 C MET A 121 4.726 -18.134 7.102 1.00 1.00 C ATOM 698 O MET A 121 4.413 -19.298 6.859 1.00 1.00 O ATOM 699 CB MET A 121 2.504 -17.667 8.147 1.00 1.00 C ATOM 700 CG MET A 121 1.807 -17.222 9.434 1.00 1.00 C ATOM 701 SD MET A 121 0.790 -18.546 10.066 1.00 1.00 S ATOM 702 CE MET A 121 -0.746 -18.182 9.234 1.00 1.00 C ATOM 0 H MET A 121 4.552 -15.432 8.845 1.00 1.00 H new ATOM 0 HA MET A 121 4.412 -17.636 9.160 1.00 1.00 H new ATOM 0 HB2 MET A 121 2.048 -17.169 7.291 1.00 1.00 H new ATOM 0 HB3 MET A 121 2.363 -18.738 8.004 1.00 1.00 H new ATOM 0 HG2 MET A 121 2.549 -16.935 10.179 1.00 1.00 H new ATOM 0 HG3 MET A 121 1.194 -16.342 9.240 1.00 1.00 H new ATOM 0 HE1 MET A 121 -1.529 -18.840 9.611 1.00 1.00 H new ATOM 0 HE2 MET A 121 -1.023 -17.144 9.420 1.00 1.00 H new ATOM 0 HE3 MET A 121 -0.625 -18.339 8.162 1.00 1.00 H new ATOM 710 N LYS A 122 5.683 -17.467 6.473 1.00 1.00 N ATOM 711 CA LYS A 122 6.457 -18.091 5.413 1.00 1.00 C ATOM 712 C LYS A 122 5.594 -18.199 4.154 1.00 1.00 C ATOM 713 O LYS A 122 5.615 -19.220 3.468 1.00 1.00 O ATOM 714 CB LYS A 122 7.029 -19.429 5.883 1.00 1.00 C ATOM 715 CG LYS A 122 8.543 -19.480 5.677 1.00 1.00 C ATOM 716 CD LYS A 122 9.285 -19.193 6.984 1.00 1.00 C ATOM 717 CE LYS A 122 9.201 -17.708 7.346 1.00 1.00 C ATOM 718 NZ LYS A 122 9.569 -17.499 8.764 1.00 1.00 N ATOM 0 H LYS A 122 5.940 -16.501 6.677 1.00 1.00 H new ATOM 0 HA LYS A 122 7.319 -17.475 5.158 1.00 1.00 H new ATOM 0 HB2 LYS A 122 6.797 -19.578 6.938 1.00 1.00 H new ATOM 0 HB3 LYS A 122 6.556 -20.244 5.334 1.00 1.00 H new ATOM 0 HG2 LYS A 122 8.829 -20.462 5.300 1.00 1.00 H new ATOM 0 HG3 LYS A 122 8.835 -18.751 4.921 1.00 1.00 H new ATOM 0 HD2 LYS A 122 8.858 -19.792 7.788 1.00 1.00 H new ATOM 0 HD3 LYS A 122 10.329 -19.489 6.886 1.00 1.00 H new ATOM 0 HE2 LYS A 122 9.867 -17.133 6.703 1.00 1.00 H new ATOM 0 HE3 LYS A 122 8.190 -17.341 7.168 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 9.507 -16.486 8.993 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 8.917 -18.033 9.374 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 10.542 -17.831 8.923 1.00 1.00 H new ATOM 727 N MET A 123 4.854 -17.132 3.888 1.00 1.00 N ATOM 728 CA MET A 123 3.984 -17.095 2.725 1.00 1.00 C ATOM 729 C MET A 123 3.589 -15.657 2.382 1.00 1.00 C ATOM 730 O MET A 123 3.304 -14.859 3.274 1.00 1.00 O ATOM 731 CB MET A 123 2.726 -17.919 3.000 1.00 1.00 C ATOM 732 CG MET A 123 2.036 -17.454 4.283 1.00 1.00 C ATOM 733 SD MET A 123 0.377 -18.109 4.356 1.00 1.00 S ATOM 734 CE MET A 123 -0.415 -16.842 5.334 1.00 1.00 C ATOM 0 H MET A 123 4.839 -16.287 4.458 1.00 1.00 H new ATOM 0 HA MET A 123 4.525 -17.516 1.877 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.038 -17.830 2.160 1.00 1.00 H new ATOM 0 HB3 MET A 123 2.989 -18.973 3.086 1.00 1.00 H new ATOM 0 HG2 MET A 123 2.605 -17.785 5.152 1.00 1.00 H new ATOM 0 HG3 MET A 123 2.008 -16.365 4.316 1.00 1.00 H new ATOM 0 HE1 MET A 123 -1.035 -17.308 6.100 1.00 1.00 H new ATOM 0 HE2 MET A 123 0.345 -16.222 5.810 1.00 1.00 H new ATOM 0 HE3 MET A 123 -1.038 -16.222 4.690 1.00 1.00 H new ATOM 742 N MET A 124 3.582 -15.371 1.088 1.00 1.00 N ATOM 743 CA MET A 124 3.226 -14.044 0.617 1.00 1.00 C ATOM 744 C MET A 124 1.710 -13.837 0.653 1.00 1.00 C ATOM 745 O MET A 124 0.947 -14.768 0.397 1.00 1.00 O ATOM 746 CB MET A 124 3.733 -13.857 -0.815 1.00 1.00 C ATOM 747 CG MET A 124 2.814 -14.557 -1.818 1.00 1.00 C ATOM 748 SD MET A 124 3.733 -15.002 -3.281 1.00 1.00 S ATOM 749 CE MET A 124 4.109 -16.706 -2.907 1.00 1.00 C ATOM 0 H MET A 124 3.817 -16.036 0.351 1.00 1.00 H new ATOM 0 HA MET A 124 3.690 -13.309 1.275 1.00 1.00 H new ATOM 0 HB2 MET A 124 3.789 -12.794 -1.049 1.00 1.00 H new ATOM 0 HB3 MET A 124 4.743 -14.257 -0.902 1.00 1.00 H new ATOM 0 HG2 MET A 124 2.381 -15.449 -1.366 1.00 1.00 H new ATOM 0 HG3 MET A 124 1.986 -13.900 -2.085 1.00 1.00 H new ATOM 0 HE1 MET A 124 4.685 -17.139 -3.725 1.00 1.00 H new ATOM 0 HE2 MET A 124 4.691 -16.757 -1.987 1.00 1.00 H new ATOM 0 HE3 MET A 124 3.181 -17.264 -2.781 1.00 1.00 H new ATOM 757 N ASN A 125 1.319 -12.613 0.974 1.00 1.00 N ATOM 758 CA ASN A 125 -0.092 -12.274 1.047 1.00 1.00 C ATOM 759 C ASN A 125 -0.311 -10.888 0.435 1.00 1.00 C ATOM 760 O ASN A 125 0.028 -9.876 1.045 1.00 1.00 O ATOM 761 CB ASN A 125 -0.573 -12.230 2.498 1.00 1.00 C ATOM 762 CG ASN A 125 -0.506 -13.617 3.140 1.00 1.00 C ATOM 763 OD1 ASN A 125 -1.382 -14.450 2.973 1.00 1.00 O ATOM 764 ND2 ASN A 125 0.580 -13.818 3.881 1.00 1.00 N ATOM 0 H ASN A 125 1.954 -11.844 1.186 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.651 -13.037 0.504 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.041 -11.532 3.067 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.597 -11.858 2.534 1.00 1.00 H new ATOM 0 HD21 ASN A 125 0.718 -14.713 4.351 1.00 1.00 H new ATOM 0 HD22 ASN A 125 1.275 -13.078 3.979 1.00 1.00 H new ATOM 770 N GLN A 126 -0.876 -10.889 -0.764 1.00 1.00 N ATOM 771 CA GLN A 126 -1.144 -9.645 -1.465 1.00 1.00 C ATOM 772 C GLN A 126 -2.178 -8.817 -0.700 1.00 1.00 C ATOM 773 O GLN A 126 -3.063 -9.369 -0.050 1.00 1.00 O ATOM 774 CB GLN A 126 -1.607 -9.912 -2.898 1.00 1.00 C ATOM 775 CG GLN A 126 -0.439 -10.362 -3.777 1.00 1.00 C ATOM 776 CD GLN A 126 -0.932 -11.203 -4.957 1.00 1.00 C ATOM 777 OE1 GLN A 126 -0.923 -10.779 -6.101 1.00 1.00 O ATOM 778 NE2 GLN A 126 -1.361 -12.415 -4.615 1.00 1.00 N ATOM 0 H GLN A 126 -1.155 -11.731 -1.267 1.00 1.00 H new ATOM 0 HA GLN A 126 -0.217 -9.074 -1.518 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -2.382 -10.678 -2.897 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -2.053 -9.009 -3.314 1.00 1.00 H new ATOM 0 HG2 GLN A 126 0.099 -9.489 -4.148 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.266 -10.942 -3.182 1.00 1.00 H new ATOM 0 HE21 GLN A 126 -1.341 -12.706 -3.638 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -1.710 -13.053 -5.330 1.00 1.00 H new ATOM 785 N ILE A 127 -2.032 -7.504 -0.804 1.00 1.00 N ATOM 786 CA ILE A 127 -2.942 -6.593 -0.130 1.00 1.00 C ATOM 787 C ILE A 127 -3.728 -5.799 -1.175 1.00 1.00 C ATOM 788 O ILE A 127 -3.148 -5.032 -1.942 1.00 1.00 O ATOM 789 CB ILE A 127 -2.182 -5.716 0.866 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.534 -6.565 1.961 1.00 1.00 C ATOM 791 CG2 ILE A 127 -3.092 -4.631 1.447 1.00 1.00 C ATOM 792 CD1 ILE A 127 -1.203 -5.716 3.190 1.00 1.00 C ATOM 0 H ILE A 127 -1.297 -7.049 -1.345 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.669 -7.149 0.462 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.378 -5.211 0.331 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -2.207 -7.374 2.244 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.624 -7.026 1.578 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.527 -4.021 2.152 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.466 -4.000 0.641 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.932 -5.098 1.962 1.00 1.00 H new ATOM 0 HD11 ILE A 127 -0.743 -6.344 3.953 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -0.511 -4.922 2.908 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -2.118 -5.276 3.585 1.00 1.00 H new ATOM 803 N GLU A 128 -5.036 -6.010 -1.172 1.00 1.00 N ATOM 804 CA GLU A 128 -5.908 -5.323 -2.109 1.00 1.00 C ATOM 805 C GLU A 128 -6.302 -3.949 -1.560 1.00 1.00 C ATOM 806 O GLU A 128 -6.692 -3.830 -0.399 1.00 1.00 O ATOM 807 CB GLU A 128 -7.146 -6.163 -2.423 1.00 1.00 C ATOM 808 CG GLU A 128 -7.257 -6.436 -3.925 1.00 1.00 C ATOM 809 CD GLU A 128 -6.539 -7.735 -4.300 1.00 1.00 C ATOM 810 OE1 GLU A 128 -5.700 -8.224 -3.530 1.00 1.00 O ATOM 811 OE2 GLU A 128 -6.882 -8.237 -5.438 1.00 1.00 O ATOM 0 H GLU A 128 -5.513 -6.648 -0.535 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.363 -5.177 -3.041 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -7.096 -7.107 -1.881 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -8.040 -5.644 -2.077 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -8.307 -6.501 -4.210 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -6.826 -5.604 -4.482 1.00 1.00 H new ATOM 817 N ALA A 129 -6.185 -2.948 -2.420 1.00 1.00 N ATOM 818 CA ALA A 129 -6.525 -1.588 -2.034 1.00 1.00 C ATOM 819 C ALA A 129 -7.931 -1.568 -1.434 1.00 1.00 C ATOM 820 O ALA A 129 -8.858 -2.151 -1.996 1.00 1.00 O ATOM 821 CB ALA A 129 -6.396 -0.667 -3.250 1.00 1.00 C ATOM 0 H ALA A 129 -5.860 -3.051 -3.381 1.00 1.00 H new ATOM 0 HA ALA A 129 -5.838 -1.222 -1.271 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -6.651 0.353 -2.962 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.371 -0.695 -3.620 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.074 -1.003 -4.034 1.00 1.00 H new ATOM 827 N ASP A 130 -8.046 -0.894 -0.300 1.00 1.00 N ATOM 828 CA ASP A 130 -9.324 -0.791 0.383 1.00 1.00 C ATOM 829 C ASP A 130 -9.660 0.685 0.609 1.00 1.00 C ATOM 830 O ASP A 130 -10.431 1.021 1.507 1.00 1.00 O ATOM 831 CB ASP A 130 -9.276 -1.477 1.749 1.00 1.00 C ATOM 832 CG ASP A 130 -9.537 -2.985 1.725 1.00 1.00 C ATOM 833 OD1 ASP A 130 -8.711 -3.784 2.190 1.00 1.00 O ATOM 834 OD2 ASP A 130 -10.659 -3.335 1.192 1.00 1.00 O ATOM 0 H ASP A 130 -7.275 -0.413 0.163 1.00 1.00 H new ATOM 0 HA ASP A 130 -10.077 -1.275 -0.238 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -8.297 -1.300 2.193 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -10.012 -1.006 2.401 1.00 1.00 H new ATOM 839 N LYS A 131 -9.065 1.528 -0.223 1.00 1.00 N ATOM 840 CA LYS A 131 -9.291 2.960 -0.126 1.00 1.00 C ATOM 841 C LYS A 131 -8.694 3.651 -1.354 1.00 1.00 C ATOM 842 O LYS A 131 -7.584 4.179 -1.295 1.00 1.00 O ATOM 843 CB LYS A 131 -8.757 3.498 1.203 1.00 1.00 C ATOM 844 CG LYS A 131 -9.897 3.744 2.193 1.00 1.00 C ATOM 845 CD LYS A 131 -9.477 3.373 3.617 1.00 1.00 C ATOM 846 CE LYS A 131 -10.697 3.203 4.523 1.00 1.00 C ATOM 847 NZ LYS A 131 -11.413 1.949 4.197 1.00 1.00 N ATOM 0 H LYS A 131 -8.427 1.246 -0.967 1.00 1.00 H new ATOM 0 HA LYS A 131 -10.359 3.178 -0.125 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -8.048 2.788 1.628 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -8.213 4.427 1.031 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -10.193 4.793 2.159 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -10.768 3.157 1.903 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -8.901 2.448 3.600 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -8.825 4.148 4.021 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -10.383 3.189 5.567 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -11.368 4.054 4.403 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -12.430 2.144 4.105 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -11.052 1.566 3.300 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -11.260 1.255 4.956 1.00 1.00 H new ATOM 856 N SER A 132 -9.456 3.625 -2.437 1.00 1.00 N ATOM 857 CA SER A 132 -9.016 4.241 -3.677 1.00 1.00 C ATOM 858 C SER A 132 -8.292 5.556 -3.378 1.00 1.00 C ATOM 859 O SER A 132 -8.631 6.253 -2.424 1.00 1.00 O ATOM 860 CB SER A 132 -10.196 4.488 -4.619 1.00 1.00 C ATOM 861 OG SER A 132 -11.042 5.536 -4.153 1.00 1.00 O ATOM 0 H SER A 132 -10.376 3.187 -2.482 1.00 1.00 H new ATOM 0 HA SER A 132 -8.327 3.557 -4.173 1.00 1.00 H new ATOM 0 HB2 SER A 132 -9.821 4.739 -5.611 1.00 1.00 H new ATOM 0 HB3 SER A 132 -10.777 3.571 -4.720 1.00 1.00 H new ATOM 0 HG SER A 132 -11.782 5.664 -4.783 1.00 1.00 H new ATOM 866 N GLY A 133 -7.308 5.855 -4.214 1.00 1.00 N ATOM 867 CA GLY A 133 -6.533 7.073 -4.052 1.00 1.00 C ATOM 868 C GLY A 133 -5.484 7.208 -5.158 1.00 1.00 C ATOM 869 O GLY A 133 -5.475 6.425 -6.107 1.00 1.00 O ATOM 0 H GLY A 133 -7.030 5.275 -5.005 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.198 7.936 -4.070 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -6.042 7.069 -3.079 1.00 1.00 H new ATOM 873 N THR A 134 -4.628 8.206 -4.999 1.00 1.00 N ATOM 874 CA THR A 134 -3.577 8.454 -5.973 1.00 1.00 C ATOM 875 C THR A 134 -2.218 8.550 -5.278 1.00 1.00 C ATOM 876 O THR A 134 -1.550 9.579 -5.355 1.00 1.00 O ATOM 877 CB THR A 134 -3.949 9.711 -6.759 1.00 1.00 C ATOM 878 OG1 THR A 134 -4.544 10.565 -5.788 1.00 1.00 O ATOM 879 CG2 THR A 134 -5.068 9.461 -7.772 1.00 1.00 C ATOM 0 H THR A 134 -4.640 8.853 -4.211 1.00 1.00 H new ATOM 0 HA THR A 134 -3.487 7.628 -6.678 1.00 1.00 H new ATOM 0 HB THR A 134 -3.068 10.086 -7.279 1.00 1.00 H new ATOM 0 HG1 THR A 134 -4.814 11.406 -6.213 1.00 1.00 H new ATOM 0 HG21 THR A 134 -5.292 10.387 -8.302 1.00 1.00 H new ATOM 0 HG22 THR A 134 -4.749 8.702 -8.486 1.00 1.00 H new ATOM 0 HG23 THR A 134 -5.961 9.116 -7.250 1.00 1.00 H new ATOM 887 N VAL A 135 -1.850 7.463 -4.614 1.00 1.00 N ATOM 888 CA VAL A 135 -0.581 7.413 -3.907 1.00 1.00 C ATOM 889 C VAL A 135 -0.436 8.666 -3.040 1.00 1.00 C ATOM 890 O VAL A 135 -1.338 9.501 -2.993 1.00 1.00 O ATOM 891 CB VAL A 135 0.567 7.238 -4.902 1.00 1.00 C ATOM 892 CG1 VAL A 135 0.889 8.557 -5.605 1.00 1.00 C ATOM 893 CG2 VAL A 135 1.807 6.667 -4.212 1.00 1.00 C ATOM 0 H VAL A 135 -2.408 6.611 -4.551 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.549 6.551 -3.241 1.00 1.00 H new ATOM 0 HB VAL A 135 0.247 6.524 -5.661 1.00 1.00 H new ATOM 0 HG11 VAL A 135 1.709 8.404 -6.307 1.00 1.00 H new ATOM 0 HG12 VAL A 135 0.009 8.906 -6.145 1.00 1.00 H new ATOM 0 HG13 VAL A 135 1.179 9.302 -4.865 1.00 1.00 H new ATOM 0 HG21 VAL A 135 2.609 6.552 -4.941 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.129 7.346 -3.422 1.00 1.00 H new ATOM 0 HG23 VAL A 135 1.568 5.695 -3.780 1.00 1.00 H new ATOM 903 N LYS A 136 0.706 8.757 -2.376 1.00 1.00 N ATOM 904 CA LYS A 136 0.981 9.894 -1.514 1.00 1.00 C ATOM 905 C LYS A 136 2.441 9.843 -1.060 1.00 1.00 C ATOM 906 O LYS A 136 3.120 10.869 -1.022 1.00 1.00 O ATOM 907 CB LYS A 136 -0.019 9.944 -0.357 1.00 1.00 C ATOM 908 CG LYS A 136 -0.111 11.355 0.229 1.00 1.00 C ATOM 909 CD LYS A 136 -0.453 12.377 -0.857 1.00 1.00 C ATOM 910 CE LYS A 136 -1.319 13.506 -0.293 1.00 1.00 C ATOM 911 NZ LYS A 136 -0.492 14.697 0.001 1.00 1.00 N ATOM 0 H LYS A 136 1.452 8.062 -2.417 1.00 1.00 H new ATOM 0 HA LYS A 136 0.848 10.827 -2.062 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -1.001 9.627 -0.707 1.00 1.00 H new ATOM 0 HB3 LYS A 136 0.284 9.243 0.420 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -0.871 11.380 1.010 1.00 1.00 H new ATOM 0 HG3 LYS A 136 0.836 11.621 0.698 1.00 1.00 H new ATOM 0 HD2 LYS A 136 0.465 12.791 -1.274 1.00 1.00 H new ATOM 0 HD3 LYS A 136 -0.979 11.883 -1.674 1.00 1.00 H new ATOM 0 HE2 LYS A 136 -2.099 13.766 -1.008 1.00 1.00 H new ATOM 0 HE3 LYS A 136 -1.819 13.170 0.616 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -1.096 15.453 0.383 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 0.237 14.449 0.700 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 -0.035 15.027 -0.873 1.00 1.00 H new ATOM 920 N ALA A 137 2.883 8.639 -0.728 1.00 1.00 N ATOM 921 CA ALA A 137 4.252 8.441 -0.279 1.00 1.00 C ATOM 922 C ALA A 137 4.386 7.044 0.330 1.00 1.00 C ATOM 923 O ALA A 137 3.531 6.615 1.103 1.00 1.00 O ATOM 924 CB ALA A 137 4.630 9.547 0.708 1.00 1.00 C ATOM 0 H ALA A 137 2.318 7.790 -0.761 1.00 1.00 H new ATOM 0 HA ALA A 137 4.945 8.503 -1.118 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.656 9.399 1.045 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.545 10.517 0.218 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.958 9.514 1.566 1.00 1.00 H new ATOM 930 N ILE A 138 5.467 6.373 -0.042 1.00 1.00 N ATOM 931 CA ILE A 138 5.725 5.034 0.458 1.00 1.00 C ATOM 932 C ILE A 138 6.804 5.097 1.541 1.00 1.00 C ATOM 933 O ILE A 138 7.930 5.518 1.277 1.00 1.00 O ATOM 934 CB ILE A 138 6.066 4.088 -0.695 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.277 4.452 -1.954 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.856 2.628 -0.288 1.00 1.00 C ATOM 937 CD1 ILE A 138 6.037 5.475 -2.802 1.00 1.00 C ATOM 0 H ILE A 138 6.174 6.732 -0.684 1.00 1.00 H new ATOM 0 HA ILE A 138 4.829 4.623 0.924 1.00 1.00 H new ATOM 0 HB ILE A 138 7.123 4.206 -0.932 1.00 1.00 H new ATOM 0 HG12 ILE A 138 5.090 3.554 -2.543 1.00 1.00 H new ATOM 0 HG13 ILE A 138 4.305 4.857 -1.674 1.00 1.00 H new ATOM 0 HG21 ILE A 138 6.106 1.977 -1.126 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.499 2.391 0.560 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.814 2.475 -0.008 1.00 1.00 H new ATOM 0 HD11 ILE A 138 5.454 5.716 -3.691 1.00 1.00 H new ATOM 0 HD12 ILE A 138 6.201 6.381 -2.219 1.00 1.00 H new ATOM 0 HD13 ILE A 138 6.998 5.057 -3.101 1.00 1.00 H new ATOM 948 N LEU A 139 6.422 4.674 2.737 1.00 1.00 N ATOM 949 CA LEU A 139 7.343 4.678 3.861 1.00 1.00 C ATOM 950 C LEU A 139 8.135 3.369 3.871 1.00 1.00 C ATOM 951 O LEU A 139 9.354 3.377 4.034 1.00 1.00 O ATOM 952 CB LEU A 139 6.594 4.954 5.166 1.00 1.00 C ATOM 953 CG LEU A 139 5.149 5.436 5.021 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.550 5.790 6.385 1.00 1.00 C ATOM 955 CD2 LEU A 139 5.056 6.602 4.035 1.00 1.00 C ATOM 0 H LEU A 139 5.488 4.326 2.952 1.00 1.00 H new ATOM 0 HA LEU A 139 8.066 5.487 3.758 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.594 4.041 5.762 1.00 1.00 H new ATOM 0 HB3 LEU A 139 7.151 5.702 5.730 1.00 1.00 H new ATOM 0 HG LEU A 139 4.556 4.619 4.610 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.523 6.130 6.254 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.562 4.909 7.027 1.00 1.00 H new ATOM 0 HD13 LEU A 139 5.138 6.583 6.846 1.00 1.00 H new ATOM 0 HD21 LEU A 139 4.018 6.925 3.951 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.666 7.431 4.393 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.417 6.282 3.058 1.00 1.00 H new ATOM 966 N VAL A 140 7.408 2.274 3.694 1.00 1.00 N ATOM 967 CA VAL A 140 8.027 0.960 3.681 1.00 1.00 C ATOM 968 C VAL A 140 8.611 0.691 2.293 1.00 1.00 C ATOM 969 O VAL A 140 7.988 1.006 1.281 1.00 1.00 O ATOM 970 CB VAL A 140 7.014 -0.100 4.120 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.868 -0.213 3.111 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.694 -1.454 4.330 1.00 1.00 C ATOM 0 H VAL A 140 6.397 2.271 3.559 1.00 1.00 H new ATOM 0 HA VAL A 140 8.850 0.918 4.394 1.00 1.00 H new ATOM 0 HB VAL A 140 6.592 0.214 5.074 1.00 1.00 H new ATOM 0 HG11 VAL A 140 5.162 -0.973 3.446 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.358 0.747 3.031 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.268 -0.494 2.136 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.952 -2.189 4.642 1.00 1.00 H new ATOM 0 HG22 VAL A 140 8.156 -1.778 3.397 1.00 1.00 H new ATOM 0 HG23 VAL A 140 8.459 -1.361 5.101 1.00 1.00 H new ATOM 982 N GLU A 141 9.803 0.109 2.290 1.00 1.00 N ATOM 983 CA GLU A 141 10.478 -0.207 1.043 1.00 1.00 C ATOM 984 C GLU A 141 10.304 -1.689 0.705 1.00 1.00 C ATOM 985 O GLU A 141 10.410 -2.545 1.581 1.00 1.00 O ATOM 986 CB GLU A 141 11.959 0.170 1.111 1.00 1.00 C ATOM 987 CG GLU A 141 12.676 -0.620 2.208 1.00 1.00 C ATOM 988 CD GLU A 141 14.191 -0.605 1.994 1.00 1.00 C ATOM 989 OE1 GLU A 141 14.774 -1.633 1.619 1.00 1.00 O ATOM 990 OE2 GLU A 141 14.764 0.526 2.231 1.00 1.00 O ATOM 0 H GLU A 141 10.317 -0.151 3.131 1.00 1.00 H new ATOM 0 HA GLU A 141 10.023 0.382 0.247 1.00 1.00 H new ATOM 0 HB2 GLU A 141 12.432 -0.025 0.149 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.058 1.238 1.304 1.00 1.00 H new ATOM 0 HG2 GLU A 141 12.439 -0.193 3.183 1.00 1.00 H new ATOM 0 HG3 GLU A 141 12.316 -1.649 2.214 1.00 1.00 H new ATOM 996 N SER A 142 10.040 -1.946 -0.567 1.00 1.00 N ATOM 997 CA SER A 142 9.851 -3.310 -1.032 1.00 1.00 C ATOM 998 C SER A 142 10.903 -4.227 -0.404 1.00 1.00 C ATOM 999 O SER A 142 12.046 -4.266 -0.855 1.00 1.00 O ATOM 1000 CB SER A 142 9.922 -3.387 -2.558 1.00 1.00 C ATOM 1001 OG SER A 142 11.267 -3.395 -3.029 1.00 1.00 O ATOM 0 H SER A 142 9.952 -1.233 -1.291 1.00 1.00 H new ATOM 0 HA SER A 142 8.859 -3.642 -0.725 1.00 1.00 H new ATOM 0 HB2 SER A 142 9.413 -4.288 -2.900 1.00 1.00 H new ATOM 0 HB3 SER A 142 9.392 -2.538 -2.989 1.00 1.00 H new ATOM 0 HG SER A 142 11.881 -3.342 -2.267 1.00 1.00 H new ATOM 1006 N GLY A 143 10.477 -4.942 0.627 1.00 1.00 N ATOM 1007 CA GLY A 143 11.368 -5.857 1.322 1.00 1.00 C ATOM 1008 C GLY A 143 11.387 -5.569 2.825 1.00 1.00 C ATOM 1009 O GLY A 143 11.477 -6.489 3.636 1.00 1.00 O ATOM 0 H GLY A 143 9.528 -4.907 0.998 1.00 1.00 H new ATOM 0 HA2 GLY A 143 11.047 -6.884 1.149 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.376 -5.766 0.918 1.00 1.00 H new ATOM 1013 N GLN A 144 11.300 -4.287 3.151 1.00 1.00 N ATOM 1014 CA GLN A 144 11.306 -3.867 4.542 1.00 1.00 C ATOM 1015 C GLN A 144 10.170 -4.549 5.307 1.00 1.00 C ATOM 1016 O GLN A 144 9.070 -4.707 4.781 1.00 1.00 O ATOM 1017 CB GLN A 144 11.206 -2.344 4.654 1.00 1.00 C ATOM 1018 CG GLN A 144 11.119 -1.908 6.118 1.00 1.00 C ATOM 1019 CD GLN A 144 10.526 -0.501 6.236 1.00 1.00 C ATOM 1020 OE1 GLN A 144 10.982 0.446 5.618 1.00 1.00 O ATOM 1021 NE2 GLN A 144 9.488 -0.420 7.063 1.00 1.00 N ATOM 0 H GLN A 144 11.225 -3.526 2.476 1.00 1.00 H new ATOM 0 HA GLN A 144 12.252 -4.170 4.990 1.00 1.00 H new ATOM 0 HB2 GLN A 144 12.075 -1.883 4.184 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.327 -1.993 4.113 1.00 1.00 H new ATOM 0 HG2 GLN A 144 10.504 -2.614 6.676 1.00 1.00 H new ATOM 0 HG3 GLN A 144 12.112 -1.927 6.567 1.00 1.00 H new ATOM 0 HE21 GLN A 144 9.157 -1.253 7.549 1.00 1.00 H new ATOM 0 HE22 GLN A 144 9.023 0.475 7.211 1.00 1.00 H new ATOM 1028 N PRO A 145 10.485 -4.946 6.568 1.00 1.00 N ATOM 1029 CA PRO A 145 9.504 -5.608 7.412 1.00 1.00 C ATOM 1030 C PRO A 145 8.477 -4.608 7.946 1.00 1.00 C ATOM 1031 O PRO A 145 8.703 -3.399 7.907 1.00 1.00 O ATOM 1032 CB PRO A 145 10.315 -6.271 8.513 1.00 1.00 C ATOM 1033 CG PRO A 145 11.666 -5.574 8.513 1.00 1.00 C ATOM 1034 CD PRO A 145 11.779 -4.776 7.224 1.00 1.00 C ATOM 0 HA PRO A 145 8.914 -6.347 6.870 1.00 1.00 H new ATOM 0 HB2 PRO A 145 9.821 -6.166 9.479 1.00 1.00 H new ATOM 0 HB3 PRO A 145 10.427 -7.339 8.327 1.00 1.00 H new ATOM 0 HG2 PRO A 145 11.756 -4.917 9.378 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.472 -6.304 8.582 1.00 1.00 H new ATOM 0 HD2 PRO A 145 11.986 -3.725 7.426 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.592 -5.146 6.599 1.00 1.00 H new ATOM 1039 N VAL A 146 7.369 -5.149 8.432 1.00 1.00 N ATOM 1040 CA VAL A 146 6.306 -4.319 8.972 1.00 1.00 C ATOM 1041 C VAL A 146 5.698 -5.010 10.195 1.00 1.00 C ATOM 1042 O VAL A 146 5.812 -6.225 10.347 1.00 1.00 O ATOM 1043 CB VAL A 146 5.275 -4.014 7.884 1.00 1.00 C ATOM 1044 CG1 VAL A 146 5.961 -3.610 6.578 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.339 -5.205 7.667 1.00 1.00 C ATOM 0 H VAL A 146 7.185 -6.152 8.463 1.00 1.00 H new ATOM 0 HA VAL A 146 6.702 -3.359 9.303 1.00 1.00 H new ATOM 0 HB VAL A 146 4.671 -3.171 8.220 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.206 -3.398 5.821 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.567 -2.719 6.745 1.00 1.00 H new ATOM 0 HG13 VAL A 146 6.600 -4.424 6.236 1.00 1.00 H new ATOM 0 HG21 VAL A 146 3.616 -4.962 6.889 1.00 1.00 H new ATOM 0 HG22 VAL A 146 4.921 -6.075 7.363 1.00 1.00 H new ATOM 0 HG23 VAL A 146 3.812 -5.428 8.595 1.00 1.00 H new ATOM 1055 N GLU A 147 5.065 -4.204 11.036 1.00 1.00 N ATOM 1056 CA GLU A 147 4.439 -4.723 12.241 1.00 1.00 C ATOM 1057 C GLU A 147 2.976 -4.280 12.312 1.00 1.00 C ATOM 1058 O GLU A 147 2.546 -3.422 11.542 1.00 1.00 O ATOM 1059 CB GLU A 147 5.206 -4.284 13.490 1.00 1.00 C ATOM 1060 CG GLU A 147 6.293 -5.299 13.850 1.00 1.00 C ATOM 1061 CD GLU A 147 7.324 -5.420 12.727 1.00 1.00 C ATOM 1062 OE1 GLU A 147 7.588 -4.437 12.019 1.00 1.00 O ATOM 1063 OE2 GLU A 147 7.861 -6.586 12.603 1.00 1.00 O ATOM 0 H GLU A 147 4.972 -3.196 10.907 1.00 1.00 H new ATOM 0 HA GLU A 147 4.467 -5.812 12.202 1.00 1.00 H new ATOM 0 HB2 GLU A 147 5.658 -3.307 13.319 1.00 1.00 H new ATOM 0 HB3 GLU A 147 4.515 -4.174 14.326 1.00 1.00 H new ATOM 0 HG2 GLU A 147 6.788 -4.995 14.772 1.00 1.00 H new ATOM 0 HG3 GLU A 147 5.839 -6.272 14.038 1.00 1.00 H new ATOM 1069 N PHE A 148 2.253 -4.882 13.243 1.00 1.00 N ATOM 1070 CA PHE A 148 0.848 -4.560 13.425 1.00 1.00 C ATOM 1071 C PHE A 148 0.674 -3.119 13.907 1.00 1.00 C ATOM 1072 O PHE A 148 1.327 -2.696 14.859 1.00 1.00 O ATOM 1073 CB PHE A 148 0.305 -5.512 14.493 1.00 1.00 C ATOM 1074 CG PHE A 148 -1.173 -5.296 14.826 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.541 -4.287 15.659 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -2.117 -6.113 14.289 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.912 -4.086 15.969 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -3.489 -5.913 14.599 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.857 -4.903 15.432 1.00 1.00 C ATOM 0 H PHE A 148 2.614 -5.592 13.880 1.00 1.00 H new ATOM 0 HA PHE A 148 0.317 -4.665 12.479 1.00 1.00 H new ATOM 0 HB2 PHE A 148 0.444 -6.539 14.155 1.00 1.00 H new ATOM 0 HB3 PHE A 148 0.893 -5.394 15.403 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -0.790 -3.638 16.085 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -1.824 -6.914 13.627 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -3.204 -3.284 16.631 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -4.239 -6.563 14.173 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.900 -4.750 15.667 1.00 1.00 H new ATOM 1088 N ASP A 149 -0.212 -2.404 13.227 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.480 -1.019 13.574 1.00 1.00 C ATOM 1090 C ASP A 149 0.587 -0.123 12.943 1.00 1.00 C ATOM 1091 O ASP A 149 0.513 1.100 13.040 1.00 1.00 O ATOM 1092 CB ASP A 149 -0.434 -0.812 15.090 1.00 1.00 C ATOM 1093 CG ASP A 149 -1.220 0.397 15.601 1.00 1.00 C ATOM 1094 OD1 ASP A 149 -2.459 0.418 15.556 1.00 1.00 O ATOM 1095 OD2 ASP A 149 -0.499 1.359 16.067 1.00 1.00 O ATOM 0 H ASP A 149 -0.753 -2.758 12.438 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.474 -0.766 13.205 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -0.819 -1.709 15.576 1.00 1.00 H new ATOM 0 HB3 ASP A 149 0.607 -0.706 15.396 1.00 1.00 H new ATOM 1100 N GLU A 150 1.556 -0.768 12.308 1.00 1.00 N ATOM 1101 CA GLU A 150 2.637 -0.046 11.660 1.00 1.00 C ATOM 1102 C GLU A 150 2.183 0.478 10.297 1.00 1.00 C ATOM 1103 O GLU A 150 1.382 -0.161 9.616 1.00 1.00 O ATOM 1104 CB GLU A 150 3.880 -0.926 11.522 1.00 1.00 C ATOM 1105 CG GLU A 150 5.153 -0.129 11.817 1.00 1.00 C ATOM 1106 CD GLU A 150 6.151 -0.966 12.620 1.00 1.00 C ATOM 1107 OE1 GLU A 150 6.068 -1.013 13.856 1.00 1.00 O ATOM 1108 OE2 GLU A 150 7.036 -1.584 11.913 1.00 1.00 O ATOM 0 H GLU A 150 1.614 -1.783 12.229 1.00 1.00 H new ATOM 0 HA GLU A 150 2.904 0.806 12.285 1.00 1.00 H new ATOM 0 HB2 GLU A 150 3.809 -1.771 12.207 1.00 1.00 H new ATOM 0 HB3 GLU A 150 3.929 -1.336 10.513 1.00 1.00 H new ATOM 0 HG2 GLU A 150 5.611 0.191 10.881 1.00 1.00 H new ATOM 0 HG3 GLU A 150 4.900 0.774 12.373 1.00 1.00 H new ATOM 1114 N PRO A 151 2.727 1.669 9.928 1.00 1.00 N ATOM 1115 CA PRO A 151 2.387 2.287 8.657 1.00 1.00 C ATOM 1116 C PRO A 151 3.079 1.570 7.497 1.00 1.00 C ATOM 1117 O PRO A 151 4.155 0.998 7.667 1.00 1.00 O ATOM 1118 CB PRO A 151 2.814 3.738 8.799 1.00 1.00 C ATOM 1119 CG PRO A 151 3.794 3.773 9.959 1.00 1.00 C ATOM 1120 CD PRO A 151 3.679 2.456 10.707 1.00 1.00 C ATOM 0 HA PRO A 151 1.324 2.220 8.427 1.00 1.00 H new ATOM 0 HB2 PRO A 151 3.281 4.099 7.883 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.955 4.380 8.994 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.811 3.917 9.595 1.00 1.00 H new ATOM 0 HG3 PRO A 151 3.571 4.609 10.622 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.644 1.954 10.776 1.00 1.00 H new ATOM 0 HD3 PRO A 151 3.325 2.609 11.727 1.00 1.00 H new ATOM 1125 N LEU A 152 2.435 1.625 6.340 1.00 1.00 N ATOM 1126 CA LEU A 152 2.975 0.988 5.151 1.00 1.00 C ATOM 1127 C LEU A 152 3.222 2.051 4.077 1.00 1.00 C ATOM 1128 O LEU A 152 4.348 2.516 3.907 1.00 1.00 O ATOM 1129 CB LEU A 152 2.062 -0.150 4.690 1.00 1.00 C ATOM 1130 CG LEU A 152 1.978 -1.360 5.624 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.417 -2.580 4.891 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.334 -1.652 6.268 1.00 1.00 C ATOM 0 H LEU A 152 1.544 2.101 6.201 1.00 1.00 H new ATOM 0 HA LEU A 152 3.937 0.525 5.371 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.057 0.249 4.553 1.00 1.00 H new ATOM 0 HB3 LEU A 152 2.405 -0.492 3.714 1.00 1.00 H new ATOM 0 HG LEU A 152 1.284 -1.121 6.430 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.368 -3.426 5.577 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.417 -2.354 4.521 1.00 1.00 H new ATOM 0 HD13 LEU A 152 2.066 -2.831 4.052 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.246 -2.516 6.926 1.00 1.00 H new ATOM 0 HD22 LEU A 152 4.068 -1.862 5.490 1.00 1.00 H new ATOM 0 HD23 LEU A 152 3.656 -0.786 6.847 1.00 1.00 H new ATOM 1143 N VAL A 153 2.151 2.401 3.380 1.00 1.00 N ATOM 1144 CA VAL A 153 2.238 3.399 2.328 1.00 1.00 C ATOM 1145 C VAL A 153 1.090 4.399 2.483 1.00 1.00 C ATOM 1146 O VAL A 153 0.018 4.048 2.975 1.00 1.00 O ATOM 1147 CB VAL A 153 2.254 2.716 0.959 1.00 1.00 C ATOM 1148 CG1 VAL A 153 2.688 3.693 -0.137 1.00 1.00 C ATOM 1149 CG2 VAL A 153 3.152 1.477 0.975 1.00 1.00 C ATOM 0 H VAL A 153 1.219 2.012 3.523 1.00 1.00 H new ATOM 0 HA VAL A 153 3.170 3.958 2.409 1.00 1.00 H new ATOM 0 HB VAL A 153 1.238 2.391 0.735 1.00 1.00 H new ATOM 0 HG11 VAL A 153 2.691 3.182 -1.100 1.00 1.00 H new ATOM 0 HG12 VAL A 153 1.992 4.531 -0.173 1.00 1.00 H new ATOM 0 HG13 VAL A 153 3.690 4.062 0.081 1.00 1.00 H new ATOM 0 HG21 VAL A 153 3.146 1.010 -0.010 1.00 1.00 H new ATOM 0 HG22 VAL A 153 4.170 1.769 1.232 1.00 1.00 H new ATOM 0 HG23 VAL A 153 2.781 0.768 1.715 1.00 1.00 H new ATOM 1159 N VAL A 154 1.354 5.625 2.055 1.00 1.00 N ATOM 1160 CA VAL A 154 0.357 6.679 2.141 1.00 1.00 C ATOM 1161 C VAL A 154 -0.230 6.933 0.751 1.00 1.00 C ATOM 1162 O VAL A 154 0.508 7.150 -0.209 1.00 1.00 O ATOM 1163 CB VAL A 154 0.971 7.931 2.769 1.00 1.00 C ATOM 1164 CG1 VAL A 154 -0.048 9.070 2.830 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.536 7.626 4.157 1.00 1.00 C ATOM 0 H VAL A 154 2.244 5.912 1.648 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.464 6.376 2.791 1.00 1.00 H new ATOM 0 HB VAL A 154 1.796 8.254 2.134 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.414 9.948 3.281 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.382 9.313 1.822 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -0.903 8.761 3.431 1.00 1.00 H new ATOM 0 HG21 VAL A 154 1.967 8.533 4.582 1.00 1.00 H new ATOM 0 HG22 VAL A 154 0.736 7.266 4.804 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.308 6.861 4.075 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.554 6.898 0.686 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.248 7.123 -0.570 1.00 1.00 C ATOM 1177 C ILE A 155 -3.164 8.340 -0.430 1.00 1.00 C ATOM 1178 O ILE A 155 -3.671 8.620 0.655 1.00 1.00 O ATOM 1179 CB ILE A 155 -2.975 5.853 -1.014 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -1.992 4.832 -1.591 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.103 6.181 -1.995 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -2.435 3.403 -1.271 1.00 1.00 C ATOM 0 H ILE A 155 -2.164 6.717 1.484 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.537 7.349 -1.364 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.434 5.398 -0.137 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -1.920 4.961 -2.671 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -0.997 5.008 -1.182 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -4.604 5.260 -2.295 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -4.822 6.845 -1.514 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -3.688 6.672 -2.875 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.719 2.697 -1.692 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -2.482 3.270 -0.190 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -3.420 3.222 -1.702 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.351 9.032 -1.545 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.198 10.212 -1.561 1.00 1.00 C ATOM 1195 C GLU A 156 -4.273 10.791 -2.975 1.00 1.00 C ATOM 1196 O GLU A 156 -3.303 11.361 -3.470 1.00 1.00 O ATOM 1197 CB GLU A 156 -3.696 11.260 -0.565 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.809 12.243 -0.196 1.00 1.00 C ATOM 1199 CD GLU A 156 -4.490 12.967 1.114 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -4.654 14.192 1.199 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -4.059 12.209 2.064 1.00 1.00 O ATOM 0 H GLU A 156 -2.930 8.797 -2.444 1.00 1.00 H new ATOM 0 HA GLU A 156 -5.203 9.920 -1.255 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -3.329 10.766 0.335 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -2.855 11.803 -0.996 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -4.936 12.972 -0.997 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -5.754 11.708 -0.099 1.00 1.00 H new