USER MOD reduce.3.24.130724 H: found=0, std=0, add=865, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 867 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 105 GLN : amide:sc= -9.35! C(o=-22!,f=-23!) USER MOD Set 1.2: A 108 CYS SG : rot -121:sc= 0.00965 USER MOD Set 1.3: A 121 MET CE :methyl 156:sc= -12.5! (180deg=-12.1!) USER MOD Set 2.1: A 44 MET CE :methyl -161:sc= -0.14 (180deg=-0.669) USER MOD Set 2.2: A 46 SER OG : rot 180:sc= -0.158 USER MOD Set 3.1: A 23 ASN : amide:sc= -0.219 X(o=-0.41,f=0.081) USER MOD Set 3.2: A 24 SER OG : rot 180:sc= 0.0166 USER MOD Set 3.3: A 26 THR OG1 : rot -80:sc= -0.211 USER MOD Single : A 13 LYS NZ :NH3+ -162:sc= -0.0417 (180deg=-0.395) USER MOD Single : A 17 LYS NZ :NH3+ 166:sc= -0.0266 (180deg=-0.219) USER MOD Single : A 18 MET CE :methyl 150:sc= -0.154 (180deg=-0.798) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -178:sc= -1 (180deg=-1.17) USER MOD Single : A 37 LYS NZ :NH3+ -134:sc= -3.09! (180deg=-6.14!) USER MOD Single : A 41 SER OG : rot 180:sc= -0.0781 USER MOD Single : A 49 LYS NZ :NH3+ -141:sc= -1.06 (180deg=-2.98!) USER MOD Single : A 52 MET CE :methyl -152:sc= -3.8! (180deg=-5.45!) USER MOD Single : A 59 LYS NZ :NH3+ -153:sc= -1.88 (180deg=-3.98!) USER MOD Single : A 60 SER OG : rot -77:sc= 0.0158 USER MOD Single : A 62 THR OG1 : rot 155:sc= -2.16! USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 78:sc= 1.16 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot -98:sc= 0.48 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 GLN :FLIP amide:sc= -1.1 F(o=-1.6!,f=-1.1) USER MOD Single : A 109 LYS NZ :NH3+ 166:sc= -0.0327 (180deg=-0.264) USER MOD Single : A 117 HIS : no HD1:sc= -1.85 K(o=-1.8,f=-5.4!) USER MOD Single : A 123 LYS NZ :NH3+ -139:sc= -0.581 (180deg=-2.38) USER MOD Single : A 127 GLN :FLIP amide:sc= -12.1! C(o=-14!,f=-12!) USER MOD Single : A 129 ASN :FLIP amide:sc= -4.34! C(o=-8.3!,f=-4.3!) USER MOD Single : A 132 GLN : amide:sc= -2.32! X(o=-2.3!,f=-2.4) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 MET CE :methyl -172:sc= -0.64 (180deg=-0.796) USER MOD Single : A 142 MET CE :methyl -110:sc= -1.57 (180deg=-5.66!) USER MOD ----------------------------------------------------------------- ATOM 160 N LEU A 12 2.263 -12.422 5.465 1.00 0.00 N ATOM 161 CA LEU A 12 1.655 -11.102 5.599 1.00 0.00 C ATOM 162 C LEU A 12 2.580 -10.027 5.046 1.00 0.00 C ATOM 163 O LEU A 12 2.120 -9.025 4.500 1.00 0.00 O ATOM 164 CB LEU A 12 1.326 -10.815 7.066 1.00 0.00 C ATOM 165 CG LEU A 12 0.608 -9.490 7.329 1.00 0.00 C ATOM 166 CD1 LEU A 12 -0.763 -9.485 6.674 1.00 0.00 C ATOM 167 CD2 LEU A 12 0.484 -9.239 8.823 1.00 0.00 C ATOM 0 HA LEU A 12 0.729 -11.090 5.023 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.707 -11.627 7.448 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.254 -10.826 7.638 1.00 0.00 H new ATOM 0 HG LEU A 12 1.201 -8.687 6.892 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.258 -8.534 6.873 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -0.653 -9.619 5.598 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.364 -10.298 7.081 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.029 -8.292 8.992 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.086 -10.047 9.282 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.478 -9.197 9.269 1.00 0.00 H new ATOM 179 N LYS A 13 3.887 -10.247 5.164 1.00 0.00 N ATOM 180 CA LYS A 13 4.851 -9.293 4.640 1.00 0.00 C ATOM 181 C LYS A 13 4.643 -9.170 3.139 1.00 0.00 C ATOM 182 O LYS A 13 4.619 -8.068 2.581 1.00 0.00 O ATOM 183 CB LYS A 13 6.283 -9.733 4.949 1.00 0.00 C ATOM 184 CG LYS A 13 7.333 -8.769 4.425 1.00 0.00 C ATOM 185 CD LYS A 13 8.735 -9.189 4.840 1.00 0.00 C ATOM 186 CE LYS A 13 9.790 -8.294 4.214 1.00 0.00 C ATOM 187 NZ LYS A 13 9.764 -8.363 2.726 1.00 0.00 N ATOM 0 H LYS A 13 4.296 -11.067 5.612 1.00 0.00 H new ATOM 0 HA LYS A 13 4.698 -8.325 5.117 1.00 0.00 H new ATOM 0 HB2 LYS A 13 6.400 -9.835 6.028 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.455 -10.718 4.515 1.00 0.00 H new ATOM 0 HG2 LYS A 13 7.274 -8.721 3.338 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.127 -7.766 4.800 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.821 -9.151 5.926 1.00 0.00 H new ATOM 0 HD3 LYS A 13 8.910 -10.223 4.542 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.628 -7.264 4.533 1.00 0.00 H new ATOM 0 HE3 LYS A 13 10.776 -8.588 4.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 10.661 -7.999 2.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.637 -9.351 2.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 8.976 -7.788 2.366 1.00 0.00 H new ATOM 201 N GLU A 14 4.446 -10.318 2.500 1.00 0.00 N ATOM 202 CA GLU A 14 4.190 -10.356 1.072 1.00 0.00 C ATOM 203 C GLU A 14 2.851 -9.690 0.798 1.00 0.00 C ATOM 204 O GLU A 14 2.625 -9.143 -0.278 1.00 0.00 O ATOM 205 CB GLU A 14 4.182 -11.799 0.561 1.00 0.00 C ATOM 206 CG GLU A 14 3.970 -11.912 -0.941 1.00 0.00 C ATOM 207 CD GLU A 14 3.973 -13.348 -1.428 1.00 0.00 C ATOM 208 OE1 GLU A 14 4.141 -14.261 -0.593 1.00 0.00 O ATOM 209 OE2 GLU A 14 3.809 -13.562 -2.649 1.00 0.00 O ATOM 0 H GLU A 14 4.459 -11.232 2.952 1.00 0.00 H new ATOM 0 HA GLU A 14 4.982 -9.822 0.547 1.00 0.00 H new ATOM 0 HB2 GLU A 14 5.128 -12.274 0.823 1.00 0.00 H new ATOM 0 HB3 GLU A 14 3.395 -12.353 1.073 1.00 0.00 H new ATOM 0 HG2 GLU A 14 3.021 -11.445 -1.206 1.00 0.00 H new ATOM 0 HG3 GLU A 14 4.753 -11.356 -1.457 1.00 0.00 H new ATOM 216 N LEU A 15 1.972 -9.729 1.801 1.00 0.00 N ATOM 217 CA LEU A 15 0.659 -9.115 1.690 1.00 0.00 C ATOM 218 C LEU A 15 0.789 -7.598 1.738 1.00 0.00 C ATOM 219 O LEU A 15 0.013 -6.879 1.109 1.00 0.00 O ATOM 220 CB LEU A 15 -0.264 -9.608 2.805 1.00 0.00 C ATOM 221 CG LEU A 15 -1.711 -9.112 2.721 1.00 0.00 C ATOM 222 CD1 LEU A 15 -2.317 -9.449 1.368 1.00 0.00 C ATOM 223 CD2 LEU A 15 -2.546 -9.715 3.839 1.00 0.00 C ATOM 0 H LEU A 15 2.151 -10.181 2.698 1.00 0.00 H new ATOM 0 HA LEU A 15 0.220 -9.402 0.735 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -0.269 -10.698 2.795 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.154 -9.300 3.763 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.707 -8.028 2.836 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.345 -9.088 1.330 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.735 -8.972 0.580 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -2.306 -10.529 1.223 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.571 -9.352 3.764 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.539 -10.802 3.753 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.128 -9.425 4.803 1.00 0.00 H new ATOM 235 N PHE A 16 1.795 -7.117 2.466 1.00 0.00 N ATOM 236 CA PHE A 16 2.039 -5.684 2.562 1.00 0.00 C ATOM 237 C PHE A 16 2.453 -5.142 1.208 1.00 0.00 C ATOM 238 O PHE A 16 1.929 -4.134 0.736 1.00 0.00 O ATOM 239 CB PHE A 16 3.144 -5.371 3.569 1.00 0.00 C ATOM 240 CG PHE A 16 3.714 -3.991 3.380 1.00 0.00 C ATOM 241 CD1 PHE A 16 2.895 -2.873 3.447 1.00 0.00 C ATOM 242 CD2 PHE A 16 5.059 -3.814 3.105 1.00 0.00 C ATOM 243 CE1 PHE A 16 3.410 -1.609 3.249 1.00 0.00 C ATOM 244 CE2 PHE A 16 5.577 -2.549 2.900 1.00 0.00 C ATOM 245 CZ PHE A 16 4.751 -1.447 2.974 1.00 0.00 C ATOM 0 H PHE A 16 2.449 -7.696 2.994 1.00 0.00 H new ATOM 0 HA PHE A 16 1.114 -5.214 2.896 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.748 -5.463 4.580 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.941 -6.108 3.471 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.842 -2.994 3.657 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.711 -4.673 3.050 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.763 -0.746 3.309 1.00 0.00 H new ATOM 0 HE2 PHE A 16 6.627 -2.424 2.682 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.155 -0.458 2.817 1.00 0.00 H new ATOM 255 N LYS A 17 3.398 -5.832 0.592 1.00 0.00 N ATOM 256 CA LYS A 17 3.890 -5.438 -0.713 1.00 0.00 C ATOM 257 C LYS A 17 2.865 -5.834 -1.749 1.00 0.00 C ATOM 258 O LYS A 17 2.853 -5.327 -2.871 1.00 0.00 O ATOM 259 CB LYS A 17 5.260 -6.065 -0.988 1.00 0.00 C ATOM 260 CG LYS A 17 5.287 -7.583 -0.913 1.00 0.00 C ATOM 261 CD LYS A 17 4.732 -8.236 -2.173 1.00 0.00 C ATOM 262 CE LYS A 17 5.577 -7.909 -3.394 1.00 0.00 C ATOM 263 NZ LYS A 17 6.969 -8.415 -3.257 1.00 0.00 N ATOM 0 H LYS A 17 3.839 -6.668 0.976 1.00 0.00 H new ATOM 0 HA LYS A 17 4.032 -4.358 -0.753 1.00 0.00 H new ATOM 0 HB2 LYS A 17 5.594 -5.757 -1.979 1.00 0.00 H new ATOM 0 HB3 LYS A 17 5.978 -5.666 -0.272 1.00 0.00 H new ATOM 0 HG2 LYS A 17 6.312 -7.918 -0.754 1.00 0.00 H new ATOM 0 HG3 LYS A 17 4.707 -7.912 -0.051 1.00 0.00 H new ATOM 0 HD2 LYS A 17 4.693 -9.317 -2.036 1.00 0.00 H new ATOM 0 HD3 LYS A 17 3.709 -7.898 -2.337 1.00 0.00 H new ATOM 0 HE2 LYS A 17 5.118 -8.346 -4.281 1.00 0.00 H new ATOM 0 HE3 LYS A 17 5.596 -6.829 -3.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 7.441 -8.388 -4.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 7.491 -7.817 -2.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 6.950 -9.394 -2.907 1.00 0.00 H new ATOM 277 N MET A 18 1.965 -6.712 -1.325 1.00 0.00 N ATOM 278 CA MET A 18 0.878 -7.150 -2.170 1.00 0.00 C ATOM 279 C MET A 18 -0.035 -5.965 -2.405 1.00 0.00 C ATOM 280 O MET A 18 -0.574 -5.782 -3.497 1.00 0.00 O ATOM 281 CB MET A 18 0.120 -8.317 -1.518 1.00 0.00 C ATOM 282 CG MET A 18 -1.379 -8.306 -1.772 1.00 0.00 C ATOM 283 SD MET A 18 -1.803 -8.355 -3.524 1.00 0.00 S ATOM 284 CE MET A 18 -0.936 -9.832 -4.041 1.00 0.00 C ATOM 0 H MET A 18 1.973 -7.132 -0.396 1.00 0.00 H new ATOM 0 HA MET A 18 1.262 -7.514 -3.123 1.00 0.00 H new ATOM 0 HB2 MET A 18 0.533 -9.256 -1.888 1.00 0.00 H new ATOM 0 HB3 MET A 18 0.295 -8.294 -0.442 1.00 0.00 H new ATOM 0 HG2 MET A 18 -1.832 -9.161 -1.271 1.00 0.00 H new ATOM 0 HG3 MET A 18 -1.810 -7.410 -1.325 1.00 0.00 H new ATOM 0 HE1 MET A 18 -1.471 -10.297 -4.869 1.00 0.00 H new ATOM 0 HE2 MET A 18 0.071 -9.569 -4.363 1.00 0.00 H new ATOM 0 HE3 MET A 18 -0.879 -10.531 -3.207 1.00 0.00 H new ATOM 294 N ILE A 19 -0.181 -5.138 -1.374 1.00 0.00 N ATOM 295 CA ILE A 19 -0.999 -3.953 -1.464 1.00 0.00 C ATOM 296 C ILE A 19 -0.421 -3.012 -2.509 1.00 0.00 C ATOM 297 O ILE A 19 -1.089 -2.644 -3.474 1.00 0.00 O ATOM 298 CB ILE A 19 -1.046 -3.208 -0.117 1.00 0.00 C ATOM 299 CG1 ILE A 19 -1.349 -4.152 1.056 1.00 0.00 C ATOM 300 CG2 ILE A 19 -2.070 -2.092 -0.171 1.00 0.00 C ATOM 301 CD1 ILE A 19 -2.470 -5.133 0.793 1.00 0.00 C ATOM 0 H ILE A 19 0.263 -5.276 -0.466 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.007 -4.262 -1.739 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.057 -2.783 0.055 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -0.445 -4.709 1.302 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -1.603 -3.554 1.932 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -2.094 -1.573 0.787 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -1.800 -1.388 -0.958 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -3.054 -2.511 -0.381 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -2.618 -5.761 1.672 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -3.389 -4.587 0.579 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -2.212 -5.759 -0.061 1.00 0.00 H new ATOM 313 N ASP A 20 0.838 -2.635 -2.301 1.00 0.00 N ATOM 314 CA ASP A 20 1.529 -1.745 -3.214 1.00 0.00 C ATOM 315 C ASP A 20 2.093 -2.504 -4.403 1.00 0.00 C ATOM 316 O ASP A 20 3.236 -2.962 -4.399 1.00 0.00 O ATOM 317 CB ASP A 20 2.634 -0.976 -2.495 1.00 0.00 C ATOM 318 CG ASP A 20 3.685 -0.471 -3.451 1.00 0.00 C ATOM 319 OD1 ASP A 20 3.456 0.584 -4.065 1.00 0.00 O ATOM 320 OD2 ASP A 20 4.723 -1.147 -3.615 1.00 0.00 O ATOM 0 H ASP A 20 1.398 -2.936 -1.503 1.00 0.00 H new ATOM 0 HA ASP A 20 0.800 -1.027 -3.589 1.00 0.00 H new ATOM 0 HB2 ASP A 20 2.199 -0.134 -1.957 1.00 0.00 H new ATOM 0 HB3 ASP A 20 3.101 -1.622 -1.752 1.00 0.00 H new ATOM 325 N THR A 21 1.261 -2.645 -5.413 1.00 0.00 N ATOM 326 CA THR A 21 1.642 -3.352 -6.619 1.00 0.00 C ATOM 327 C THR A 21 2.306 -2.421 -7.631 1.00 0.00 C ATOM 328 O THR A 21 3.056 -2.879 -8.493 1.00 0.00 O ATOM 329 CB THR A 21 0.421 -4.028 -7.243 1.00 0.00 C ATOM 330 OG1 THR A 21 0.770 -4.678 -8.452 1.00 0.00 O ATOM 331 CG2 THR A 21 -0.708 -3.066 -7.546 1.00 0.00 C ATOM 0 H THR A 21 0.310 -2.277 -5.423 1.00 0.00 H new ATOM 0 HA THR A 21 2.371 -4.114 -6.342 1.00 0.00 H new ATOM 0 HB THR A 21 0.075 -4.743 -6.497 1.00 0.00 H new ATOM 0 HG1 THR A 21 -0.024 -5.106 -8.835 1.00 0.00 H new ATOM 0 HG21 THR A 21 -1.542 -3.611 -7.987 1.00 0.00 H new ATOM 0 HG22 THR A 21 -1.035 -2.587 -6.623 1.00 0.00 H new ATOM 0 HG23 THR A 21 -0.361 -2.306 -8.246 1.00 0.00 H new ATOM 339 N ASP A 22 2.008 -1.120 -7.558 1.00 0.00 N ATOM 340 CA ASP A 22 2.576 -0.183 -8.525 1.00 0.00 C ATOM 341 C ASP A 22 3.025 1.168 -7.947 1.00 0.00 C ATOM 342 O ASP A 22 3.579 1.979 -8.691 1.00 0.00 O ATOM 343 CB ASP A 22 1.560 0.072 -9.637 1.00 0.00 C ATOM 344 CG ASP A 22 0.275 0.685 -9.110 1.00 0.00 C ATOM 345 OD1 ASP A 22 0.331 1.802 -8.554 1.00 0.00 O ATOM 346 OD2 ASP A 22 -0.789 0.047 -9.258 1.00 0.00 O ATOM 0 H ASP A 22 1.394 -0.702 -6.859 1.00 0.00 H new ATOM 0 HA ASP A 22 3.482 -0.665 -8.894 1.00 0.00 H new ATOM 0 HB2 ASP A 22 1.998 0.736 -10.382 1.00 0.00 H new ATOM 0 HB3 ASP A 22 1.332 -0.867 -10.141 1.00 0.00 H new ATOM 351 N ASN A 23 2.771 1.463 -6.669 1.00 0.00 N ATOM 352 CA ASN A 23 3.158 2.774 -6.150 1.00 0.00 C ATOM 353 C ASN A 23 4.662 2.893 -5.900 1.00 0.00 C ATOM 354 O ASN A 23 5.372 3.477 -6.718 1.00 0.00 O ATOM 355 CB ASN A 23 2.349 3.163 -4.906 1.00 0.00 C ATOM 356 CG ASN A 23 2.669 4.569 -4.427 1.00 0.00 C ATOM 357 OD1 ASN A 23 2.638 5.521 -5.205 1.00 0.00 O ATOM 358 ND2 ASN A 23 2.957 4.710 -3.138 1.00 0.00 N ATOM 0 H ASN A 23 2.318 0.840 -6.000 1.00 0.00 H new ATOM 0 HA ASN A 23 2.915 3.490 -6.935 1.00 0.00 H new ATOM 0 HB2 ASN A 23 1.285 3.091 -5.130 1.00 0.00 H new ATOM 0 HB3 ASN A 23 2.554 2.453 -4.105 1.00 0.00 H new ATOM 0 HD21 ASN A 23 3.163 5.635 -2.760 1.00 0.00 H new ATOM 0 HD22 ASN A 23 2.972 3.894 -2.527 1.00 0.00 H new ATOM 365 N SER A 24 5.153 2.373 -4.776 1.00 0.00 N ATOM 366 CA SER A 24 6.583 2.484 -4.470 1.00 0.00 C ATOM 367 C SER A 24 6.998 1.674 -3.240 1.00 0.00 C ATOM 368 O SER A 24 8.166 1.695 -2.847 1.00 0.00 O ATOM 369 CB SER A 24 6.921 3.952 -4.229 1.00 0.00 C ATOM 370 OG SER A 24 6.089 4.491 -3.215 1.00 0.00 O ATOM 0 H SER A 24 4.599 1.881 -4.075 1.00 0.00 H new ATOM 0 HA SER A 24 7.129 2.080 -5.322 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.967 4.048 -3.939 1.00 0.00 H new ATOM 0 HB3 SER A 24 6.793 4.517 -5.152 1.00 0.00 H new ATOM 0 HG SER A 24 6.318 5.433 -3.070 1.00 0.00 H new ATOM 376 N GLY A 25 6.048 0.998 -2.615 1.00 0.00 N ATOM 377 CA GLY A 25 6.341 0.238 -1.416 1.00 0.00 C ATOM 378 C GLY A 25 5.707 0.891 -0.211 1.00 0.00 C ATOM 379 O GLY A 25 6.123 0.692 0.930 1.00 0.00 O ATOM 0 H GLY A 25 5.074 0.961 -2.917 1.00 0.00 H new ATOM 0 HA2 GLY A 25 5.969 -0.781 -1.523 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.420 0.170 -1.275 1.00 0.00 H new ATOM 383 N THR A 26 4.668 1.660 -0.499 1.00 0.00 N ATOM 384 CA THR A 26 3.901 2.361 0.515 1.00 0.00 C ATOM 385 C THR A 26 2.426 2.271 0.184 1.00 0.00 C ATOM 386 O THR A 26 2.050 2.205 -0.981 1.00 0.00 O ATOM 387 CB THR A 26 4.315 3.823 0.620 1.00 0.00 C ATOM 388 OG1 THR A 26 4.176 4.475 -0.629 1.00 0.00 O ATOM 389 CG2 THR A 26 5.741 4.015 1.088 1.00 0.00 C ATOM 0 H THR A 26 4.332 1.815 -1.450 1.00 0.00 H new ATOM 0 HA THR A 26 4.098 1.887 1.477 1.00 0.00 H new ATOM 0 HB THR A 26 3.649 4.256 1.366 1.00 0.00 H new ATOM 0 HG1 THR A 26 4.948 4.266 -1.195 1.00 0.00 H new ATOM 0 HG21 THR A 26 5.967 5.080 1.139 1.00 0.00 H new ATOM 0 HG22 THR A 26 5.863 3.570 2.076 1.00 0.00 H new ATOM 0 HG23 THR A 26 6.422 3.533 0.387 1.00 0.00 H new ATOM 397 N ILE A 27 1.599 2.229 1.208 1.00 0.00 N ATOM 398 CA ILE A 27 0.169 2.096 1.015 1.00 0.00 C ATOM 399 C ILE A 27 -0.559 3.396 1.237 1.00 0.00 C ATOM 400 O ILE A 27 -0.787 3.786 2.368 1.00 0.00 O ATOM 401 CB ILE A 27 -0.368 1.085 2.013 1.00 0.00 C ATOM 402 CG1 ILE A 27 0.549 -0.133 2.016 1.00 0.00 C ATOM 403 CG2 ILE A 27 -1.805 0.717 1.681 1.00 0.00 C ATOM 404 CD1 ILE A 27 -0.107 -1.390 2.523 1.00 0.00 C ATOM 0 H ILE A 27 1.892 2.285 2.183 1.00 0.00 H new ATOM 0 HA ILE A 27 0.004 1.779 -0.015 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.379 1.515 3.014 1.00 0.00 H new ATOM 0 HG12 ILE A 27 0.909 -0.307 1.002 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.422 0.083 2.632 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.172 -0.008 2.407 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.427 1.611 1.716 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -1.848 0.284 0.682 1.00 0.00 H new ATOM 0 HD11 ILE A 27 0.609 -2.211 2.494 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.443 -1.237 3.549 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -0.963 -1.633 1.894 1.00 0.00 H new ATOM 416 N THR A 28 -0.968 4.051 0.170 1.00 0.00 N ATOM 417 CA THR A 28 -1.677 5.304 0.330 1.00 0.00 C ATOM 418 C THR A 28 -3.160 5.100 0.137 1.00 0.00 C ATOM 419 O THR A 28 -3.577 4.083 -0.385 1.00 0.00 O ATOM 420 CB THR A 28 -1.138 6.347 -0.649 1.00 0.00 C ATOM 421 OG1 THR A 28 -1.224 5.880 -1.983 1.00 0.00 O ATOM 422 CG2 THR A 28 0.304 6.713 -0.376 1.00 0.00 C ATOM 0 H THR A 28 -0.827 3.747 -0.794 1.00 0.00 H new ATOM 0 HA THR A 28 -1.515 5.671 1.344 1.00 0.00 H new ATOM 0 HB THR A 28 -1.759 7.232 -0.510 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.875 6.564 -2.592 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.634 7.457 -1.101 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.391 7.123 0.630 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.927 5.823 -0.460 1.00 0.00 H new ATOM 430 N PHE A 29 -3.942 6.059 0.612 1.00 0.00 N ATOM 431 CA PHE A 29 -5.403 5.988 0.546 1.00 0.00 C ATOM 432 C PHE A 29 -5.862 5.278 -0.728 1.00 0.00 C ATOM 433 O PHE A 29 -6.833 4.520 -0.711 1.00 0.00 O ATOM 434 CB PHE A 29 -5.992 7.399 0.591 1.00 0.00 C ATOM 435 CG PHE A 29 -7.331 7.470 1.259 1.00 0.00 C ATOM 436 CD1 PHE A 29 -8.466 6.978 0.637 1.00 0.00 C ATOM 437 CD2 PHE A 29 -7.449 8.026 2.520 1.00 0.00 C ATOM 438 CE1 PHE A 29 -9.697 7.041 1.260 1.00 0.00 C ATOM 439 CE2 PHE A 29 -8.674 8.093 3.151 1.00 0.00 C ATOM 440 CZ PHE A 29 -9.801 7.603 2.525 1.00 0.00 C ATOM 0 H PHE A 29 -3.588 6.907 1.053 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.756 5.415 1.404 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -5.299 8.056 1.115 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -6.083 7.778 -0.427 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -8.388 6.540 -0.347 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.571 8.412 3.017 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -10.575 6.654 0.765 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -8.751 8.529 4.136 1.00 0.00 H new ATOM 0 HZ PHE A 29 -10.761 7.656 3.017 1.00 0.00 H new ATOM 450 N ASP A 30 -5.142 5.508 -1.818 1.00 0.00 N ATOM 451 CA ASP A 30 -5.451 4.870 -3.094 1.00 0.00 C ATOM 452 C ASP A 30 -5.018 3.401 -3.076 1.00 0.00 C ATOM 453 O ASP A 30 -5.814 2.504 -3.373 1.00 0.00 O ATOM 454 CB ASP A 30 -4.755 5.608 -4.239 1.00 0.00 C ATOM 455 CG ASP A 30 -5.060 4.994 -5.593 1.00 0.00 C ATOM 456 OD1 ASP A 30 -6.250 4.949 -5.968 1.00 0.00 O ATOM 457 OD2 ASP A 30 -4.109 4.560 -6.275 1.00 0.00 O ATOM 0 H ASP A 30 -4.337 6.134 -1.845 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.529 4.915 -3.250 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -5.068 6.652 -4.238 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -3.678 5.598 -4.073 1.00 0.00 H new ATOM 462 N GLU A 31 -3.758 3.157 -2.711 1.00 0.00 N ATOM 463 CA GLU A 31 -3.231 1.800 -2.642 1.00 0.00 C ATOM 464 C GLU A 31 -3.831 1.037 -1.474 1.00 0.00 C ATOM 465 O GLU A 31 -3.748 -0.187 -1.417 1.00 0.00 O ATOM 466 CB GLU A 31 -1.721 1.816 -2.508 1.00 0.00 C ATOM 467 CG GLU A 31 -1.063 0.691 -3.287 1.00 0.00 C ATOM 468 CD GLU A 31 0.291 1.070 -3.836 1.00 0.00 C ATOM 469 OE1 GLU A 31 1.165 1.463 -3.041 1.00 0.00 O ATOM 470 OE2 GLU A 31 0.478 0.963 -5.066 1.00 0.00 O ATOM 0 H GLU A 31 -3.087 3.883 -2.460 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.505 1.297 -3.569 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.337 2.773 -2.861 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.451 1.733 -1.455 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.956 -0.179 -2.639 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.714 0.397 -4.110 1.00 0.00 H new ATOM 477 N LEU A 32 -4.430 1.765 -0.543 1.00 0.00 N ATOM 478 CA LEU A 32 -5.029 1.155 0.621 1.00 0.00 C ATOM 479 C LEU A 32 -6.101 0.168 0.196 1.00 0.00 C ATOM 480 O LEU A 32 -6.065 -1.008 0.552 1.00 0.00 O ATOM 481 CB LEU A 32 -5.621 2.223 1.534 1.00 0.00 C ATOM 482 CG LEU A 32 -5.906 1.761 2.966 1.00 0.00 C ATOM 483 CD1 LEU A 32 -7.136 0.867 3.015 1.00 0.00 C ATOM 484 CD2 LEU A 32 -4.701 1.027 3.540 1.00 0.00 C ATOM 0 H LEU A 32 -4.511 2.781 -0.577 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.258 0.619 1.174 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -4.936 3.070 1.571 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.550 2.584 1.092 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.100 2.646 3.572 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.317 0.553 4.043 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.001 1.418 2.647 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.973 -0.011 2.390 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -4.922 0.706 4.558 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.479 0.155 2.925 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -3.839 1.694 3.549 1.00 0.00 H new ATOM 496 N LYS A 33 -7.046 0.668 -0.588 1.00 0.00 N ATOM 497 CA LYS A 33 -8.133 -0.148 -1.094 1.00 0.00 C ATOM 498 C LYS A 33 -7.653 -1.036 -2.232 1.00 0.00 C ATOM 499 O LYS A 33 -8.131 -2.148 -2.395 1.00 0.00 O ATOM 500 CB LYS A 33 -9.285 0.739 -1.565 1.00 0.00 C ATOM 501 CG LYS A 33 -8.832 1.974 -2.331 1.00 0.00 C ATOM 502 CD LYS A 33 -10.006 2.775 -2.873 1.00 0.00 C ATOM 503 CE LYS A 33 -11.105 2.940 -1.839 1.00 0.00 C ATOM 504 NZ LYS A 33 -12.245 3.740 -2.363 1.00 0.00 N ATOM 0 H LYS A 33 -7.078 1.643 -0.887 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.489 -0.787 -0.286 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -9.948 0.151 -2.200 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -9.868 1.053 -0.699 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -8.234 2.607 -1.676 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -8.188 1.672 -3.157 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.658 3.757 -3.193 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -10.409 2.277 -3.755 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -11.463 1.958 -1.530 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.699 3.425 -0.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.959 3.858 -1.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -11.903 4.674 -2.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -12.671 3.247 -3.174 1.00 0.00 H new ATOM 518 N ASP A 34 -6.706 -0.535 -3.015 1.00 0.00 N ATOM 519 CA ASP A 34 -6.167 -1.289 -4.144 1.00 0.00 C ATOM 520 C ASP A 34 -5.786 -2.720 -3.747 1.00 0.00 C ATOM 521 O ASP A 34 -6.280 -3.685 -4.332 1.00 0.00 O ATOM 522 CB ASP A 34 -4.943 -0.570 -4.717 1.00 0.00 C ATOM 523 CG ASP A 34 -4.388 -1.252 -5.955 1.00 0.00 C ATOM 524 OD1 ASP A 34 -4.983 -2.256 -6.400 1.00 0.00 O ATOM 525 OD2 ASP A 34 -3.359 -0.779 -6.482 1.00 0.00 O ATOM 0 H ASP A 34 -6.294 0.390 -2.891 1.00 0.00 H new ATOM 0 HA ASP A 34 -6.949 -1.349 -4.901 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -5.212 0.457 -4.963 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -4.165 -0.522 -3.955 1.00 0.00 H new ATOM 530 N GLY A 35 -4.890 -2.847 -2.772 1.00 0.00 N ATOM 531 CA GLY A 35 -4.430 -4.161 -2.340 1.00 0.00 C ATOM 532 C GLY A 35 -5.518 -5.068 -1.781 1.00 0.00 C ATOM 533 O GLY A 35 -5.352 -6.287 -1.769 1.00 0.00 O ATOM 0 H GLY A 35 -4.472 -2.063 -2.271 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -3.959 -4.661 -3.186 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -3.661 -4.029 -1.579 1.00 0.00 H new ATOM 537 N LEU A 36 -6.622 -4.495 -1.312 1.00 0.00 N ATOM 538 CA LEU A 36 -7.704 -5.304 -0.754 1.00 0.00 C ATOM 539 C LEU A 36 -8.772 -5.597 -1.802 1.00 0.00 C ATOM 540 O LEU A 36 -9.299 -6.707 -1.868 1.00 0.00 O ATOM 541 CB LEU A 36 -8.302 -4.622 0.477 1.00 0.00 C ATOM 542 CG LEU A 36 -8.891 -3.240 0.240 1.00 0.00 C ATOM 543 CD1 LEU A 36 -10.316 -3.361 -0.256 1.00 0.00 C ATOM 544 CD2 LEU A 36 -8.812 -2.413 1.508 1.00 0.00 C ATOM 0 H LEU A 36 -6.792 -3.489 -1.306 1.00 0.00 H new ATOM 0 HA LEU A 36 -7.287 -6.261 -0.441 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -9.082 -5.265 0.884 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -7.526 -4.541 1.239 1.00 0.00 H new ATOM 0 HG LEU A 36 -8.311 -2.728 -0.528 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -10.729 -2.366 -0.423 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -10.329 -3.921 -1.191 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -10.917 -3.883 0.488 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.237 -1.426 1.326 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.372 -2.908 2.301 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -7.770 -2.309 1.810 1.00 0.00 H new ATOM 556 N LYS A 37 -9.072 -4.612 -2.636 1.00 0.00 N ATOM 557 CA LYS A 37 -10.053 -4.785 -3.691 1.00 0.00 C ATOM 558 C LYS A 37 -9.477 -5.697 -4.765 1.00 0.00 C ATOM 559 O LYS A 37 -10.198 -6.234 -5.606 1.00 0.00 O ATOM 560 CB LYS A 37 -10.447 -3.426 -4.274 1.00 0.00 C ATOM 561 CG LYS A 37 -9.318 -2.706 -4.996 1.00 0.00 C ATOM 562 CD LYS A 37 -9.792 -1.417 -5.661 1.00 0.00 C ATOM 563 CE LYS A 37 -10.300 -0.396 -4.649 1.00 0.00 C ATOM 564 NZ LYS A 37 -11.593 -0.804 -4.034 1.00 0.00 N ATOM 0 H LYS A 37 -8.648 -3.685 -2.600 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.953 -5.246 -3.285 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -11.275 -3.567 -4.968 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.812 -2.789 -3.468 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.523 -2.476 -4.287 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -8.891 -3.367 -5.750 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -8.971 -0.982 -6.232 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.586 -1.648 -6.371 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -9.554 -0.262 -3.866 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -10.423 0.569 -5.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -12.246 0.005 -4.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -12.009 -1.582 -4.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -11.428 -1.120 -3.057 1.00 0.00 H new ATOM 578 N ARG A 38 -8.158 -5.878 -4.703 1.00 0.00 N ATOM 579 CA ARG A 38 -7.445 -6.736 -5.636 1.00 0.00 C ATOM 580 C ARG A 38 -7.430 -8.170 -5.127 1.00 0.00 C ATOM 581 O ARG A 38 -7.515 -9.117 -5.910 1.00 0.00 O ATOM 582 CB ARG A 38 -6.013 -6.213 -5.828 1.00 0.00 C ATOM 583 CG ARG A 38 -5.100 -7.128 -6.636 1.00 0.00 C ATOM 584 CD ARG A 38 -4.478 -8.220 -5.771 1.00 0.00 C ATOM 585 NE ARG A 38 -3.593 -9.093 -6.540 1.00 0.00 N ATOM 586 CZ ARG A 38 -2.466 -8.682 -7.117 1.00 0.00 C ATOM 587 NH1 ARG A 38 -2.080 -7.419 -7.004 1.00 0.00 N ATOM 588 NH2 ARG A 38 -1.724 -9.538 -7.806 1.00 0.00 N ATOM 0 H ARG A 38 -7.560 -5.434 -4.006 1.00 0.00 H new ATOM 0 HA ARG A 38 -7.956 -6.722 -6.599 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -6.059 -5.242 -6.321 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -5.566 -6.051 -4.847 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -5.669 -7.586 -7.445 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -4.309 -6.536 -7.098 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -3.916 -7.761 -4.957 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -5.269 -8.816 -5.316 1.00 0.00 H new ATOM 0 HE ARG A 38 -3.854 -10.074 -6.640 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -2.647 -6.758 -6.473 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -1.216 -7.108 -7.448 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -2.017 -10.511 -7.894 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -0.860 -9.223 -8.248 1.00 0.00 H new ATOM 602 N VAL A 39 -7.308 -8.325 -3.812 1.00 0.00 N ATOM 603 CA VAL A 39 -7.266 -9.644 -3.199 1.00 0.00 C ATOM 604 C VAL A 39 -8.649 -10.290 -3.164 1.00 0.00 C ATOM 605 O VAL A 39 -8.773 -11.503 -2.995 1.00 0.00 O ATOM 606 CB VAL A 39 -6.708 -9.559 -1.763 1.00 0.00 C ATOM 607 CG1 VAL A 39 -7.724 -8.938 -0.816 1.00 0.00 C ATOM 608 CG2 VAL A 39 -6.278 -10.931 -1.277 1.00 0.00 C ATOM 0 H VAL A 39 -7.237 -7.551 -3.152 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.608 -10.262 -3.810 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.831 -8.912 -1.777 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.304 -8.891 0.189 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.969 -7.931 -1.154 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.628 -9.546 -0.803 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.887 -10.852 -0.263 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.135 -11.605 -1.284 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.503 -11.324 -1.935 1.00 0.00 H new ATOM 618 N GLY A 40 -9.688 -9.474 -3.327 1.00 0.00 N ATOM 619 CA GLY A 40 -11.045 -9.989 -3.310 1.00 0.00 C ATOM 620 C GLY A 40 -11.899 -9.349 -2.232 1.00 0.00 C ATOM 621 O GLY A 40 -12.664 -10.032 -1.549 1.00 0.00 O ATOM 0 H GLY A 40 -9.613 -8.467 -3.470 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -11.506 -9.819 -4.283 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -11.018 -11.068 -3.154 1.00 0.00 H new ATOM 625 N SER A 41 -11.771 -8.034 -2.081 1.00 0.00 N ATOM 626 CA SER A 41 -12.537 -7.299 -1.080 1.00 0.00 C ATOM 627 C SER A 41 -13.201 -6.077 -1.708 1.00 0.00 C ATOM 628 O SER A 41 -12.838 -5.661 -2.807 1.00 0.00 O ATOM 629 CB SER A 41 -11.627 -6.863 0.069 1.00 0.00 C ATOM 630 OG SER A 41 -12.365 -6.200 1.082 1.00 0.00 O ATOM 0 H SER A 41 -11.144 -7.455 -2.640 1.00 0.00 H new ATOM 0 HA SER A 41 -13.312 -7.958 -0.688 1.00 0.00 H new ATOM 0 HB2 SER A 41 -11.126 -7.734 0.491 1.00 0.00 H new ATOM 0 HB3 SER A 41 -10.849 -6.201 -0.311 1.00 0.00 H new ATOM 0 HG SER A 41 -11.760 -5.933 1.806 1.00 0.00 H new ATOM 636 N GLU A 42 -14.179 -5.506 -1.009 1.00 0.00 N ATOM 637 CA GLU A 42 -14.884 -4.334 -1.517 1.00 0.00 C ATOM 638 C GLU A 42 -15.205 -3.341 -0.402 1.00 0.00 C ATOM 639 O GLU A 42 -16.117 -3.553 0.398 1.00 0.00 O ATOM 640 CB GLU A 42 -16.167 -4.756 -2.239 1.00 0.00 C ATOM 641 CG GLU A 42 -17.094 -5.615 -1.395 1.00 0.00 C ATOM 642 CD GLU A 42 -18.357 -6.010 -2.136 1.00 0.00 C ATOM 643 OE1 GLU A 42 -18.245 -6.679 -3.185 1.00 0.00 O ATOM 644 OE2 GLU A 42 -19.457 -5.650 -1.668 1.00 0.00 O ATOM 0 H GLU A 42 -14.499 -5.833 -0.097 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.224 -3.833 -2.226 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -16.704 -3.862 -2.556 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -15.900 -5.305 -3.142 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -16.565 -6.515 -1.081 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -17.363 -5.071 -0.489 1.00 0.00 H new ATOM 651 N LEU A 43 -14.447 -2.249 -0.364 1.00 0.00 N ATOM 652 CA LEU A 43 -14.635 -1.208 0.635 1.00 0.00 C ATOM 653 C LEU A 43 -14.846 0.139 -0.043 1.00 0.00 C ATOM 654 O LEU A 43 -14.550 0.297 -1.227 1.00 0.00 O ATOM 655 CB LEU A 43 -13.409 -1.106 1.536 1.00 0.00 C ATOM 656 CG LEU A 43 -12.844 -2.427 2.051 1.00 0.00 C ATOM 657 CD1 LEU A 43 -11.672 -2.160 2.980 1.00 0.00 C ATOM 658 CD2 LEU A 43 -13.912 -3.241 2.762 1.00 0.00 C ATOM 0 H LEU A 43 -13.690 -2.064 -1.022 1.00 0.00 H new ATOM 0 HA LEU A 43 -15.510 -1.468 1.231 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -12.623 -0.587 0.988 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -13.664 -0.484 2.394 1.00 0.00 H new ATOM 0 HG LEU A 43 -12.497 -3.009 1.197 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -11.273 -3.107 3.344 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.893 -1.623 2.438 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -12.007 -1.559 3.825 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -13.480 -4.176 3.118 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -14.298 -2.674 3.609 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -14.726 -3.457 2.070 1.00 0.00 H new ATOM 670 N MET A 44 -15.312 1.122 0.719 1.00 0.00 N ATOM 671 CA MET A 44 -15.502 2.465 0.196 1.00 0.00 C ATOM 672 C MET A 44 -14.511 3.389 0.885 1.00 0.00 C ATOM 673 O MET A 44 -13.935 3.016 1.905 1.00 0.00 O ATOM 674 CB MET A 44 -16.937 2.946 0.426 1.00 0.00 C ATOM 675 CG MET A 44 -17.345 2.979 1.889 1.00 0.00 C ATOM 676 SD MET A 44 -19.063 3.480 2.119 1.00 0.00 S ATOM 677 CE MET A 44 -19.052 5.101 1.358 1.00 0.00 C ATOM 0 H MET A 44 -15.565 1.012 1.701 1.00 0.00 H new ATOM 0 HA MET A 44 -15.329 2.467 -0.880 1.00 0.00 H new ATOM 0 HB2 MET A 44 -17.047 3.945 0.005 1.00 0.00 H new ATOM 0 HB3 MET A 44 -17.621 2.294 -0.118 1.00 0.00 H new ATOM 0 HG2 MET A 44 -17.197 1.992 2.326 1.00 0.00 H new ATOM 0 HG3 MET A 44 -16.694 3.667 2.428 1.00 0.00 H new ATOM 0 HE1 MET A 44 -19.914 5.671 1.704 1.00 0.00 H new ATOM 0 HE2 MET A 44 -18.136 5.625 1.631 1.00 0.00 H new ATOM 0 HE3 MET A 44 -19.099 4.994 0.274 1.00 0.00 H new ATOM 687 N GLU A 45 -14.292 4.577 0.333 1.00 0.00 N ATOM 688 CA GLU A 45 -13.338 5.509 0.924 1.00 0.00 C ATOM 689 C GLU A 45 -13.510 5.613 2.434 1.00 0.00 C ATOM 690 O GLU A 45 -12.599 5.256 3.179 1.00 0.00 O ATOM 691 CB GLU A 45 -13.423 6.884 0.271 1.00 0.00 C ATOM 692 CG GLU A 45 -12.727 6.933 -1.078 1.00 0.00 C ATOM 693 CD GLU A 45 -13.572 6.358 -2.201 1.00 0.00 C ATOM 694 OE1 GLU A 45 -14.752 6.034 -1.954 1.00 0.00 O ATOM 695 OE2 GLU A 45 -13.055 6.247 -3.332 1.00 0.00 O ATOM 0 H GLU A 45 -14.755 4.915 -0.511 1.00 0.00 H new ATOM 0 HA GLU A 45 -12.343 5.108 0.733 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -14.470 7.159 0.146 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -12.976 7.625 0.934 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -12.474 7.967 -1.313 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -11.789 6.381 -1.017 1.00 0.00 H new ATOM 702 N SER A 46 -14.658 6.118 2.889 1.00 0.00 N ATOM 703 CA SER A 46 -14.920 6.275 4.321 1.00 0.00 C ATOM 704 C SER A 46 -14.447 5.075 5.143 1.00 0.00 C ATOM 705 O SER A 46 -14.186 5.209 6.338 1.00 0.00 O ATOM 706 CB SER A 46 -16.414 6.500 4.556 1.00 0.00 C ATOM 707 OG SER A 46 -17.178 5.411 4.064 1.00 0.00 O ATOM 0 H SER A 46 -15.421 6.425 2.286 1.00 0.00 H new ATOM 0 HA SER A 46 -14.351 7.142 4.655 1.00 0.00 H new ATOM 0 HB2 SER A 46 -16.602 6.628 5.622 1.00 0.00 H new ATOM 0 HB3 SER A 46 -16.728 7.420 4.064 1.00 0.00 H new ATOM 0 HG SER A 46 -18.130 5.579 4.228 1.00 0.00 H new ATOM 713 N GLU A 47 -14.315 3.909 4.509 1.00 0.00 N ATOM 714 CA GLU A 47 -13.847 2.717 5.206 1.00 0.00 C ATOM 715 C GLU A 47 -12.325 2.727 5.284 1.00 0.00 C ATOM 716 O GLU A 47 -11.746 2.516 6.348 1.00 0.00 O ATOM 717 CB GLU A 47 -14.331 1.452 4.495 1.00 0.00 C ATOM 718 CG GLU A 47 -15.844 1.300 4.481 1.00 0.00 C ATOM 719 CD GLU A 47 -16.434 1.107 5.865 1.00 0.00 C ATOM 720 OE1 GLU A 47 -15.657 1.037 6.842 1.00 0.00 O ATOM 721 OE2 GLU A 47 -17.675 1.017 5.972 1.00 0.00 O ATOM 0 H GLU A 47 -14.525 3.768 3.521 1.00 0.00 H new ATOM 0 HA GLU A 47 -14.256 2.720 6.216 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -13.966 1.461 3.468 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.892 0.581 4.982 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -16.288 2.184 4.023 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -16.112 0.448 3.856 1.00 0.00 H new ATOM 728 N ILE A 48 -11.687 3.003 4.148 1.00 0.00 N ATOM 729 CA ILE A 48 -10.234 3.077 4.084 1.00 0.00 C ATOM 730 C ILE A 48 -9.725 4.007 5.168 1.00 0.00 C ATOM 731 O ILE A 48 -9.008 3.595 6.076 1.00 0.00 O ATOM 732 CB ILE A 48 -9.765 3.589 2.705 1.00 0.00 C ATOM 733 CG1 ILE A 48 -9.872 2.476 1.670 1.00 0.00 C ATOM 734 CG2 ILE A 48 -8.338 4.117 2.775 1.00 0.00 C ATOM 735 CD1 ILE A 48 -11.287 2.020 1.391 1.00 0.00 C ATOM 0 H ILE A 48 -12.157 3.179 3.260 1.00 0.00 H new ATOM 0 HA ILE A 48 -9.832 2.075 4.235 1.00 0.00 H new ATOM 0 HB ILE A 48 -10.413 4.413 2.406 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -9.422 2.818 0.738 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -9.288 1.621 2.011 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -8.032 4.471 1.791 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -8.289 4.940 3.488 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -7.670 3.318 3.097 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -11.273 1.227 0.644 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -11.736 1.645 2.310 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -11.873 2.860 1.018 1.00 0.00 H new ATOM 747 N LYS A 49 -10.126 5.261 5.061 1.00 0.00 N ATOM 748 CA LYS A 49 -9.749 6.275 6.028 1.00 0.00 C ATOM 749 C LYS A 49 -9.941 5.767 7.444 1.00 0.00 C ATOM 750 O LYS A 49 -9.190 6.120 8.352 1.00 0.00 O ATOM 751 CB LYS A 49 -10.592 7.531 5.824 1.00 0.00 C ATOM 752 CG LYS A 49 -10.667 8.407 7.059 1.00 0.00 C ATOM 753 CD LYS A 49 -11.900 8.089 7.881 1.00 0.00 C ATOM 754 CE LYS A 49 -12.053 9.091 8.995 1.00 0.00 C ATOM 755 NZ LYS A 49 -10.891 9.048 9.922 1.00 0.00 N ATOM 0 H LYS A 49 -10.719 5.604 4.305 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.696 6.512 5.878 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -10.175 8.111 5.000 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -11.601 7.240 5.531 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -9.774 8.261 7.667 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -10.684 9.456 6.764 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -12.785 8.104 7.244 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -11.821 7.083 8.294 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -12.150 10.092 8.576 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -12.970 8.887 9.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -11.223 9.166 10.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -10.406 8.133 9.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -10.230 9.815 9.686 1.00 0.00 H new ATOM 769 N ASP A 50 -10.956 4.935 7.626 1.00 0.00 N ATOM 770 CA ASP A 50 -11.241 4.384 8.937 1.00 0.00 C ATOM 771 C ASP A 50 -10.095 3.485 9.353 1.00 0.00 C ATOM 772 O ASP A 50 -9.618 3.545 10.476 1.00 0.00 O ATOM 773 CB ASP A 50 -12.561 3.617 8.916 1.00 0.00 C ATOM 774 CG ASP A 50 -12.992 3.163 10.298 1.00 0.00 C ATOM 775 OD1 ASP A 50 -12.248 2.379 10.925 1.00 0.00 O ATOM 776 OD2 ASP A 50 -14.073 3.592 10.754 1.00 0.00 O ATOM 0 H ASP A 50 -11.590 4.630 6.887 1.00 0.00 H new ATOM 0 HA ASP A 50 -11.341 5.192 9.662 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.338 4.249 8.486 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -12.462 2.748 8.266 1.00 0.00 H new ATOM 781 N LEU A 51 -9.643 2.674 8.412 1.00 0.00 N ATOM 782 CA LEU A 51 -8.531 1.768 8.639 1.00 0.00 C ATOM 783 C LEU A 51 -7.249 2.555 8.914 1.00 0.00 C ATOM 784 O LEU A 51 -6.339 2.065 9.581 1.00 0.00 O ATOM 785 CB LEU A 51 -8.412 0.822 7.420 1.00 0.00 C ATOM 786 CG LEU A 51 -7.044 0.674 6.723 1.00 0.00 C ATOM 787 CD1 LEU A 51 -6.524 2.001 6.196 1.00 0.00 C ATOM 788 CD2 LEU A 51 -6.023 0.008 7.634 1.00 0.00 C ATOM 0 H LEU A 51 -10.035 2.625 7.472 1.00 0.00 H new ATOM 0 HA LEU A 51 -8.704 1.157 9.525 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -8.728 -0.171 7.741 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -9.129 1.158 6.671 1.00 0.00 H new ATOM 0 HG LEU A 51 -7.198 0.024 5.862 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -5.559 1.848 5.713 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -7.231 2.407 5.473 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -6.409 2.701 7.023 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -5.071 -0.080 7.110 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -5.889 0.611 8.532 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -6.377 -0.985 7.913 1.00 0.00 H new ATOM 800 N MET A 52 -7.182 3.779 8.392 1.00 0.00 N ATOM 801 CA MET A 52 -6.007 4.618 8.580 1.00 0.00 C ATOM 802 C MET A 52 -5.998 5.296 9.939 1.00 0.00 C ATOM 803 O MET A 52 -5.147 5.031 10.784 1.00 0.00 O ATOM 804 CB MET A 52 -5.958 5.705 7.511 1.00 0.00 C ATOM 805 CG MET A 52 -5.612 5.218 6.120 1.00 0.00 C ATOM 806 SD MET A 52 -4.037 4.346 6.062 1.00 0.00 S ATOM 807 CE MET A 52 -3.818 4.179 4.294 1.00 0.00 C ATOM 0 H MET A 52 -7.925 4.207 7.839 1.00 0.00 H new ATOM 0 HA MET A 52 -5.140 3.961 8.507 1.00 0.00 H new ATOM 0 HB2 MET A 52 -6.927 6.202 7.475 1.00 0.00 H new ATOM 0 HB3 MET A 52 -5.226 6.455 7.810 1.00 0.00 H new ATOM 0 HG2 MET A 52 -6.402 4.557 5.764 1.00 0.00 H new ATOM 0 HG3 MET A 52 -5.577 6.069 5.440 1.00 0.00 H new ATOM 0 HE1 MET A 52 -3.221 3.292 4.084 1.00 0.00 H new ATOM 0 HE2 MET A 52 -4.792 4.083 3.814 1.00 0.00 H new ATOM 0 HE3 MET A 52 -3.308 5.061 3.906 1.00 0.00 H new ATOM 817 N ASP A 53 -6.945 6.187 10.133 1.00 0.00 N ATOM 818 CA ASP A 53 -7.032 6.925 11.379 1.00 0.00 C ATOM 819 C ASP A 53 -7.217 5.980 12.557 1.00 0.00 C ATOM 820 O ASP A 53 -6.922 6.332 13.695 1.00 0.00 O ATOM 821 CB ASP A 53 -8.171 7.939 11.322 1.00 0.00 C ATOM 822 CG ASP A 53 -7.965 8.979 10.239 1.00 0.00 C ATOM 823 OD1 ASP A 53 -7.877 8.593 9.054 1.00 0.00 O ATOM 824 OD2 ASP A 53 -7.891 10.179 10.575 1.00 0.00 O ATOM 0 H ASP A 53 -7.664 6.419 9.448 1.00 0.00 H new ATOM 0 HA ASP A 53 -6.095 7.464 11.520 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -9.111 7.416 11.146 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -8.259 8.437 12.288 1.00 0.00 H new ATOM 829 N ALA A 54 -7.707 4.780 12.285 1.00 0.00 N ATOM 830 CA ALA A 54 -7.917 3.809 13.344 1.00 0.00 C ATOM 831 C ALA A 54 -6.711 2.886 13.535 1.00 0.00 C ATOM 832 O ALA A 54 -6.339 2.571 14.664 1.00 0.00 O ATOM 833 CB ALA A 54 -9.162 2.982 13.079 1.00 0.00 C ATOM 0 H ALA A 54 -7.964 4.459 11.351 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.050 4.376 14.266 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -9.299 2.262 13.885 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.031 3.638 13.028 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.052 2.451 12.133 1.00 0.00 H new ATOM 839 N ALA A 55 -6.128 2.419 12.426 1.00 0.00 N ATOM 840 CA ALA A 55 -4.998 1.492 12.495 1.00 0.00 C ATOM 841 C ALA A 55 -3.683 2.097 12.017 1.00 0.00 C ATOM 842 O ALA A 55 -2.640 1.823 12.606 1.00 0.00 O ATOM 843 CB ALA A 55 -5.310 0.230 11.708 1.00 0.00 C ATOM 0 H ALA A 55 -6.418 2.666 11.480 1.00 0.00 H new ATOM 0 HA ALA A 55 -4.860 1.252 13.549 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -4.463 -0.453 11.766 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.194 -0.251 12.127 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.498 0.488 10.666 1.00 0.00 H new ATOM 849 N ASP A 56 -3.723 2.899 10.953 1.00 0.00 N ATOM 850 CA ASP A 56 -2.506 3.517 10.421 1.00 0.00 C ATOM 851 C ASP A 56 -1.729 4.193 11.555 1.00 0.00 C ATOM 852 O ASP A 56 -1.927 5.373 11.841 1.00 0.00 O ATOM 853 CB ASP A 56 -2.854 4.539 9.330 1.00 0.00 C ATOM 854 CG ASP A 56 -1.667 4.903 8.462 1.00 0.00 C ATOM 855 OD1 ASP A 56 -0.611 4.263 8.607 1.00 0.00 O ATOM 856 OD2 ASP A 56 -1.805 5.815 7.618 1.00 0.00 O ATOM 0 H ASP A 56 -4.576 3.135 10.446 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.883 2.741 9.976 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -3.647 4.135 8.701 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -3.246 5.442 9.797 1.00 0.00 H new ATOM 861 N ILE A 57 -0.870 3.412 12.213 1.00 0.00 N ATOM 862 CA ILE A 57 -0.071 3.882 13.345 1.00 0.00 C ATOM 863 C ILE A 57 0.612 5.214 13.065 1.00 0.00 C ATOM 864 O ILE A 57 0.983 5.939 13.990 1.00 0.00 O ATOM 865 CB ILE A 57 1.017 2.851 13.705 1.00 0.00 C ATOM 866 CG1 ILE A 57 0.399 1.463 13.900 1.00 0.00 C ATOM 867 CG2 ILE A 57 1.776 3.281 14.953 1.00 0.00 C ATOM 868 CD1 ILE A 57 -0.592 1.386 15.043 1.00 0.00 C ATOM 0 H ILE A 57 -0.709 2.433 11.975 1.00 0.00 H new ATOM 0 HA ILE A 57 -0.767 4.014 14.173 1.00 0.00 H new ATOM 0 HB ILE A 57 1.725 2.799 12.878 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.101 1.166 12.978 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.198 0.742 14.076 1.00 0.00 H new ATOM 0 HG21 ILE A 57 2.539 2.539 15.189 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.251 4.246 14.776 1.00 0.00 H new ATOM 0 HG23 ILE A 57 1.082 3.366 15.789 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.985 0.372 15.116 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.093 1.650 15.975 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.412 2.081 14.861 1.00 0.00 H new ATOM 880 N ASP A 58 0.792 5.524 11.795 1.00 0.00 N ATOM 881 CA ASP A 58 1.455 6.766 11.412 1.00 0.00 C ATOM 882 C ASP A 58 0.687 7.498 10.322 1.00 0.00 C ATOM 883 O ASP A 58 1.281 7.966 9.351 1.00 0.00 O ATOM 884 CB ASP A 58 2.883 6.475 10.946 1.00 0.00 C ATOM 885 CG ASP A 58 3.733 5.854 12.037 1.00 0.00 C ATOM 886 OD1 ASP A 58 3.896 6.491 13.098 1.00 0.00 O ATOM 887 OD2 ASP A 58 4.235 4.729 11.830 1.00 0.00 O ATOM 0 H ASP A 58 0.493 4.941 11.013 1.00 0.00 H new ATOM 0 HA ASP A 58 1.485 7.413 12.289 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.852 5.804 10.087 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.348 7.402 10.610 1.00 0.00 H new ATOM 892 N LYS A 59 -0.635 7.555 10.479 1.00 0.00 N ATOM 893 CA LYS A 59 -1.516 8.186 9.511 1.00 0.00 C ATOM 894 C LYS A 59 -0.868 9.380 8.820 1.00 0.00 C ATOM 895 O LYS A 59 -0.975 10.523 9.267 1.00 0.00 O ATOM 896 CB LYS A 59 -2.813 8.622 10.183 1.00 0.00 C ATOM 897 CG LYS A 59 -3.757 9.340 9.246 1.00 0.00 C ATOM 898 CD LYS A 59 -4.201 8.453 8.098 1.00 0.00 C ATOM 899 CE LYS A 59 -5.083 9.215 7.121 1.00 0.00 C ATOM 900 NZ LYS A 59 -5.497 8.369 5.969 1.00 0.00 N ATOM 0 H LYS A 59 -1.121 7.162 11.285 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.728 7.441 8.744 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.315 7.745 10.593 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -2.578 9.276 11.023 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -4.631 9.679 9.802 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.267 10.229 8.849 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.326 8.065 7.576 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -4.746 7.594 8.489 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -5.969 9.579 7.641 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.546 10.090 6.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -5.680 8.973 5.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.738 7.695 5.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -6.362 7.847 6.215 1.00 0.00 H new ATOM 914 N SER A 60 -0.217 9.082 7.708 1.00 0.00 N ATOM 915 CA SER A 60 0.449 10.081 6.885 1.00 0.00 C ATOM 916 C SER A 60 -0.035 9.925 5.453 1.00 0.00 C ATOM 917 O SER A 60 0.601 10.382 4.503 1.00 0.00 O ATOM 918 CB SER A 60 1.969 9.918 6.959 1.00 0.00 C ATOM 919 OG SER A 60 2.367 8.637 6.504 1.00 0.00 O ATOM 0 H SER A 60 -0.134 8.132 7.347 1.00 0.00 H new ATOM 0 HA SER A 60 0.207 11.079 7.251 1.00 0.00 H new ATOM 0 HB2 SER A 60 2.450 10.687 6.355 1.00 0.00 H new ATOM 0 HB3 SER A 60 2.304 10.063 7.986 1.00 0.00 H new ATOM 0 HG SER A 60 2.184 7.971 7.200 1.00 0.00 H new ATOM 925 N GLY A 61 -1.173 9.253 5.327 1.00 0.00 N ATOM 926 CA GLY A 61 -1.760 9.004 4.029 1.00 0.00 C ATOM 927 C GLY A 61 -1.174 7.773 3.371 1.00 0.00 C ATOM 928 O GLY A 61 -1.500 7.467 2.222 1.00 0.00 O ATOM 0 H GLY A 61 -1.703 8.873 6.112 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -2.838 8.880 4.136 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -1.601 9.870 3.386 1.00 0.00 H new ATOM 932 N THR A 62 -0.315 7.057 4.106 1.00 0.00 N ATOM 933 CA THR A 62 0.311 5.851 3.585 1.00 0.00 C ATOM 934 C THR A 62 0.689 4.891 4.711 1.00 0.00 C ATOM 935 O THR A 62 0.963 5.310 5.836 1.00 0.00 O ATOM 936 CB THR A 62 1.551 6.182 2.753 1.00 0.00 C ATOM 937 OG1 THR A 62 1.792 5.162 1.801 1.00 0.00 O ATOM 938 CG2 THR A 62 2.811 6.316 3.575 1.00 0.00 C ATOM 0 H THR A 62 -0.043 7.296 5.059 1.00 0.00 H new ATOM 0 HA THR A 62 -0.422 5.365 2.941 1.00 0.00 H new ATOM 0 HB THR A 62 1.332 7.141 2.283 1.00 0.00 H new ATOM 0 HG1 THR A 62 2.294 5.532 1.045 1.00 0.00 H new ATOM 0 HG21 THR A 62 3.650 6.551 2.920 1.00 0.00 H new ATOM 0 HG22 THR A 62 2.686 7.116 4.305 1.00 0.00 H new ATOM 0 HG23 THR A 62 3.008 5.378 4.094 1.00 0.00 H new ATOM 946 N ILE A 63 0.692 3.601 4.392 1.00 0.00 N ATOM 947 CA ILE A 63 1.024 2.575 5.360 1.00 0.00 C ATOM 948 C ILE A 63 2.277 1.813 4.952 1.00 0.00 C ATOM 949 O ILE A 63 2.441 1.437 3.793 1.00 0.00 O ATOM 950 CB ILE A 63 -0.138 1.576 5.533 1.00 0.00 C ATOM 951 CG1 ILE A 63 -1.343 2.268 6.173 1.00 0.00 C ATOM 952 CG2 ILE A 63 0.297 0.376 6.364 1.00 0.00 C ATOM 953 CD1 ILE A 63 -2.546 1.364 6.344 1.00 0.00 C ATOM 0 H ILE A 63 0.466 3.245 3.463 1.00 0.00 H new ATOM 0 HA ILE A 63 1.207 3.082 6.308 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.429 1.214 4.547 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.051 2.657 7.148 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.627 3.123 5.560 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -0.540 -0.314 6.472 1.00 0.00 H new ATOM 0 HG22 ILE A 63 1.124 -0.131 5.866 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.619 0.713 7.349 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.360 1.925 6.804 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.865 0.995 5.369 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -2.280 0.521 6.982 1.00 0.00 H new ATOM 965 N ASP A 64 3.150 1.574 5.920 1.00 0.00 N ATOM 966 CA ASP A 64 4.381 0.844 5.669 1.00 0.00 C ATOM 967 C ASP A 64 4.283 -0.559 6.242 1.00 0.00 C ATOM 968 O ASP A 64 3.360 -0.856 6.997 1.00 0.00 O ATOM 969 CB ASP A 64 5.596 1.580 6.243 1.00 0.00 C ATOM 970 CG ASP A 64 5.542 1.728 7.752 1.00 0.00 C ATOM 971 OD1 ASP A 64 5.445 0.696 8.450 1.00 0.00 O ATOM 972 OD2 ASP A 64 5.613 2.876 8.236 1.00 0.00 O ATOM 0 H ASP A 64 3.027 1.876 6.887 1.00 0.00 H new ATOM 0 HA ASP A 64 4.520 0.775 4.590 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.503 1.041 5.969 1.00 0.00 H new ATOM 0 HB3 ASP A 64 5.663 2.569 5.789 1.00 0.00 H new ATOM 977 N TYR A 65 5.227 -1.417 5.867 1.00 0.00 N ATOM 978 CA TYR A 65 5.246 -2.799 6.332 1.00 0.00 C ATOM 979 C TYR A 65 4.772 -2.912 7.775 1.00 0.00 C ATOM 980 O TYR A 65 3.919 -3.740 8.092 1.00 0.00 O ATOM 981 CB TYR A 65 6.651 -3.390 6.210 1.00 0.00 C ATOM 982 CG TYR A 65 6.756 -4.790 6.769 1.00 0.00 C ATOM 983 CD1 TYR A 65 5.814 -5.757 6.441 1.00 0.00 C ATOM 984 CD2 TYR A 65 7.782 -5.142 7.636 1.00 0.00 C ATOM 985 CE1 TYR A 65 5.891 -7.032 6.958 1.00 0.00 C ATOM 986 CE2 TYR A 65 7.869 -6.419 8.156 1.00 0.00 C ATOM 987 CZ TYR A 65 6.920 -7.361 7.814 1.00 0.00 C ATOM 988 OH TYR A 65 7.001 -8.634 8.332 1.00 0.00 O ATOM 0 H TYR A 65 5.993 -1.177 5.238 1.00 0.00 H new ATOM 0 HA TYR A 65 4.560 -3.361 5.699 1.00 0.00 H new ATOM 0 HB2 TYR A 65 6.944 -3.402 5.160 1.00 0.00 H new ATOM 0 HB3 TYR A 65 7.357 -2.743 6.731 1.00 0.00 H new ATOM 0 HD1 TYR A 65 5.007 -5.505 5.769 1.00 0.00 H new ATOM 0 HD2 TYR A 65 8.524 -4.406 7.908 1.00 0.00 H new ATOM 0 HE1 TYR A 65 5.148 -7.770 6.694 1.00 0.00 H new ATOM 0 HE2 TYR A 65 8.675 -6.679 8.826 1.00 0.00 H new ATOM 0 HH TYR A 65 7.785 -8.700 8.916 1.00 0.00 H new ATOM 998 N GLY A 66 5.335 -2.083 8.644 1.00 0.00 N ATOM 999 CA GLY A 66 4.957 -2.120 10.040 1.00 0.00 C ATOM 1000 C GLY A 66 3.500 -1.763 10.262 1.00 0.00 C ATOM 1001 O GLY A 66 2.727 -2.570 10.785 1.00 0.00 O ATOM 0 H GLY A 66 6.044 -1.389 8.407 1.00 0.00 H new ATOM 0 HA2 GLY A 66 5.147 -3.117 10.437 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.586 -1.428 10.601 1.00 0.00 H new ATOM 1005 N GLU A 67 3.123 -0.550 9.864 1.00 0.00 N ATOM 1006 CA GLU A 67 1.754 -0.086 10.019 1.00 0.00 C ATOM 1007 C GLU A 67 0.776 -1.077 9.390 1.00 0.00 C ATOM 1008 O GLU A 67 -0.386 -1.150 9.786 1.00 0.00 O ATOM 1009 CB GLU A 67 1.601 1.292 9.375 1.00 0.00 C ATOM 1010 CG GLU A 67 2.722 2.252 9.739 1.00 0.00 C ATOM 1011 CD GLU A 67 2.542 3.624 9.123 1.00 0.00 C ATOM 1012 OE1 GLU A 67 1.584 4.320 9.506 1.00 0.00 O ATOM 1013 OE2 GLU A 67 3.355 4.001 8.255 1.00 0.00 O ATOM 0 H GLU A 67 3.751 0.128 9.431 1.00 0.00 H new ATOM 0 HA GLU A 67 1.526 -0.011 11.082 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.567 1.178 8.292 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.648 1.724 9.680 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.773 2.349 10.823 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.674 1.833 9.411 1.00 0.00 H new ATOM 1020 N PHE A 68 1.262 -1.845 8.414 1.00 0.00 N ATOM 1021 CA PHE A 68 0.438 -2.839 7.738 1.00 0.00 C ATOM 1022 C PHE A 68 0.019 -3.924 8.704 1.00 0.00 C ATOM 1023 O PHE A 68 -1.155 -4.278 8.796 1.00 0.00 O ATOM 1024 CB PHE A 68 1.200 -3.488 6.591 1.00 0.00 C ATOM 1025 CG PHE A 68 0.343 -4.353 5.725 1.00 0.00 C ATOM 1026 CD1 PHE A 68 -0.673 -3.805 4.968 1.00 0.00 C ATOM 1027 CD2 PHE A 68 0.564 -5.718 5.663 1.00 0.00 C ATOM 1028 CE1 PHE A 68 -1.458 -4.604 4.164 1.00 0.00 C ATOM 1029 CE2 PHE A 68 -0.215 -6.523 4.859 1.00 0.00 C ATOM 1030 CZ PHE A 68 -1.228 -5.966 4.109 1.00 0.00 C ATOM 0 H PHE A 68 2.223 -1.795 8.076 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.441 -2.324 7.349 1.00 0.00 H new ATOM 0 HB2 PHE A 68 1.653 -2.709 5.978 1.00 0.00 H new ATOM 0 HB3 PHE A 68 2.014 -4.087 6.998 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -0.855 -2.741 5.006 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.356 -6.158 6.251 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.252 -4.166 3.578 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.032 -7.587 4.817 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.842 -6.593 3.479 1.00 0.00 H new ATOM 1040 N ILE A 69 1.003 -4.461 9.404 1.00 0.00 N ATOM 1041 CA ILE A 69 0.767 -5.526 10.354 1.00 0.00 C ATOM 1042 C ILE A 69 -0.188 -5.080 11.452 1.00 0.00 C ATOM 1043 O ILE A 69 -1.171 -5.761 11.743 1.00 0.00 O ATOM 1044 CB ILE A 69 2.077 -6.019 10.986 1.00 0.00 C ATOM 1045 CG1 ILE A 69 3.221 -6.008 9.965 1.00 0.00 C ATOM 1046 CG2 ILE A 69 1.870 -7.417 11.518 1.00 0.00 C ATOM 1047 CD1 ILE A 69 2.931 -6.804 8.708 1.00 0.00 C ATOM 0 H ILE A 69 1.978 -4.172 9.329 1.00 0.00 H new ATOM 0 HA ILE A 69 0.315 -6.349 9.801 1.00 0.00 H new ATOM 0 HB ILE A 69 2.351 -5.348 11.800 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.437 -4.976 9.688 1.00 0.00 H new ATOM 0 HG13 ILE A 69 4.119 -6.407 10.436 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.795 -7.775 11.969 1.00 0.00 H new ATOM 0 HG22 ILE A 69 1.080 -7.407 12.269 1.00 0.00 H new ATOM 0 HG23 ILE A 69 1.585 -8.079 10.700 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.787 -6.748 8.036 1.00 0.00 H new ATOM 0 HD12 ILE A 69 2.745 -7.845 8.972 1.00 0.00 H new ATOM 0 HD13 ILE A 69 2.052 -6.393 8.211 1.00 0.00 H new ATOM 1059 N ALA A 70 0.098 -3.930 12.054 1.00 0.00 N ATOM 1060 CA ALA A 70 -0.755 -3.401 13.112 1.00 0.00 C ATOM 1061 C ALA A 70 -2.166 -3.168 12.584 1.00 0.00 C ATOM 1062 O ALA A 70 -3.144 -3.268 13.323 1.00 0.00 O ATOM 1063 CB ALA A 70 -0.173 -2.109 13.668 1.00 0.00 C ATOM 0 H ALA A 70 0.907 -3.351 11.830 1.00 0.00 H new ATOM 0 HA ALA A 70 -0.803 -4.131 13.920 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.822 -1.727 14.457 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.819 -2.303 14.076 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -0.099 -1.370 12.870 1.00 0.00 H new ATOM 1069 N ALA A 71 -2.252 -2.862 11.294 1.00 0.00 N ATOM 1070 CA ALA A 71 -3.532 -2.616 10.642 1.00 0.00 C ATOM 1071 C ALA A 71 -4.317 -3.913 10.460 1.00 0.00 C ATOM 1072 O ALA A 71 -5.514 -3.968 10.735 1.00 0.00 O ATOM 1073 CB ALA A 71 -3.320 -1.933 9.299 1.00 0.00 C ATOM 0 H ALA A 71 -1.445 -2.778 10.676 1.00 0.00 H new ATOM 0 HA ALA A 71 -4.115 -1.956 11.284 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -4.285 -1.756 8.824 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.811 -0.981 9.451 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -2.712 -2.572 8.658 1.00 0.00 H new ATOM 1303 N VAL A 85 -15.602 0.507 20.688 1.00 0.00 N ATOM 1304 CA VAL A 85 -14.508 0.282 19.747 1.00 0.00 C ATOM 1305 C VAL A 85 -14.384 1.436 18.755 1.00 0.00 C ATOM 1306 O VAL A 85 -13.312 1.671 18.194 1.00 0.00 O ATOM 1307 CB VAL A 85 -14.693 -1.043 18.982 1.00 0.00 C ATOM 1308 CG1 VAL A 85 -16.016 -1.050 18.231 1.00 0.00 C ATOM 1309 CG2 VAL A 85 -13.529 -1.288 18.031 1.00 0.00 C ATOM 0 HA VAL A 85 -13.590 0.224 20.332 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.710 -1.855 19.709 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.127 -1.994 17.698 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -16.837 -0.935 18.939 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -16.034 -0.226 17.518 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -13.683 -2.229 17.503 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -13.470 -0.473 17.310 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -12.600 -1.338 18.599 1.00 0.00 H new ATOM 1319 N SER A 86 -15.480 2.165 18.560 1.00 0.00 N ATOM 1320 CA SER A 86 -15.482 3.305 17.651 1.00 0.00 C ATOM 1321 C SER A 86 -14.399 4.290 18.063 1.00 0.00 C ATOM 1322 O SER A 86 -13.639 4.789 17.230 1.00 0.00 O ATOM 1323 CB SER A 86 -16.847 3.993 17.656 1.00 0.00 C ATOM 1324 OG SER A 86 -17.867 3.106 17.228 1.00 0.00 O ATOM 0 H SER A 86 -16.374 1.987 19.018 1.00 0.00 H new ATOM 0 HA SER A 86 -15.280 2.949 16.641 1.00 0.00 H new ATOM 0 HB2 SER A 86 -17.072 4.354 18.660 1.00 0.00 H new ATOM 0 HB3 SER A 86 -16.821 4.865 17.002 1.00 0.00 H new ATOM 0 HG SER A 86 -18.730 3.569 17.242 1.00 0.00 H new ATOM 1330 N ALA A 87 -14.322 4.543 19.363 1.00 0.00 N ATOM 1331 CA ALA A 87 -13.323 5.443 19.911 1.00 0.00 C ATOM 1332 C ALA A 87 -11.967 4.754 19.938 1.00 0.00 C ATOM 1333 O ALA A 87 -10.998 5.251 19.377 1.00 0.00 O ATOM 1334 CB ALA A 87 -13.729 5.888 21.302 1.00 0.00 C ATOM 0 H ALA A 87 -14.945 4.133 20.059 1.00 0.00 H new ATOM 0 HA ALA A 87 -13.250 6.327 19.278 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -12.973 6.563 21.703 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -14.687 6.405 21.253 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -13.819 5.017 21.951 1.00 0.00 H new ATOM 1340 N PHE A 88 -11.924 3.592 20.578 1.00 0.00 N ATOM 1341 CA PHE A 88 -10.707 2.789 20.670 1.00 0.00 C ATOM 1342 C PHE A 88 -9.950 2.797 19.338 1.00 0.00 C ATOM 1343 O PHE A 88 -8.736 2.617 19.297 1.00 0.00 O ATOM 1344 CB PHE A 88 -11.102 1.366 21.075 1.00 0.00 C ATOM 1345 CG PHE A 88 -9.964 0.422 21.342 1.00 0.00 C ATOM 1346 CD1 PHE A 88 -8.733 0.866 21.813 1.00 0.00 C ATOM 1347 CD2 PHE A 88 -10.144 -0.935 21.131 1.00 0.00 C ATOM 1348 CE1 PHE A 88 -7.717 -0.031 22.061 1.00 0.00 C ATOM 1349 CE2 PHE A 88 -9.129 -1.831 21.382 1.00 0.00 C ATOM 1350 CZ PHE A 88 -7.913 -1.380 21.846 1.00 0.00 C ATOM 0 H PHE A 88 -12.729 3.179 21.048 1.00 0.00 H new ATOM 0 HA PHE A 88 -10.037 3.209 21.420 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -11.720 1.422 21.971 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -11.723 0.943 20.285 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.573 1.920 21.985 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -11.094 -1.295 20.764 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -6.764 0.323 22.425 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -9.286 -2.886 21.215 1.00 0.00 H new ATOM 0 HZ PHE A 88 -7.115 -2.081 22.041 1.00 0.00 H new ATOM 1360 N SER A 89 -10.677 3.014 18.248 1.00 0.00 N ATOM 1361 CA SER A 89 -10.066 3.069 16.926 1.00 0.00 C ATOM 1362 C SER A 89 -9.646 4.491 16.533 1.00 0.00 C ATOM 1363 O SER A 89 -8.459 4.758 16.343 1.00 0.00 O ATOM 1364 CB SER A 89 -11.014 2.497 15.885 1.00 0.00 C ATOM 1365 OG SER A 89 -11.425 1.184 16.231 1.00 0.00 O ATOM 0 H SER A 89 -11.687 3.154 18.254 1.00 0.00 H new ATOM 0 HA SER A 89 -9.160 2.465 16.966 1.00 0.00 H new ATOM 0 HB2 SER A 89 -11.888 3.142 15.792 1.00 0.00 H new ATOM 0 HB3 SER A 89 -10.524 2.483 14.912 1.00 0.00 H new ATOM 0 HG SER A 89 -12.117 1.230 16.923 1.00 0.00 H new ATOM 1371 N TYR A 90 -10.621 5.396 16.386 1.00 0.00 N ATOM 1372 CA TYR A 90 -10.329 6.774 15.983 1.00 0.00 C ATOM 1373 C TYR A 90 -9.821 7.610 17.157 1.00 0.00 C ATOM 1374 O TYR A 90 -8.838 8.341 17.031 1.00 0.00 O ATOM 1375 CB TYR A 90 -11.565 7.434 15.380 1.00 0.00 C ATOM 1376 CG TYR A 90 -11.243 8.731 14.678 1.00 0.00 C ATOM 1377 CD1 TYR A 90 -10.705 8.741 13.394 1.00 0.00 C ATOM 1378 CD2 TYR A 90 -11.458 9.949 15.308 1.00 0.00 C ATOM 1379 CE1 TYR A 90 -10.394 9.924 12.766 1.00 0.00 C ATOM 1380 CE2 TYR A 90 -11.147 11.140 14.681 1.00 0.00 C ATOM 1381 CZ TYR A 90 -10.614 11.122 13.411 1.00 0.00 C ATOM 1382 OH TYR A 90 -10.301 12.306 12.783 1.00 0.00 O ATOM 0 H TYR A 90 -11.610 5.200 16.539 1.00 0.00 H new ATOM 0 HA TYR A 90 -9.542 6.728 15.230 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -12.031 6.748 14.673 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -12.294 7.622 16.169 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -10.529 7.806 12.884 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -11.875 9.966 16.304 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -9.978 9.914 11.769 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -11.321 12.080 15.184 1.00 0.00 H new ATOM 0 HH TYR A 90 -10.518 13.057 13.374 1.00 0.00 H new ATOM 1392 N PHE A 91 -10.454 7.442 18.313 1.00 0.00 N ATOM 1393 CA PHE A 91 -10.004 8.133 19.516 1.00 0.00 C ATOM 1394 C PHE A 91 -8.614 7.604 19.807 1.00 0.00 C ATOM 1395 O PHE A 91 -7.626 8.323 19.661 1.00 0.00 O ATOM 1396 CB PHE A 91 -10.960 7.925 20.691 1.00 0.00 C ATOM 1397 CG PHE A 91 -12.197 8.781 20.605 1.00 0.00 C ATOM 1398 CD1 PHE A 91 -12.998 8.762 19.473 1.00 0.00 C ATOM 1399 CD2 PHE A 91 -12.556 9.606 21.658 1.00 0.00 C ATOM 1400 CE1 PHE A 91 -14.132 9.550 19.395 1.00 0.00 C ATOM 1401 CE2 PHE A 91 -13.688 10.396 21.586 1.00 0.00 C ATOM 1402 CZ PHE A 91 -14.477 10.367 20.453 1.00 0.00 C ATOM 0 H PHE A 91 -11.269 6.842 18.443 1.00 0.00 H new ATOM 0 HA PHE A 91 -9.985 9.212 19.363 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -11.253 6.876 20.732 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -10.436 8.146 21.621 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -12.733 8.124 18.643 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -11.943 9.632 22.547 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -14.747 9.526 18.507 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -13.955 11.035 22.415 1.00 0.00 H new ATOM 0 HZ PHE A 91 -15.363 10.982 20.395 1.00 0.00 H new ATOM 1412 N ASP A 92 -8.538 6.312 20.114 1.00 0.00 N ATOM 1413 CA ASP A 92 -7.255 5.660 20.291 1.00 0.00 C ATOM 1414 C ASP A 92 -6.706 5.405 18.896 1.00 0.00 C ATOM 1415 O ASP A 92 -6.700 4.279 18.405 1.00 0.00 O ATOM 1416 CB ASP A 92 -7.409 4.344 21.053 1.00 0.00 C ATOM 1417 CG ASP A 92 -6.101 3.586 21.193 1.00 0.00 C ATOM 1418 OD1 ASP A 92 -5.072 4.069 20.674 1.00 0.00 O ATOM 1419 OD2 ASP A 92 -6.106 2.507 21.821 1.00 0.00 O ATOM 0 H ASP A 92 -9.347 5.704 20.244 1.00 0.00 H new ATOM 0 HA ASP A 92 -6.580 6.286 20.875 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -7.812 4.549 22.045 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -8.135 3.714 20.538 1.00 0.00 H new ATOM 1424 N LYS A 93 -6.321 6.493 18.246 1.00 0.00 N ATOM 1425 CA LYS A 93 -5.835 6.469 16.878 1.00 0.00 C ATOM 1426 C LYS A 93 -4.865 5.329 16.602 1.00 0.00 C ATOM 1427 O LYS A 93 -5.017 4.613 15.613 1.00 0.00 O ATOM 1428 CB LYS A 93 -5.183 7.799 16.547 1.00 0.00 C ATOM 1429 CG LYS A 93 -5.043 8.034 15.058 1.00 0.00 C ATOM 1430 CD LYS A 93 -4.936 9.514 14.737 1.00 0.00 C ATOM 1431 CE LYS A 93 -6.253 10.233 15.001 1.00 0.00 C ATOM 1432 NZ LYS A 93 -6.114 11.711 14.878 1.00 0.00 N ATOM 0 H LYS A 93 -6.338 7.426 18.659 1.00 0.00 H new ATOM 0 HA LYS A 93 -6.700 6.299 16.237 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -5.773 8.605 16.983 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -4.197 7.839 17.010 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.159 7.515 14.688 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -5.902 7.609 14.539 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.147 9.963 15.340 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -4.652 9.642 13.693 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.007 9.880 14.297 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -6.608 9.984 16.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -7.032 12.163 15.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.413 12.052 15.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.800 11.951 13.916 1.00 0.00 H new ATOM 1446 N ASP A 94 -3.866 5.165 17.454 1.00 0.00 N ATOM 1447 CA ASP A 94 -2.890 4.108 17.250 1.00 0.00 C ATOM 1448 C ASP A 94 -3.545 2.744 17.443 1.00 0.00 C ATOM 1449 O ASP A 94 -3.074 1.735 16.917 1.00 0.00 O ATOM 1450 CB ASP A 94 -1.724 4.297 18.219 1.00 0.00 C ATOM 1451 CG ASP A 94 -0.646 3.242 18.066 1.00 0.00 C ATOM 1452 OD1 ASP A 94 -0.947 2.047 18.256 1.00 0.00 O ATOM 1453 OD2 ASP A 94 0.506 3.615 17.757 1.00 0.00 O ATOM 0 H ASP A 94 -3.711 5.741 18.281 1.00 0.00 H new ATOM 0 HA ASP A 94 -2.508 4.157 16.230 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -1.285 5.282 18.062 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -2.102 4.276 19.241 1.00 0.00 H new ATOM 1458 N GLY A 95 -4.652 2.732 18.183 1.00 0.00 N ATOM 1459 CA GLY A 95 -5.380 1.503 18.426 1.00 0.00 C ATOM 1460 C GLY A 95 -4.487 0.383 18.907 1.00 0.00 C ATOM 1461 O GLY A 95 -4.488 -0.712 18.345 1.00 0.00 O ATOM 0 H GLY A 95 -5.058 3.559 18.620 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -6.158 1.686 19.168 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -5.881 1.194 17.508 1.00 0.00 H new ATOM 1465 N SER A 96 -3.750 0.656 19.973 1.00 0.00 N ATOM 1466 CA SER A 96 -2.867 -0.321 20.584 1.00 0.00 C ATOM 1467 C SER A 96 -3.239 -0.419 22.051 1.00 0.00 C ATOM 1468 O SER A 96 -2.515 -0.987 22.869 1.00 0.00 O ATOM 1469 CB SER A 96 -1.406 0.112 20.436 1.00 0.00 C ATOM 1470 OG SER A 96 -1.211 1.426 20.937 1.00 0.00 O ATOM 0 H SER A 96 -3.749 1.564 20.438 1.00 0.00 H new ATOM 0 HA SER A 96 -2.976 -1.289 20.095 1.00 0.00 H new ATOM 0 HB2 SER A 96 -0.761 -0.585 20.971 1.00 0.00 H new ATOM 0 HB3 SER A 96 -1.116 0.073 19.386 1.00 0.00 H new ATOM 0 HG SER A 96 -1.220 2.064 20.193 1.00 0.00 H new ATOM 1476 N GLY A 97 -4.390 0.172 22.356 1.00 0.00 N ATOM 1477 CA GLY A 97 -4.899 0.197 23.704 1.00 0.00 C ATOM 1478 C GLY A 97 -4.313 1.336 24.492 1.00 0.00 C ATOM 1479 O GLY A 97 -4.282 1.300 25.717 1.00 0.00 O ATOM 0 H GLY A 97 -4.985 0.641 21.674 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -5.985 0.288 23.683 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -4.668 -0.746 24.199 1.00 0.00 H new ATOM 1483 N TYR A 98 -3.820 2.337 23.776 1.00 0.00 N ATOM 1484 CA TYR A 98 -3.196 3.492 24.400 1.00 0.00 C ATOM 1485 C TYR A 98 -3.494 4.798 23.655 1.00 0.00 C ATOM 1486 O TYR A 98 -3.330 4.890 22.438 1.00 0.00 O ATOM 1487 CB TYR A 98 -1.671 3.310 24.463 1.00 0.00 C ATOM 1488 CG TYR A 98 -1.168 2.227 25.399 1.00 0.00 C ATOM 1489 CD1 TYR A 98 -1.425 0.882 25.160 1.00 0.00 C ATOM 1490 CD2 TYR A 98 -0.422 2.559 26.523 1.00 0.00 C ATOM 1491 CE1 TYR A 98 -0.956 -0.099 26.014 1.00 0.00 C ATOM 1492 CE2 TYR A 98 0.049 1.584 27.383 1.00 0.00 C ATOM 1493 CZ TYR A 98 -0.221 0.258 27.124 1.00 0.00 C ATOM 1494 OH TYR A 98 0.246 -0.715 27.977 1.00 0.00 O ATOM 0 H TYR A 98 -3.841 2.371 22.757 1.00 0.00 H new ATOM 0 HA TYR A 98 -3.618 3.562 25.402 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -1.309 3.091 23.458 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -1.224 4.258 24.763 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -2.001 0.598 24.292 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.206 3.597 26.729 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -1.164 -1.139 25.812 1.00 0.00 H new ATOM 0 HE2 TYR A 98 0.626 1.861 28.253 1.00 0.00 H new ATOM 0 HH TYR A 98 0.746 -0.296 28.708 1.00 0.00 H new ATOM 1504 N ILE A 99 -3.895 5.811 24.416 1.00 0.00 N ATOM 1505 CA ILE A 99 -4.180 7.137 23.862 1.00 0.00 C ATOM 1506 C ILE A 99 -3.456 8.202 24.671 1.00 0.00 C ATOM 1507 O ILE A 99 -3.909 8.566 25.743 1.00 0.00 O ATOM 1508 CB ILE A 99 -5.687 7.453 23.916 1.00 0.00 C ATOM 1509 CG1 ILE A 99 -6.492 6.333 23.294 1.00 0.00 C ATOM 1510 CG2 ILE A 99 -5.989 8.774 23.232 1.00 0.00 C ATOM 1511 CD1 ILE A 99 -7.988 6.535 23.428 1.00 0.00 C ATOM 0 H ILE A 99 -4.032 5.742 25.424 1.00 0.00 H new ATOM 0 HA ILE A 99 -3.843 7.137 22.825 1.00 0.00 H new ATOM 0 HB ILE A 99 -5.976 7.541 24.963 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -6.235 6.251 22.238 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -6.215 5.389 23.764 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.059 8.974 23.284 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -5.445 9.575 23.732 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -5.680 8.722 22.188 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -8.511 5.699 22.963 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -8.255 6.588 24.483 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -8.276 7.463 22.934 1.00 0.00 H new ATOM 1523 N THR A 100 -2.345 8.715 24.167 1.00 0.00 N ATOM 1524 CA THR A 100 -1.600 9.726 24.892 1.00 0.00 C ATOM 1525 C THR A 100 -2.307 11.067 24.840 1.00 0.00 C ATOM 1526 O THR A 100 -3.192 11.279 24.013 1.00 0.00 O ATOM 1527 CB THR A 100 -0.193 9.848 24.312 1.00 0.00 C ATOM 1528 OG1 THR A 100 -0.239 10.329 22.981 1.00 0.00 O ATOM 1529 CG2 THR A 100 0.554 8.533 24.298 1.00 0.00 C ATOM 0 H THR A 100 -1.944 8.450 23.267 1.00 0.00 H new ATOM 0 HA THR A 100 -1.533 9.421 25.936 1.00 0.00 H new ATOM 0 HB THR A 100 0.333 10.546 24.963 1.00 0.00 H new ATOM 0 HG1 THR A 100 0.672 10.402 22.628 1.00 0.00 H new ATOM 0 HG21 THR A 100 1.547 8.683 23.875 1.00 0.00 H new ATOM 0 HG22 THR A 100 0.647 8.156 25.317 1.00 0.00 H new ATOM 0 HG23 THR A 100 0.007 7.810 23.692 1.00 0.00 H new ATOM 1537 N LEU A 101 -1.887 11.968 25.719 1.00 0.00 N ATOM 1538 CA LEU A 101 -2.448 13.308 25.772 1.00 0.00 C ATOM 1539 C LEU A 101 -2.661 13.852 24.363 1.00 0.00 C ATOM 1540 O LEU A 101 -3.634 14.546 24.097 1.00 0.00 O ATOM 1541 CB LEU A 101 -1.517 14.241 26.538 1.00 0.00 C ATOM 1542 CG LEU A 101 -0.065 14.222 26.063 1.00 0.00 C ATOM 1543 CD1 LEU A 101 0.588 15.573 26.307 1.00 0.00 C ATOM 1544 CD2 LEU A 101 0.716 13.126 26.773 1.00 0.00 C ATOM 0 H LEU A 101 -1.156 11.792 26.408 1.00 0.00 H new ATOM 0 HA LEU A 101 -3.408 13.255 26.285 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -1.898 15.259 26.458 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.543 13.973 27.594 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.056 14.016 24.993 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.622 15.545 25.964 1.00 0.00 H new ATOM 0 HD12 LEU A 101 0.045 16.344 25.760 1.00 0.00 H new ATOM 0 HD13 LEU A 101 0.566 15.801 27.373 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.748 13.128 26.421 1.00 0.00 H new ATOM 0 HD22 LEU A 101 0.699 13.305 27.848 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.262 12.159 26.559 1.00 0.00 H new ATOM 1556 N ASP A 102 -1.744 13.521 23.460 1.00 0.00 N ATOM 1557 CA ASP A 102 -1.833 13.970 22.076 1.00 0.00 C ATOM 1558 C ASP A 102 -3.023 13.316 21.384 1.00 0.00 C ATOM 1559 O ASP A 102 -3.869 13.996 20.802 1.00 0.00 O ATOM 1560 CB ASP A 102 -0.538 13.643 21.328 1.00 0.00 C ATOM 1561 CG ASP A 102 -0.526 14.187 19.912 1.00 0.00 C ATOM 1562 OD1 ASP A 102 -1.508 14.850 19.519 1.00 0.00 O ATOM 1563 OD2 ASP A 102 0.471 13.953 19.195 1.00 0.00 O ATOM 0 H ASP A 102 -0.929 12.942 23.663 1.00 0.00 H new ATOM 0 HA ASP A 102 -1.976 15.050 22.068 1.00 0.00 H new ATOM 0 HB2 ASP A 102 0.308 14.055 21.878 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -0.403 12.562 21.299 1.00 0.00 H new ATOM 1568 N GLU A 103 -3.089 11.991 21.466 1.00 0.00 N ATOM 1569 CA GLU A 103 -4.180 11.236 20.864 1.00 0.00 C ATOM 1570 C GLU A 103 -5.506 11.574 21.541 1.00 0.00 C ATOM 1571 O GLU A 103 -6.579 11.281 21.014 1.00 0.00 O ATOM 1572 CB GLU A 103 -3.904 9.736 20.974 1.00 0.00 C ATOM 1573 CG GLU A 103 -2.706 9.268 20.161 1.00 0.00 C ATOM 1574 CD GLU A 103 -2.489 7.765 20.244 1.00 0.00 C ATOM 1575 OE1 GLU A 103 -2.276 7.253 21.365 1.00 0.00 O ATOM 1576 OE2 GLU A 103 -2.530 7.101 19.188 1.00 0.00 O ATOM 0 H GLU A 103 -2.396 11.417 21.946 1.00 0.00 H new ATOM 0 HA GLU A 103 -4.249 11.510 19.811 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -3.741 9.482 22.022 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -4.788 9.189 20.647 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -2.846 9.553 19.118 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -1.811 9.780 20.514 1.00 0.00 H new ATOM 1583 N ILE A 104 -5.416 12.194 22.714 1.00 0.00 N ATOM 1584 CA ILE A 104 -6.595 12.582 23.480 1.00 0.00 C ATOM 1585 C ILE A 104 -7.096 13.961 23.058 1.00 0.00 C ATOM 1586 O ILE A 104 -8.216 14.103 22.566 1.00 0.00 O ATOM 1587 CB ILE A 104 -6.281 12.610 24.989 1.00 0.00 C ATOM 1588 CG1 ILE A 104 -5.968 11.207 25.507 1.00 0.00 C ATOM 1589 CG2 ILE A 104 -7.440 13.213 25.770 1.00 0.00 C ATOM 1590 CD1 ILE A 104 -5.437 11.199 26.924 1.00 0.00 C ATOM 0 H ILE A 104 -4.531 12.440 23.157 1.00 0.00 H new ATOM 0 HA ILE A 104 -7.369 11.841 23.279 1.00 0.00 H new ATOM 0 HB ILE A 104 -5.401 13.236 25.136 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -6.872 10.600 25.461 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -5.236 10.739 24.849 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -7.197 13.223 26.832 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -7.617 14.233 25.429 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -8.337 12.616 25.609 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -5.235 10.173 27.231 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -4.516 11.780 26.971 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -6.177 11.639 27.592 1.00 0.00 H new ATOM 1602 N GLN A 105 -6.257 14.972 23.265 1.00 0.00 N ATOM 1603 CA GLN A 105 -6.601 16.346 22.918 1.00 0.00 C ATOM 1604 C GLN A 105 -7.119 16.434 21.484 1.00 0.00 C ATOM 1605 O GLN A 105 -8.188 16.990 21.235 1.00 0.00 O ATOM 1606 CB GLN A 105 -5.382 17.259 23.089 1.00 0.00 C ATOM 1607 CG GLN A 105 -4.726 17.179 24.461 1.00 0.00 C ATOM 1608 CD GLN A 105 -5.675 17.439 25.612 1.00 0.00 C ATOM 1609 OE1 GLN A 105 -6.598 16.662 25.857 1.00 0.00 O ATOM 1610 NE2 GLN A 105 -5.452 18.534 26.329 1.00 0.00 N ATOM 0 H GLN A 105 -5.329 14.863 23.674 1.00 0.00 H new ATOM 0 HA GLN A 105 -7.392 16.676 23.592 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -4.642 17.004 22.330 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -5.686 18.289 22.904 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -4.284 16.190 24.584 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -3.910 17.901 24.505 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -4.675 19.150 26.091 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -6.058 18.759 27.118 1.00 0.00 H new ATOM 1619 N GLN A 106 -6.355 15.879 20.545 1.00 0.00 N ATOM 1620 CA GLN A 106 -6.740 15.895 19.136 1.00 0.00 C ATOM 1621 C GLN A 106 -8.064 15.169 18.917 1.00 0.00 C ATOM 1622 O GLN A 106 -8.830 15.519 18.019 1.00 0.00 O ATOM 1623 CB GLN A 106 -5.653 15.258 18.269 1.00 0.00 C ATOM 1624 CG GLN A 106 -4.335 16.017 18.283 1.00 0.00 C ATOM 1625 CD GLN A 106 -3.308 15.450 17.316 1.00 0.00 C ATOM 1626 OE1 GLN A 106 -3.664 14.378 16.615 1.00 0.00 O flip ATOM 1627 NE2 GLN A 106 -2.201 15.975 17.199 1.00 0.00 N flip ATOM 0 H GLN A 106 -5.467 15.414 20.734 1.00 0.00 H new ATOM 0 HA GLN A 106 -6.863 16.938 18.843 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -5.478 14.238 18.612 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -6.013 15.191 17.242 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -4.522 17.061 18.033 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -3.923 15.999 19.292 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -1.965 16.797 17.755 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -1.519 15.588 16.546 1.00 0.00 H new ATOM 1636 N ALA A 107 -8.329 14.158 19.740 1.00 0.00 N ATOM 1637 CA ALA A 107 -9.564 13.391 19.627 1.00 0.00 C ATOM 1638 C ALA A 107 -10.782 14.290 19.809 1.00 0.00 C ATOM 1639 O ALA A 107 -11.884 13.957 19.372 1.00 0.00 O ATOM 1640 CB ALA A 107 -9.583 12.261 20.646 1.00 0.00 C ATOM 0 H ALA A 107 -7.708 13.853 20.489 1.00 0.00 H new ATOM 0 HA ALA A 107 -9.605 12.960 18.627 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -10.511 11.698 20.548 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -8.736 11.598 20.469 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -9.515 12.677 21.651 1.00 0.00 H new ATOM 1646 N CYS A 108 -10.572 15.433 20.453 1.00 0.00 N ATOM 1647 CA CYS A 108 -11.646 16.388 20.693 1.00 0.00 C ATOM 1648 C CYS A 108 -11.361 17.710 19.983 1.00 0.00 C ATOM 1649 O CYS A 108 -11.131 18.736 20.625 1.00 0.00 O ATOM 1650 CB CYS A 108 -11.811 16.621 22.195 1.00 0.00 C ATOM 1651 SG CYS A 108 -12.273 15.141 23.124 1.00 0.00 S ATOM 0 H CYS A 108 -9.664 15.721 20.819 1.00 0.00 H new ATOM 0 HA CYS A 108 -12.572 15.976 20.292 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -10.876 17.012 22.596 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -12.570 17.387 22.352 1.00 0.00 H new ATOM 0 HG CYS A 108 -13.404 15.346 23.732 1.00 0.00 H new ATOM 1657 N LYS A 109 -11.371 17.675 18.653 1.00 0.00 N ATOM 1658 CA LYS A 109 -11.108 18.867 17.851 1.00 0.00 C ATOM 1659 C LYS A 109 -12.336 19.772 17.790 1.00 0.00 C ATOM 1660 O LYS A 109 -12.219 20.997 17.848 1.00 0.00 O ATOM 1661 CB LYS A 109 -10.665 18.487 16.431 1.00 0.00 C ATOM 1662 CG LYS A 109 -11.762 17.875 15.564 1.00 0.00 C ATOM 1663 CD LYS A 109 -12.189 16.505 16.065 1.00 0.00 C ATOM 1664 CE LYS A 109 -13.251 15.888 15.169 1.00 0.00 C ATOM 1665 NZ LYS A 109 -12.747 15.663 13.785 1.00 0.00 N ATOM 0 H LYS A 109 -11.558 16.834 18.107 1.00 0.00 H new ATOM 0 HA LYS A 109 -10.299 19.414 18.334 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -10.282 19.378 15.934 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -9.838 17.780 16.500 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -12.625 18.540 15.549 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -11.407 17.790 14.537 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -11.322 15.846 16.109 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -12.575 16.592 17.081 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -13.579 14.940 15.595 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -14.123 16.541 15.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -13.401 15.035 13.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -12.682 16.574 13.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -11.806 15.223 13.826 1.00 0.00 H new ATOM 1679 N ASP A 110 -13.514 19.165 17.676 1.00 0.00 N ATOM 1680 CA ASP A 110 -14.760 19.921 17.610 1.00 0.00 C ATOM 1681 C ASP A 110 -15.049 20.586 18.953 1.00 0.00 C ATOM 1682 O ASP A 110 -15.918 21.451 19.062 1.00 0.00 O ATOM 1683 CB ASP A 110 -15.918 18.997 17.220 1.00 0.00 C ATOM 1684 CG ASP A 110 -17.200 19.753 16.920 1.00 0.00 C ATOM 1685 OD1 ASP A 110 -17.170 21.002 16.915 1.00 0.00 O ATOM 1686 OD2 ASP A 110 -18.233 19.094 16.679 1.00 0.00 O ATOM 0 H ASP A 110 -13.631 18.153 17.627 1.00 0.00 H new ATOM 0 HA ASP A 110 -14.657 20.697 16.851 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -15.632 18.414 16.344 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -16.100 18.289 18.029 1.00 0.00 H new ATOM 1691 N PHE A 111 -14.309 20.169 19.974 1.00 0.00 N ATOM 1692 CA PHE A 111 -14.472 20.709 21.318 1.00 0.00 C ATOM 1693 C PHE A 111 -13.881 22.108 21.442 1.00 0.00 C ATOM 1694 O PHE A 111 -14.499 23.002 22.020 1.00 0.00 O ATOM 1695 CB PHE A 111 -13.804 19.787 22.343 1.00 0.00 C ATOM 1696 CG PHE A 111 -14.596 18.548 22.664 1.00 0.00 C ATOM 1697 CD1 PHE A 111 -15.179 17.793 21.656 1.00 0.00 C ATOM 1698 CD2 PHE A 111 -14.750 18.135 23.977 1.00 0.00 C ATOM 1699 CE1 PHE A 111 -15.902 16.654 21.955 1.00 0.00 C ATOM 1700 CE2 PHE A 111 -15.471 16.997 24.282 1.00 0.00 C ATOM 1701 CZ PHE A 111 -16.048 16.254 23.269 1.00 0.00 C ATOM 0 H PHE A 111 -13.586 19.454 19.895 1.00 0.00 H new ATOM 0 HA PHE A 111 -15.542 20.771 21.514 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -12.825 19.492 21.966 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -13.636 20.346 23.263 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -15.066 18.099 20.626 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -14.300 18.710 24.773 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -16.353 16.077 21.161 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -15.584 16.688 25.311 1.00 0.00 H new ATOM 0 HZ PHE A 111 -16.611 15.363 23.504 1.00 0.00 H new ATOM 1711 N GLY A 112 -12.665 22.281 20.938 1.00 0.00 N ATOM 1712 CA GLY A 112 -12.001 23.563 21.053 1.00 0.00 C ATOM 1713 C GLY A 112 -10.927 23.496 22.113 1.00 0.00 C ATOM 1714 O GLY A 112 -10.750 24.428 22.897 1.00 0.00 O ATOM 0 H GLY A 112 -12.130 21.560 20.454 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -11.561 23.841 20.095 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -12.726 24.336 21.307 1.00 0.00 H new ATOM 1718 N LEU A 113 -10.251 22.348 22.156 1.00 0.00 N ATOM 1719 CA LEU A 113 -9.214 22.072 23.146 1.00 0.00 C ATOM 1720 C LEU A 113 -8.422 23.306 23.554 1.00 0.00 C ATOM 1721 O LEU A 113 -8.075 24.156 22.735 1.00 0.00 O ATOM 1722 CB LEU A 113 -8.270 20.971 22.642 1.00 0.00 C ATOM 1723 CG LEU A 113 -7.846 21.056 21.169 1.00 0.00 C ATOM 1724 CD1 LEU A 113 -6.997 22.288 20.905 1.00 0.00 C ATOM 1725 CD2 LEU A 113 -7.087 19.801 20.774 1.00 0.00 C ATOM 0 H LEU A 113 -10.409 21.581 21.502 1.00 0.00 H new ATOM 0 HA LEU A 113 -9.730 21.729 24.043 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -7.371 20.984 23.258 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -8.753 20.007 22.803 1.00 0.00 H new ATOM 0 HG LEU A 113 -8.748 21.138 20.563 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -6.715 22.317 19.853 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -7.568 23.183 21.152 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -6.099 22.250 21.521 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -6.790 19.870 19.728 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -6.199 19.702 21.398 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -7.727 18.930 20.913 1.00 0.00 H new ATOM 1737 N ASP A 114 -8.153 23.383 24.852 1.00 0.00 N ATOM 1738 CA ASP A 114 -7.408 24.493 25.426 1.00 0.00 C ATOM 1739 C ASP A 114 -6.681 24.044 26.692 1.00 0.00 C ATOM 1740 O ASP A 114 -7.131 23.133 27.389 1.00 0.00 O ATOM 1741 CB ASP A 114 -8.354 25.656 25.744 1.00 0.00 C ATOM 1742 CG ASP A 114 -7.618 26.933 26.114 1.00 0.00 C ATOM 1743 OD1 ASP A 114 -6.374 26.955 26.021 1.00 0.00 O ATOM 1744 OD2 ASP A 114 -8.293 27.917 26.485 1.00 0.00 O ATOM 0 H ASP A 114 -8.444 22.681 25.532 1.00 0.00 H new ATOM 0 HA ASP A 114 -6.669 24.830 24.700 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -8.990 25.847 24.880 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -9.010 25.370 26.566 1.00 0.00 H new ATOM 1749 N ASP A 115 -5.552 24.684 26.976 1.00 0.00 N ATOM 1750 CA ASP A 115 -4.746 24.358 28.149 1.00 0.00 C ATOM 1751 C ASP A 115 -5.555 24.497 29.442 1.00 0.00 C ATOM 1752 O ASP A 115 -5.092 24.120 30.517 1.00 0.00 O ATOM 1753 CB ASP A 115 -3.510 25.268 28.189 1.00 0.00 C ATOM 1754 CG ASP A 115 -2.549 24.924 29.313 1.00 0.00 C ATOM 1755 OD1 ASP A 115 -2.893 25.164 30.490 1.00 0.00 O ATOM 1756 OD2 ASP A 115 -1.449 24.413 29.015 1.00 0.00 O ATOM 0 H ASP A 115 -5.171 25.438 26.405 1.00 0.00 H new ATOM 0 HA ASP A 115 -4.430 23.318 28.072 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -2.985 25.198 27.237 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -3.833 26.303 28.300 1.00 0.00 H new ATOM 1761 N ILE A 116 -6.762 25.048 29.338 1.00 0.00 N ATOM 1762 CA ILE A 116 -7.611 25.242 30.509 1.00 0.00 C ATOM 1763 C ILE A 116 -8.464 24.012 30.835 1.00 0.00 C ATOM 1764 O ILE A 116 -8.310 23.410 31.898 1.00 0.00 O ATOM 1765 CB ILE A 116 -8.540 26.459 30.317 1.00 0.00 C ATOM 1766 CG1 ILE A 116 -7.717 27.726 30.059 1.00 0.00 C ATOM 1767 CG2 ILE A 116 -9.444 26.643 31.530 1.00 0.00 C ATOM 1768 CD1 ILE A 116 -6.780 28.092 31.196 1.00 0.00 C ATOM 0 H ILE A 116 -7.172 25.366 28.460 1.00 0.00 H new ATOM 0 HA ILE A 116 -6.934 25.415 31.346 1.00 0.00 H new ATOM 0 HB ILE A 116 -9.171 26.276 29.447 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -7.133 27.589 29.149 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -8.397 28.559 29.879 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -10.091 27.506 31.374 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -10.056 25.751 31.667 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -8.833 26.803 32.418 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -6.233 28.999 30.939 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -7.359 28.262 32.104 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -6.075 27.278 31.363 1.00 0.00 H new ATOM 1780 N HIS A 117 -9.385 23.658 29.938 1.00 0.00 N ATOM 1781 CA HIS A 117 -10.276 22.518 30.169 1.00 0.00 C ATOM 1782 C HIS A 117 -9.729 21.208 29.609 1.00 0.00 C ATOM 1783 O HIS A 117 -9.389 20.296 30.362 1.00 0.00 O ATOM 1784 CB HIS A 117 -11.651 22.800 29.557 1.00 0.00 C ATOM 1785 CG HIS A 117 -12.580 21.623 29.584 1.00 0.00 C ATOM 1786 ND1 HIS A 117 -12.372 20.478 28.841 1.00 0.00 N ATOM 1787 CD2 HIS A 117 -13.724 21.415 30.276 1.00 0.00 C ATOM 1788 CE1 HIS A 117 -13.348 19.619 29.075 1.00 0.00 C ATOM 1789 NE2 HIS A 117 -14.180 20.163 29.943 1.00 0.00 N ATOM 0 H HIS A 117 -9.534 24.139 29.051 1.00 0.00 H new ATOM 0 HA HIS A 117 -10.356 22.397 31.249 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -12.114 23.628 30.093 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -11.519 23.123 28.524 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -14.192 22.105 30.963 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -13.448 18.639 28.632 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -15.026 19.724 30.308 1.00 0.00 H new ATOM 1798 N ILE A 118 -9.681 21.114 28.286 1.00 0.00 N ATOM 1799 CA ILE A 118 -9.213 19.905 27.615 1.00 0.00 C ATOM 1800 C ILE A 118 -7.860 19.435 28.149 1.00 0.00 C ATOM 1801 O ILE A 118 -7.526 18.252 28.073 1.00 0.00 O ATOM 1802 CB ILE A 118 -9.146 20.125 26.088 1.00 0.00 C ATOM 1803 CG1 ILE A 118 -10.559 20.143 25.503 1.00 0.00 C ATOM 1804 CG2 ILE A 118 -8.306 19.053 25.412 1.00 0.00 C ATOM 1805 CD1 ILE A 118 -11.260 18.803 25.584 1.00 0.00 C ATOM 0 H ILE A 118 -9.961 21.863 27.653 1.00 0.00 H new ATOM 0 HA ILE A 118 -9.935 19.117 27.829 1.00 0.00 H new ATOM 0 HB ILE A 118 -8.669 21.087 25.902 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -11.154 20.888 26.031 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -10.509 20.456 24.460 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -8.278 19.236 24.338 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -7.292 19.080 25.811 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -8.745 18.073 25.602 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -12.257 18.887 25.152 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -10.687 18.058 25.032 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -11.342 18.498 26.627 1.00 0.00 H new ATOM 1817 N ASP A 119 -7.097 20.359 28.709 1.00 0.00 N ATOM 1818 CA ASP A 119 -5.794 20.036 29.275 1.00 0.00 C ATOM 1819 C ASP A 119 -5.972 19.318 30.603 1.00 0.00 C ATOM 1820 O ASP A 119 -5.348 18.286 30.851 1.00 0.00 O ATOM 1821 CB ASP A 119 -4.958 21.300 29.467 1.00 0.00 C ATOM 1822 CG ASP A 119 -3.582 21.004 30.029 1.00 0.00 C ATOM 1823 OD1 ASP A 119 -2.823 20.255 29.377 1.00 0.00 O ATOM 1824 OD2 ASP A 119 -3.262 21.520 31.121 1.00 0.00 O ATOM 0 H ASP A 119 -7.357 21.342 28.785 1.00 0.00 H new ATOM 0 HA ASP A 119 -5.267 19.381 28.581 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -4.854 21.812 28.510 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -5.482 21.981 30.138 1.00 0.00 H new ATOM 1829 N ASP A 120 -6.851 19.853 31.446 1.00 0.00 N ATOM 1830 CA ASP A 120 -7.133 19.235 32.733 1.00 0.00 C ATOM 1831 C ASP A 120 -7.720 17.854 32.490 1.00 0.00 C ATOM 1832 O ASP A 120 -7.670 16.976 33.348 1.00 0.00 O ATOM 1833 CB ASP A 120 -8.106 20.092 33.546 1.00 0.00 C ATOM 1834 CG ASP A 120 -8.431 19.476 34.891 1.00 0.00 C ATOM 1835 OD1 ASP A 120 -7.493 19.256 35.686 1.00 0.00 O ATOM 1836 OD2 ASP A 120 -9.625 19.214 35.153 1.00 0.00 O ATOM 0 H ASP A 120 -7.376 20.708 31.261 1.00 0.00 H new ATOM 0 HA ASP A 120 -6.209 19.150 33.305 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -7.675 21.082 33.697 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -9.027 20.228 32.979 1.00 0.00 H new ATOM 1841 N MET A 121 -8.257 17.686 31.285 1.00 0.00 N ATOM 1842 CA MET A 121 -8.850 16.444 30.838 1.00 0.00 C ATOM 1843 C MET A 121 -7.793 15.349 30.738 1.00 0.00 C ATOM 1844 O MET A 121 -8.067 14.184 31.015 1.00 0.00 O ATOM 1845 CB MET A 121 -9.536 16.663 29.492 1.00 0.00 C ATOM 1846 CG MET A 121 -9.608 15.412 28.647 1.00 0.00 C ATOM 1847 SD MET A 121 -10.701 15.567 27.227 1.00 0.00 S ATOM 1848 CE MET A 121 -9.500 15.857 25.937 1.00 0.00 C ATOM 0 H MET A 121 -8.289 18.427 30.584 1.00 0.00 H new ATOM 0 HA MET A 121 -9.595 16.121 31.565 1.00 0.00 H new ATOM 0 HB2 MET A 121 -10.546 17.036 29.663 1.00 0.00 H new ATOM 0 HB3 MET A 121 -9.000 17.435 28.940 1.00 0.00 H new ATOM 0 HG2 MET A 121 -8.606 15.160 28.299 1.00 0.00 H new ATOM 0 HG3 MET A 121 -9.947 14.583 29.268 1.00 0.00 H new ATOM 0 HE1 MET A 121 -9.919 15.559 24.976 1.00 0.00 H new ATOM 0 HE2 MET A 121 -9.245 16.916 25.909 1.00 0.00 H new ATOM 0 HE3 MET A 121 -8.602 15.272 26.138 1.00 0.00 H new ATOM 1858 N ILE A 122 -6.576 15.741 30.382 1.00 0.00 N ATOM 1859 CA ILE A 122 -5.464 14.806 30.296 1.00 0.00 C ATOM 1860 C ILE A 122 -5.284 14.182 31.650 1.00 0.00 C ATOM 1861 O ILE A 122 -5.088 12.978 31.792 1.00 0.00 O ATOM 1862 CB ILE A 122 -4.178 15.548 29.927 1.00 0.00 C ATOM 1863 CG1 ILE A 122 -4.413 16.409 28.690 1.00 0.00 C ATOM 1864 CG2 ILE A 122 -3.034 14.570 29.702 1.00 0.00 C ATOM 1865 CD1 ILE A 122 -3.216 17.246 28.289 1.00 0.00 C ATOM 0 H ILE A 122 -6.335 16.704 30.148 1.00 0.00 H new ATOM 0 HA ILE A 122 -5.672 14.053 29.535 1.00 0.00 H new ATOM 0 HB ILE A 122 -3.898 16.198 30.756 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -4.688 15.763 27.856 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -5.260 17.069 28.874 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -2.130 15.121 29.441 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -2.860 13.998 30.613 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -3.291 13.890 28.890 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -3.461 17.830 27.402 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -2.953 17.919 29.105 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -2.371 16.592 28.071 1.00 0.00 H new ATOM 1877 N LYS A 123 -5.384 15.040 32.640 1.00 0.00 N ATOM 1878 CA LYS A 123 -5.269 14.646 34.020 1.00 0.00 C ATOM 1879 C LYS A 123 -6.626 14.201 34.546 1.00 0.00 C ATOM 1880 O LYS A 123 -6.731 13.611 35.621 1.00 0.00 O ATOM 1881 CB LYS A 123 -4.702 15.791 34.856 1.00 0.00 C ATOM 1882 CG LYS A 123 -3.219 16.025 34.618 1.00 0.00 C ATOM 1883 CD LYS A 123 -2.946 16.575 33.228 1.00 0.00 C ATOM 1884 CE LYS A 123 -1.602 16.103 32.704 1.00 0.00 C ATOM 1885 NZ LYS A 123 -1.282 16.698 31.377 1.00 0.00 N ATOM 0 H LYS A 123 -5.549 16.038 32.506 1.00 0.00 H new ATOM 0 HA LYS A 123 -4.579 13.806 34.095 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -5.249 16.706 34.628 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -4.865 15.577 35.912 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -2.837 16.721 35.365 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -2.678 15.088 34.750 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -3.736 16.258 32.547 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -2.966 17.664 33.255 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -0.821 16.367 33.418 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -1.606 15.016 32.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -0.853 15.974 30.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -2.155 17.051 30.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -0.614 17.486 31.502 1.00 0.00 H new ATOM 1899 N GLU A 124 -7.664 14.504 33.773 1.00 0.00 N ATOM 1900 CA GLU A 124 -9.026 14.155 34.143 1.00 0.00 C ATOM 1901 C GLU A 124 -9.380 12.740 33.697 1.00 0.00 C ATOM 1902 O GLU A 124 -10.305 12.128 34.233 1.00 0.00 O ATOM 1903 CB GLU A 124 -10.024 15.134 33.527 1.00 0.00 C ATOM 1904 CG GLU A 124 -11.465 14.876 33.936 1.00 0.00 C ATOM 1905 CD GLU A 124 -11.692 15.066 35.424 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -11.452 16.184 35.924 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -12.111 14.095 36.089 1.00 0.00 O ATOM 0 H GLU A 124 -7.584 14.993 32.882 1.00 0.00 H new ATOM 0 HA GLU A 124 -9.085 14.209 35.230 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -9.750 16.149 33.816 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.949 15.081 32.441 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -12.122 15.548 33.383 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -11.742 13.859 33.657 1.00 0.00 H new ATOM 1914 N ILE A 125 -8.667 12.233 32.693 1.00 0.00 N ATOM 1915 CA ILE A 125 -8.952 10.907 32.167 1.00 0.00 C ATOM 1916 C ILE A 125 -7.793 9.939 32.365 1.00 0.00 C ATOM 1917 O ILE A 125 -7.961 8.734 32.197 1.00 0.00 O ATOM 1918 CB ILE A 125 -9.308 10.976 30.682 1.00 0.00 C ATOM 1919 CG1 ILE A 125 -10.268 12.142 30.417 1.00 0.00 C ATOM 1920 CG2 ILE A 125 -9.933 9.658 30.258 1.00 0.00 C ATOM 1921 CD1 ILE A 125 -11.523 12.110 31.260 1.00 0.00 C ATOM 0 H ILE A 125 -7.896 12.718 32.234 1.00 0.00 H new ATOM 0 HA ILE A 125 -9.804 10.529 32.732 1.00 0.00 H new ATOM 0 HB ILE A 125 -8.404 11.147 30.098 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -9.743 13.080 30.600 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -10.550 12.135 29.364 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -10.189 9.701 29.199 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -9.224 8.848 30.427 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -10.835 9.478 30.843 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -12.149 12.967 31.013 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -12.072 11.190 31.060 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -11.253 12.150 32.315 1.00 0.00 H new ATOM 1933 N ASP A 126 -6.614 10.448 32.715 1.00 0.00 N ATOM 1934 CA ASP A 126 -5.470 9.601 32.925 1.00 0.00 C ATOM 1935 C ASP A 126 -5.541 8.959 34.303 1.00 0.00 C ATOM 1936 O ASP A 126 -4.612 9.053 35.107 1.00 0.00 O ATOM 1937 CB ASP A 126 -4.224 10.448 32.787 1.00 0.00 C ATOM 1938 CG ASP A 126 -3.928 11.281 34.018 1.00 0.00 C ATOM 1939 OD1 ASP A 126 -4.866 11.905 34.550 1.00 0.00 O ATOM 1940 OD2 ASP A 126 -2.756 11.307 34.450 1.00 0.00 O ATOM 0 H ASP A 126 -6.438 11.443 32.856 1.00 0.00 H new ATOM 0 HA ASP A 126 -5.450 8.799 32.187 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -3.372 9.799 32.582 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -4.335 11.109 31.927 1.00 0.00 H new ATOM 1945 N GLN A 127 -6.656 8.301 34.571 1.00 0.00 N ATOM 1946 CA GLN A 127 -6.855 7.646 35.850 1.00 0.00 C ATOM 1947 C GLN A 127 -5.824 6.551 36.054 1.00 0.00 C ATOM 1948 O GLN A 127 -5.736 5.975 37.137 1.00 0.00 O ATOM 1949 CB GLN A 127 -8.267 7.051 35.977 1.00 0.00 C ATOM 1950 CG GLN A 127 -9.217 7.363 34.823 1.00 0.00 C ATOM 1951 CD GLN A 127 -8.882 6.613 33.545 1.00 0.00 C ATOM 1952 OE1 GLN A 127 -7.779 5.874 33.551 1.00 0.00 O flip ATOM 1953 NE2 GLN A 127 -9.610 6.702 32.557 1.00 0.00 N flip ATOM 0 H GLN A 127 -7.436 8.207 33.920 1.00 0.00 H new ATOM 0 HA GLN A 127 -6.737 8.408 36.621 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -8.179 5.969 36.070 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -8.714 7.415 36.902 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -10.235 7.116 35.124 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -9.194 8.434 34.623 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -10.449 7.281 32.592 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -9.374 6.197 31.703 1.00 0.00 H new ATOM 1962 N ASP A 128 -5.060 6.235 35.007 1.00 0.00 N ATOM 1963 CA ASP A 128 -4.077 5.170 35.124 1.00 0.00 C ATOM 1964 C ASP A 128 -2.620 5.652 35.163 1.00 0.00 C ATOM 1965 O ASP A 128 -1.817 5.031 35.862 1.00 0.00 O ATOM 1966 CB ASP A 128 -4.252 4.188 33.963 1.00 0.00 C ATOM 1967 CG ASP A 128 -3.224 3.072 33.979 1.00 0.00 C ATOM 1968 OD1 ASP A 128 -2.033 3.353 33.734 1.00 0.00 O ATOM 1969 OD2 ASP A 128 -3.608 1.916 34.247 1.00 0.00 O ATOM 0 H ASP A 128 -5.103 6.690 34.095 1.00 0.00 H new ATOM 0 HA ASP A 128 -4.265 4.692 36.085 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -5.252 3.756 34.006 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -4.179 4.730 33.020 1.00 0.00 H new ATOM 1974 N ASN A 129 -2.254 6.752 34.472 1.00 0.00 N ATOM 1975 CA ASN A 129 -0.854 7.210 34.556 1.00 0.00 C ATOM 1976 C ASN A 129 -0.464 8.455 33.722 1.00 0.00 C ATOM 1977 O ASN A 129 -0.528 9.597 34.177 1.00 0.00 O ATOM 1978 CB ASN A 129 0.115 6.055 34.238 1.00 0.00 C ATOM 1979 CG ASN A 129 -0.212 5.302 32.954 1.00 0.00 C ATOM 1980 OD1 ASN A 129 -1.262 5.716 32.256 1.00 0.00 O flip ATOM 1981 ND2 ASN A 129 0.483 4.351 32.594 1.00 0.00 N flip ATOM 0 H ASN A 129 -2.869 7.312 33.882 1.00 0.00 H new ATOM 0 HA ASN A 129 -0.766 7.540 35.591 1.00 0.00 H new ATOM 0 HB2 ASN A 129 1.127 6.454 34.165 1.00 0.00 H new ATOM 0 HB3 ASN A 129 0.110 5.351 35.070 1.00 0.00 H new ATOM 0 HD21 ASN A 129 1.283 4.062 33.157 1.00 0.00 H new ATOM 0 HD22 ASN A 129 0.259 3.853 31.733 1.00 0.00 H new ATOM 1988 N ASP A 130 0.074 8.143 32.540 1.00 0.00 N ATOM 1989 CA ASP A 130 0.678 9.074 31.573 1.00 0.00 C ATOM 1990 C ASP A 130 -0.201 10.136 30.898 1.00 0.00 C ATOM 1991 O ASP A 130 0.125 10.522 29.773 1.00 0.00 O ATOM 1992 CB ASP A 130 1.314 8.224 30.473 1.00 0.00 C ATOM 1993 CG ASP A 130 2.470 7.390 30.983 1.00 0.00 C ATOM 1994 OD1 ASP A 130 2.244 6.544 31.875 1.00 0.00 O ATOM 1995 OD2 ASP A 130 3.603 7.582 30.495 1.00 0.00 O ATOM 0 H ASP A 130 0.103 7.178 32.210 1.00 0.00 H new ATOM 0 HA ASP A 130 1.360 9.672 32.178 1.00 0.00 H new ATOM 0 HB2 ASP A 130 0.558 7.567 30.042 1.00 0.00 H new ATOM 0 HB3 ASP A 130 1.665 8.875 29.672 1.00 0.00 H new ATOM 2000 N GLY A 131 -1.275 10.644 31.500 1.00 0.00 N ATOM 2001 CA GLY A 131 -2.028 11.651 30.776 1.00 0.00 C ATOM 2002 C GLY A 131 -2.501 11.070 29.472 1.00 0.00 C ATOM 2003 O GLY A 131 -2.482 11.718 28.418 1.00 0.00 O ATOM 0 H GLY A 131 -1.622 10.393 32.426 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -2.879 11.983 31.370 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -1.405 12.527 30.593 1.00 0.00 H new ATOM 2007 N GLN A 132 -2.868 9.805 29.556 1.00 0.00 N ATOM 2008 CA GLN A 132 -3.302 9.042 28.419 1.00 0.00 C ATOM 2009 C GLN A 132 -4.514 8.228 28.783 1.00 0.00 C ATOM 2010 O GLN A 132 -4.866 8.119 29.957 1.00 0.00 O ATOM 2011 CB GLN A 132 -2.202 8.123 27.921 1.00 0.00 C ATOM 2012 CG GLN A 132 -1.729 7.132 28.959 1.00 0.00 C ATOM 2013 CD GLN A 132 -1.128 5.899 28.331 1.00 0.00 C ATOM 2014 OE1 GLN A 132 -0.006 5.919 27.825 1.00 0.00 O ATOM 2015 NE2 GLN A 132 -1.900 4.826 28.332 1.00 0.00 N ATOM 0 H GLN A 132 -2.870 9.279 30.430 1.00 0.00 H new ATOM 0 HA GLN A 132 -3.553 9.739 27.620 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -2.562 7.579 27.048 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -1.355 8.727 27.594 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -0.990 7.607 29.604 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -2.567 6.844 29.594 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -2.823 4.862 28.765 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -1.573 3.962 27.899 1.00 0.00 H new ATOM 2024 N ILE A 133 -5.152 7.648 27.786 1.00 0.00 N ATOM 2025 CA ILE A 133 -6.306 6.847 27.996 1.00 0.00 C ATOM 2026 C ILE A 133 -6.152 5.572 27.209 1.00 0.00 C ATOM 2027 O ILE A 133 -5.939 5.590 26.004 1.00 0.00 O ATOM 2028 CB ILE A 133 -7.549 7.585 27.523 1.00 0.00 C ATOM 2029 CG1 ILE A 133 -7.617 8.941 28.195 1.00 0.00 C ATOM 2030 CG2 ILE A 133 -8.796 6.782 27.821 1.00 0.00 C ATOM 2031 CD1 ILE A 133 -8.595 9.864 27.532 1.00 0.00 C ATOM 0 H ILE A 133 -4.871 7.729 26.809 1.00 0.00 H new ATOM 0 HA ILE A 133 -6.412 6.628 29.058 1.00 0.00 H new ATOM 0 HB ILE A 133 -7.490 7.722 26.443 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -7.897 8.811 29.240 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -6.627 9.398 28.185 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -9.673 7.329 27.474 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -8.741 5.822 27.308 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.874 6.616 28.895 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -8.603 10.821 28.054 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -8.302 10.019 26.494 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -9.591 9.424 27.566 1.00 0.00 H new ATOM 2043 N ASP A 134 -6.252 4.479 27.892 1.00 0.00 N ATOM 2044 CA ASP A 134 -6.115 3.190 27.261 1.00 0.00 C ATOM 2045 C ASP A 134 -7.476 2.588 27.054 1.00 0.00 C ATOM 2046 O ASP A 134 -8.457 3.054 27.625 1.00 0.00 O ATOM 2047 CB ASP A 134 -5.283 2.247 28.117 1.00 0.00 C ATOM 2048 CG ASP A 134 -3.897 2.774 28.387 1.00 0.00 C ATOM 2049 OD1 ASP A 134 -3.157 2.987 27.409 1.00 0.00 O ATOM 2050 OD2 ASP A 134 -3.550 2.970 29.569 1.00 0.00 O ATOM 0 H ASP A 134 -6.429 4.444 28.896 1.00 0.00 H new ATOM 0 HA ASP A 134 -5.612 3.330 26.304 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -5.794 2.078 29.065 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -5.209 1.281 27.618 1.00 0.00 H new ATOM 2055 N TYR A 135 -7.535 1.561 26.233 1.00 0.00 N ATOM 2056 CA TYR A 135 -8.801 0.900 25.955 1.00 0.00 C ATOM 2057 C TYR A 135 -9.576 0.697 27.243 1.00 0.00 C ATOM 2058 O TYR A 135 -10.803 0.709 27.249 1.00 0.00 O ATOM 2059 CB TYR A 135 -8.568 -0.429 25.257 1.00 0.00 C ATOM 2060 CG TYR A 135 -9.827 -1.248 25.048 1.00 0.00 C ATOM 2061 CD1 TYR A 135 -10.950 -0.702 24.436 1.00 0.00 C ATOM 2062 CD2 TYR A 135 -9.891 -2.570 25.470 1.00 0.00 C ATOM 2063 CE1 TYR A 135 -12.098 -1.449 24.251 1.00 0.00 C ATOM 2064 CE2 TYR A 135 -11.035 -3.324 25.287 1.00 0.00 C ATOM 2065 CZ TYR A 135 -12.135 -2.760 24.677 1.00 0.00 C ATOM 2066 OH TYR A 135 -13.277 -3.506 24.496 1.00 0.00 O ATOM 0 H TYR A 135 -6.730 1.165 25.748 1.00 0.00 H new ATOM 0 HA TYR A 135 -9.388 1.534 25.290 1.00 0.00 H new ATOM 0 HB2 TYR A 135 -8.104 -0.242 24.288 1.00 0.00 H new ATOM 0 HB3 TYR A 135 -7.859 -1.015 25.842 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -10.925 0.324 24.099 1.00 0.00 H new ATOM 0 HD2 TYR A 135 -9.032 -3.016 25.949 1.00 0.00 H new ATOM 0 HE1 TYR A 135 -12.962 -1.008 23.775 1.00 0.00 H new ATOM 0 HE2 TYR A 135 -11.067 -4.351 25.621 1.00 0.00 H new ATOM 0 HH TYR A 135 -13.138 -4.409 24.850 1.00 0.00 H new ATOM 2076 N GLY A 136 -8.845 0.542 28.340 1.00 0.00 N ATOM 2077 CA GLY A 136 -9.481 0.378 29.624 1.00 0.00 C ATOM 2078 C GLY A 136 -9.809 1.710 30.259 1.00 0.00 C ATOM 2079 O GLY A 136 -10.875 1.872 30.850 1.00 0.00 O ATOM 0 H GLY A 136 -7.825 0.528 28.359 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -10.395 -0.204 29.506 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -8.826 -0.189 30.285 1.00 0.00 H new ATOM 2083 N GLU A 137 -8.902 2.678 30.123 1.00 0.00 N ATOM 2084 CA GLU A 137 -9.134 4.003 30.677 1.00 0.00 C ATOM 2085 C GLU A 137 -10.375 4.603 30.046 1.00 0.00 C ATOM 2086 O GLU A 137 -11.266 5.080 30.746 1.00 0.00 O ATOM 2087 CB GLU A 137 -7.942 4.936 30.446 1.00 0.00 C ATOM 2088 CG GLU A 137 -6.635 4.427 31.023 1.00 0.00 C ATOM 2089 CD GLU A 137 -5.562 5.495 31.068 1.00 0.00 C ATOM 2090 OE1 GLU A 137 -5.756 6.498 31.788 1.00 0.00 O ATOM 2091 OE2 GLU A 137 -4.529 5.332 30.386 1.00 0.00 O ATOM 0 H GLU A 137 -8.011 2.567 29.639 1.00 0.00 H new ATOM 0 HA GLU A 137 -9.269 3.896 31.753 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -7.818 5.090 29.374 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -8.166 5.909 30.884 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -6.810 4.050 32.031 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -6.281 3.587 30.425 1.00 0.00 H new ATOM 2098 N PHE A 138 -10.432 4.581 28.716 1.00 0.00 N ATOM 2099 CA PHE A 138 -11.580 5.132 28.017 1.00 0.00 C ATOM 2100 C PHE A 138 -12.833 4.338 28.344 1.00 0.00 C ATOM 2101 O PHE A 138 -13.804 4.877 28.875 1.00 0.00 O ATOM 2102 CB PHE A 138 -11.383 5.144 26.495 1.00 0.00 C ATOM 2103 CG PHE A 138 -12.041 6.332 25.866 1.00 0.00 C ATOM 2104 CD1 PHE A 138 -11.807 7.613 26.356 1.00 0.00 C ATOM 2105 CD2 PHE A 138 -12.906 6.171 24.800 1.00 0.00 C ATOM 2106 CE1 PHE A 138 -12.425 8.707 25.781 1.00 0.00 C ATOM 2107 CE2 PHE A 138 -13.527 7.262 24.225 1.00 0.00 C ATOM 2108 CZ PHE A 138 -13.285 8.531 24.716 1.00 0.00 C ATOM 0 H PHE A 138 -9.707 4.193 28.113 1.00 0.00 H new ATOM 0 HA PHE A 138 -11.688 6.162 28.357 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -10.318 5.153 26.265 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -11.794 4.230 26.067 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -11.138 7.753 27.192 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -13.098 5.181 24.413 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -12.235 9.699 26.165 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -14.201 7.124 23.393 1.00 0.00 H new ATOM 0 HZ PHE A 138 -13.769 9.385 24.266 1.00 0.00 H new ATOM 2118 N ALA A 139 -12.804 3.057 27.998 1.00 0.00 N ATOM 2119 CA ALA A 139 -13.935 2.165 28.218 1.00 0.00 C ATOM 2120 C ALA A 139 -14.505 2.274 29.636 1.00 0.00 C ATOM 2121 O ALA A 139 -15.704 2.100 29.833 1.00 0.00 O ATOM 2122 CB ALA A 139 -13.529 0.728 27.909 1.00 0.00 C ATOM 0 H ALA A 139 -12.000 2.609 27.559 1.00 0.00 H new ATOM 0 HA ALA A 139 -14.731 2.472 27.539 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -14.379 0.066 28.075 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -13.211 0.655 26.869 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -12.707 0.434 28.561 1.00 0.00 H new ATOM 2128 N ALA A 140 -13.653 2.544 30.626 1.00 0.00 N ATOM 2129 CA ALA A 140 -14.114 2.650 32.011 1.00 0.00 C ATOM 2130 C ALA A 140 -14.536 4.072 32.392 1.00 0.00 C ATOM 2131 O ALA A 140 -15.666 4.291 32.826 1.00 0.00 O ATOM 2132 CB ALA A 140 -13.036 2.150 32.960 1.00 0.00 C ATOM 0 H ALA A 140 -12.652 2.692 30.498 1.00 0.00 H new ATOM 0 HA ALA A 140 -15.002 2.024 32.098 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -13.389 2.233 33.988 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -12.810 1.107 32.737 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -12.135 2.751 32.836 1.00 0.00 H new ATOM 2138 N MET A 141 -13.613 5.025 32.261 1.00 0.00 N ATOM 2139 CA MET A 141 -13.873 6.415 32.625 1.00 0.00 C ATOM 2140 C MET A 141 -15.216 6.911 32.087 1.00 0.00 C ATOM 2141 O MET A 141 -15.872 7.740 32.719 1.00 0.00 O ATOM 2142 CB MET A 141 -12.727 7.307 32.124 1.00 0.00 C ATOM 2143 CG MET A 141 -12.830 7.714 30.662 1.00 0.00 C ATOM 2144 SD MET A 141 -13.952 9.103 30.407 1.00 0.00 S ATOM 2145 CE MET A 141 -13.663 9.461 28.679 1.00 0.00 C ATOM 0 H MET A 141 -12.673 4.856 31.903 1.00 0.00 H new ATOM 0 HA MET A 141 -13.927 6.470 33.712 1.00 0.00 H new ATOM 0 HB2 MET A 141 -12.692 8.208 32.736 1.00 0.00 H new ATOM 0 HB3 MET A 141 -11.784 6.782 32.275 1.00 0.00 H new ATOM 0 HG2 MET A 141 -11.840 7.979 30.292 1.00 0.00 H new ATOM 0 HG3 MET A 141 -13.173 6.862 30.075 1.00 0.00 H new ATOM 0 HE1 MET A 141 -14.176 10.383 28.408 1.00 0.00 H new ATOM 0 HE2 MET A 141 -12.593 9.577 28.505 1.00 0.00 H new ATOM 0 HE3 MET A 141 -14.043 8.641 28.069 1.00 0.00 H new ATOM 2155 N MET A 142 -15.621 6.413 30.922 1.00 0.00 N ATOM 2156 CA MET A 142 -16.886 6.827 30.322 1.00 0.00 C ATOM 2157 C MET A 142 -18.040 5.967 30.826 1.00 0.00 C ATOM 2158 O MET A 142 -19.169 6.442 30.957 1.00 0.00 O ATOM 2159 CB MET A 142 -16.809 6.751 28.795 1.00 0.00 C ATOM 2160 CG MET A 142 -16.698 5.333 28.259 1.00 0.00 C ATOM 2161 SD MET A 142 -16.621 5.279 26.459 1.00 0.00 S ATOM 2162 CE MET A 142 -16.533 3.513 26.181 1.00 0.00 C ATOM 0 H MET A 142 -15.097 5.728 30.378 1.00 0.00 H new ATOM 0 HA MET A 142 -17.070 7.860 30.617 1.00 0.00 H new ATOM 0 HB2 MET A 142 -17.696 7.222 28.371 1.00 0.00 H new ATOM 0 HB3 MET A 142 -15.949 7.327 28.454 1.00 0.00 H new ATOM 0 HG2 MET A 142 -15.807 4.861 28.672 1.00 0.00 H new ATOM 0 HG3 MET A 142 -17.554 4.751 28.600 1.00 0.00 H new ATOM 0 HE1 MET A 142 -15.539 3.251 25.818 1.00 0.00 H new ATOM 0 HE2 MET A 142 -16.728 2.987 27.116 1.00 0.00 H new ATOM 0 HE3 MET A 142 -17.278 3.224 25.440 1.00 0.00 H new