USER MOD reduce.3.24.130724 H: found=0, std=0, add=569, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 570 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 174:sc= -1.79! (180deg=-1.83!) USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.89 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 TYR OH : rot -149:sc= 0.755 USER MOD Single : A 126 THR OG1 : rot -104:sc= 1.08 USER MOD Single : A 132 MET CE :methyl -176:sc= -1.61 (180deg=-1.74!) USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=-0.0048) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 151:sc= -0.496 (180deg=-1.6!) USER MOD Single : A 144 SER OG : rot 140:sc= -0.0211 USER MOD Single : A 145 LYS NZ :NH3+ -166:sc= -0.497! (180deg=-1.11!) USER MOD Single : A 153 THR OG1 : rot 150:sc= -0.587 USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 THR OG1 : rot 180:sc= -0.532 USER MOD Single : A 158 GLN :FLIP amide:sc= 0.42 F(o=-0.11,f=0.42) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 MET CE :methyl -127:sc= -0.995 (180deg=-2.29!) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 GLN : amide:sc= 0.35 X(o=0.35,f=0) USER MOD Single : A 166 HIS : +bothHN:sc= -5.21! C(o=-5.2!,f=-10!) USER MOD Single : A 167 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 173 CYS SG : rot -25:sc= -0.805 USER MOD Single : A 175 CYS SG : rot -150:sc= -2.13! USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 207 N SER A 104 -1.669 10.329 -2.095 1.00 0.00 N ATOM 208 CA SER A 104 -0.340 9.764 -2.300 1.00 0.00 C ATOM 209 C SER A 104 -0.408 8.244 -2.416 1.00 0.00 C ATOM 210 O SER A 104 -1.408 7.626 -2.049 1.00 0.00 O ATOM 211 CB SER A 104 0.588 10.158 -1.150 1.00 0.00 C ATOM 212 OG SER A 104 1.122 11.456 -1.348 1.00 0.00 O ATOM 0 HA SER A 104 0.058 10.165 -3.232 1.00 0.00 H new ATOM 0 HB2 SER A 104 0.039 10.127 -0.209 1.00 0.00 H new ATOM 0 HB3 SER A 104 1.400 9.435 -1.070 1.00 0.00 H new ATOM 0 HG SER A 104 1.711 11.685 -0.599 1.00 0.00 H new ATOM 218 N ASP A 105 0.663 7.648 -2.929 1.00 0.00 N ATOM 219 CA ASP A 105 0.727 6.200 -3.092 1.00 0.00 C ATOM 220 C ASP A 105 0.927 5.509 -1.747 1.00 0.00 C ATOM 221 O ASP A 105 1.833 5.857 -0.988 1.00 0.00 O ATOM 222 CB ASP A 105 1.860 5.823 -4.048 1.00 0.00 C ATOM 223 CG ASP A 105 1.632 4.481 -4.715 1.00 0.00 C ATOM 224 OD1 ASP A 105 0.876 3.661 -4.155 1.00 0.00 O ATOM 225 OD2 ASP A 105 2.212 4.251 -5.798 1.00 0.00 O ATOM 0 H ASP A 105 1.498 8.145 -3.239 1.00 0.00 H new ATOM 0 HA ASP A 105 -0.220 5.864 -3.514 1.00 0.00 H new ATOM 0 HB2 ASP A 105 1.958 6.594 -4.813 1.00 0.00 H new ATOM 0 HB3 ASP A 105 2.801 5.797 -3.499 1.00 0.00 H new ATOM 230 N LEU A 106 0.077 4.530 -1.458 1.00 0.00 N ATOM 231 CA LEU A 106 0.160 3.790 -0.204 1.00 0.00 C ATOM 232 C LEU A 106 0.689 2.379 -0.438 1.00 0.00 C ATOM 233 O LEU A 106 0.322 1.722 -1.412 1.00 0.00 O ATOM 234 CB LEU A 106 -1.213 3.729 0.467 1.00 0.00 C ATOM 235 CG LEU A 106 -2.022 5.026 0.461 1.00 0.00 C ATOM 236 CD1 LEU A 106 -3.478 4.750 0.803 1.00 0.00 C ATOM 237 CD2 LEU A 106 -1.425 6.031 1.435 1.00 0.00 C ATOM 0 H LEU A 106 -0.678 4.230 -2.075 1.00 0.00 H new ATOM 0 HA LEU A 106 0.855 4.313 0.453 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -1.802 2.955 -0.026 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.076 3.415 1.502 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.981 5.452 -0.541 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.038 5.685 0.794 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.901 4.067 0.067 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -3.540 4.300 1.794 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -2.014 6.948 1.418 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.435 5.612 2.441 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -0.398 6.253 1.145 1.00 0.00 H new ATOM 249 N ILE A 107 1.550 1.918 0.463 1.00 0.00 N ATOM 250 CA ILE A 107 2.126 0.583 0.356 1.00 0.00 C ATOM 251 C ILE A 107 1.435 -0.391 1.304 1.00 0.00 C ATOM 252 O ILE A 107 1.178 -0.069 2.464 1.00 0.00 O ATOM 253 CB ILE A 107 3.635 0.595 0.661 1.00 0.00 C ATOM 254 CG1 ILE A 107 4.196 -0.828 0.626 1.00 0.00 C ATOM 255 CG2 ILE A 107 3.898 1.241 2.013 1.00 0.00 C ATOM 256 CD1 ILE A 107 5.703 -0.887 0.742 1.00 0.00 C ATOM 0 H ILE A 107 1.864 2.449 1.275 1.00 0.00 H new ATOM 0 HA ILE A 107 1.974 0.255 -0.672 1.00 0.00 H new ATOM 0 HB ILE A 107 4.140 1.184 -0.105 1.00 0.00 H new ATOM 0 HG12 ILE A 107 3.754 -1.404 1.439 1.00 0.00 H new ATOM 0 HG13 ILE A 107 3.892 -1.307 -0.305 1.00 0.00 H new ATOM 0 HG21 ILE A 107 4.969 1.242 2.214 1.00 0.00 H new ATOM 0 HG22 ILE A 107 3.530 2.267 2.004 1.00 0.00 H new ATOM 0 HG23 ILE A 107 3.383 0.678 2.792 1.00 0.00 H new ATOM 0 HD11 ILE A 107 6.030 -1.926 0.710 1.00 0.00 H new ATOM 0 HD12 ILE A 107 6.153 -0.339 -0.086 1.00 0.00 H new ATOM 0 HD13 ILE A 107 6.013 -0.438 1.686 1.00 0.00 H new ATOM 268 N VAL A 108 1.137 -1.586 0.803 1.00 0.00 N ATOM 269 CA VAL A 108 0.478 -2.609 1.605 1.00 0.00 C ATOM 270 C VAL A 108 1.441 -3.739 1.952 1.00 0.00 C ATOM 271 O VAL A 108 2.160 -4.244 1.089 1.00 0.00 O ATOM 272 CB VAL A 108 -0.743 -3.196 0.874 1.00 0.00 C ATOM 273 CG1 VAL A 108 -1.419 -4.257 1.729 1.00 0.00 C ATOM 274 CG2 VAL A 108 -1.723 -2.093 0.504 1.00 0.00 C ATOM 0 H VAL A 108 1.342 -1.869 -0.155 1.00 0.00 H new ATOM 0 HA VAL A 108 0.144 -2.125 2.523 1.00 0.00 H new ATOM 0 HB VAL A 108 -0.401 -3.670 -0.046 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -2.280 -4.660 1.195 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -0.713 -5.060 1.938 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -1.750 -3.812 2.667 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -2.580 -2.526 -0.012 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -2.061 -1.588 1.409 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.231 -1.374 -0.150 1.00 0.00 H new ATOM 284 N LEU A 109 1.449 -4.133 3.221 1.00 0.00 N ATOM 285 CA LEU A 109 2.324 -5.205 3.683 1.00 0.00 C ATOM 286 C LEU A 109 1.511 -6.415 4.134 1.00 0.00 C ATOM 287 O LEU A 109 0.342 -6.289 4.496 1.00 0.00 O ATOM 288 CB LEU A 109 3.205 -4.712 4.832 1.00 0.00 C ATOM 289 CG LEU A 109 4.251 -3.657 4.470 1.00 0.00 C ATOM 290 CD1 LEU A 109 3.578 -2.352 4.072 1.00 0.00 C ATOM 291 CD2 LEU A 109 5.207 -3.433 5.633 1.00 0.00 C ATOM 0 H LEU A 109 0.860 -3.727 3.948 1.00 0.00 H new ATOM 0 HA LEU A 109 2.959 -5.506 2.850 1.00 0.00 H new ATOM 0 HB2 LEU A 109 2.559 -4.303 5.609 1.00 0.00 H new ATOM 0 HB3 LEU A 109 3.719 -5.571 5.264 1.00 0.00 H new ATOM 0 HG LEU A 109 4.825 -4.020 3.618 1.00 0.00 H new ATOM 0 HD11 LEU A 109 4.338 -1.613 3.818 1.00 0.00 H new ATOM 0 HD12 LEU A 109 2.935 -2.523 3.209 1.00 0.00 H new ATOM 0 HD13 LEU A 109 2.978 -1.984 4.904 1.00 0.00 H new ATOM 0 HD21 LEU A 109 5.945 -2.679 5.358 1.00 0.00 H new ATOM 0 HD22 LEU A 109 4.647 -3.092 6.504 1.00 0.00 H new ATOM 0 HD23 LEU A 109 5.715 -4.367 5.872 1.00 0.00 H new ATOM 303 N GLY A 110 2.140 -7.586 4.112 1.00 0.00 N ATOM 304 CA GLY A 110 1.460 -8.801 4.523 1.00 0.00 C ATOM 305 C GLY A 110 0.528 -9.334 3.453 1.00 0.00 C ATOM 306 O GLY A 110 -0.508 -9.926 3.760 1.00 0.00 O ATOM 0 H GLY A 110 3.108 -7.715 3.817 1.00 0.00 H new ATOM 0 HA2 GLY A 110 2.200 -9.563 4.768 1.00 0.00 H new ATOM 0 HA3 GLY A 110 0.891 -8.605 5.432 1.00 0.00 H new ATOM 310 N LEU A 111 0.894 -9.123 2.193 1.00 0.00 N ATOM 311 CA LEU A 111 0.082 -9.586 1.073 1.00 0.00 C ATOM 312 C LEU A 111 0.505 -10.984 0.634 1.00 0.00 C ATOM 313 O LEU A 111 1.688 -11.326 0.623 1.00 0.00 O ATOM 314 CB LEU A 111 0.198 -8.613 -0.102 1.00 0.00 C ATOM 315 CG LEU A 111 -0.637 -7.336 -0.002 1.00 0.00 C ATOM 316 CD1 LEU A 111 -0.574 -6.553 -1.304 1.00 0.00 C ATOM 317 CD2 LEU A 111 -2.079 -7.669 0.353 1.00 0.00 C ATOM 0 H LEU A 111 1.747 -8.635 1.922 1.00 0.00 H new ATOM 0 HA LEU A 111 -0.956 -9.628 1.402 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.245 -8.331 -0.212 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -0.087 -9.139 -1.013 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.222 -6.715 0.792 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -1.174 -5.648 -1.214 1.00 0.00 H new ATOM 0 HD12 LEU A 111 0.460 -6.283 -1.516 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -0.963 -7.166 -2.117 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -2.659 -6.749 0.420 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -2.505 -8.311 -0.418 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -2.107 -8.186 1.312 1.00 0.00 H new ATOM 329 N PRO A 112 -0.482 -11.812 0.263 1.00 0.00 N ATOM 330 CA PRO A 112 -0.237 -13.186 -0.186 1.00 0.00 C ATOM 331 C PRO A 112 0.451 -13.237 -1.546 1.00 0.00 C ATOM 332 O PRO A 112 0.983 -12.233 -2.021 1.00 0.00 O ATOM 333 CB PRO A 112 -1.642 -13.787 -0.274 1.00 0.00 C ATOM 334 CG PRO A 112 -2.540 -12.619 -0.491 1.00 0.00 C ATOM 335 CD PRO A 112 -1.915 -11.471 0.252 1.00 0.00 C ATOM 0 HA PRO A 112 0.429 -13.723 0.490 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -1.716 -14.501 -1.094 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -1.902 -14.322 0.639 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -2.634 -12.391 -1.553 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -3.544 -12.824 -0.119 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -2.098 -10.521 -0.249 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -2.314 -11.381 1.262 1.00 0.00 H new ATOM 343 N TRP A 113 0.435 -14.410 -2.168 1.00 0.00 N ATOM 344 CA TRP A 113 1.057 -14.591 -3.475 1.00 0.00 C ATOM 345 C TRP A 113 0.004 -14.648 -4.576 1.00 0.00 C ATOM 346 O TRP A 113 0.106 -13.948 -5.584 1.00 0.00 O ATOM 347 CB TRP A 113 1.898 -15.868 -3.490 1.00 0.00 C ATOM 348 CG TRP A 113 1.142 -17.082 -3.041 1.00 0.00 C ATOM 349 CD1 TRP A 113 0.991 -17.525 -1.758 1.00 0.00 C ATOM 350 CD2 TRP A 113 0.436 -18.009 -3.873 1.00 0.00 C ATOM 351 NE1 TRP A 113 0.234 -18.672 -1.743 1.00 0.00 N ATOM 352 CE2 TRP A 113 -0.120 -18.989 -3.027 1.00 0.00 C ATOM 353 CE3 TRP A 113 0.218 -18.105 -5.250 1.00 0.00 C ATOM 354 CZ2 TRP A 113 -0.878 -20.050 -3.516 1.00 0.00 C ATOM 355 CZ3 TRP A 113 -0.534 -19.159 -5.733 1.00 0.00 C ATOM 356 CH2 TRP A 113 -1.075 -20.120 -4.868 1.00 0.00 C ATOM 0 H TRP A 113 -0.002 -15.250 -1.789 1.00 0.00 H new ATOM 0 HA TRP A 113 1.705 -13.735 -3.663 1.00 0.00 H new ATOM 0 HB2 TRP A 113 2.274 -16.035 -4.499 1.00 0.00 H new ATOM 0 HB3 TRP A 113 2.766 -15.730 -2.846 1.00 0.00 H new ATOM 0 HD1 TRP A 113 1.405 -17.045 -0.884 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -0.023 -19.202 -0.910 1.00 0.00 H new ATOM 0 HE3 TRP A 113 0.630 -17.369 -5.924 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -1.296 -20.792 -2.851 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -0.708 -19.244 -6.796 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -1.659 -20.932 -5.277 1.00 0.00 H new ATOM 367 N LYS A 114 -1.010 -15.484 -4.377 1.00 0.00 N ATOM 368 CA LYS A 114 -2.084 -15.631 -5.352 1.00 0.00 C ATOM 369 C LYS A 114 -2.669 -14.273 -5.725 1.00 0.00 C ATOM 370 O LYS A 114 -3.103 -14.062 -6.859 1.00 0.00 O ATOM 371 CB LYS A 114 -3.184 -16.538 -4.796 1.00 0.00 C ATOM 372 CG LYS A 114 -3.643 -16.152 -3.400 1.00 0.00 C ATOM 373 CD LYS A 114 -4.351 -17.305 -2.708 1.00 0.00 C ATOM 374 CE LYS A 114 -4.274 -17.178 -1.195 1.00 0.00 C ATOM 375 NZ LYS A 114 -5.210 -16.141 -0.677 1.00 0.00 N ATOM 0 H LYS A 114 -1.110 -16.070 -3.548 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.667 -16.086 -6.250 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -4.040 -16.513 -5.471 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -2.822 -17.566 -4.779 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.783 -15.842 -2.806 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -4.314 -15.295 -3.460 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.395 -17.332 -3.019 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -3.902 -18.248 -3.018 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.508 -18.139 -0.737 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.255 -16.926 -0.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -5.202 -16.155 0.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.910 -15.204 -1.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.172 -16.340 -1.019 1.00 0.00 H new ATOM 389 N THR A 115 -2.679 -13.353 -4.765 1.00 0.00 N ATOM 390 CA THR A 115 -3.211 -12.016 -4.994 1.00 0.00 C ATOM 391 C THR A 115 -2.426 -11.290 -6.080 1.00 0.00 C ATOM 392 O THR A 115 -1.205 -11.150 -5.992 1.00 0.00 O ATOM 393 CB THR A 115 -3.182 -11.172 -3.705 1.00 0.00 C ATOM 394 OG1 THR A 115 -4.249 -11.568 -2.836 1.00 0.00 O ATOM 395 CG2 THR A 115 -3.305 -9.690 -4.025 1.00 0.00 C ATOM 0 H THR A 115 -2.325 -13.510 -3.822 1.00 0.00 H new ATOM 0 HA THR A 115 -4.245 -12.138 -5.317 1.00 0.00 H new ATOM 0 HB THR A 115 -2.227 -11.342 -3.208 1.00 0.00 H new ATOM 0 HG1 THR A 115 -4.223 -11.028 -2.019 1.00 0.00 H new ATOM 0 HG21 THR A 115 -3.282 -9.115 -3.099 1.00 0.00 H new ATOM 0 HG22 THR A 115 -2.475 -9.385 -4.662 1.00 0.00 H new ATOM 0 HG23 THR A 115 -4.246 -9.507 -4.543 1.00 0.00 H new ATOM 403 N THR A 116 -3.133 -10.828 -7.107 1.00 0.00 N ATOM 404 CA THR A 116 -2.503 -10.117 -8.211 1.00 0.00 C ATOM 405 C THR A 116 -3.094 -8.721 -8.375 1.00 0.00 C ATOM 406 O THR A 116 -4.063 -8.366 -7.706 1.00 0.00 O ATOM 407 CB THR A 116 -2.657 -10.886 -9.537 1.00 0.00 C ATOM 408 OG1 THR A 116 -4.033 -11.221 -9.752 1.00 0.00 O ATOM 409 CG2 THR A 116 -1.818 -12.155 -9.527 1.00 0.00 C ATOM 0 H THR A 116 -4.144 -10.934 -7.196 1.00 0.00 H new ATOM 0 HA THR A 116 -1.443 -10.034 -7.969 1.00 0.00 H new ATOM 0 HB THR A 116 -2.308 -10.244 -10.346 1.00 0.00 H new ATOM 0 HG1 THR A 116 -4.123 -11.708 -10.598 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.943 -12.681 -10.473 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.768 -11.896 -9.392 1.00 0.00 H new ATOM 0 HG23 THR A 116 -2.141 -12.798 -8.709 1.00 0.00 H new ATOM 417 N GLU A 117 -2.504 -7.935 -9.271 1.00 0.00 N ATOM 418 CA GLU A 117 -2.974 -6.578 -9.522 1.00 0.00 C ATOM 419 C GLU A 117 -4.468 -6.568 -9.834 1.00 0.00 C ATOM 420 O GLU A 117 -5.204 -5.700 -9.366 1.00 0.00 O ATOM 421 CB GLU A 117 -2.196 -5.951 -10.680 1.00 0.00 C ATOM 422 CG GLU A 117 -0.794 -5.504 -10.300 1.00 0.00 C ATOM 423 CD GLU A 117 0.093 -5.276 -11.509 1.00 0.00 C ATOM 424 OE1 GLU A 117 -0.084 -5.991 -12.517 1.00 0.00 O ATOM 425 OE2 GLU A 117 0.964 -4.383 -11.446 1.00 0.00 O ATOM 0 H GLU A 117 -1.701 -8.215 -9.834 1.00 0.00 H new ATOM 0 HA GLU A 117 -2.805 -5.990 -8.620 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -2.130 -6.672 -11.495 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -2.752 -5.093 -11.058 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -0.855 -4.583 -9.720 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -0.339 -6.257 -9.657 1.00 0.00 H new ATOM 432 N GLN A 118 -4.907 -7.539 -10.628 1.00 0.00 N ATOM 433 CA GLN A 118 -6.312 -7.642 -11.003 1.00 0.00 C ATOM 434 C GLN A 118 -7.190 -7.857 -9.775 1.00 0.00 C ATOM 435 O GLN A 118 -8.251 -7.248 -9.644 1.00 0.00 O ATOM 436 CB GLN A 118 -6.514 -8.788 -11.996 1.00 0.00 C ATOM 437 CG GLN A 118 -7.963 -8.986 -12.411 1.00 0.00 C ATOM 438 CD GLN A 118 -8.346 -8.147 -13.614 1.00 0.00 C ATOM 439 OE1 GLN A 118 -7.904 -8.408 -14.733 1.00 0.00 O ATOM 440 NE2 GLN A 118 -9.172 -7.132 -13.389 1.00 0.00 N ATOM 0 H GLN A 118 -4.310 -8.265 -11.024 1.00 0.00 H new ATOM 0 HA GLN A 118 -6.605 -6.705 -11.476 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -5.913 -8.597 -12.885 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -6.142 -9.712 -11.552 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -8.131 -10.039 -12.639 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -8.614 -8.733 -11.574 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -9.514 -6.952 -12.445 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -9.465 -6.532 -14.160 1.00 0.00 H new ATOM 449 N ASP A 119 -6.740 -8.728 -8.878 1.00 0.00 N ATOM 450 CA ASP A 119 -7.484 -9.023 -7.659 1.00 0.00 C ATOM 451 C ASP A 119 -7.469 -7.829 -6.710 1.00 0.00 C ATOM 452 O ASP A 119 -8.470 -7.526 -6.060 1.00 0.00 O ATOM 453 CB ASP A 119 -6.896 -10.252 -6.962 1.00 0.00 C ATOM 454 CG ASP A 119 -7.270 -11.546 -7.658 1.00 0.00 C ATOM 455 OD1 ASP A 119 -8.395 -11.628 -8.194 1.00 0.00 O ATOM 456 OD2 ASP A 119 -6.437 -12.476 -7.667 1.00 0.00 O ATOM 0 H ASP A 119 -5.864 -9.242 -8.972 1.00 0.00 H new ATOM 0 HA ASP A 119 -8.518 -9.231 -7.935 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -5.810 -10.162 -6.928 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -7.246 -10.283 -5.930 1.00 0.00 H new ATOM 461 N LEU A 120 -6.327 -7.155 -6.634 1.00 0.00 N ATOM 462 CA LEU A 120 -6.180 -5.994 -5.763 1.00 0.00 C ATOM 463 C LEU A 120 -7.067 -4.845 -6.233 1.00 0.00 C ATOM 464 O LEU A 120 -7.660 -4.132 -5.423 1.00 0.00 O ATOM 465 CB LEU A 120 -4.719 -5.542 -5.725 1.00 0.00 C ATOM 466 CG LEU A 120 -3.786 -6.363 -4.834 1.00 0.00 C ATOM 467 CD1 LEU A 120 -2.379 -5.785 -4.859 1.00 0.00 C ATOM 468 CD2 LEU A 120 -4.318 -6.415 -3.409 1.00 0.00 C ATOM 0 H LEU A 120 -5.489 -7.392 -7.165 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.491 -6.282 -4.759 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -4.327 -5.561 -6.742 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -4.689 -4.505 -5.391 1.00 0.00 H new ATOM 0 HG LEU A 120 -3.746 -7.381 -5.223 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.729 -6.382 -4.219 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -1.997 -5.801 -5.880 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.401 -4.758 -4.496 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.641 -7.003 -2.789 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -4.388 -5.403 -3.010 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -5.306 -6.876 -3.406 1.00 0.00 H new ATOM 480 N LYS A 121 -7.156 -4.673 -7.548 1.00 0.00 N ATOM 481 CA LYS A 121 -7.973 -3.614 -8.127 1.00 0.00 C ATOM 482 C LYS A 121 -9.444 -3.803 -7.768 1.00 0.00 C ATOM 483 O LYS A 121 -10.139 -2.843 -7.439 1.00 0.00 O ATOM 484 CB LYS A 121 -7.808 -3.588 -9.649 1.00 0.00 C ATOM 485 CG LYS A 121 -8.419 -2.364 -10.307 1.00 0.00 C ATOM 486 CD LYS A 121 -9.873 -2.598 -10.680 1.00 0.00 C ATOM 487 CE LYS A 121 -10.666 -1.300 -10.678 1.00 0.00 C ATOM 488 NZ LYS A 121 -12.132 -1.545 -10.771 1.00 0.00 N ATOM 0 H LYS A 121 -6.672 -5.254 -8.233 1.00 0.00 H new ATOM 0 HA LYS A 121 -7.636 -2.663 -7.715 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -6.746 -3.628 -9.891 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -8.265 -4.483 -10.071 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -8.349 -1.513 -9.630 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -7.850 -2.108 -11.201 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -9.927 -3.057 -11.667 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -10.321 -3.300 -9.977 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -10.448 -0.743 -9.767 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -10.348 -0.679 -11.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -12.637 -0.636 -10.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -12.344 -2.054 -11.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -12.441 -2.116 -9.959 1.00 0.00 H new ATOM 502 N GLU A 122 -9.909 -5.047 -7.833 1.00 0.00 N ATOM 503 CA GLU A 122 -11.296 -5.360 -7.514 1.00 0.00 C ATOM 504 C GLU A 122 -11.554 -5.226 -6.016 1.00 0.00 C ATOM 505 O GLU A 122 -12.550 -4.637 -5.596 1.00 0.00 O ATOM 506 CB GLU A 122 -11.642 -6.777 -7.977 1.00 0.00 C ATOM 507 CG GLU A 122 -10.670 -7.834 -7.479 1.00 0.00 C ATOM 508 CD GLU A 122 -11.075 -9.237 -7.888 1.00 0.00 C ATOM 509 OE1 GLU A 122 -12.010 -9.788 -7.270 1.00 0.00 O ATOM 510 OE2 GLU A 122 -10.457 -9.784 -8.825 1.00 0.00 O ATOM 0 H GLU A 122 -9.346 -5.853 -8.103 1.00 0.00 H new ATOM 0 HA GLU A 122 -11.932 -4.648 -8.040 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -12.646 -7.028 -7.633 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -11.663 -6.799 -9.067 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -9.675 -7.619 -7.868 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -10.606 -7.780 -6.392 1.00 0.00 H new ATOM 517 N TYR A 123 -10.649 -5.776 -5.214 1.00 0.00 N ATOM 518 CA TYR A 123 -10.778 -5.721 -3.763 1.00 0.00 C ATOM 519 C TYR A 123 -10.806 -4.276 -3.273 1.00 0.00 C ATOM 520 O TYR A 123 -11.688 -3.885 -2.509 1.00 0.00 O ATOM 521 CB TYR A 123 -9.625 -6.474 -3.098 1.00 0.00 C ATOM 522 CG TYR A 123 -9.735 -6.542 -1.592 1.00 0.00 C ATOM 523 CD1 TYR A 123 -9.241 -5.519 -0.792 1.00 0.00 C ATOM 524 CD2 TYR A 123 -10.334 -7.630 -0.968 1.00 0.00 C ATOM 525 CE1 TYR A 123 -9.338 -5.578 0.584 1.00 0.00 C ATOM 526 CE2 TYR A 123 -10.437 -7.696 0.408 1.00 0.00 C ATOM 527 CZ TYR A 123 -9.938 -6.668 1.180 1.00 0.00 C ATOM 528 OH TYR A 123 -10.038 -6.730 2.551 1.00 0.00 O ATOM 0 H TYR A 123 -9.817 -6.265 -5.545 1.00 0.00 H new ATOM 0 HA TYR A 123 -11.720 -6.197 -3.489 1.00 0.00 H new ATOM 0 HB2 TYR A 123 -9.586 -7.488 -3.497 1.00 0.00 H new ATOM 0 HB3 TYR A 123 -8.685 -5.990 -3.364 1.00 0.00 H new ATOM 0 HD1 TYR A 123 -8.773 -4.663 -1.255 1.00 0.00 H new ATOM 0 HD2 TYR A 123 -10.726 -8.437 -1.569 1.00 0.00 H new ATOM 0 HE1 TYR A 123 -8.946 -4.775 1.191 1.00 0.00 H new ATOM 0 HE2 TYR A 123 -10.906 -8.548 0.877 1.00 0.00 H new ATOM 0 HH TYR A 123 -10.005 -7.666 2.839 1.00 0.00 H new ATOM 538 N PHE A 124 -9.834 -3.488 -3.720 1.00 0.00 N ATOM 539 CA PHE A 124 -9.746 -2.086 -3.328 1.00 0.00 C ATOM 540 C PHE A 124 -10.938 -1.296 -3.860 1.00 0.00 C ATOM 541 O PHE A 124 -11.390 -0.337 -3.234 1.00 0.00 O ATOM 542 CB PHE A 124 -8.443 -1.472 -3.842 1.00 0.00 C ATOM 543 CG PHE A 124 -7.227 -1.924 -3.085 1.00 0.00 C ATOM 544 CD1 PHE A 124 -7.212 -1.908 -1.700 1.00 0.00 C ATOM 545 CD2 PHE A 124 -6.100 -2.366 -3.759 1.00 0.00 C ATOM 546 CE1 PHE A 124 -6.094 -2.322 -1.001 1.00 0.00 C ATOM 547 CE2 PHE A 124 -4.979 -2.783 -3.065 1.00 0.00 C ATOM 548 CZ PHE A 124 -4.977 -2.762 -1.684 1.00 0.00 C ATOM 0 H PHE A 124 -9.096 -3.796 -4.354 1.00 0.00 H new ATOM 0 HA PHE A 124 -9.758 -2.038 -2.239 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -8.321 -1.727 -4.895 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -8.515 -0.386 -3.783 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -8.084 -1.568 -1.160 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -6.097 -2.385 -4.839 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -6.094 -2.301 0.079 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -4.106 -3.125 -3.602 1.00 0.00 H new ATOM 0 HZ PHE A 124 -4.104 -3.089 -1.139 1.00 0.00 H new ATOM 558 N SER A 125 -11.443 -1.707 -5.019 1.00 0.00 N ATOM 559 CA SER A 125 -12.580 -1.036 -5.639 1.00 0.00 C ATOM 560 C SER A 125 -13.793 -1.058 -4.714 1.00 0.00 C ATOM 561 O SER A 125 -14.725 -0.268 -4.873 1.00 0.00 O ATOM 562 CB SER A 125 -12.928 -1.702 -6.971 1.00 0.00 C ATOM 563 OG SER A 125 -14.104 -1.142 -7.529 1.00 0.00 O ATOM 0 H SER A 125 -11.083 -2.501 -5.548 1.00 0.00 H new ATOM 0 HA SER A 125 -12.303 0.002 -5.822 1.00 0.00 H new ATOM 0 HB2 SER A 125 -12.099 -1.583 -7.668 1.00 0.00 H new ATOM 0 HB3 SER A 125 -13.067 -2.773 -6.821 1.00 0.00 H new ATOM 0 HG SER A 125 -14.304 -1.584 -8.381 1.00 0.00 H new ATOM 569 N THR A 126 -13.775 -1.969 -3.746 1.00 0.00 N ATOM 570 CA THR A 126 -14.873 -2.096 -2.796 1.00 0.00 C ATOM 571 C THR A 126 -14.944 -0.885 -1.873 1.00 0.00 C ATOM 572 O THR A 126 -16.020 -0.511 -1.405 1.00 0.00 O ATOM 573 CB THR A 126 -14.732 -3.370 -1.942 1.00 0.00 C ATOM 574 OG1 THR A 126 -13.587 -3.264 -1.089 1.00 0.00 O ATOM 575 CG2 THR A 126 -14.601 -4.602 -2.825 1.00 0.00 C ATOM 0 H THR A 126 -13.012 -2.630 -3.599 1.00 0.00 H new ATOM 0 HA THR A 126 -15.791 -2.159 -3.380 1.00 0.00 H new ATOM 0 HB THR A 126 -15.630 -3.473 -1.333 1.00 0.00 H new ATOM 0 HG1 THR A 126 -12.859 -3.813 -1.449 1.00 0.00 H new ATOM 0 HG21 THR A 126 -14.503 -5.489 -2.199 1.00 0.00 H new ATOM 0 HG22 THR A 126 -15.488 -4.696 -3.452 1.00 0.00 H new ATOM 0 HG23 THR A 126 -13.719 -4.504 -3.457 1.00 0.00 H new ATOM 583 N PHE A 127 -13.793 -0.274 -1.615 1.00 0.00 N ATOM 584 CA PHE A 127 -13.725 0.896 -0.747 1.00 0.00 C ATOM 585 C PHE A 127 -14.278 2.130 -1.454 1.00 0.00 C ATOM 586 O PHE A 127 -14.831 3.026 -0.818 1.00 0.00 O ATOM 587 CB PHE A 127 -12.281 1.149 -0.310 1.00 0.00 C ATOM 588 CG PHE A 127 -11.626 -0.047 0.321 1.00 0.00 C ATOM 589 CD1 PHE A 127 -12.391 -1.042 0.908 1.00 0.00 C ATOM 590 CD2 PHE A 127 -10.247 -0.176 0.326 1.00 0.00 C ATOM 591 CE1 PHE A 127 -11.791 -2.143 1.490 1.00 0.00 C ATOM 592 CE2 PHE A 127 -9.642 -1.275 0.906 1.00 0.00 C ATOM 593 CZ PHE A 127 -10.415 -2.260 1.488 1.00 0.00 C ATOM 0 H PHE A 127 -12.894 -0.570 -1.995 1.00 0.00 H new ATOM 0 HA PHE A 127 -14.335 0.700 0.135 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -11.697 1.458 -1.177 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -12.264 1.978 0.398 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -13.468 -0.956 0.911 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -9.637 0.591 -0.129 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -12.398 -2.911 1.946 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -8.566 -1.363 0.904 1.00 0.00 H new ATOM 0 HZ PHE A 127 -9.944 -3.120 1.941 1.00 0.00 H new ATOM 603 N GLY A 128 -14.125 2.167 -2.774 1.00 0.00 N ATOM 604 CA GLY A 128 -14.613 3.295 -3.545 1.00 0.00 C ATOM 605 C GLY A 128 -14.222 3.210 -5.007 1.00 0.00 C ATOM 606 O GLY A 128 -14.956 2.649 -5.820 1.00 0.00 O ATOM 0 H GLY A 128 -13.672 1.436 -3.323 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -15.699 3.344 -3.465 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -14.220 4.219 -3.120 1.00 0.00 H new ATOM 610 N GLU A 129 -13.064 3.769 -5.342 1.00 0.00 N ATOM 611 CA GLU A 129 -12.579 3.756 -6.718 1.00 0.00 C ATOM 612 C GLU A 129 -11.056 3.667 -6.757 1.00 0.00 C ATOM 613 O GLU A 129 -10.359 4.619 -6.405 1.00 0.00 O ATOM 614 CB GLU A 129 -13.047 5.009 -7.459 1.00 0.00 C ATOM 615 CG GLU A 129 -12.694 5.010 -8.937 1.00 0.00 C ATOM 616 CD GLU A 129 -13.441 3.946 -9.716 1.00 0.00 C ATOM 617 OE1 GLU A 129 -13.197 2.747 -9.466 1.00 0.00 O ATOM 618 OE2 GLU A 129 -14.270 4.311 -10.576 1.00 0.00 O ATOM 0 H GLU A 129 -12.444 4.236 -4.680 1.00 0.00 H new ATOM 0 HA GLU A 129 -12.990 2.876 -7.213 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -14.128 5.101 -7.352 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -12.604 5.886 -6.988 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -12.919 5.989 -9.360 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -11.621 4.852 -9.051 1.00 0.00 H new ATOM 625 N VAL A 130 -10.547 2.517 -7.187 1.00 0.00 N ATOM 626 CA VAL A 130 -9.107 2.304 -7.273 1.00 0.00 C ATOM 627 C VAL A 130 -8.456 3.318 -8.206 1.00 0.00 C ATOM 628 O VAL A 130 -8.935 3.555 -9.316 1.00 0.00 O ATOM 629 CB VAL A 130 -8.779 0.883 -7.769 1.00 0.00 C ATOM 630 CG1 VAL A 130 -7.318 0.784 -8.179 1.00 0.00 C ATOM 631 CG2 VAL A 130 -9.111 -0.145 -6.697 1.00 0.00 C ATOM 0 H VAL A 130 -11.110 1.719 -7.481 1.00 0.00 H new ATOM 0 HA VAL A 130 -8.708 2.432 -6.267 1.00 0.00 H new ATOM 0 HB VAL A 130 -9.392 0.672 -8.645 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.105 -0.227 -8.526 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -7.116 1.493 -8.982 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -6.684 1.014 -7.323 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -8.873 -1.143 -7.064 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -8.525 0.061 -5.801 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -10.173 -0.090 -6.457 1.00 0.00 H new ATOM 641 N LEU A 131 -7.360 3.915 -7.750 1.00 0.00 N ATOM 642 CA LEU A 131 -6.641 4.905 -8.544 1.00 0.00 C ATOM 643 C LEU A 131 -5.372 4.305 -9.143 1.00 0.00 C ATOM 644 O LEU A 131 -4.972 4.657 -10.253 1.00 0.00 O ATOM 645 CB LEU A 131 -6.287 6.119 -7.684 1.00 0.00 C ATOM 646 CG LEU A 131 -5.703 7.321 -8.426 1.00 0.00 C ATOM 647 CD1 LEU A 131 -6.503 7.611 -9.686 1.00 0.00 C ATOM 648 CD2 LEU A 131 -5.669 8.543 -7.520 1.00 0.00 C ATOM 0 H LEU A 131 -6.950 3.731 -6.834 1.00 0.00 H new ATOM 0 HA LEU A 131 -7.291 5.222 -9.359 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -7.187 6.443 -7.161 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -5.572 5.804 -6.924 1.00 0.00 H new ATOM 0 HG LEU A 131 -4.680 7.081 -8.717 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -6.072 8.470 -10.201 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -6.474 6.742 -10.343 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -7.537 7.829 -9.418 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -5.250 9.389 -8.065 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -6.682 8.785 -7.197 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -5.051 8.332 -6.647 1.00 0.00 H new ATOM 660 N MET A 132 -4.746 3.398 -8.402 1.00 0.00 N ATOM 661 CA MET A 132 -3.525 2.747 -8.862 1.00 0.00 C ATOM 662 C MET A 132 -3.323 1.409 -8.157 1.00 0.00 C ATOM 663 O MET A 132 -3.589 1.279 -6.962 1.00 0.00 O ATOM 664 CB MET A 132 -2.316 3.652 -8.618 1.00 0.00 C ATOM 665 CG MET A 132 -2.151 4.741 -9.665 1.00 0.00 C ATOM 666 SD MET A 132 -0.651 5.713 -9.426 1.00 0.00 S ATOM 667 CE MET A 132 0.144 4.791 -8.113 1.00 0.00 C ATOM 0 H MET A 132 -5.064 3.097 -7.481 1.00 0.00 H new ATOM 0 HA MET A 132 -3.622 2.563 -9.932 1.00 0.00 H new ATOM 0 HB2 MET A 132 -2.412 4.115 -7.636 1.00 0.00 H new ATOM 0 HB3 MET A 132 -1.414 3.041 -8.596 1.00 0.00 H new ATOM 0 HG2 MET A 132 -2.131 4.287 -10.656 1.00 0.00 H new ATOM 0 HG3 MET A 132 -3.017 5.403 -9.635 1.00 0.00 H new ATOM 0 HE1 MET A 132 1.052 5.308 -7.804 1.00 0.00 H new ATOM 0 HE2 MET A 132 -0.534 4.709 -7.264 1.00 0.00 H new ATOM 0 HE3 MET A 132 0.399 3.794 -8.471 1.00 0.00 H new ATOM 677 N VAL A 133 -2.853 0.416 -8.905 1.00 0.00 N ATOM 678 CA VAL A 133 -2.616 -0.912 -8.352 1.00 0.00 C ATOM 679 C VAL A 133 -1.329 -1.515 -8.904 1.00 0.00 C ATOM 680 O VAL A 133 -1.061 -1.440 -10.102 1.00 0.00 O ATOM 681 CB VAL A 133 -3.787 -1.865 -8.656 1.00 0.00 C ATOM 682 CG1 VAL A 133 -4.055 -1.921 -10.152 1.00 0.00 C ATOM 683 CG2 VAL A 133 -3.501 -3.253 -8.104 1.00 0.00 C ATOM 0 H VAL A 133 -2.629 0.506 -9.896 1.00 0.00 H new ATOM 0 HA VAL A 133 -2.525 -0.793 -7.272 1.00 0.00 H new ATOM 0 HB VAL A 133 -4.682 -1.482 -8.165 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -4.886 -2.599 -10.348 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -4.307 -0.924 -10.514 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -3.164 -2.280 -10.668 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -4.339 -3.913 -8.328 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -2.595 -3.648 -8.564 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.364 -3.194 -7.024 1.00 0.00 H new ATOM 693 N GLN A 134 -0.536 -2.114 -8.020 1.00 0.00 N ATOM 694 CA GLN A 134 0.724 -2.730 -8.419 1.00 0.00 C ATOM 695 C GLN A 134 1.177 -3.759 -7.389 1.00 0.00 C ATOM 696 O GLN A 134 0.825 -3.671 -6.213 1.00 0.00 O ATOM 697 CB GLN A 134 1.804 -1.662 -8.600 1.00 0.00 C ATOM 698 CG GLN A 134 2.867 -2.038 -9.619 1.00 0.00 C ATOM 699 CD GLN A 134 3.459 -0.830 -10.318 1.00 0.00 C ATOM 700 OE1 GLN A 134 3.815 0.160 -9.678 1.00 0.00 O ATOM 701 NE2 GLN A 134 3.568 -0.905 -11.639 1.00 0.00 N ATOM 0 H GLN A 134 -0.744 -2.185 -7.024 1.00 0.00 H new ATOM 0 HA GLN A 134 0.565 -3.240 -9.369 1.00 0.00 H new ATOM 0 HB2 GLN A 134 1.332 -0.729 -8.907 1.00 0.00 H new ATOM 0 HB3 GLN A 134 2.284 -1.476 -7.639 1.00 0.00 H new ATOM 0 HG2 GLN A 134 3.663 -2.591 -9.121 1.00 0.00 H new ATOM 0 HG3 GLN A 134 2.432 -2.706 -10.362 1.00 0.00 H new ATOM 0 HE21 GLN A 134 3.260 -1.745 -12.129 1.00 0.00 H new ATOM 0 HE22 GLN A 134 3.959 -0.123 -12.164 1.00 0.00 H new ATOM 710 N VAL A 135 1.960 -4.734 -7.839 1.00 0.00 N ATOM 711 CA VAL A 135 2.463 -5.780 -6.956 1.00 0.00 C ATOM 712 C VAL A 135 3.965 -5.970 -7.128 1.00 0.00 C ATOM 713 O VAL A 135 4.456 -6.148 -8.243 1.00 0.00 O ATOM 714 CB VAL A 135 1.753 -7.122 -7.215 1.00 0.00 C ATOM 715 CG1 VAL A 135 2.549 -8.271 -6.615 1.00 0.00 C ATOM 716 CG2 VAL A 135 0.338 -7.093 -6.657 1.00 0.00 C ATOM 0 H VAL A 135 2.260 -4.822 -8.810 1.00 0.00 H new ATOM 0 HA VAL A 135 2.256 -5.459 -5.935 1.00 0.00 H new ATOM 0 HB VAL A 135 1.690 -7.278 -8.292 1.00 0.00 H new ATOM 0 HG11 VAL A 135 2.032 -9.211 -6.808 1.00 0.00 H new ATOM 0 HG12 VAL A 135 3.540 -8.302 -7.067 1.00 0.00 H new ATOM 0 HG13 VAL A 135 2.646 -8.124 -5.539 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -0.149 -8.049 -6.849 1.00 0.00 H new ATOM 0 HG22 VAL A 135 0.374 -6.914 -5.582 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -0.227 -6.295 -7.139 1.00 0.00 H new ATOM 726 N LYS A 136 4.692 -5.932 -6.017 1.00 0.00 N ATOM 727 CA LYS A 136 6.140 -6.102 -6.043 1.00 0.00 C ATOM 728 C LYS A 136 6.514 -7.580 -6.075 1.00 0.00 C ATOM 729 O LYS A 136 5.947 -8.391 -5.343 1.00 0.00 O ATOM 730 CB LYS A 136 6.775 -5.431 -4.823 1.00 0.00 C ATOM 731 CG LYS A 136 8.182 -4.916 -5.075 1.00 0.00 C ATOM 732 CD LYS A 136 8.176 -3.703 -5.991 1.00 0.00 C ATOM 733 CE LYS A 136 9.570 -3.396 -6.517 1.00 0.00 C ATOM 734 NZ LYS A 136 10.311 -2.470 -5.617 1.00 0.00 N ATOM 0 H LYS A 136 4.302 -5.785 -5.086 1.00 0.00 H new ATOM 0 HA LYS A 136 6.520 -5.629 -6.949 1.00 0.00 H new ATOM 0 HB2 LYS A 136 6.144 -4.600 -4.507 1.00 0.00 H new ATOM 0 HB3 LYS A 136 6.800 -6.144 -3.999 1.00 0.00 H new ATOM 0 HG2 LYS A 136 8.650 -4.654 -4.126 1.00 0.00 H new ATOM 0 HG3 LYS A 136 8.786 -5.707 -5.521 1.00 0.00 H new ATOM 0 HD2 LYS A 136 7.501 -3.881 -6.828 1.00 0.00 H new ATOM 0 HD3 LYS A 136 7.791 -2.839 -5.450 1.00 0.00 H new ATOM 0 HE2 LYS A 136 10.131 -4.325 -6.624 1.00 0.00 H new ATOM 0 HE3 LYS A 136 9.494 -2.954 -7.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 11.256 -2.286 -6.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 9.789 -1.574 -5.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 10.406 -2.903 -4.676 1.00 0.00 H new ATOM 748 N LYS A 137 7.474 -7.924 -6.927 1.00 0.00 N ATOM 749 CA LYS A 137 7.926 -9.305 -7.054 1.00 0.00 C ATOM 750 C LYS A 137 9.450 -9.378 -7.070 1.00 0.00 C ATOM 751 O LYS A 137 10.124 -8.415 -7.435 1.00 0.00 O ATOM 752 CB LYS A 137 7.361 -9.934 -8.329 1.00 0.00 C ATOM 753 CG LYS A 137 5.847 -9.857 -8.426 1.00 0.00 C ATOM 754 CD LYS A 137 5.397 -8.584 -9.122 1.00 0.00 C ATOM 755 CE LYS A 137 5.303 -8.775 -10.628 1.00 0.00 C ATOM 756 NZ LYS A 137 4.579 -10.026 -10.984 1.00 0.00 N ATOM 0 H LYS A 137 7.954 -7.265 -7.540 1.00 0.00 H new ATOM 0 HA LYS A 137 7.561 -9.861 -6.191 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.798 -9.436 -9.194 1.00 0.00 H new ATOM 0 HB3 LYS A 137 7.667 -10.979 -8.375 1.00 0.00 H new ATOM 0 HG2 LYS A 137 5.472 -10.723 -8.971 1.00 0.00 H new ATOM 0 HG3 LYS A 137 5.415 -9.898 -7.426 1.00 0.00 H new ATOM 0 HD2 LYS A 137 4.426 -8.278 -8.732 1.00 0.00 H new ATOM 0 HD3 LYS A 137 6.098 -7.779 -8.899 1.00 0.00 H new ATOM 0 HE2 LYS A 137 4.791 -7.921 -11.071 1.00 0.00 H new ATOM 0 HE3 LYS A 137 6.306 -8.802 -11.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 4.110 -9.906 -11.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 5.255 -10.814 -11.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 3.866 -10.233 -10.256 1.00 0.00 H new ATOM 861 N SER A 144 6.383 -13.168 -5.296 1.00 0.00 N ATOM 862 CA SER A 144 5.905 -11.877 -4.816 1.00 0.00 C ATOM 863 C SER A 144 6.562 -11.513 -3.488 1.00 0.00 C ATOM 864 O SER A 144 6.755 -12.368 -2.622 1.00 0.00 O ATOM 865 CB SER A 144 4.383 -11.901 -4.654 1.00 0.00 C ATOM 866 OG SER A 144 4.001 -12.692 -3.542 1.00 0.00 O ATOM 0 HA SER A 144 6.174 -11.121 -5.554 1.00 0.00 H new ATOM 0 HB2 SER A 144 4.012 -10.884 -4.526 1.00 0.00 H new ATOM 0 HB3 SER A 144 3.924 -12.296 -5.560 1.00 0.00 H new ATOM 0 HG SER A 144 3.263 -12.255 -3.068 1.00 0.00 H new ATOM 872 N LYS A 145 6.905 -10.239 -3.334 1.00 0.00 N ATOM 873 CA LYS A 145 7.540 -9.759 -2.112 1.00 0.00 C ATOM 874 C LYS A 145 6.535 -9.690 -0.967 1.00 0.00 C ATOM 875 O LYS A 145 6.913 -9.578 0.198 1.00 0.00 O ATOM 876 CB LYS A 145 8.161 -8.379 -2.344 1.00 0.00 C ATOM 877 CG LYS A 145 9.188 -8.354 -3.462 1.00 0.00 C ATOM 878 CD LYS A 145 10.150 -7.188 -3.310 1.00 0.00 C ATOM 879 CE LYS A 145 11.387 -7.368 -4.176 1.00 0.00 C ATOM 880 NZ LYS A 145 11.118 -7.036 -5.603 1.00 0.00 N ATOM 0 H LYS A 145 6.754 -9.519 -4.041 1.00 0.00 H new ATOM 0 HA LYS A 145 8.326 -10.464 -1.840 1.00 0.00 H new ATOM 0 HB2 LYS A 145 7.368 -7.667 -2.574 1.00 0.00 H new ATOM 0 HB3 LYS A 145 8.633 -8.043 -1.421 1.00 0.00 H new ATOM 0 HG2 LYS A 145 9.747 -9.290 -3.465 1.00 0.00 H new ATOM 0 HG3 LYS A 145 8.679 -8.284 -4.423 1.00 0.00 H new ATOM 0 HD2 LYS A 145 9.646 -6.261 -3.583 1.00 0.00 H new ATOM 0 HD3 LYS A 145 10.447 -7.094 -2.265 1.00 0.00 H new ATOM 0 HE2 LYS A 145 12.189 -6.733 -3.800 1.00 0.00 H new ATOM 0 HE3 LYS A 145 11.735 -8.398 -4.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 11.896 -7.390 -6.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 10.226 -7.481 -5.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 11.043 -6.004 -5.711 1.00 0.00 H new ATOM 894 N GLY A 146 5.251 -9.760 -1.307 1.00 0.00 N ATOM 895 CA GLY A 146 4.212 -9.706 -0.296 1.00 0.00 C ATOM 896 C GLY A 146 3.766 -8.288 0.001 1.00 0.00 C ATOM 897 O GLY A 146 3.086 -8.039 0.998 1.00 0.00 O ATOM 0 H GLY A 146 4.913 -9.853 -2.265 1.00 0.00 H new ATOM 0 HA2 GLY A 146 3.355 -10.291 -0.629 1.00 0.00 H new ATOM 0 HA3 GLY A 146 4.577 -10.168 0.621 1.00 0.00 H new ATOM 901 N PHE A 147 4.150 -7.355 -0.864 1.00 0.00 N ATOM 902 CA PHE A 147 3.787 -5.953 -0.687 1.00 0.00 C ATOM 903 C PHE A 147 3.693 -5.243 -2.034 1.00 0.00 C ATOM 904 O PHE A 147 4.383 -5.601 -2.987 1.00 0.00 O ATOM 905 CB PHE A 147 4.811 -5.248 0.204 1.00 0.00 C ATOM 906 CG PHE A 147 6.095 -4.919 -0.502 1.00 0.00 C ATOM 907 CD1 PHE A 147 6.141 -3.908 -1.449 1.00 0.00 C ATOM 908 CD2 PHE A 147 7.256 -5.620 -0.220 1.00 0.00 C ATOM 909 CE1 PHE A 147 7.321 -3.604 -2.101 1.00 0.00 C ATOM 910 CE2 PHE A 147 8.439 -5.321 -0.868 1.00 0.00 C ATOM 911 CZ PHE A 147 8.472 -4.310 -1.809 1.00 0.00 C ATOM 0 H PHE A 147 4.712 -7.544 -1.694 1.00 0.00 H new ATOM 0 HA PHE A 147 2.810 -5.914 -0.206 1.00 0.00 H new ATOM 0 HB2 PHE A 147 4.372 -4.328 0.590 1.00 0.00 H new ATOM 0 HB3 PHE A 147 5.030 -5.882 1.063 1.00 0.00 H new ATOM 0 HD1 PHE A 147 5.245 -3.352 -1.680 1.00 0.00 H new ATOM 0 HD2 PHE A 147 7.236 -6.410 0.516 1.00 0.00 H new ATOM 0 HE1 PHE A 147 7.343 -2.815 -2.838 1.00 0.00 H new ATOM 0 HE2 PHE A 147 9.336 -5.877 -0.639 1.00 0.00 H new ATOM 0 HZ PHE A 147 9.396 -4.072 -2.315 1.00 0.00 H new ATOM 921 N GLY A 148 2.832 -4.232 -2.105 1.00 0.00 N ATOM 922 CA GLY A 148 2.663 -3.486 -3.338 1.00 0.00 C ATOM 923 C GLY A 148 2.234 -2.053 -3.095 1.00 0.00 C ATOM 924 O GLY A 148 2.136 -1.612 -1.950 1.00 0.00 O ATOM 0 H GLY A 148 2.249 -3.917 -1.330 1.00 0.00 H new ATOM 0 HA2 GLY A 148 3.601 -3.492 -3.894 1.00 0.00 H new ATOM 0 HA3 GLY A 148 1.920 -3.984 -3.961 1.00 0.00 H new ATOM 928 N PHE A 149 1.980 -1.322 -4.175 1.00 0.00 N ATOM 929 CA PHE A 149 1.562 0.072 -4.074 1.00 0.00 C ATOM 930 C PHE A 149 0.133 0.249 -4.578 1.00 0.00 C ATOM 931 O PHE A 149 -0.276 -0.379 -5.555 1.00 0.00 O ATOM 932 CB PHE A 149 2.511 0.970 -4.872 1.00 0.00 C ATOM 933 CG PHE A 149 3.916 0.977 -4.342 1.00 0.00 C ATOM 934 CD1 PHE A 149 4.746 -0.118 -4.526 1.00 0.00 C ATOM 935 CD2 PHE A 149 4.408 2.078 -3.660 1.00 0.00 C ATOM 936 CE1 PHE A 149 6.040 -0.114 -4.040 1.00 0.00 C ATOM 937 CE2 PHE A 149 5.701 2.088 -3.172 1.00 0.00 C ATOM 938 CZ PHE A 149 6.518 0.990 -3.361 1.00 0.00 C ATOM 0 H PHE A 149 2.056 -1.671 -5.130 1.00 0.00 H new ATOM 0 HA PHE A 149 1.597 0.361 -3.023 1.00 0.00 H new ATOM 0 HB2 PHE A 149 2.524 0.639 -5.910 1.00 0.00 H new ATOM 0 HB3 PHE A 149 2.124 1.989 -4.867 1.00 0.00 H new ATOM 0 HD1 PHE A 149 4.377 -0.984 -5.055 1.00 0.00 H new ATOM 0 HD2 PHE A 149 3.774 2.939 -3.508 1.00 0.00 H new ATOM 0 HE1 PHE A 149 6.677 -0.973 -4.191 1.00 0.00 H new ATOM 0 HE2 PHE A 149 6.072 2.953 -2.643 1.00 0.00 H new ATOM 0 HZ PHE A 149 7.528 0.995 -2.979 1.00 0.00 H new ATOM 948 N VAL A 150 -0.623 1.109 -3.903 1.00 0.00 N ATOM 949 CA VAL A 150 -2.007 1.370 -4.281 1.00 0.00 C ATOM 950 C VAL A 150 -2.425 2.784 -3.893 1.00 0.00 C ATOM 951 O VAL A 150 -1.932 3.342 -2.913 1.00 0.00 O ATOM 952 CB VAL A 150 -2.969 0.364 -3.621 1.00 0.00 C ATOM 953 CG1 VAL A 150 -3.157 0.692 -2.148 1.00 0.00 C ATOM 954 CG2 VAL A 150 -4.305 0.350 -4.348 1.00 0.00 C ATOM 0 H VAL A 150 -0.301 1.637 -3.092 1.00 0.00 H new ATOM 0 HA VAL A 150 -2.065 1.260 -5.364 1.00 0.00 H new ATOM 0 HB VAL A 150 -2.532 -0.632 -3.693 1.00 0.00 H new ATOM 0 HG11 VAL A 150 -3.840 -0.029 -1.699 1.00 0.00 H new ATOM 0 HG12 VAL A 150 -2.194 0.646 -1.639 1.00 0.00 H new ATOM 0 HG13 VAL A 150 -3.572 1.695 -2.049 1.00 0.00 H new ATOM 0 HG21 VAL A 150 -4.973 -0.366 -3.869 1.00 0.00 H new ATOM 0 HG22 VAL A 150 -4.751 1.344 -4.309 1.00 0.00 H new ATOM 0 HG23 VAL A 150 -4.150 0.062 -5.388 1.00 0.00 H new ATOM 964 N ARG A 151 -3.338 3.359 -4.669 1.00 0.00 N ATOM 965 CA ARG A 151 -3.822 4.709 -4.408 1.00 0.00 C ATOM 966 C ARG A 151 -5.321 4.810 -4.675 1.00 0.00 C ATOM 967 O ARG A 151 -5.854 4.127 -5.549 1.00 0.00 O ATOM 968 CB ARG A 151 -3.070 5.721 -5.274 1.00 0.00 C ATOM 969 CG ARG A 151 -3.607 7.138 -5.162 1.00 0.00 C ATOM 970 CD ARG A 151 -2.595 8.159 -5.658 1.00 0.00 C ATOM 971 NE ARG A 151 -2.359 8.043 -7.094 1.00 0.00 N ATOM 972 CZ ARG A 151 -1.632 8.909 -7.792 1.00 0.00 C ATOM 973 NH1 ARG A 151 -1.074 9.948 -7.188 1.00 0.00 N ATOM 974 NH2 ARG A 151 -1.463 8.735 -9.097 1.00 0.00 N ATOM 0 H ARG A 151 -3.757 2.911 -5.484 1.00 0.00 H new ATOM 0 HA ARG A 151 -3.641 4.935 -3.357 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -2.017 5.717 -4.991 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -3.121 5.404 -6.316 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -4.527 7.226 -5.740 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -3.861 7.351 -4.124 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -2.952 9.163 -5.429 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -1.654 8.026 -5.124 1.00 0.00 H new ATOM 0 HE ARG A 151 -2.775 7.254 -7.589 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -1.202 10.084 -6.185 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -0.516 10.611 -7.726 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -1.891 7.936 -9.565 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -0.905 9.400 -9.632 1.00 0.00 H new ATOM 988 N PHE A 152 -5.996 5.668 -3.916 1.00 0.00 N ATOM 989 CA PHE A 152 -7.434 5.857 -4.070 1.00 0.00 C ATOM 990 C PHE A 152 -7.743 7.248 -4.616 1.00 0.00 C ATOM 991 O PHE A 152 -7.023 8.210 -4.344 1.00 0.00 O ATOM 992 CB PHE A 152 -8.142 5.654 -2.729 1.00 0.00 C ATOM 993 CG PHE A 152 -8.013 4.258 -2.189 1.00 0.00 C ATOM 994 CD1 PHE A 152 -8.898 3.265 -2.578 1.00 0.00 C ATOM 995 CD2 PHE A 152 -7.007 3.940 -1.291 1.00 0.00 C ATOM 996 CE1 PHE A 152 -8.781 1.980 -2.083 1.00 0.00 C ATOM 997 CE2 PHE A 152 -6.886 2.656 -0.792 1.00 0.00 C ATOM 998 CZ PHE A 152 -7.774 1.676 -1.188 1.00 0.00 C ATOM 0 H PHE A 152 -5.570 6.243 -3.189 1.00 0.00 H new ATOM 0 HA PHE A 152 -7.800 5.117 -4.782 1.00 0.00 H new ATOM 0 HB2 PHE A 152 -7.734 6.356 -2.002 1.00 0.00 H new ATOM 0 HB3 PHE A 152 -9.199 5.894 -2.845 1.00 0.00 H new ATOM 0 HD1 PHE A 152 -9.688 3.498 -3.276 1.00 0.00 H new ATOM 0 HD2 PHE A 152 -6.310 4.703 -0.977 1.00 0.00 H new ATOM 0 HE1 PHE A 152 -9.476 1.215 -2.396 1.00 0.00 H new ATOM 0 HE2 PHE A 152 -6.097 2.420 -0.093 1.00 0.00 H new ATOM 0 HZ PHE A 152 -7.681 0.673 -0.798 1.00 0.00 H new ATOM 1008 N THR A 153 -8.820 7.348 -5.389 1.00 0.00 N ATOM 1009 CA THR A 153 -9.226 8.619 -5.975 1.00 0.00 C ATOM 1010 C THR A 153 -9.540 9.647 -4.894 1.00 0.00 C ATOM 1011 O THR A 153 -9.086 10.789 -4.961 1.00 0.00 O ATOM 1012 CB THR A 153 -10.459 8.452 -6.882 1.00 0.00 C ATOM 1013 OG1 THR A 153 -11.491 7.749 -6.181 1.00 0.00 O ATOM 1014 CG2 THR A 153 -10.098 7.697 -8.152 1.00 0.00 C ATOM 0 H THR A 153 -9.427 6.563 -5.624 1.00 0.00 H new ATOM 0 HA THR A 153 -8.388 8.972 -6.576 1.00 0.00 H new ATOM 0 HB THR A 153 -10.817 9.444 -7.157 1.00 0.00 H new ATOM 0 HG1 THR A 153 -12.367 8.041 -6.509 1.00 0.00 H new ATOM 0 HG21 THR A 153 -10.985 7.591 -8.777 1.00 0.00 H new ATOM 0 HG22 THR A 153 -9.333 8.249 -8.698 1.00 0.00 H new ATOM 0 HG23 THR A 153 -9.717 6.709 -7.892 1.00 0.00 H new ATOM 1022 N GLU A 154 -10.319 9.234 -3.899 1.00 0.00 N ATOM 1023 CA GLU A 154 -10.693 10.122 -2.804 1.00 0.00 C ATOM 1024 C GLU A 154 -9.664 10.061 -1.679 1.00 0.00 C ATOM 1025 O GLU A 154 -9.372 8.990 -1.147 1.00 0.00 O ATOM 1026 CB GLU A 154 -12.076 9.749 -2.266 1.00 0.00 C ATOM 1027 CG GLU A 154 -13.124 9.570 -3.352 1.00 0.00 C ATOM 1028 CD GLU A 154 -14.501 9.271 -2.790 1.00 0.00 C ATOM 1029 OE1 GLU A 154 -14.747 8.106 -2.414 1.00 0.00 O ATOM 1030 OE2 GLU A 154 -15.332 10.201 -2.728 1.00 0.00 O ATOM 0 H GLU A 154 -10.703 8.292 -3.829 1.00 0.00 H new ATOM 0 HA GLU A 154 -10.724 11.141 -3.190 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -11.997 8.825 -1.694 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -12.409 10.524 -1.576 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -13.172 10.474 -3.958 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -12.821 8.758 -4.014 1.00 0.00 H new ATOM 1037 N TYR A 155 -9.118 11.218 -1.322 1.00 0.00 N ATOM 1038 CA TYR A 155 -8.119 11.298 -0.263 1.00 0.00 C ATOM 1039 C TYR A 155 -8.682 10.778 1.056 1.00 0.00 C ATOM 1040 O TYR A 155 -7.964 10.181 1.857 1.00 0.00 O ATOM 1041 CB TYR A 155 -7.639 12.740 -0.093 1.00 0.00 C ATOM 1042 CG TYR A 155 -6.691 12.929 1.070 1.00 0.00 C ATOM 1043 CD1 TYR A 155 -5.504 12.213 1.147 1.00 0.00 C ATOM 1044 CD2 TYR A 155 -6.983 13.826 2.091 1.00 0.00 C ATOM 1045 CE1 TYR A 155 -4.635 12.383 2.208 1.00 0.00 C ATOM 1046 CE2 TYR A 155 -6.120 14.003 3.155 1.00 0.00 C ATOM 1047 CZ TYR A 155 -4.947 13.279 3.209 1.00 0.00 C ATOM 1048 OH TYR A 155 -4.084 13.452 4.267 1.00 0.00 O ATOM 0 H TYR A 155 -9.351 12.114 -1.751 1.00 0.00 H new ATOM 0 HA TYR A 155 -7.273 10.673 -0.548 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -7.144 13.060 -1.010 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -8.504 13.388 0.045 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -5.256 11.511 0.364 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -7.900 14.394 2.052 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -3.716 11.817 2.253 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -6.362 14.704 3.940 1.00 0.00 H new ATOM 0 HH TYR A 155 -4.452 14.119 4.883 1.00 0.00 H new ATOM 1058 N GLU A 156 -9.973 11.009 1.274 1.00 0.00 N ATOM 1059 CA GLU A 156 -10.633 10.565 2.496 1.00 0.00 C ATOM 1060 C GLU A 156 -10.675 9.041 2.568 1.00 0.00 C ATOM 1061 O GLU A 156 -10.606 8.457 3.650 1.00 0.00 O ATOM 1062 CB GLU A 156 -12.053 11.129 2.569 1.00 0.00 C ATOM 1063 CG GLU A 156 -12.963 10.632 1.458 1.00 0.00 C ATOM 1064 CD GLU A 156 -14.146 11.550 1.218 1.00 0.00 C ATOM 1065 OE1 GLU A 156 -14.480 12.337 2.129 1.00 0.00 O ATOM 1066 OE2 GLU A 156 -14.738 11.483 0.121 1.00 0.00 O ATOM 0 H GLU A 156 -10.582 11.501 0.620 1.00 0.00 H new ATOM 0 HA GLU A 156 -10.058 10.936 3.345 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -12.491 10.865 3.532 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -12.005 12.217 2.529 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -12.388 10.538 0.537 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -13.326 9.636 1.709 1.00 0.00 H new ATOM 1073 N THR A 157 -10.789 8.402 1.407 1.00 0.00 N ATOM 1074 CA THR A 157 -10.842 6.947 1.338 1.00 0.00 C ATOM 1075 C THR A 157 -9.494 6.331 1.693 1.00 0.00 C ATOM 1076 O THR A 157 -9.419 5.401 2.497 1.00 0.00 O ATOM 1077 CB THR A 157 -11.260 6.467 -0.065 1.00 0.00 C ATOM 1078 OG1 THR A 157 -12.556 6.981 -0.392 1.00 0.00 O ATOM 1079 CG2 THR A 157 -11.279 4.947 -0.132 1.00 0.00 C ATOM 0 H THR A 157 -10.846 8.870 0.502 1.00 0.00 H new ATOM 0 HA THR A 157 -11.589 6.622 2.063 1.00 0.00 H new ATOM 0 HB THR A 157 -10.531 6.838 -0.785 1.00 0.00 H new ATOM 0 HG1 THR A 157 -12.814 6.673 -1.286 1.00 0.00 H new ATOM 0 HG21 THR A 157 -11.577 4.631 -1.132 1.00 0.00 H new ATOM 0 HG22 THR A 157 -10.284 4.561 0.090 1.00 0.00 H new ATOM 0 HG23 THR A 157 -11.990 4.559 0.598 1.00 0.00 H new ATOM 1087 N GLN A 158 -8.431 6.854 1.089 1.00 0.00 N ATOM 1088 CA GLN A 158 -7.086 6.353 1.343 1.00 0.00 C ATOM 1089 C GLN A 158 -6.677 6.600 2.791 1.00 0.00 C ATOM 1090 O GLN A 158 -6.016 5.767 3.412 1.00 0.00 O ATOM 1091 CB GLN A 158 -6.084 7.018 0.397 1.00 0.00 C ATOM 1092 CG GLN A 158 -5.677 8.418 0.829 1.00 0.00 C ATOM 1093 CD GLN A 158 -4.446 8.919 0.100 1.00 0.00 C ATOM 1094 OE1 GLN A 158 -3.360 9.115 0.838 1.00 0.00 O flip ATOM 1095 NE2 GLN A 158 -4.470 9.127 -1.113 1.00 0.00 N flip ATOM 0 H GLN A 158 -8.476 7.624 0.421 1.00 0.00 H new ATOM 0 HA GLN A 158 -7.086 5.278 1.163 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -5.193 6.394 0.328 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -6.517 7.066 -0.602 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -6.505 9.104 0.650 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -5.486 8.422 1.902 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -5.327 8.963 -1.642 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -3.633 9.463 -1.589 1.00 0.00 H new ATOM 1104 N VAL A 159 -7.074 7.751 3.325 1.00 0.00 N ATOM 1105 CA VAL A 159 -6.749 8.109 4.701 1.00 0.00 C ATOM 1106 C VAL A 159 -7.364 7.120 5.685 1.00 0.00 C ATOM 1107 O VAL A 159 -6.680 6.592 6.562 1.00 0.00 O ATOM 1108 CB VAL A 159 -7.239 9.528 5.043 1.00 0.00 C ATOM 1109 CG1 VAL A 159 -7.215 9.754 6.547 1.00 0.00 C ATOM 1110 CG2 VAL A 159 -6.394 10.570 4.325 1.00 0.00 C ATOM 0 H VAL A 159 -7.621 8.452 2.825 1.00 0.00 H new ATOM 0 HA VAL A 159 -5.663 8.077 4.788 1.00 0.00 H new ATOM 0 HB VAL A 159 -8.269 9.630 4.702 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -7.565 10.762 6.769 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -7.866 9.029 7.034 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -6.197 9.633 6.917 1.00 0.00 H new ATOM 0 HG21 VAL A 159 -6.754 11.567 4.578 1.00 0.00 H new ATOM 0 HG22 VAL A 159 -5.353 10.471 4.634 1.00 0.00 H new ATOM 0 HG23 VAL A 159 -6.468 10.420 3.248 1.00 0.00 H new ATOM 1120 N LYS A 160 -8.660 6.872 5.533 1.00 0.00 N ATOM 1121 CA LYS A 160 -9.370 5.944 6.407 1.00 0.00 C ATOM 1122 C LYS A 160 -8.878 4.516 6.198 1.00 0.00 C ATOM 1123 O LYS A 160 -8.927 3.692 7.111 1.00 0.00 O ATOM 1124 CB LYS A 160 -10.876 6.019 6.149 1.00 0.00 C ATOM 1125 CG LYS A 160 -11.508 7.323 6.607 1.00 0.00 C ATOM 1126 CD LYS A 160 -12.844 7.564 5.925 1.00 0.00 C ATOM 1127 CE LYS A 160 -13.861 6.496 6.296 1.00 0.00 C ATOM 1128 NZ LYS A 160 -14.522 6.787 7.598 1.00 0.00 N ATOM 0 H LYS A 160 -9.241 7.301 4.813 1.00 0.00 H new ATOM 0 HA LYS A 160 -9.170 6.231 7.439 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -11.060 5.891 5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -11.365 5.189 6.659 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -11.649 7.300 7.688 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -10.833 8.151 6.391 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -13.226 8.545 6.207 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -12.705 7.575 4.844 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -14.616 6.426 5.513 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -13.366 5.526 6.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -15.208 6.036 7.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -13.805 6.828 8.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -15.016 7.700 7.540 1.00 0.00 H new ATOM 1142 N VAL A 161 -8.402 4.229 4.990 1.00 0.00 N ATOM 1143 CA VAL A 161 -7.898 2.901 4.662 1.00 0.00 C ATOM 1144 C VAL A 161 -6.682 2.549 5.512 1.00 0.00 C ATOM 1145 O VAL A 161 -6.568 1.432 6.017 1.00 0.00 O ATOM 1146 CB VAL A 161 -7.518 2.797 3.174 1.00 0.00 C ATOM 1147 CG1 VAL A 161 -6.734 1.520 2.911 1.00 0.00 C ATOM 1148 CG2 VAL A 161 -8.762 2.857 2.301 1.00 0.00 C ATOM 0 H VAL A 161 -8.355 4.899 4.222 1.00 0.00 H new ATOM 0 HA VAL A 161 -8.702 2.196 4.874 1.00 0.00 H new ATOM 0 HB VAL A 161 -6.882 3.645 2.920 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -6.474 1.464 1.854 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -5.823 1.523 3.509 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -7.343 0.657 3.181 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -8.474 2.782 1.252 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -9.425 2.030 2.555 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -9.279 3.802 2.469 1.00 0.00 H new ATOM 1158 N MET A 162 -5.777 3.509 5.666 1.00 0.00 N ATOM 1159 CA MET A 162 -4.570 3.301 6.457 1.00 0.00 C ATOM 1160 C MET A 162 -4.894 3.272 7.948 1.00 0.00 C ATOM 1161 O MET A 162 -4.191 2.637 8.733 1.00 0.00 O ATOM 1162 CB MET A 162 -3.548 4.402 6.167 1.00 0.00 C ATOM 1163 CG MET A 162 -2.882 4.270 4.806 1.00 0.00 C ATOM 1164 SD MET A 162 -1.330 5.181 4.701 1.00 0.00 S ATOM 1165 CE MET A 162 -1.912 6.864 4.895 1.00 0.00 C ATOM 0 H MET A 162 -5.856 4.439 5.254 1.00 0.00 H new ATOM 0 HA MET A 162 -4.145 2.337 6.177 1.00 0.00 H new ATOM 0 HB2 MET A 162 -4.043 5.371 6.228 1.00 0.00 H new ATOM 0 HB3 MET A 162 -2.781 4.387 6.941 1.00 0.00 H new ATOM 0 HG2 MET A 162 -2.695 3.216 4.598 1.00 0.00 H new ATOM 0 HG3 MET A 162 -3.564 4.631 4.036 1.00 0.00 H new ATOM 0 HE1 MET A 162 -1.541 7.474 4.072 1.00 0.00 H new ATOM 0 HE2 MET A 162 -3.002 6.875 4.892 1.00 0.00 H new ATOM 0 HE3 MET A 162 -1.548 7.268 5.839 1.00 0.00 H new ATOM 1175 N SER A 163 -5.963 3.964 8.329 1.00 0.00 N ATOM 1176 CA SER A 163 -6.377 4.021 9.726 1.00 0.00 C ATOM 1177 C SER A 163 -6.772 2.637 10.232 1.00 0.00 C ATOM 1178 O SER A 163 -6.242 2.157 11.234 1.00 0.00 O ATOM 1179 CB SER A 163 -7.549 4.991 9.893 1.00 0.00 C ATOM 1180 OG SER A 163 -7.967 5.057 11.246 1.00 0.00 O ATOM 0 H SER A 163 -6.558 4.492 7.691 1.00 0.00 H new ATOM 0 HA SER A 163 -5.532 4.377 10.316 1.00 0.00 H new ATOM 0 HB2 SER A 163 -7.256 5.983 9.551 1.00 0.00 H new ATOM 0 HB3 SER A 163 -8.382 4.671 9.267 1.00 0.00 H new ATOM 0 HG SER A 163 -8.716 5.684 11.327 1.00 0.00 H new ATOM 1186 N GLN A 164 -7.706 2.002 9.532 1.00 0.00 N ATOM 1187 CA GLN A 164 -8.173 0.673 9.911 1.00 0.00 C ATOM 1188 C GLN A 164 -7.393 -0.409 9.171 1.00 0.00 C ATOM 1189 O GLN A 164 -6.443 -0.116 8.445 1.00 0.00 O ATOM 1190 CB GLN A 164 -9.668 0.532 9.618 1.00 0.00 C ATOM 1191 CG GLN A 164 -9.984 0.345 8.143 1.00 0.00 C ATOM 1192 CD GLN A 164 -11.377 0.822 7.780 1.00 0.00 C ATOM 1193 OE1 GLN A 164 -12.318 0.031 7.711 1.00 0.00 O ATOM 1194 NE2 GLN A 164 -11.515 2.122 7.546 1.00 0.00 N ATOM 0 H GLN A 164 -8.154 2.386 8.700 1.00 0.00 H new ATOM 0 HA GLN A 164 -8.007 0.548 10.981 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -10.060 -0.318 10.176 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -10.186 1.419 9.982 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -9.251 0.888 7.546 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -9.886 -0.710 7.885 1.00 0.00 H new ATOM 0 HE21 GLN A 164 -10.707 2.741 7.615 1.00 0.00 H new ATOM 0 HE22 GLN A 164 -12.429 2.501 7.298 1.00 0.00 H new ATOM 1203 N ARG A 165 -7.802 -1.659 9.360 1.00 0.00 N ATOM 1204 CA ARG A 165 -7.140 -2.785 8.712 1.00 0.00 C ATOM 1205 C ARG A 165 -8.054 -3.426 7.671 1.00 0.00 C ATOM 1206 O ARG A 165 -9.178 -2.974 7.454 1.00 0.00 O ATOM 1207 CB ARG A 165 -6.724 -3.827 9.751 1.00 0.00 C ATOM 1208 CG ARG A 165 -7.832 -4.192 10.726 1.00 0.00 C ATOM 1209 CD ARG A 165 -7.814 -3.291 11.951 1.00 0.00 C ATOM 1210 NE ARG A 165 -8.995 -3.483 12.788 1.00 0.00 N ATOM 1211 CZ ARG A 165 -9.112 -4.458 13.683 1.00 0.00 C ATOM 1212 NH1 ARG A 165 -8.123 -5.324 13.857 1.00 0.00 N ATOM 1213 NH2 ARG A 165 -10.218 -4.567 14.408 1.00 0.00 N ATOM 0 H ARG A 165 -8.588 -1.918 9.956 1.00 0.00 H new ATOM 0 HA ARG A 165 -6.249 -2.410 8.208 1.00 0.00 H new ATOM 0 HB2 ARG A 165 -6.393 -4.729 9.236 1.00 0.00 H new ATOM 0 HB3 ARG A 165 -5.869 -3.448 10.311 1.00 0.00 H new ATOM 0 HG2 ARG A 165 -8.798 -4.111 10.228 1.00 0.00 H new ATOM 0 HG3 ARG A 165 -7.719 -5.231 11.035 1.00 0.00 H new ATOM 0 HD2 ARG A 165 -6.917 -3.493 12.537 1.00 0.00 H new ATOM 0 HD3 ARG A 165 -7.759 -2.249 11.634 1.00 0.00 H new ATOM 0 HE ARG A 165 -9.773 -2.833 12.680 1.00 0.00 H new ATOM 0 HH11 ARG A 165 -7.270 -5.242 13.303 1.00 0.00 H new ATOM 0 HH12 ARG A 165 -8.215 -6.072 14.545 1.00 0.00 H new ATOM 0 HH21 ARG A 165 -10.980 -3.902 14.279 1.00 0.00 H new ATOM 0 HH22 ARG A 165 -10.306 -5.316 15.095 1.00 0.00 H new ATOM 1227 N HIS A 166 -7.563 -4.483 7.030 1.00 0.00 N ATOM 1228 CA HIS A 166 -8.335 -5.186 6.012 1.00 0.00 C ATOM 1229 C HIS A 166 -7.860 -6.629 5.871 1.00 0.00 C ATOM 1230 O HIS A 166 -6.665 -6.910 5.957 1.00 0.00 O ATOM 1231 CB HIS A 166 -8.223 -4.466 4.669 1.00 0.00 C ATOM 1232 CG HIS A 166 -8.364 -2.978 4.773 1.00 0.00 C ATOM 1233 ND1 HIS A 166 -9.464 -2.292 4.304 1.00 0.00 N ATOM 1234 CD2 HIS A 166 -7.535 -2.045 5.297 1.00 0.00 C ATOM 1235 CE1 HIS A 166 -9.306 -1.001 4.534 1.00 0.00 C ATOM 1236 NE2 HIS A 166 -8.143 -0.825 5.136 1.00 0.00 N ATOM 0 H HIS A 166 -6.635 -4.871 7.198 1.00 0.00 H new ATOM 0 HA HIS A 166 -9.379 -5.195 6.324 1.00 0.00 H new ATOM 0 HB2 HIS A 166 -7.258 -4.701 4.220 1.00 0.00 H new ATOM 0 HB3 HIS A 166 -8.990 -4.849 3.996 1.00 0.00 H new ATOM 0 HD1 HIS A 166 -10.273 -2.715 3.850 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -6.574 -2.227 5.756 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -10.008 -0.222 4.274 1.00 0.00 H new ATOM 0 HE2 HIS A 166 -7.759 0.072 5.433 1.00 0.00 H new ATOM 1244 N MET A 167 -8.804 -7.539 5.655 1.00 0.00 N ATOM 1245 CA MET A 167 -8.481 -8.953 5.501 1.00 0.00 C ATOM 1246 C MET A 167 -8.618 -9.387 4.045 1.00 0.00 C ATOM 1247 O MET A 167 -9.723 -9.427 3.502 1.00 0.00 O ATOM 1248 CB MET A 167 -9.390 -9.805 6.388 1.00 0.00 C ATOM 1249 CG MET A 167 -8.966 -9.830 7.847 1.00 0.00 C ATOM 1250 SD MET A 167 -7.376 -10.643 8.095 1.00 0.00 S ATOM 1251 CE MET A 167 -7.905 -12.307 8.496 1.00 0.00 C ATOM 0 H MET A 167 -9.798 -7.323 5.583 1.00 0.00 H new ATOM 0 HA MET A 167 -7.446 -9.099 5.808 1.00 0.00 H new ATOM 0 HB2 MET A 167 -10.409 -9.425 6.321 1.00 0.00 H new ATOM 0 HB3 MET A 167 -9.405 -10.825 6.005 1.00 0.00 H new ATOM 0 HG2 MET A 167 -8.910 -8.808 8.222 1.00 0.00 H new ATOM 0 HG3 MET A 167 -9.728 -10.344 8.434 1.00 0.00 H new ATOM 0 HE1 MET A 167 -7.031 -12.933 8.677 1.00 0.00 H new ATOM 0 HE2 MET A 167 -8.527 -12.285 9.391 1.00 0.00 H new ATOM 0 HE3 MET A 167 -8.479 -12.717 7.665 1.00 0.00 H new ATOM 1261 N ILE A 168 -7.492 -9.711 3.420 1.00 0.00 N ATOM 1262 CA ILE A 168 -7.488 -10.143 2.028 1.00 0.00 C ATOM 1263 C ILE A 168 -7.335 -11.656 1.922 1.00 0.00 C ATOM 1264 O ILE A 168 -6.299 -12.212 2.286 1.00 0.00 O ATOM 1265 CB ILE A 168 -6.356 -9.466 1.232 1.00 0.00 C ATOM 1266 CG1 ILE A 168 -6.595 -7.958 1.145 1.00 0.00 C ATOM 1267 CG2 ILE A 168 -6.252 -10.073 -0.160 1.00 0.00 C ATOM 1268 CD1 ILE A 168 -5.371 -7.175 0.723 1.00 0.00 C ATOM 0 H ILE A 168 -6.570 -9.683 3.855 1.00 0.00 H new ATOM 0 HA ILE A 168 -8.447 -9.847 1.603 1.00 0.00 H new ATOM 0 HB ILE A 168 -5.414 -9.635 1.753 1.00 0.00 H new ATOM 0 HG12 ILE A 168 -7.401 -7.766 0.437 1.00 0.00 H new ATOM 0 HG13 ILE A 168 -6.931 -7.595 2.116 1.00 0.00 H new ATOM 0 HG21 ILE A 168 -5.448 -9.585 -0.711 1.00 0.00 H new ATOM 0 HG22 ILE A 168 -6.040 -11.139 -0.077 1.00 0.00 H new ATOM 0 HG23 ILE A 168 -7.194 -9.931 -0.690 1.00 0.00 H new ATOM 0 HD11 ILE A 168 -5.614 -6.113 0.683 1.00 0.00 H new ATOM 0 HD12 ILE A 168 -4.569 -7.336 1.444 1.00 0.00 H new ATOM 0 HD13 ILE A 168 -5.046 -7.510 -0.262 1.00 0.00 H new ATOM 1280 N ASP A 169 -8.372 -12.316 1.419 1.00 0.00 N ATOM 1281 CA ASP A 169 -8.352 -13.766 1.262 1.00 0.00 C ATOM 1282 C ASP A 169 -8.077 -14.454 2.596 1.00 0.00 C ATOM 1283 O ASP A 169 -7.522 -15.551 2.637 1.00 0.00 O ATOM 1284 CB ASP A 169 -7.295 -14.175 0.235 1.00 0.00 C ATOM 1285 CG ASP A 169 -7.759 -13.957 -1.191 1.00 0.00 C ATOM 1286 OD1 ASP A 169 -8.980 -14.040 -1.438 1.00 0.00 O ATOM 1287 OD2 ASP A 169 -6.900 -13.702 -2.061 1.00 0.00 O ATOM 0 H ASP A 169 -9.237 -11.870 1.113 1.00 0.00 H new ATOM 0 HA ASP A 169 -9.333 -14.082 0.907 1.00 0.00 H new ATOM 0 HB2 ASP A 169 -6.383 -13.603 0.409 1.00 0.00 H new ATOM 0 HB3 ASP A 169 -7.044 -15.226 0.376 1.00 0.00 H new ATOM 1292 N GLY A 170 -8.467 -13.799 3.685 1.00 0.00 N ATOM 1293 CA GLY A 170 -8.253 -14.362 5.006 1.00 0.00 C ATOM 1294 C GLY A 170 -6.877 -14.042 5.555 1.00 0.00 C ATOM 1295 O GLY A 170 -6.407 -14.695 6.488 1.00 0.00 O ATOM 0 H GLY A 170 -8.927 -12.889 3.676 1.00 0.00 H new ATOM 0 HA2 GLY A 170 -9.012 -13.979 5.688 1.00 0.00 H new ATOM 0 HA3 GLY A 170 -8.381 -15.444 4.962 1.00 0.00 H new ATOM 1299 N ARG A 171 -6.229 -13.037 4.976 1.00 0.00 N ATOM 1300 CA ARG A 171 -4.897 -12.635 5.412 1.00 0.00 C ATOM 1301 C ARG A 171 -4.916 -11.220 5.982 1.00 0.00 C ATOM 1302 O ARG A 171 -5.635 -10.351 5.489 1.00 0.00 O ATOM 1303 CB ARG A 171 -3.910 -12.713 4.246 1.00 0.00 C ATOM 1304 CG ARG A 171 -3.912 -14.056 3.535 1.00 0.00 C ATOM 1305 CD ARG A 171 -2.984 -15.049 4.218 1.00 0.00 C ATOM 1306 NE ARG A 171 -3.651 -15.765 5.302 1.00 0.00 N ATOM 1307 CZ ARG A 171 -3.049 -16.670 6.065 1.00 0.00 C ATOM 1308 NH1 ARG A 171 -1.772 -16.967 5.864 1.00 0.00 N ATOM 1309 NH2 ARG A 171 -3.723 -17.280 7.031 1.00 0.00 N ATOM 0 H ARG A 171 -6.604 -12.486 4.204 1.00 0.00 H new ATOM 0 HA ARG A 171 -4.577 -13.320 6.197 1.00 0.00 H new ATOM 0 HB2 ARG A 171 -4.149 -11.930 3.526 1.00 0.00 H new ATOM 0 HB3 ARG A 171 -2.906 -12.509 4.617 1.00 0.00 H new ATOM 0 HG2 ARG A 171 -4.925 -14.457 3.516 1.00 0.00 H new ATOM 0 HG3 ARG A 171 -3.603 -13.921 2.499 1.00 0.00 H new ATOM 0 HD2 ARG A 171 -2.615 -15.765 3.483 1.00 0.00 H new ATOM 0 HD3 ARG A 171 -2.116 -14.521 4.612 1.00 0.00 H new ATOM 0 HE ARG A 171 -4.633 -15.559 5.483 1.00 0.00 H new ATOM 0 HH11 ARG A 171 -1.250 -16.500 5.122 1.00 0.00 H new ATOM 0 HH12 ARG A 171 -1.312 -17.662 6.451 1.00 0.00 H new ATOM 0 HH21 ARG A 171 -4.705 -17.054 7.189 1.00 0.00 H new ATOM 0 HH22 ARG A 171 -3.259 -17.975 7.616 1.00 0.00 H new ATOM 1323 N TRP A 172 -4.123 -10.996 7.024 1.00 0.00 N ATOM 1324 CA TRP A 172 -4.050 -9.687 7.662 1.00 0.00 C ATOM 1325 C TRP A 172 -3.158 -8.742 6.864 1.00 0.00 C ATOM 1326 O TRP A 172 -1.980 -9.026 6.641 1.00 0.00 O ATOM 1327 CB TRP A 172 -3.521 -9.822 9.091 1.00 0.00 C ATOM 1328 CG TRP A 172 -4.600 -10.068 10.102 1.00 0.00 C ATOM 1329 CD1 TRP A 172 -4.634 -11.061 11.039 1.00 0.00 C ATOM 1330 CD2 TRP A 172 -5.801 -9.308 10.276 1.00 0.00 C ATOM 1331 NE1 TRP A 172 -5.784 -10.964 11.785 1.00 0.00 N ATOM 1332 CE2 TRP A 172 -6.516 -9.897 11.337 1.00 0.00 C ATOM 1333 CE3 TRP A 172 -6.340 -8.186 9.641 1.00 0.00 C ATOM 1334 CZ2 TRP A 172 -7.742 -9.401 11.774 1.00 0.00 C ATOM 1335 CZ3 TRP A 172 -7.557 -7.696 10.075 1.00 0.00 C ATOM 1336 CH2 TRP A 172 -8.247 -8.302 11.133 1.00 0.00 C ATOM 0 H TRP A 172 -3.522 -11.704 7.445 1.00 0.00 H new ATOM 0 HA TRP A 172 -5.056 -9.269 7.693 1.00 0.00 H new ATOM 0 HB2 TRP A 172 -2.803 -10.641 9.129 1.00 0.00 H new ATOM 0 HB3 TRP A 172 -2.982 -8.913 9.359 1.00 0.00 H new ATOM 0 HD1 TRP A 172 -3.870 -11.812 11.174 1.00 0.00 H new ATOM 0 HE1 TRP A 172 -6.049 -11.586 12.549 1.00 0.00 H new ATOM 0 HE3 TRP A 172 -5.815 -7.710 8.826 1.00 0.00 H new ATOM 0 HZ2 TRP A 172 -8.275 -9.867 12.590 1.00 0.00 H new ATOM 0 HZ3 TRP A 172 -7.984 -6.831 9.590 1.00 0.00 H new ATOM 0 HH2 TRP A 172 -9.196 -7.894 11.449 1.00 0.00 H new ATOM 1347 N CYS A 173 -3.725 -7.619 6.437 1.00 0.00 N ATOM 1348 CA CYS A 173 -2.980 -6.633 5.663 1.00 0.00 C ATOM 1349 C CYS A 173 -3.239 -5.223 6.185 1.00 0.00 C ATOM 1350 O CYS A 173 -4.319 -4.929 6.698 1.00 0.00 O ATOM 1351 CB CYS A 173 -3.362 -6.720 4.185 1.00 0.00 C ATOM 1352 SG CYS A 173 -4.992 -6.038 3.802 1.00 0.00 S ATOM 0 H CYS A 173 -4.698 -7.369 6.614 1.00 0.00 H new ATOM 0 HA CYS A 173 -1.917 -6.851 5.770 1.00 0.00 H new ATOM 0 HB2 CYS A 173 -2.612 -6.193 3.595 1.00 0.00 H new ATOM 0 HB3 CYS A 173 -3.335 -7.765 3.875 1.00 0.00 H new ATOM 0 HG CYS A 173 -5.741 -6.082 4.863 1.00 0.00 H new ATOM 1358 N ASP A 174 -2.241 -4.357 6.054 1.00 0.00 N ATOM 1359 CA ASP A 174 -2.361 -2.978 6.513 1.00 0.00 C ATOM 1360 C ASP A 174 -1.758 -2.012 5.497 1.00 0.00 C ATOM 1361 O ASP A 174 -0.718 -2.293 4.900 1.00 0.00 O ATOM 1362 CB ASP A 174 -1.671 -2.807 7.868 1.00 0.00 C ATOM 1363 CG ASP A 174 -2.575 -3.176 9.028 1.00 0.00 C ATOM 1364 OD1 ASP A 174 -3.333 -2.298 9.492 1.00 0.00 O ATOM 1365 OD2 ASP A 174 -2.525 -4.342 9.471 1.00 0.00 O ATOM 0 H ASP A 174 -1.340 -4.585 5.634 1.00 0.00 H new ATOM 0 HA ASP A 174 -3.421 -2.749 6.621 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -0.775 -3.427 7.897 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -1.346 -1.773 7.979 1.00 0.00 H new ATOM 1370 N CYS A 175 -2.419 -0.876 5.305 1.00 0.00 N ATOM 1371 CA CYS A 175 -1.950 0.131 4.359 1.00 0.00 C ATOM 1372 C CYS A 175 -1.157 1.220 5.073 1.00 0.00 C ATOM 1373 O CYS A 175 -1.644 1.837 6.021 1.00 0.00 O ATOM 1374 CB CYS A 175 -3.132 0.749 3.612 1.00 0.00 C ATOM 1375 SG CYS A 175 -4.014 -0.408 2.539 1.00 0.00 S ATOM 0 H CYS A 175 -3.281 -0.629 5.791 1.00 0.00 H new ATOM 0 HA CYS A 175 -1.293 -0.359 3.641 1.00 0.00 H new ATOM 0 HB2 CYS A 175 -3.833 1.160 4.339 1.00 0.00 H new ATOM 0 HB3 CYS A 175 -2.771 1.583 3.010 1.00 0.00 H new ATOM 0 HG CYS A 175 -4.524 0.237 1.532 1.00 0.00 H new ATOM 1381 N LYS A 176 0.068 1.452 4.614 1.00 0.00 N ATOM 1382 CA LYS A 176 0.929 2.467 5.208 1.00 0.00 C ATOM 1383 C LYS A 176 1.615 3.298 4.129 1.00 0.00 C ATOM 1384 O LYS A 176 1.720 2.874 2.977 1.00 0.00 O ATOM 1385 CB LYS A 176 1.980 1.811 6.106 1.00 0.00 C ATOM 1386 CG LYS A 176 1.387 1.005 7.249 1.00 0.00 C ATOM 1387 CD LYS A 176 2.438 0.143 7.928 1.00 0.00 C ATOM 1388 CE LYS A 176 1.856 -0.617 9.110 1.00 0.00 C ATOM 1389 NZ LYS A 176 2.649 -1.836 9.431 1.00 0.00 N ATOM 0 H LYS A 176 0.487 0.950 3.831 1.00 0.00 H new ATOM 0 HA LYS A 176 0.306 3.129 5.810 1.00 0.00 H new ATOM 0 HB2 LYS A 176 2.607 1.158 5.499 1.00 0.00 H new ATOM 0 HB3 LYS A 176 2.629 2.585 6.517 1.00 0.00 H new ATOM 0 HG2 LYS A 176 0.942 1.681 7.979 1.00 0.00 H new ATOM 0 HG3 LYS A 176 0.585 0.372 6.871 1.00 0.00 H new ATOM 0 HD2 LYS A 176 2.852 -0.563 7.208 1.00 0.00 H new ATOM 0 HD3 LYS A 176 3.261 0.771 8.268 1.00 0.00 H new ATOM 0 HE2 LYS A 176 1.825 0.036 9.982 1.00 0.00 H new ATOM 0 HE3 LYS A 176 0.827 -0.901 8.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 2.220 -2.326 10.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 2.657 -2.471 8.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 3.624 -1.563 9.668 1.00 0.00 H new ATOM 1403 N LEU A 177 2.082 4.483 4.508 1.00 0.00 N ATOM 1404 CA LEU A 177 2.760 5.373 3.573 1.00 0.00 C ATOM 1405 C LEU A 177 4.221 4.970 3.398 1.00 0.00 C ATOM 1406 O LEU A 177 4.886 4.533 4.337 1.00 0.00 O ATOM 1407 CB LEU A 177 2.673 6.820 4.061 1.00 0.00 C ATOM 1408 CG LEU A 177 1.346 7.536 3.807 1.00 0.00 C ATOM 1409 CD1 LEU A 177 1.293 8.850 4.571 1.00 0.00 C ATOM 1410 CD2 LEU A 177 1.147 7.775 2.317 1.00 0.00 C ATOM 0 H LEU A 177 2.003 4.849 5.457 1.00 0.00 H new ATOM 0 HA LEU A 177 2.262 5.291 2.607 1.00 0.00 H new ATOM 0 HB2 LEU A 177 2.870 6.833 5.133 1.00 0.00 H new ATOM 0 HB3 LEU A 177 3.469 7.392 3.583 1.00 0.00 H new ATOM 0 HG LEU A 177 0.537 6.899 4.165 1.00 0.00 H new ATOM 0 HD11 LEU A 177 0.341 9.345 4.378 1.00 0.00 H new ATOM 0 HD12 LEU A 177 1.390 8.654 5.639 1.00 0.00 H new ATOM 0 HD13 LEU A 177 2.110 9.494 4.245 1.00 0.00 H new ATOM 0 HD21 LEU A 177 0.198 8.285 2.154 1.00 0.00 H new ATOM 0 HD22 LEU A 177 1.961 8.392 1.936 1.00 0.00 H new ATOM 0 HD23 LEU A 177 1.140 6.819 1.793 1.00 0.00 H new ATOM 1422 N PRO A 178 4.734 5.123 2.169 1.00 0.00 N ATOM 1423 CA PRO A 178 6.122 4.783 1.843 1.00 0.00 C ATOM 1424 C PRO A 178 7.120 5.742 2.484 1.00 0.00 C ATOM 1425 O PRO A 178 8.330 5.533 2.413 1.00 0.00 O ATOM 1426 CB PRO A 178 6.169 4.905 0.318 1.00 0.00 C ATOM 1427 CG PRO A 178 5.080 5.865 -0.019 1.00 0.00 C ATOM 1428 CD PRO A 178 3.999 5.639 1.002 1.00 0.00 C ATOM 0 HA PRO A 178 6.397 3.796 2.214 1.00 0.00 H new ATOM 0 HB2 PRO A 178 7.138 5.271 -0.020 1.00 0.00 H new ATOM 0 HB3 PRO A 178 6.008 3.939 -0.162 1.00 0.00 H new ATOM 0 HG2 PRO A 178 5.441 6.893 0.016 1.00 0.00 H new ATOM 0 HG3 PRO A 178 4.706 5.693 -1.028 1.00 0.00 H new ATOM 0 HD2 PRO A 178 3.469 6.562 1.237 1.00 0.00 H new ATOM 0 HD3 PRO A 178 3.255 4.925 0.648 1.00 0.00 H new