USER MOD reduce.3.24.130724 H: found=0, std=0, add=1358, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1364 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: B 38 GLN : amide:sc= -1.25! C(o=-1.8!,f=-5.6!) USER MOD Set 1.2: B 48 GLN : amide:sc= -0.559 K(o=-1.8,f=-5.6!) USER MOD Set 2.1: A 38 GLN : amide:sc= -1.27! C(o=-1.9!,f=-5.6!) USER MOD Set 2.2: A 48 GLN : amide:sc= -0.58 K(o=-1.9,f=-5.6!) USER MOD Single : A 2 SER OG : rot -38:sc= 0.0819 USER MOD Single : A 6 THR OG1 : rot -15:sc= -0.0526 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 THR OG1 : rot -12:sc= -3.07! USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 16 HIS : no HD1:sc= -1.63 K(o=-1.6,f=-2.8) USER MOD Single : A 18 HIS : no HE2:sc= -2.48 K(o=-2.5,f=-6.3!) USER MOD Single : A 19 SER OG : rot -12:sc= -0.402! USER MOD Single : A 21 LYS NZ :NH3+ 154:sc= -0.0848 (180deg=-0.712) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc=-0.00257 USER MOD Single : A 30 LYS NZ :NH3+ -152:sc= -0.106 (180deg=-0.714) USER MOD Single : A 31 LYS NZ :NH3+ -164:sc=-0.00692 (180deg=-0.196) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 95:sc= 0.63 USER MOD Single : A 42 SER OG : rot -20:sc= 1.27 USER MOD Single : A 43 SER OG : rot -97:sc= -1.5! USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 145:sc= -0.0434 (180deg=-0.705) USER MOD Single : A 58 MET CE :methyl 156:sc= -3.04 (180deg=-3.22) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -0.101 X(o=-0.1,f=0) USER MOD Single : A 72 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 82 THR OG1 : rot 91:sc= 1.08 USER MOD Single : A 85 CYS SG : rot 142:sc= -1.75! USER MOD Single : A 86 ASN : amide:sc= -0.0627 X(o=-0.063,f=0) USER MOD Single : A 87 ASN : amide:sc= 0.0133 K(o=0.013,f=-1.6!) USER MOD Single : B 2 SER OG : rot -35:sc= 0.0899 USER MOD Single : B 6 THR OG1 : rot -13:sc= 0.409 USER MOD Single : B 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 10 THR OG1 : rot -3:sc= -3.44! USER MOD Single : B 13 ASN : amide:sc= 0 X(o=0,f=-0.091) USER MOD Single : B 16 HIS : no HD1:sc= -1.61 K(o=-1.6,f=-2.8) USER MOD Single : B 18 HIS : no HE2:sc= -2.37 K(o=-2.4,f=-6.2!) USER MOD Single : B 19 SER OG : rot -27:sc= -0.322! USER MOD Single : B 21 LYS NZ :NH3+ 155:sc= -0.0748 (180deg=-0.702) USER MOD Single : B 26 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 30 LYS NZ :NH3+ -154:sc= -0.0851 (180deg=-0.594) USER MOD Single : B 31 LYS NZ :NH3+ -163:sc=-0.00492 (180deg=-0.195) USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 THR OG1 : rot 94:sc= 0.682 USER MOD Single : B 42 SER OG : rot -28:sc= 1.24 USER MOD Single : B 43 SER OG : rot -97:sc= -1.46! USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ 141:sc= 0 (180deg=-0.329) USER MOD Single : B 58 MET CE :methyl 165:sc= -2.89 (180deg=-3.17) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 64 ASN : amide:sc= -0.107 X(o=-0.11,f=0) USER MOD Single : B 72 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : B 82 THR OG1 : rot 91:sc= 1.1 USER MOD Single : B 85 CYS SG : rot 152:sc= -1.86! USER MOD Single : B 86 ASN : amide:sc= -0.0596 X(o=-0.06,f=0) USER MOD Single : B 87 ASN : amide:sc= 0.0465 K(o=0.046,f=-1.6!) USER MOD Single : C 6 HIS : no HD1:sc= -0.186 X(o=-0.19,f=-0.015) USER MOD Single : C 7 LYS NZ :NH3+ 156:sc= -4.94! (180deg=-5.72!) USER MOD Single : C 10 SER OG : rot 180:sc= 0 USER MOD Single : D 6 HIS : no HD1:sc= -0.166 X(o=-0.17,f=-0.022) USER MOD Single : D 7 LYS NZ :NH3+ 162:sc= -4.76 (180deg=-5.27) USER MOD Single : D 10 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 97 N HIS C 6 78.088 10.423 5.571 1.00 0.00 N ATOM 98 CA HIS C 6 78.894 10.905 6.724 1.00 0.00 C ATOM 99 C HIS C 6 78.573 12.377 6.987 1.00 0.00 C ATOM 100 O HIS C 6 78.429 12.796 8.117 1.00 0.00 O ATOM 101 CB HIS C 6 80.382 10.750 6.402 1.00 0.00 C ATOM 102 CG HIS C 6 81.205 11.234 7.563 1.00 0.00 C ATOM 103 ND1 HIS C 6 81.157 10.628 8.813 1.00 0.00 N ATOM 104 CD2 HIS C 6 82.103 12.266 7.682 1.00 0.00 C ATOM 105 CE1 HIS C 6 82.002 11.296 9.620 1.00 0.00 C ATOM 106 NE2 HIS C 6 82.601 12.301 8.979 1.00 0.00 N ATOM 0 HA HIS C 6 78.654 10.319 7.611 1.00 0.00 H new ATOM 0 HB2 HIS C 6 80.611 9.705 6.192 1.00 0.00 H new ATOM 0 HB3 HIS C 6 80.631 11.318 5.506 1.00 0.00 H new ATOM 0 HD2 HIS C 6 82.380 12.946 6.890 1.00 0.00 H new ATOM 0 HE1 HIS C 6 82.174 11.049 10.657 1.00 0.00 H new ATOM 0 HE2 HIS C 6 83.282 12.958 9.361 1.00 0.00 H new ATOM 115 N LYS C 7 78.452 13.165 5.955 1.00 0.00 N ATOM 116 CA LYS C 7 78.137 14.608 6.160 1.00 0.00 C ATOM 117 C LYS C 7 76.798 14.760 6.888 1.00 0.00 C ATOM 118 O LYS C 7 76.692 15.482 7.860 1.00 0.00 O ATOM 119 CB LYS C 7 78.055 15.309 4.794 1.00 0.00 C ATOM 120 CG LYS C 7 77.583 16.780 4.965 1.00 0.00 C ATOM 121 CD LYS C 7 76.105 16.918 4.573 1.00 0.00 C ATOM 122 CE LYS C 7 75.589 18.296 4.992 1.00 0.00 C ATOM 123 NZ LYS C 7 74.258 18.538 4.363 1.00 0.00 N ATOM 0 H LYS C 7 78.557 12.875 4.983 1.00 0.00 H new ATOM 0 HA LYS C 7 78.923 15.061 6.764 1.00 0.00 H new ATOM 0 HB2 LYS C 7 79.031 15.288 4.309 1.00 0.00 H new ATOM 0 HB3 LYS C 7 77.364 14.772 4.144 1.00 0.00 H new ATOM 0 HG2 LYS C 7 77.722 17.095 5.999 1.00 0.00 H new ATOM 0 HG3 LYS C 7 78.193 17.438 4.346 1.00 0.00 H new ATOM 0 HD2 LYS C 7 75.990 16.787 3.497 1.00 0.00 H new ATOM 0 HD3 LYS C 7 75.516 16.137 5.054 1.00 0.00 H new ATOM 0 HE2 LYS C 7 75.506 18.351 6.077 1.00 0.00 H new ATOM 0 HE3 LYS C 7 76.294 19.069 4.686 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 73.730 19.235 4.926 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 74.391 18.902 3.398 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 73.724 17.646 4.326 1.00 0.00 H new ATOM 137 N LEU C 8 75.772 14.100 6.423 1.00 0.00 N ATOM 138 CA LEU C 8 74.442 14.226 7.089 1.00 0.00 C ATOM 139 C LEU C 8 74.508 13.676 8.516 1.00 0.00 C ATOM 140 O LEU C 8 74.090 14.315 9.462 1.00 0.00 O ATOM 141 CB LEU C 8 73.400 13.459 6.267 1.00 0.00 C ATOM 142 CG LEU C 8 72.013 13.562 6.918 1.00 0.00 C ATOM 143 CD1 LEU C 8 71.572 15.034 7.001 1.00 0.00 C ATOM 144 CD2 LEU C 8 71.010 12.772 6.069 1.00 0.00 C ATOM 0 H LEU C 8 75.796 13.480 5.613 1.00 0.00 H new ATOM 0 HA LEU C 8 74.159 15.277 7.145 1.00 0.00 H new ATOM 0 HB2 LEU C 8 73.362 13.859 5.254 1.00 0.00 H new ATOM 0 HB3 LEU C 8 73.692 12.412 6.186 1.00 0.00 H new ATOM 0 HG LEU C 8 72.054 13.153 7.928 1.00 0.00 H new ATOM 0 HD11 LEU C 8 70.587 15.093 7.464 1.00 0.00 H new ATOM 0 HD12 LEU C 8 72.289 15.595 7.600 1.00 0.00 H new ATOM 0 HD13 LEU C 8 71.527 15.457 5.998 1.00 0.00 H new ATOM 0 HD21 LEU C 8 70.020 12.837 6.521 1.00 0.00 H new ATOM 0 HD22 LEU C 8 70.978 13.189 5.062 1.00 0.00 H new ATOM 0 HD23 LEU C 8 71.318 11.728 6.019 1.00 0.00 H new ATOM 156 N LEU C 9 75.024 12.495 8.676 1.00 0.00 N ATOM 157 CA LEU C 9 75.122 11.885 10.031 1.00 0.00 C ATOM 158 C LEU C 9 76.168 12.618 10.879 1.00 0.00 C ATOM 159 O LEU C 9 75.975 12.832 12.060 1.00 0.00 O ATOM 160 CB LEU C 9 75.498 10.409 9.877 1.00 0.00 C ATOM 161 CG LEU C 9 74.268 9.576 9.452 1.00 0.00 C ATOM 162 CD1 LEU C 9 73.446 10.287 8.373 1.00 0.00 C ATOM 163 CD2 LEU C 9 74.739 8.245 8.874 1.00 0.00 C ATOM 0 H LEU C 9 75.387 11.917 7.918 1.00 0.00 H new ATOM 0 HA LEU C 9 74.162 11.970 10.540 1.00 0.00 H new ATOM 0 HB2 LEU C 9 76.289 10.305 9.134 1.00 0.00 H new ATOM 0 HB3 LEU C 9 75.894 10.029 10.819 1.00 0.00 H new ATOM 0 HG LEU C 9 73.647 9.433 10.336 1.00 0.00 H new ATOM 0 HD11 LEU C 9 72.590 9.669 8.101 1.00 0.00 H new ATOM 0 HD12 LEU C 9 73.095 11.245 8.756 1.00 0.00 H new ATOM 0 HD13 LEU C 9 74.067 10.453 7.493 1.00 0.00 H new ATOM 0 HD21 LEU C 9 73.875 7.653 8.572 1.00 0.00 H new ATOM 0 HD22 LEU C 9 75.373 8.429 8.007 1.00 0.00 H new ATOM 0 HD23 LEU C 9 75.306 7.701 9.629 1.00 0.00 H new ATOM 175 N SER C 10 77.276 12.996 10.300 1.00 0.00 N ATOM 176 CA SER C 10 78.319 13.705 11.101 1.00 0.00 C ATOM 177 C SER C 10 77.739 15.005 11.659 1.00 0.00 C ATOM 178 O SER C 10 77.925 15.334 12.814 1.00 0.00 O ATOM 179 CB SER C 10 79.527 14.023 10.219 1.00 0.00 C ATOM 180 OG SER C 10 80.493 14.729 10.986 1.00 0.00 O ATOM 0 H SER C 10 77.504 12.847 9.317 1.00 0.00 H new ATOM 0 HA SER C 10 78.635 13.063 11.923 1.00 0.00 H new ATOM 0 HB2 SER C 10 79.959 13.102 9.827 1.00 0.00 H new ATOM 0 HB3 SER C 10 79.219 14.621 9.361 1.00 0.00 H new ATOM 0 HG SER C 10 81.270 14.934 10.425 1.00 0.00 H new ATOM 323 N HIS D 6 69.834 -9.458 -13.183 1.00 0.00 N ATOM 324 CA HIS D 6 69.531 -9.941 -14.557 1.00 0.00 C ATOM 325 C HIS D 6 69.100 -11.409 -14.497 1.00 0.00 C ATOM 326 O HIS D 6 68.169 -11.817 -15.161 1.00 0.00 O ATOM 327 CB HIS D 6 70.781 -9.805 -15.429 1.00 0.00 C ATOM 328 CG HIS D 6 70.482 -10.290 -16.820 1.00 0.00 C ATOM 329 ND1 HIS D 6 69.552 -9.666 -17.641 1.00 0.00 N ATOM 330 CD2 HIS D 6 70.985 -11.338 -17.552 1.00 0.00 C ATOM 331 CE1 HIS D 6 69.524 -10.339 -18.807 1.00 0.00 C ATOM 332 NE2 HIS D 6 70.378 -11.364 -18.802 1.00 0.00 N ATOM 0 HA HIS D 6 68.725 -9.346 -14.986 1.00 0.00 H new ATOM 0 HB2 HIS D 6 71.105 -8.765 -15.458 1.00 0.00 H new ATOM 0 HB3 HIS D 6 71.600 -10.382 -15.000 1.00 0.00 H new ATOM 0 HD2 HIS D 6 71.736 -12.034 -17.209 1.00 0.00 H new ATOM 0 HE1 HIS D 6 68.889 -10.081 -19.642 1.00 0.00 H new ATOM 0 HE2 HIS D 6 70.550 -12.028 -19.557 1.00 0.00 H new ATOM 341 N LYS D 7 69.762 -12.207 -13.705 1.00 0.00 N ATOM 342 CA LYS D 7 69.376 -13.643 -13.612 1.00 0.00 C ATOM 343 C LYS D 7 67.928 -13.772 -13.128 1.00 0.00 C ATOM 344 O LYS D 7 67.133 -14.482 -13.711 1.00 0.00 O ATOM 345 CB LYS D 7 70.310 -14.361 -12.625 1.00 0.00 C ATOM 346 CG LYS D 7 69.835 -15.822 -12.388 1.00 0.00 C ATOM 347 CD LYS D 7 69.127 -15.943 -11.031 1.00 0.00 C ATOM 348 CE LYS D 7 68.431 -17.302 -10.938 1.00 0.00 C ATOM 349 NZ LYS D 7 68.027 -17.558 -9.528 1.00 0.00 N ATOM 0 H LYS D 7 70.550 -11.928 -13.121 1.00 0.00 H new ATOM 0 HA LYS D 7 69.462 -14.098 -14.599 1.00 0.00 H new ATOM 0 HB2 LYS D 7 71.328 -14.362 -13.014 1.00 0.00 H new ATOM 0 HB3 LYS D 7 70.332 -13.822 -11.678 1.00 0.00 H new ATOM 0 HG2 LYS D 7 69.158 -16.125 -13.187 1.00 0.00 H new ATOM 0 HG3 LYS D 7 70.689 -16.498 -12.421 1.00 0.00 H new ATOM 0 HD2 LYS D 7 69.849 -15.836 -10.221 1.00 0.00 H new ATOM 0 HD3 LYS D 7 68.398 -15.141 -10.916 1.00 0.00 H new ATOM 0 HE2 LYS D 7 67.556 -17.319 -11.587 1.00 0.00 H new ATOM 0 HE3 LYS D 7 69.100 -18.090 -11.284 1.00 0.00 H new ATOM 0 HZ1 LYS D 7 67.305 -18.306 -9.504 1.00 0.00 H new ATOM 0 HZ2 LYS D 7 68.857 -17.859 -8.978 1.00 0.00 H new ATOM 0 HZ3 LYS D 7 67.636 -16.687 -9.115 1.00 0.00 H new ATOM 363 N LEU D 8 67.579 -13.106 -12.061 1.00 0.00 N ATOM 364 CA LEU D 8 66.185 -13.212 -11.541 1.00 0.00 C ATOM 365 C LEU D 8 65.191 -12.649 -12.564 1.00 0.00 C ATOM 366 O LEU D 8 64.205 -13.275 -12.900 1.00 0.00 O ATOM 367 CB LEU D 8 66.087 -12.447 -10.215 1.00 0.00 C ATOM 368 CG LEU D 8 64.663 -12.530 -9.639 1.00 0.00 C ATOM 369 CD1 LEU D 8 64.286 -13.995 -9.360 1.00 0.00 C ATOM 370 CD2 LEU D 8 64.608 -11.726 -8.329 1.00 0.00 C ATOM 0 H LEU D 8 68.197 -12.494 -11.528 1.00 0.00 H new ATOM 0 HA LEU D 8 65.936 -14.260 -11.372 1.00 0.00 H new ATOM 0 HB2 LEU D 8 66.798 -12.859 -9.499 1.00 0.00 H new ATOM 0 HB3 LEU D 8 66.360 -11.403 -10.371 1.00 0.00 H new ATOM 0 HG LEU D 8 63.957 -12.119 -10.360 1.00 0.00 H new ATOM 0 HD11 LEU D 8 63.276 -14.040 -8.953 1.00 0.00 H new ATOM 0 HD12 LEU D 8 64.328 -14.565 -10.288 1.00 0.00 H new ATOM 0 HD13 LEU D 8 64.986 -14.420 -8.641 1.00 0.00 H new ATOM 0 HD21 LEU D 8 63.602 -11.778 -7.912 1.00 0.00 H new ATOM 0 HD22 LEU D 8 65.319 -12.143 -7.616 1.00 0.00 H new ATOM 0 HD23 LEU D 8 64.864 -10.686 -8.530 1.00 0.00 H new ATOM 382 N LEU D 9 65.443 -11.471 -13.055 1.00 0.00 N ATOM 383 CA LEU D 9 64.523 -10.853 -14.052 1.00 0.00 C ATOM 384 C LEU D 9 64.604 -11.591 -15.392 1.00 0.00 C ATOM 385 O LEU D 9 63.604 -11.797 -16.051 1.00 0.00 O ATOM 386 CB LEU D 9 64.907 -9.382 -14.230 1.00 0.00 C ATOM 387 CG LEU D 9 64.407 -8.538 -13.036 1.00 0.00 C ATOM 388 CD1 LEU D 9 64.630 -9.261 -11.702 1.00 0.00 C ATOM 389 CD2 LEU D 9 65.186 -7.227 -12.989 1.00 0.00 C ATOM 0 H LEU D 9 66.253 -10.903 -12.808 1.00 0.00 H new ATOM 0 HA LEU D 9 63.496 -10.925 -13.693 1.00 0.00 H new ATOM 0 HB2 LEU D 9 65.990 -9.292 -14.317 1.00 0.00 H new ATOM 0 HB3 LEU D 9 64.479 -8.999 -15.157 1.00 0.00 H new ATOM 0 HG LEU D 9 63.340 -8.366 -13.175 1.00 0.00 H new ATOM 0 HD11 LEU D 9 64.266 -8.638 -10.885 1.00 0.00 H new ATOM 0 HD12 LEU D 9 64.088 -10.207 -11.706 1.00 0.00 H new ATOM 0 HD13 LEU D 9 65.694 -9.453 -11.566 1.00 0.00 H new ATOM 0 HD21 LEU D 9 64.838 -6.627 -12.148 1.00 0.00 H new ATOM 0 HD22 LEU D 9 66.248 -7.439 -12.868 1.00 0.00 H new ATOM 0 HD23 LEU D 9 65.029 -6.677 -13.917 1.00 0.00 H new ATOM 401 N SER D 10 65.776 -11.985 -15.810 1.00 0.00 N ATOM 402 CA SER D 10 65.890 -12.700 -17.116 1.00 0.00 C ATOM 403 C SER D 10 65.070 -13.990 -17.065 1.00 0.00 C ATOM 404 O SER D 10 64.346 -14.312 -17.985 1.00 0.00 O ATOM 405 CB SER D 10 67.354 -13.037 -17.397 1.00 0.00 C ATOM 406 OG SER D 10 67.442 -13.744 -18.627 1.00 0.00 O ATOM 0 H SER D 10 66.654 -11.845 -15.310 1.00 0.00 H new ATOM 0 HA SER D 10 65.511 -12.058 -17.911 1.00 0.00 H new ATOM 0 HB2 SER D 10 67.947 -12.124 -17.445 1.00 0.00 H new ATOM 0 HB3 SER D 10 67.763 -13.640 -16.587 1.00 0.00 H new ATOM 0 HG SER D 10 68.379 -13.961 -18.813 1.00 0.00 H new ATOM 462 N SER A 2 49.425 -9.180 7.744 1.00 0.00 N ATOM 463 CA SER A 2 48.880 -8.307 6.655 1.00 0.00 C ATOM 464 C SER A 2 49.520 -6.919 6.753 1.00 0.00 C ATOM 465 O SER A 2 49.225 -6.030 5.979 1.00 0.00 O ATOM 466 CB SER A 2 47.364 -8.187 6.812 1.00 0.00 C ATOM 467 OG SER A 2 47.068 -7.592 8.069 1.00 0.00 O ATOM 0 HA SER A 2 49.108 -8.744 5.683 1.00 0.00 H new ATOM 0 HB2 SER A 2 46.950 -7.584 6.004 1.00 0.00 H new ATOM 0 HB3 SER A 2 46.901 -9.171 6.744 1.00 0.00 H new ATOM 0 HG SER A 2 47.695 -7.926 8.745 1.00 0.00 H new ATOM 473 N GLU A 3 50.379 -6.723 7.715 1.00 0.00 N ATOM 474 CA GLU A 3 51.022 -5.389 7.883 1.00 0.00 C ATOM 475 C GLU A 3 51.891 -5.057 6.668 1.00 0.00 C ATOM 476 O GLU A 3 51.792 -3.999 6.091 1.00 0.00 O ATOM 477 CB GLU A 3 51.914 -5.420 9.125 1.00 0.00 C ATOM 478 CG GLU A 3 51.053 -5.501 10.389 1.00 0.00 C ATOM 479 CD GLU A 3 50.508 -6.923 10.549 1.00 0.00 C ATOM 480 OE1 GLU A 3 50.948 -7.794 9.815 1.00 0.00 O ATOM 481 OE2 GLU A 3 49.655 -7.117 11.398 1.00 0.00 O ATOM 0 H GLU A 3 50.664 -7.430 8.393 1.00 0.00 H new ATOM 0 HA GLU A 3 50.243 -4.633 7.985 1.00 0.00 H new ATOM 0 HB2 GLU A 3 52.586 -6.277 9.078 1.00 0.00 H new ATOM 0 HB3 GLU A 3 52.538 -4.527 9.157 1.00 0.00 H new ATOM 0 HG2 GLU A 3 51.645 -5.227 11.262 1.00 0.00 H new ATOM 0 HG3 GLU A 3 50.229 -4.790 10.326 1.00 0.00 H new ATOM 488 N LEU A 4 52.780 -5.940 6.319 1.00 0.00 N ATOM 489 CA LEU A 4 53.713 -5.665 5.187 1.00 0.00 C ATOM 490 C LEU A 4 52.928 -5.420 3.892 1.00 0.00 C ATOM 491 O LEU A 4 53.267 -4.555 3.107 1.00 0.00 O ATOM 492 CB LEU A 4 54.666 -6.857 5.027 1.00 0.00 C ATOM 493 CG LEU A 4 55.669 -6.634 3.878 1.00 0.00 C ATOM 494 CD1 LEU A 4 56.299 -5.240 3.960 1.00 0.00 C ATOM 495 CD2 LEU A 4 56.792 -7.666 4.001 1.00 0.00 C ATOM 0 H LEU A 4 52.904 -6.847 6.770 1.00 0.00 H new ATOM 0 HA LEU A 4 54.292 -4.766 5.400 1.00 0.00 H new ATOM 0 HB2 LEU A 4 55.209 -7.016 5.959 1.00 0.00 H new ATOM 0 HB3 LEU A 4 54.089 -7.762 4.836 1.00 0.00 H new ATOM 0 HG LEU A 4 55.137 -6.732 2.932 1.00 0.00 H new ATOM 0 HD11 LEU A 4 57.002 -5.110 3.138 1.00 0.00 H new ATOM 0 HD12 LEU A 4 55.518 -4.483 3.893 1.00 0.00 H new ATOM 0 HD13 LEU A 4 56.826 -5.134 4.908 1.00 0.00 H new ATOM 0 HD21 LEU A 4 57.510 -7.520 3.194 1.00 0.00 H new ATOM 0 HD22 LEU A 4 57.295 -7.544 4.960 1.00 0.00 H new ATOM 0 HD23 LEU A 4 56.372 -8.670 3.936 1.00 0.00 H new ATOM 507 N GLU A 5 51.878 -6.153 3.671 1.00 0.00 N ATOM 508 CA GLU A 5 51.060 -5.945 2.438 1.00 0.00 C ATOM 509 C GLU A 5 50.626 -4.478 2.363 1.00 0.00 C ATOM 510 O GLU A 5 50.756 -3.817 1.346 1.00 0.00 O ATOM 511 CB GLU A 5 49.801 -6.812 2.559 1.00 0.00 C ATOM 512 CG GLU A 5 48.947 -6.673 1.294 1.00 0.00 C ATOM 513 CD GLU A 5 47.694 -7.541 1.425 1.00 0.00 C ATOM 514 OE1 GLU A 5 47.633 -8.320 2.362 1.00 0.00 O ATOM 515 OE2 GLU A 5 46.819 -7.415 0.584 1.00 0.00 O ATOM 0 H GLU A 5 51.545 -6.892 4.291 1.00 0.00 H new ATOM 0 HA GLU A 5 51.637 -6.207 1.552 1.00 0.00 H new ATOM 0 HB2 GLU A 5 50.080 -7.855 2.707 1.00 0.00 H new ATOM 0 HB3 GLU A 5 49.224 -6.510 3.433 1.00 0.00 H new ATOM 0 HG2 GLU A 5 48.666 -5.630 1.145 1.00 0.00 H new ATOM 0 HG3 GLU A 5 49.522 -6.976 0.419 1.00 0.00 H new ATOM 522 N THR A 6 50.104 -3.976 3.444 1.00 0.00 N ATOM 523 CA THR A 6 49.637 -2.564 3.481 1.00 0.00 C ATOM 524 C THR A 6 50.807 -1.607 3.295 1.00 0.00 C ATOM 525 O THR A 6 50.658 -0.542 2.752 1.00 0.00 O ATOM 526 CB THR A 6 48.994 -2.289 4.833 1.00 0.00 C ATOM 527 OG1 THR A 6 49.898 -2.648 5.865 1.00 0.00 O ATOM 528 CG2 THR A 6 47.711 -3.105 4.964 1.00 0.00 C ATOM 0 H THR A 6 49.979 -4.491 4.316 1.00 0.00 H new ATOM 0 HA THR A 6 48.919 -2.412 2.675 1.00 0.00 H new ATOM 0 HB THR A 6 48.754 -1.229 4.915 1.00 0.00 H new ATOM 0 HG1 THR A 6 50.617 -3.200 5.493 1.00 0.00 H new ATOM 0 HG21 THR A 6 47.251 -2.907 5.932 1.00 0.00 H new ATOM 0 HG22 THR A 6 47.019 -2.825 4.170 1.00 0.00 H new ATOM 0 HG23 THR A 6 47.945 -4.167 4.883 1.00 0.00 H new ATOM 536 N ALA A 7 51.953 -1.961 3.786 1.00 0.00 N ATOM 537 CA ALA A 7 53.132 -1.051 3.681 1.00 0.00 C ATOM 538 C ALA A 7 53.376 -0.658 2.215 1.00 0.00 C ATOM 539 O ALA A 7 53.518 0.497 1.900 1.00 0.00 O ATOM 540 CB ALA A 7 54.365 -1.768 4.242 1.00 0.00 C ATOM 0 H ALA A 7 52.132 -2.846 4.260 1.00 0.00 H new ATOM 0 HA ALA A 7 52.940 -0.143 4.253 1.00 0.00 H new ATOM 0 HB1 ALA A 7 55.232 -1.111 4.170 1.00 0.00 H new ATOM 0 HB2 ALA A 7 54.192 -2.027 5.287 1.00 0.00 H new ATOM 0 HB3 ALA A 7 54.549 -2.677 3.669 1.00 0.00 H new ATOM 546 N MET A 8 53.415 -1.600 1.316 1.00 0.00 N ATOM 547 CA MET A 8 53.647 -1.256 -0.118 1.00 0.00 C ATOM 548 C MET A 8 52.534 -0.325 -0.600 1.00 0.00 C ATOM 549 O MET A 8 52.768 0.608 -1.342 1.00 0.00 O ATOM 550 CB MET A 8 53.627 -2.538 -0.953 1.00 0.00 C ATOM 551 CG MET A 8 53.805 -2.195 -2.435 1.00 0.00 C ATOM 552 SD MET A 8 54.109 -3.715 -3.373 1.00 0.00 S ATOM 553 CE MET A 8 53.204 -3.260 -4.874 1.00 0.00 C ATOM 0 H MET A 8 53.296 -2.594 1.510 1.00 0.00 H new ATOM 0 HA MET A 8 54.612 -0.761 -0.225 1.00 0.00 H new ATOM 0 HB2 MET A 8 54.423 -3.208 -0.627 1.00 0.00 H new ATOM 0 HB3 MET A 8 52.685 -3.066 -0.803 1.00 0.00 H new ATOM 0 HG2 MET A 8 52.914 -1.694 -2.813 1.00 0.00 H new ATOM 0 HG3 MET A 8 54.638 -1.504 -2.562 1.00 0.00 H new ATOM 0 HE1 MET A 8 53.266 -4.074 -5.597 1.00 0.00 H new ATOM 0 HE2 MET A 8 52.159 -3.073 -4.626 1.00 0.00 H new ATOM 0 HE3 MET A 8 53.642 -2.359 -5.304 1.00 0.00 H new ATOM 563 N GLU A 9 51.327 -0.577 -0.186 1.00 0.00 N ATOM 564 CA GLU A 9 50.185 0.283 -0.612 1.00 0.00 C ATOM 565 C GLU A 9 50.406 1.726 -0.153 1.00 0.00 C ATOM 566 O GLU A 9 50.077 2.668 -0.842 1.00 0.00 O ATOM 567 CB GLU A 9 48.894 -0.246 0.024 1.00 0.00 C ATOM 568 CG GLU A 9 47.679 0.494 -0.558 1.00 0.00 C ATOM 569 CD GLU A 9 47.556 1.887 0.066 1.00 0.00 C ATOM 570 OE1 GLU A 9 48.118 2.094 1.129 1.00 0.00 O ATOM 571 OE2 GLU A 9 46.899 2.723 -0.530 1.00 0.00 O ATOM 0 H GLU A 9 51.078 -1.347 0.434 1.00 0.00 H new ATOM 0 HA GLU A 9 50.111 0.260 -1.699 1.00 0.00 H new ATOM 0 HB2 GLU A 9 48.800 -1.316 -0.160 1.00 0.00 H new ATOM 0 HB3 GLU A 9 48.929 -0.110 1.105 1.00 0.00 H new ATOM 0 HG2 GLU A 9 47.781 0.580 -1.640 1.00 0.00 H new ATOM 0 HG3 GLU A 9 46.771 -0.078 -0.368 1.00 0.00 H new ATOM 578 N THR A 10 50.913 1.892 1.030 1.00 0.00 N ATOM 579 CA THR A 10 51.115 3.254 1.591 1.00 0.00 C ATOM 580 C THR A 10 52.248 4.005 0.878 1.00 0.00 C ATOM 581 O THR A 10 52.123 5.161 0.538 1.00 0.00 O ATOM 582 CB THR A 10 51.470 3.099 3.071 1.00 0.00 C ATOM 583 OG1 THR A 10 52.508 2.142 3.209 1.00 0.00 O ATOM 584 CG2 THR A 10 50.247 2.633 3.871 1.00 0.00 C ATOM 0 H THR A 10 51.202 1.130 1.644 1.00 0.00 H new ATOM 0 HA THR A 10 50.201 3.832 1.453 1.00 0.00 H new ATOM 0 HB THR A 10 51.798 4.065 3.455 1.00 0.00 H new ATOM 0 HG1 THR A 10 52.622 1.658 2.364 1.00 0.00 H new ATOM 0 HG21 THR A 10 50.518 2.528 4.922 1.00 0.00 H new ATOM 0 HG22 THR A 10 49.447 3.367 3.774 1.00 0.00 H new ATOM 0 HG23 THR A 10 49.905 1.672 3.487 1.00 0.00 H new ATOM 592 N LEU A 11 53.362 3.354 0.678 1.00 0.00 N ATOM 593 CA LEU A 11 54.532 4.001 0.021 1.00 0.00 C ATOM 594 C LEU A 11 54.173 4.473 -1.390 1.00 0.00 C ATOM 595 O LEU A 11 54.616 5.507 -1.842 1.00 0.00 O ATOM 596 CB LEU A 11 55.652 2.962 -0.127 1.00 0.00 C ATOM 597 CG LEU A 11 56.096 2.428 1.242 1.00 0.00 C ATOM 598 CD1 LEU A 11 57.017 1.219 1.023 1.00 0.00 C ATOM 599 CD2 LEU A 11 56.840 3.527 2.044 1.00 0.00 C ATOM 0 H LEU A 11 53.512 2.382 0.948 1.00 0.00 H new ATOM 0 HA LEU A 11 54.839 4.850 0.632 1.00 0.00 H new ATOM 0 HB2 LEU A 11 55.306 2.136 -0.748 1.00 0.00 H new ATOM 0 HB3 LEU A 11 56.503 3.411 -0.639 1.00 0.00 H new ATOM 0 HG LEU A 11 55.219 2.129 1.816 1.00 0.00 H new ATOM 0 HD11 LEU A 11 57.341 0.829 1.988 1.00 0.00 H new ATOM 0 HD12 LEU A 11 56.476 0.443 0.481 1.00 0.00 H new ATOM 0 HD13 LEU A 11 57.889 1.526 0.445 1.00 0.00 H new ATOM 0 HD21 LEU A 11 57.146 3.128 3.011 1.00 0.00 H new ATOM 0 HD22 LEU A 11 57.721 3.849 1.489 1.00 0.00 H new ATOM 0 HD23 LEU A 11 56.176 4.378 2.197 1.00 0.00 H new ATOM 611 N ILE A 12 53.421 3.688 -2.104 1.00 0.00 N ATOM 612 CA ILE A 12 53.063 4.046 -3.508 1.00 0.00 C ATOM 613 C ILE A 12 51.881 5.026 -3.557 1.00 0.00 C ATOM 614 O ILE A 12 51.788 5.831 -4.458 1.00 0.00 O ATOM 615 CB ILE A 12 52.738 2.767 -4.279 1.00 0.00 C ATOM 616 CG1 ILE A 12 53.926 1.803 -4.159 1.00 0.00 C ATOM 617 CG2 ILE A 12 52.485 3.102 -5.752 1.00 0.00 C ATOM 618 CD1 ILE A 12 53.578 0.470 -4.816 1.00 0.00 C ATOM 0 H ILE A 12 53.033 2.804 -1.775 1.00 0.00 H new ATOM 0 HA ILE A 12 53.913 4.548 -3.971 1.00 0.00 H new ATOM 0 HB ILE A 12 51.843 2.301 -3.866 1.00 0.00 H new ATOM 0 HG12 ILE A 12 54.806 2.235 -4.635 1.00 0.00 H new ATOM 0 HG13 ILE A 12 54.175 1.648 -3.109 1.00 0.00 H new ATOM 0 HG21 ILE A 12 52.254 2.188 -6.299 1.00 0.00 H new ATOM 0 HG22 ILE A 12 51.646 3.793 -5.829 1.00 0.00 H new ATOM 0 HG23 ILE A 12 53.376 3.564 -6.178 1.00 0.00 H new ATOM 0 HD11 ILE A 12 54.425 -0.211 -4.728 1.00 0.00 H new ATOM 0 HD12 ILE A 12 52.710 0.036 -4.320 1.00 0.00 H new ATOM 0 HD13 ILE A 12 53.351 0.632 -5.870 1.00 0.00 H new ATOM 630 N ASN A 13 50.992 4.990 -2.617 1.00 0.00 N ATOM 631 CA ASN A 13 49.854 5.951 -2.655 1.00 0.00 C ATOM 632 C ASN A 13 50.413 7.373 -2.574 1.00 0.00 C ATOM 633 O ASN A 13 49.947 8.291 -3.219 1.00 0.00 O ATOM 634 CB ASN A 13 48.928 5.692 -1.465 1.00 0.00 C ATOM 635 CG ASN A 13 47.759 6.676 -1.501 1.00 0.00 C ATOM 636 OD1 ASN A 13 47.821 7.733 -0.903 1.00 0.00 O ATOM 637 ND2 ASN A 13 46.685 6.375 -2.180 1.00 0.00 N ATOM 0 H ASN A 13 50.997 4.345 -1.827 1.00 0.00 H new ATOM 0 HA ASN A 13 49.289 5.827 -3.579 1.00 0.00 H new ATOM 0 HB2 ASN A 13 48.556 4.668 -1.497 1.00 0.00 H new ATOM 0 HB3 ASN A 13 49.480 5.801 -0.531 1.00 0.00 H new ATOM 0 HD21 ASN A 13 45.900 7.026 -2.208 1.00 0.00 H new ATOM 0 HD22 ASN A 13 46.631 5.489 -2.682 1.00 0.00 H new ATOM 644 N VAL A 14 51.404 7.538 -1.754 1.00 0.00 N ATOM 645 CA VAL A 14 52.029 8.879 -1.565 1.00 0.00 C ATOM 646 C VAL A 14 53.050 9.182 -2.672 1.00 0.00 C ATOM 647 O VAL A 14 53.189 10.307 -3.105 1.00 0.00 O ATOM 648 CB VAL A 14 52.719 8.903 -0.209 1.00 0.00 C ATOM 649 CG1 VAL A 14 51.683 8.647 0.884 1.00 0.00 C ATOM 650 CG2 VAL A 14 53.793 7.817 -0.169 1.00 0.00 C ATOM 0 H VAL A 14 51.818 6.792 -1.195 1.00 0.00 H new ATOM 0 HA VAL A 14 51.252 9.642 -1.614 1.00 0.00 H new ATOM 0 HB VAL A 14 53.185 9.875 -0.047 1.00 0.00 H new ATOM 0 HG11 VAL A 14 52.171 8.663 1.859 1.00 0.00 H new ATOM 0 HG12 VAL A 14 50.918 9.422 0.849 1.00 0.00 H new ATOM 0 HG13 VAL A 14 51.220 7.673 0.726 1.00 0.00 H new ATOM 0 HG21 VAL A 14 54.289 7.832 0.801 1.00 0.00 H new ATOM 0 HG22 VAL A 14 53.331 6.842 -0.326 1.00 0.00 H new ATOM 0 HG23 VAL A 14 54.526 8.001 -0.954 1.00 0.00 H new ATOM 660 N PHE A 15 53.777 8.195 -3.113 1.00 0.00 N ATOM 661 CA PHE A 15 54.809 8.423 -4.171 1.00 0.00 C ATOM 662 C PHE A 15 54.176 8.969 -5.449 1.00 0.00 C ATOM 663 O PHE A 15 54.626 9.942 -6.014 1.00 0.00 O ATOM 664 CB PHE A 15 55.450 7.078 -4.515 1.00 0.00 C ATOM 665 CG PHE A 15 56.621 7.309 -5.441 1.00 0.00 C ATOM 666 CD1 PHE A 15 57.893 7.545 -4.908 1.00 0.00 C ATOM 667 CD2 PHE A 15 56.436 7.282 -6.829 1.00 0.00 C ATOM 668 CE1 PHE A 15 58.982 7.758 -5.763 1.00 0.00 C ATOM 669 CE2 PHE A 15 57.525 7.494 -7.683 1.00 0.00 C ATOM 670 CZ PHE A 15 58.798 7.732 -7.150 1.00 0.00 C ATOM 0 H PHE A 15 53.703 7.232 -2.786 1.00 0.00 H new ATOM 0 HA PHE A 15 55.538 9.140 -3.794 1.00 0.00 H new ATOM 0 HB2 PHE A 15 55.783 6.577 -3.606 1.00 0.00 H new ATOM 0 HB3 PHE A 15 54.719 6.424 -4.990 1.00 0.00 H new ATOM 0 HD1 PHE A 15 58.035 7.563 -3.838 1.00 0.00 H new ATOM 0 HD2 PHE A 15 55.454 7.098 -7.240 1.00 0.00 H new ATOM 0 HE1 PHE A 15 59.964 7.942 -5.352 1.00 0.00 H new ATOM 0 HE2 PHE A 15 57.383 7.474 -8.753 1.00 0.00 H new ATOM 0 HZ PHE A 15 59.638 7.895 -7.809 1.00 0.00 H new ATOM 680 N HIS A 16 53.144 8.325 -5.912 1.00 0.00 N ATOM 681 CA HIS A 16 52.472 8.761 -7.164 1.00 0.00 C ATOM 682 C HIS A 16 51.632 10.012 -6.920 1.00 0.00 C ATOM 683 O HIS A 16 51.346 10.759 -7.836 1.00 0.00 O ATOM 684 CB HIS A 16 51.572 7.628 -7.670 1.00 0.00 C ATOM 685 CG HIS A 16 52.426 6.529 -8.245 1.00 0.00 C ATOM 686 ND1 HIS A 16 53.397 5.877 -7.499 1.00 0.00 N ATOM 687 CD2 HIS A 16 52.470 5.959 -9.495 1.00 0.00 C ATOM 688 CE1 HIS A 16 53.982 4.966 -8.300 1.00 0.00 C ATOM 689 NE2 HIS A 16 53.452 4.977 -9.523 1.00 0.00 N ATOM 0 H HIS A 16 52.732 7.503 -5.469 1.00 0.00 H new ATOM 0 HA HIS A 16 53.232 8.997 -7.909 1.00 0.00 H new ATOM 0 HB2 HIS A 16 50.963 7.241 -6.853 1.00 0.00 H new ATOM 0 HB3 HIS A 16 50.886 8.005 -8.428 1.00 0.00 H new ATOM 0 HD2 HIS A 16 51.838 6.233 -10.327 1.00 0.00 H new ATOM 0 HE1 HIS A 16 54.781 4.309 -7.990 1.00 0.00 H new ATOM 0 HE2 HIS A 16 53.713 4.388 -10.314 1.00 0.00 H new ATOM 698 N ALA A 17 51.208 10.248 -5.708 1.00 0.00 N ATOM 699 CA ALA A 17 50.368 11.448 -5.458 1.00 0.00 C ATOM 700 C ALA A 17 51.198 12.732 -5.570 1.00 0.00 C ATOM 701 O ALA A 17 50.877 13.606 -6.351 1.00 0.00 O ATOM 702 CB ALA A 17 49.734 11.359 -4.069 1.00 0.00 C ATOM 0 H ALA A 17 51.405 9.669 -4.892 1.00 0.00 H new ATOM 0 HA ALA A 17 49.583 11.480 -6.214 1.00 0.00 H new ATOM 0 HB1 ALA A 17 49.120 12.242 -3.892 1.00 0.00 H new ATOM 0 HB2 ALA A 17 49.112 10.466 -4.010 1.00 0.00 H new ATOM 0 HB3 ALA A 17 50.518 11.306 -3.314 1.00 0.00 H new ATOM 708 N HIS A 18 52.226 12.897 -4.779 1.00 0.00 N ATOM 709 CA HIS A 18 52.996 14.173 -4.851 1.00 0.00 C ATOM 710 C HIS A 18 53.780 14.279 -6.169 1.00 0.00 C ATOM 711 O HIS A 18 53.867 15.336 -6.762 1.00 0.00 O ATOM 712 CB HIS A 18 53.968 14.255 -3.667 1.00 0.00 C ATOM 713 CG HIS A 18 54.384 15.686 -3.453 1.00 0.00 C ATOM 714 ND1 HIS A 18 55.057 16.415 -4.424 1.00 0.00 N ATOM 715 CD2 HIS A 18 54.222 16.538 -2.389 1.00 0.00 C ATOM 716 CE1 HIS A 18 55.273 17.648 -3.929 1.00 0.00 C ATOM 717 NE2 HIS A 18 54.784 17.772 -2.694 1.00 0.00 N ATOM 0 H HIS A 18 52.561 12.216 -4.097 1.00 0.00 H new ATOM 0 HA HIS A 18 52.288 15.000 -4.809 1.00 0.00 H new ATOM 0 HB2 HIS A 18 53.494 13.865 -2.766 1.00 0.00 H new ATOM 0 HB3 HIS A 18 54.844 13.636 -3.859 1.00 0.00 H new ATOM 0 HD1 HIS A 18 55.337 16.078 -5.345 1.00 0.00 H new ATOM 0 HD2 HIS A 18 53.733 16.288 -1.459 1.00 0.00 H new ATOM 0 HE1 HIS A 18 55.779 18.438 -4.465 1.00 0.00 H new ATOM 726 N SER A 19 54.361 13.199 -6.628 1.00 0.00 N ATOM 727 CA SER A 19 55.157 13.224 -7.895 1.00 0.00 C ATOM 728 C SER A 19 54.269 13.481 -9.107 1.00 0.00 C ATOM 729 O SER A 19 54.745 13.797 -10.180 1.00 0.00 O ATOM 730 CB SER A 19 55.791 11.848 -8.090 1.00 0.00 C ATOM 731 OG SER A 19 56.382 11.792 -9.381 1.00 0.00 O ATOM 0 H SER A 19 54.317 12.288 -6.172 1.00 0.00 H new ATOM 0 HA SER A 19 55.899 14.018 -7.814 1.00 0.00 H new ATOM 0 HB2 SER A 19 56.544 11.668 -7.323 1.00 0.00 H new ATOM 0 HB3 SER A 19 55.037 11.068 -7.986 1.00 0.00 H new ATOM 0 HG SER A 19 56.082 12.559 -9.912 1.00 0.00 H new ATOM 737 N GLY A 20 52.991 13.314 -8.961 1.00 0.00 N ATOM 738 CA GLY A 20 52.068 13.507 -10.118 1.00 0.00 C ATOM 739 C GLY A 20 51.536 14.936 -10.144 1.00 0.00 C ATOM 740 O GLY A 20 50.630 15.248 -10.891 1.00 0.00 O ATOM 0 H GLY A 20 52.537 13.050 -8.086 1.00 0.00 H new ATOM 0 HA2 GLY A 20 52.592 13.291 -11.049 1.00 0.00 H new ATOM 0 HA3 GLY A 20 51.237 12.805 -10.049 1.00 0.00 H new ATOM 744 N LYS A 21 52.097 15.826 -9.369 1.00 0.00 N ATOM 745 CA LYS A 21 51.610 17.233 -9.413 1.00 0.00 C ATOM 746 C LYS A 21 52.354 17.933 -10.537 1.00 0.00 C ATOM 747 O LYS A 21 51.773 18.353 -11.519 1.00 0.00 O ATOM 748 CB LYS A 21 51.898 17.934 -8.083 1.00 0.00 C ATOM 749 CG LYS A 21 51.321 17.116 -6.920 1.00 0.00 C ATOM 750 CD LYS A 21 49.790 17.171 -6.939 1.00 0.00 C ATOM 751 CE LYS A 21 49.244 16.638 -5.611 1.00 0.00 C ATOM 752 NZ LYS A 21 49.611 17.574 -4.510 1.00 0.00 N ATOM 0 H LYS A 21 52.860 15.643 -8.717 1.00 0.00 H new ATOM 0 HA LYS A 21 50.534 17.261 -9.583 1.00 0.00 H new ATOM 0 HB2 LYS A 21 52.973 18.057 -7.953 1.00 0.00 H new ATOM 0 HB3 LYS A 21 51.461 18.933 -8.087 1.00 0.00 H new ATOM 0 HG2 LYS A 21 51.655 16.081 -6.993 1.00 0.00 H new ATOM 0 HG3 LYS A 21 51.694 17.505 -5.973 1.00 0.00 H new ATOM 0 HD2 LYS A 21 49.454 18.196 -7.098 1.00 0.00 H new ATOM 0 HD3 LYS A 21 49.404 16.577 -7.768 1.00 0.00 H new ATOM 0 HE2 LYS A 21 48.161 16.533 -5.667 1.00 0.00 H new ATOM 0 HE3 LYS A 21 49.650 15.647 -5.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 48.921 17.488 -3.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 50.560 17.338 -4.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 49.609 18.550 -4.869 1.00 0.00 H new ATOM 822 N TYR A 26 55.356 10.089 -12.910 1.00 0.00 N ATOM 823 CA TYR A 26 55.871 9.619 -11.593 1.00 0.00 C ATOM 824 C TYR A 26 57.379 9.857 -11.475 1.00 0.00 C ATOM 825 O TYR A 26 58.053 9.199 -10.707 1.00 0.00 O ATOM 826 CB TYR A 26 55.555 8.133 -11.405 1.00 0.00 C ATOM 827 CG TYR A 26 54.145 7.848 -11.882 1.00 0.00 C ATOM 828 CD1 TYR A 26 53.067 8.601 -11.390 1.00 0.00 C ATOM 829 CD2 TYR A 26 53.913 6.831 -12.819 1.00 0.00 C ATOM 830 CE1 TYR A 26 51.766 8.336 -11.835 1.00 0.00 C ATOM 831 CE2 TYR A 26 52.611 6.567 -13.261 1.00 0.00 C ATOM 832 CZ TYR A 26 51.538 7.320 -12.769 1.00 0.00 C ATOM 833 OH TYR A 26 50.257 7.060 -13.208 1.00 0.00 O ATOM 0 HA TYR A 26 55.375 10.192 -10.809 1.00 0.00 H new ATOM 0 HB2 TYR A 26 56.268 7.526 -11.963 1.00 0.00 H new ATOM 0 HB3 TYR A 26 55.657 7.859 -10.355 1.00 0.00 H new ATOM 0 HD1 TYR A 26 53.241 9.385 -10.668 1.00 0.00 H new ATOM 0 HD2 TYR A 26 54.740 6.250 -13.200 1.00 0.00 H new ATOM 0 HE1 TYR A 26 50.938 8.917 -11.457 1.00 0.00 H new ATOM 0 HE2 TYR A 26 52.434 5.782 -13.982 1.00 0.00 H new ATOM 0 HH TYR A 26 50.276 6.325 -13.856 1.00 0.00 H new ATOM 843 N LYS A 27 57.911 10.823 -12.182 1.00 0.00 N ATOM 844 CA LYS A 27 59.371 11.121 -12.044 1.00 0.00 C ATOM 845 C LYS A 27 59.479 12.238 -11.008 1.00 0.00 C ATOM 846 O LYS A 27 58.643 13.118 -10.963 1.00 0.00 O ATOM 847 CB LYS A 27 59.968 11.585 -13.377 1.00 0.00 C ATOM 848 CG LYS A 27 61.512 11.557 -13.284 1.00 0.00 C ATOM 849 CD LYS A 27 62.049 10.164 -13.680 1.00 0.00 C ATOM 850 CE LYS A 27 62.267 10.092 -15.196 1.00 0.00 C ATOM 851 NZ LYS A 27 62.879 8.777 -15.547 1.00 0.00 N ATOM 0 H LYS A 27 57.404 11.413 -12.842 1.00 0.00 H new ATOM 0 HA LYS A 27 59.921 10.230 -11.741 1.00 0.00 H new ATOM 0 HB2 LYS A 27 59.629 10.937 -14.185 1.00 0.00 H new ATOM 0 HB3 LYS A 27 59.625 12.593 -13.611 1.00 0.00 H new ATOM 0 HG2 LYS A 27 61.936 12.317 -13.940 1.00 0.00 H new ATOM 0 HG3 LYS A 27 61.826 11.800 -12.269 1.00 0.00 H new ATOM 0 HD2 LYS A 27 62.987 9.967 -13.161 1.00 0.00 H new ATOM 0 HD3 LYS A 27 61.344 9.393 -13.370 1.00 0.00 H new ATOM 0 HE2 LYS A 27 61.318 10.214 -15.717 1.00 0.00 H new ATOM 0 HE3 LYS A 27 62.916 10.906 -15.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 63.028 8.727 -16.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 63.793 8.678 -15.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 62.244 8.008 -15.251 1.00 0.00 H new ATOM 865 N LEU A 28 60.470 12.208 -10.150 1.00 0.00 N ATOM 866 CA LEU A 28 60.573 13.268 -9.097 1.00 0.00 C ATOM 867 C LEU A 28 61.550 14.355 -9.525 1.00 0.00 C ATOM 868 O LEU A 28 62.411 14.163 -10.353 1.00 0.00 O ATOM 869 CB LEU A 28 61.068 12.655 -7.771 1.00 0.00 C ATOM 870 CG LEU A 28 59.942 11.884 -7.052 1.00 0.00 C ATOM 871 CD1 LEU A 28 58.942 12.853 -6.392 1.00 0.00 C ATOM 872 CD2 LEU A 28 59.192 11.007 -8.046 1.00 0.00 C ATOM 0 H LEU A 28 61.206 11.502 -10.132 1.00 0.00 H new ATOM 0 HA LEU A 28 59.583 13.702 -8.959 1.00 0.00 H new ATOM 0 HB2 LEU A 28 61.903 11.982 -7.969 1.00 0.00 H new ATOM 0 HB3 LEU A 28 61.443 13.445 -7.121 1.00 0.00 H new ATOM 0 HG LEU A 28 60.402 11.266 -6.281 1.00 0.00 H new ATOM 0 HD11 LEU A 28 58.159 12.283 -5.892 1.00 0.00 H new ATOM 0 HD12 LEU A 28 59.463 13.472 -5.661 1.00 0.00 H new ATOM 0 HD13 LEU A 28 58.496 13.491 -7.155 1.00 0.00 H new ATOM 0 HD21 LEU A 28 58.399 10.467 -7.529 1.00 0.00 H new ATOM 0 HD22 LEU A 28 58.756 11.632 -8.826 1.00 0.00 H new ATOM 0 HD23 LEU A 28 59.883 10.294 -8.496 1.00 0.00 H new ATOM 884 N SER A 29 61.401 15.494 -8.931 1.00 0.00 N ATOM 885 CA SER A 29 62.282 16.653 -9.218 1.00 0.00 C ATOM 886 C SER A 29 62.755 17.201 -7.879 1.00 0.00 C ATOM 887 O SER A 29 62.197 16.890 -6.847 1.00 0.00 O ATOM 888 CB SER A 29 61.501 17.728 -9.974 1.00 0.00 C ATOM 889 OG SER A 29 62.386 18.777 -10.345 1.00 0.00 O ATOM 0 H SER A 29 60.680 15.679 -8.233 1.00 0.00 H new ATOM 0 HA SER A 29 63.129 16.352 -9.835 1.00 0.00 H new ATOM 0 HB2 SER A 29 61.035 17.299 -10.861 1.00 0.00 H new ATOM 0 HB3 SER A 29 60.698 18.118 -9.349 1.00 0.00 H new ATOM 0 HG SER A 29 61.889 19.467 -10.832 1.00 0.00 H new ATOM 895 N LYS A 30 63.774 18.002 -7.874 1.00 0.00 N ATOM 896 CA LYS A 30 64.272 18.545 -6.581 1.00 0.00 C ATOM 897 C LYS A 30 63.106 19.072 -5.724 1.00 0.00 C ATOM 898 O LYS A 30 63.094 18.899 -4.522 1.00 0.00 O ATOM 899 CB LYS A 30 65.262 19.674 -6.890 1.00 0.00 C ATOM 900 CG LYS A 30 65.767 20.316 -5.598 1.00 0.00 C ATOM 901 CD LYS A 30 66.829 21.362 -5.944 1.00 0.00 C ATOM 902 CE LYS A 30 67.071 22.260 -4.735 1.00 0.00 C ATOM 903 NZ LYS A 30 65.859 23.087 -4.480 1.00 0.00 N ATOM 0 H LYS A 30 64.285 18.306 -8.703 1.00 0.00 H new ATOM 0 HA LYS A 30 64.765 17.756 -6.013 1.00 0.00 H new ATOM 0 HB2 LYS A 30 66.104 19.281 -7.460 1.00 0.00 H new ATOM 0 HB3 LYS A 30 64.780 20.428 -7.512 1.00 0.00 H new ATOM 0 HG2 LYS A 30 64.941 20.782 -5.061 1.00 0.00 H new ATOM 0 HG3 LYS A 30 66.187 19.556 -4.939 1.00 0.00 H new ATOM 0 HD2 LYS A 30 67.757 20.871 -6.237 1.00 0.00 H new ATOM 0 HD3 LYS A 30 66.502 21.960 -6.795 1.00 0.00 H new ATOM 0 HE2 LYS A 30 67.302 21.654 -3.859 1.00 0.00 H new ATOM 0 HE3 LYS A 30 67.933 22.904 -4.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 66.137 23.978 -4.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 65.384 23.294 -5.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 65.208 22.567 -3.858 1.00 0.00 H new ATOM 917 N LYS A 31 62.136 19.723 -6.312 1.00 0.00 N ATOM 918 CA LYS A 31 61.002 20.263 -5.500 1.00 0.00 C ATOM 919 C LYS A 31 59.940 19.189 -5.188 1.00 0.00 C ATOM 920 O LYS A 31 59.235 19.290 -4.203 1.00 0.00 O ATOM 921 CB LYS A 31 60.344 21.413 -6.264 1.00 0.00 C ATOM 922 CG LYS A 31 59.287 22.071 -5.377 1.00 0.00 C ATOM 923 CD LYS A 31 58.636 23.230 -6.128 1.00 0.00 C ATOM 924 CE LYS A 31 57.508 23.806 -5.274 1.00 0.00 C ATOM 925 NZ LYS A 31 56.339 22.880 -5.308 1.00 0.00 N ATOM 0 H LYS A 31 62.079 19.904 -7.314 1.00 0.00 H new ATOM 0 HA LYS A 31 61.410 20.608 -4.550 1.00 0.00 H new ATOM 0 HB2 LYS A 31 61.095 22.146 -6.558 1.00 0.00 H new ATOM 0 HB3 LYS A 31 59.886 21.041 -7.180 1.00 0.00 H new ATOM 0 HG2 LYS A 31 58.531 21.339 -5.091 1.00 0.00 H new ATOM 0 HG3 LYS A 31 59.745 22.433 -4.456 1.00 0.00 H new ATOM 0 HD2 LYS A 31 59.376 24.001 -6.344 1.00 0.00 H new ATOM 0 HD3 LYS A 31 58.245 22.886 -7.085 1.00 0.00 H new ATOM 0 HE2 LYS A 31 57.848 23.943 -4.247 1.00 0.00 H new ATOM 0 HE3 LYS A 31 57.219 24.788 -5.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 55.492 23.377 -4.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 56.180 22.557 -6.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 56.528 22.059 -4.698 1.00 0.00 H new ATOM 939 N GLU A 32 59.802 18.170 -5.999 1.00 0.00 N ATOM 940 CA GLU A 32 58.761 17.138 -5.696 1.00 0.00 C ATOM 941 C GLU A 32 59.240 16.215 -4.569 1.00 0.00 C ATOM 942 O GLU A 32 58.451 15.711 -3.795 1.00 0.00 O ATOM 943 CB GLU A 32 58.450 16.318 -6.946 1.00 0.00 C ATOM 944 CG GLU A 32 57.701 17.186 -7.961 1.00 0.00 C ATOM 945 CD GLU A 32 57.613 16.448 -9.298 1.00 0.00 C ATOM 946 OE1 GLU A 32 56.685 15.675 -9.464 1.00 0.00 O ATOM 947 OE2 GLU A 32 58.476 16.670 -10.132 1.00 0.00 O ATOM 0 H GLU A 32 60.353 18.008 -6.842 1.00 0.00 H new ATOM 0 HA GLU A 32 57.852 17.646 -5.373 1.00 0.00 H new ATOM 0 HB2 GLU A 32 59.374 15.943 -7.386 1.00 0.00 H new ATOM 0 HB3 GLU A 32 57.847 15.449 -6.682 1.00 0.00 H new ATOM 0 HG2 GLU A 32 56.701 17.413 -7.593 1.00 0.00 H new ATOM 0 HG3 GLU A 32 58.216 18.137 -8.092 1.00 0.00 H new ATOM 954 N LEU A 33 60.525 15.982 -4.470 1.00 0.00 N ATOM 955 CA LEU A 33 61.034 15.082 -3.388 1.00 0.00 C ATOM 956 C LEU A 33 61.198 15.865 -2.081 1.00 0.00 C ATOM 957 O LEU A 33 60.996 15.339 -1.006 1.00 0.00 O ATOM 958 CB LEU A 33 62.381 14.460 -3.802 1.00 0.00 C ATOM 959 CG LEU A 33 63.464 15.557 -4.017 1.00 0.00 C ATOM 960 CD1 LEU A 33 64.340 15.709 -2.758 1.00 0.00 C ATOM 961 CD2 LEU A 33 64.368 15.170 -5.202 1.00 0.00 C ATOM 0 H LEU A 33 61.239 16.372 -5.085 1.00 0.00 H new ATOM 0 HA LEU A 33 60.310 14.282 -3.231 1.00 0.00 H new ATOM 0 HB2 LEU A 33 62.714 13.762 -3.034 1.00 0.00 H new ATOM 0 HB3 LEU A 33 62.253 13.886 -4.720 1.00 0.00 H new ATOM 0 HG LEU A 33 62.958 16.501 -4.221 1.00 0.00 H new ATOM 0 HD11 LEU A 33 65.091 16.480 -2.928 1.00 0.00 H new ATOM 0 HD12 LEU A 33 63.714 15.992 -1.911 1.00 0.00 H new ATOM 0 HD13 LEU A 33 64.835 14.762 -2.543 1.00 0.00 H new ATOM 0 HD21 LEU A 33 65.125 15.941 -5.349 1.00 0.00 H new ATOM 0 HD22 LEU A 33 64.856 14.218 -4.992 1.00 0.00 H new ATOM 0 HD23 LEU A 33 63.764 15.077 -6.105 1.00 0.00 H new ATOM 973 N LYS A 34 61.564 17.116 -2.160 1.00 0.00 N ATOM 974 CA LYS A 34 61.740 17.928 -0.922 1.00 0.00 C ATOM 975 C LYS A 34 60.407 18.031 -0.159 1.00 0.00 C ATOM 976 O LYS A 34 60.366 17.938 1.054 1.00 0.00 O ATOM 977 CB LYS A 34 62.216 19.323 -1.334 1.00 0.00 C ATOM 978 CG LYS A 34 62.644 20.117 -0.103 1.00 0.00 C ATOM 979 CD LYS A 34 63.118 21.508 -0.539 1.00 0.00 C ATOM 980 CE LYS A 34 63.552 22.319 0.685 1.00 0.00 C ATOM 981 NZ LYS A 34 64.433 23.439 0.250 1.00 0.00 N ATOM 0 H LYS A 34 61.749 17.612 -3.032 1.00 0.00 H new ATOM 0 HA LYS A 34 62.471 17.457 -0.266 1.00 0.00 H new ATOM 0 HB2 LYS A 34 63.050 19.240 -2.031 1.00 0.00 H new ATOM 0 HB3 LYS A 34 61.416 19.849 -1.856 1.00 0.00 H new ATOM 0 HG2 LYS A 34 61.811 20.206 0.595 1.00 0.00 H new ATOM 0 HG3 LYS A 34 63.445 19.595 0.421 1.00 0.00 H new ATOM 0 HD2 LYS A 34 63.949 21.416 -1.238 1.00 0.00 H new ATOM 0 HD3 LYS A 34 62.316 22.027 -1.064 1.00 0.00 H new ATOM 0 HE2 LYS A 34 62.677 22.710 1.204 1.00 0.00 H new ATOM 0 HE3 LYS A 34 64.081 21.678 1.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 64.729 23.991 1.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 65.273 23.055 -0.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 63.913 24.055 -0.407 1.00 0.00 H new ATOM 995 N ASP A 35 59.320 18.215 -0.861 1.00 0.00 N ATOM 996 CA ASP A 35 57.989 18.320 -0.193 1.00 0.00 C ATOM 997 C ASP A 35 57.482 16.929 0.193 1.00 0.00 C ATOM 998 O ASP A 35 56.768 16.762 1.161 1.00 0.00 O ATOM 999 CB ASP A 35 56.991 18.985 -1.144 1.00 0.00 C ATOM 1000 CG ASP A 35 57.351 20.463 -1.308 1.00 0.00 C ATOM 1001 OD1 ASP A 35 58.033 20.984 -0.441 1.00 0.00 O ATOM 1002 OD2 ASP A 35 56.935 21.047 -2.293 1.00 0.00 O ATOM 0 H ASP A 35 59.297 18.298 -1.877 1.00 0.00 H new ATOM 0 HA ASP A 35 58.091 18.923 0.710 1.00 0.00 H new ATOM 0 HB2 ASP A 35 57.007 18.486 -2.113 1.00 0.00 H new ATOM 0 HB3 ASP A 35 55.978 18.887 -0.752 1.00 0.00 H new ATOM 1007 N LEU A 36 57.828 15.941 -0.569 1.00 0.00 N ATOM 1008 CA LEU A 36 57.360 14.555 -0.286 1.00 0.00 C ATOM 1009 C LEU A 36 57.905 14.005 1.048 1.00 0.00 C ATOM 1010 O LEU A 36 57.213 13.311 1.764 1.00 0.00 O ATOM 1011 CB LEU A 36 57.809 13.648 -1.435 1.00 0.00 C ATOM 1012 CG LEU A 36 57.354 12.202 -1.200 1.00 0.00 C ATOM 1013 CD1 LEU A 36 55.830 12.145 -1.015 1.00 0.00 C ATOM 1014 CD2 LEU A 36 57.756 11.362 -2.416 1.00 0.00 C ATOM 0 H LEU A 36 58.425 16.031 -1.391 1.00 0.00 H new ATOM 0 HA LEU A 36 56.274 14.576 -0.201 1.00 0.00 H new ATOM 0 HB2 LEU A 36 57.398 14.015 -2.375 1.00 0.00 H new ATOM 0 HB3 LEU A 36 58.895 13.682 -1.527 1.00 0.00 H new ATOM 0 HG LEU A 36 57.826 11.812 -0.298 1.00 0.00 H new ATOM 0 HD11 LEU A 36 55.522 11.113 -0.849 1.00 0.00 H new ATOM 0 HD12 LEU A 36 55.545 12.751 -0.155 1.00 0.00 H new ATOM 0 HD13 LEU A 36 55.340 12.531 -1.909 1.00 0.00 H new ATOM 0 HD21 LEU A 36 57.440 10.330 -2.266 1.00 0.00 H new ATOM 0 HD22 LEU A 36 57.276 11.762 -3.309 1.00 0.00 H new ATOM 0 HD23 LEU A 36 58.838 11.396 -2.540 1.00 0.00 H new ATOM 1026 N LEU A 37 59.141 14.273 1.368 1.00 0.00 N ATOM 1027 CA LEU A 37 59.730 13.721 2.636 1.00 0.00 C ATOM 1028 C LEU A 37 59.383 14.567 3.865 1.00 0.00 C ATOM 1029 O LEU A 37 59.153 14.042 4.935 1.00 0.00 O ATOM 1030 CB LEU A 37 61.251 13.647 2.494 1.00 0.00 C ATOM 1031 CG LEU A 37 61.629 12.535 1.504 1.00 0.00 C ATOM 1032 CD1 LEU A 37 63.091 12.704 1.082 1.00 0.00 C ATOM 1033 CD2 LEU A 37 61.446 11.145 2.153 1.00 0.00 C ATOM 0 H LEU A 37 59.773 14.849 0.812 1.00 0.00 H new ATOM 0 HA LEU A 37 59.302 12.730 2.789 1.00 0.00 H new ATOM 0 HB2 LEU A 37 61.640 14.604 2.146 1.00 0.00 H new ATOM 0 HB3 LEU A 37 61.707 13.452 3.465 1.00 0.00 H new ATOM 0 HG LEU A 37 60.977 12.607 0.633 1.00 0.00 H new ATOM 0 HD11 LEU A 37 63.360 11.915 0.379 1.00 0.00 H new ATOM 0 HD12 LEU A 37 63.222 13.675 0.605 1.00 0.00 H new ATOM 0 HD13 LEU A 37 63.733 12.642 1.961 1.00 0.00 H new ATOM 0 HD21 LEU A 37 61.719 10.370 1.436 1.00 0.00 H new ATOM 0 HD22 LEU A 37 62.085 11.067 3.032 1.00 0.00 H new ATOM 0 HD23 LEU A 37 60.405 11.016 2.449 1.00 0.00 H new ATOM 1045 N GLN A 38 59.375 15.858 3.743 1.00 0.00 N ATOM 1046 CA GLN A 38 59.082 16.705 4.925 1.00 0.00 C ATOM 1047 C GLN A 38 57.639 16.524 5.359 1.00 0.00 C ATOM 1048 O GLN A 38 57.316 16.535 6.530 1.00 0.00 O ATOM 1049 CB GLN A 38 59.305 18.173 4.540 1.00 0.00 C ATOM 1050 CG GLN A 38 58.242 18.622 3.539 1.00 0.00 C ATOM 1051 CD GLN A 38 58.637 19.982 2.961 1.00 0.00 C ATOM 1052 OE1 GLN A 38 59.802 20.249 2.749 1.00 0.00 O ATOM 1053 NE2 GLN A 38 57.706 20.854 2.687 1.00 0.00 N ATOM 0 H GLN A 38 59.558 16.365 2.877 1.00 0.00 H new ATOM 0 HA GLN A 38 59.738 16.417 5.747 1.00 0.00 H new ATOM 0 HB2 GLN A 38 59.265 18.800 5.430 1.00 0.00 H new ATOM 0 HB3 GLN A 38 60.298 18.297 4.107 1.00 0.00 H new ATOM 0 HG2 GLN A 38 58.146 17.888 2.739 1.00 0.00 H new ATOM 0 HG3 GLN A 38 57.270 18.690 4.028 1.00 0.00 H new ATOM 0 HE21 GLN A 38 56.727 20.628 2.866 1.00 0.00 H new ATOM 0 HE22 GLN A 38 57.957 21.761 2.294 1.00 0.00 H new ATOM 1062 N THR A 39 56.755 16.432 4.402 1.00 0.00 N ATOM 1063 CA THR A 39 55.314 16.335 4.728 1.00 0.00 C ATOM 1064 C THR A 39 54.899 14.908 5.089 1.00 0.00 C ATOM 1065 O THR A 39 54.453 14.630 6.185 1.00 0.00 O ATOM 1066 CB THR A 39 54.509 16.788 3.507 1.00 0.00 C ATOM 1067 OG1 THR A 39 55.010 18.037 3.047 1.00 0.00 O ATOM 1068 CG2 THR A 39 53.032 16.936 3.884 1.00 0.00 C ATOM 0 H THR A 39 56.976 16.420 3.406 1.00 0.00 H new ATOM 0 HA THR A 39 55.119 16.968 5.594 1.00 0.00 H new ATOM 0 HB THR A 39 54.604 16.043 2.717 1.00 0.00 H new ATOM 0 HG1 THR A 39 55.667 17.884 2.337 1.00 0.00 H new ATOM 0 HG21 THR A 39 52.464 17.259 3.011 1.00 0.00 H new ATOM 0 HG22 THR A 39 52.648 15.978 4.233 1.00 0.00 H new ATOM 0 HG23 THR A 39 52.931 17.677 4.677 1.00 0.00 H new ATOM 1076 N GLU A 40 54.986 14.016 4.136 1.00 0.00 N ATOM 1077 CA GLU A 40 54.537 12.615 4.363 1.00 0.00 C ATOM 1078 C GLU A 40 55.451 11.844 5.321 1.00 0.00 C ATOM 1079 O GLU A 40 54.960 11.083 6.131 1.00 0.00 O ATOM 1080 CB GLU A 40 54.504 11.878 3.021 1.00 0.00 C ATOM 1081 CG GLU A 40 53.466 12.526 2.102 1.00 0.00 C ATOM 1082 CD GLU A 40 52.063 12.270 2.655 1.00 0.00 C ATOM 1083 OE1 GLU A 40 51.919 11.352 3.445 1.00 0.00 O ATOM 1084 OE2 GLU A 40 51.158 12.999 2.281 1.00 0.00 O ATOM 0 H GLU A 40 55.353 14.203 3.203 1.00 0.00 H new ATOM 0 HA GLU A 40 53.548 12.664 4.818 1.00 0.00 H new ATOM 0 HB2 GLU A 40 55.488 11.910 2.553 1.00 0.00 H new ATOM 0 HB3 GLU A 40 54.259 10.827 3.178 1.00 0.00 H new ATOM 0 HG2 GLU A 40 53.649 13.598 2.028 1.00 0.00 H new ATOM 0 HG3 GLU A 40 53.551 12.118 1.095 1.00 0.00 H new ATOM 1091 N LEU A 41 56.765 11.991 5.238 1.00 0.00 N ATOM 1092 CA LEU A 41 57.658 11.197 6.162 1.00 0.00 C ATOM 1093 C LEU A 41 58.118 12.064 7.340 1.00 0.00 C ATOM 1094 O LEU A 41 59.199 11.895 7.863 1.00 0.00 O ATOM 1095 CB LEU A 41 58.865 10.625 5.388 1.00 0.00 C ATOM 1096 CG LEU A 41 59.219 9.216 5.886 1.00 0.00 C ATOM 1097 CD1 LEU A 41 60.412 8.687 5.090 1.00 0.00 C ATOM 1098 CD2 LEU A 41 59.590 9.260 7.372 1.00 0.00 C ATOM 0 H LEU A 41 57.247 12.611 4.587 1.00 0.00 H new ATOM 0 HA LEU A 41 57.087 10.359 6.563 1.00 0.00 H new ATOM 0 HB2 LEU A 41 58.636 10.591 4.323 1.00 0.00 H new ATOM 0 HB3 LEU A 41 59.725 11.284 5.509 1.00 0.00 H new ATOM 0 HG LEU A 41 58.357 8.563 5.750 1.00 0.00 H new ATOM 0 HD11 LEU A 41 60.668 7.687 5.439 1.00 0.00 H new ATOM 0 HD12 LEU A 41 60.154 8.647 4.032 1.00 0.00 H new ATOM 0 HD13 LEU A 41 61.266 9.350 5.231 1.00 0.00 H new ATOM 0 HD21 LEU A 41 59.839 8.256 7.715 1.00 0.00 H new ATOM 0 HD22 LEU A 41 60.450 9.915 7.513 1.00 0.00 H new ATOM 0 HD23 LEU A 41 58.746 9.640 7.947 1.00 0.00 H new ATOM 1110 N SER A 42 57.280 12.952 7.801 1.00 0.00 N ATOM 1111 CA SER A 42 57.649 13.771 8.986 1.00 0.00 C ATOM 1112 C SER A 42 58.123 12.808 10.077 1.00 0.00 C ATOM 1113 O SER A 42 57.464 11.822 10.333 1.00 0.00 O ATOM 1114 CB SER A 42 56.396 14.495 9.482 1.00 0.00 C ATOM 1115 OG SER A 42 56.045 15.515 8.555 1.00 0.00 O ATOM 0 H SER A 42 56.358 13.144 7.408 1.00 0.00 H new ATOM 0 HA SER A 42 58.425 14.495 8.740 1.00 0.00 H new ATOM 0 HB2 SER A 42 55.573 13.789 9.592 1.00 0.00 H new ATOM 0 HB3 SER A 42 56.578 14.928 10.466 1.00 0.00 H new ATOM 0 HG SER A 42 56.826 15.743 8.008 1.00 0.00 H new ATOM 1121 N SER A 43 59.226 13.081 10.733 1.00 0.00 N ATOM 1122 CA SER A 43 59.705 12.157 11.823 1.00 0.00 C ATOM 1123 C SER A 43 61.213 12.324 12.051 1.00 0.00 C ATOM 1124 O SER A 43 61.664 12.435 13.173 1.00 0.00 O ATOM 1125 CB SER A 43 59.423 10.681 11.458 1.00 0.00 C ATOM 1126 OG SER A 43 59.435 10.538 10.043 1.00 0.00 O ATOM 0 H SER A 43 59.815 13.897 10.566 1.00 0.00 H new ATOM 0 HA SER A 43 59.164 12.418 12.732 1.00 0.00 H new ATOM 0 HB2 SER A 43 60.175 10.033 11.907 1.00 0.00 H new ATOM 0 HB3 SER A 43 58.457 10.373 11.858 1.00 0.00 H new ATOM 0 HG SER A 43 58.517 10.574 9.703 1.00 0.00 H new ATOM 1132 N PHE A 44 62.002 12.328 11.009 1.00 0.00 N ATOM 1133 CA PHE A 44 63.472 12.469 11.210 1.00 0.00 C ATOM 1134 C PHE A 44 64.155 12.917 9.918 1.00 0.00 C ATOM 1135 O PHE A 44 65.116 13.659 9.952 1.00 0.00 O ATOM 1136 CB PHE A 44 64.062 11.129 11.654 1.00 0.00 C ATOM 1137 CG PHE A 44 65.553 11.279 11.841 1.00 0.00 C ATOM 1138 CD1 PHE A 44 66.064 11.671 13.083 1.00 0.00 C ATOM 1139 CD2 PHE A 44 66.425 11.040 10.771 1.00 0.00 C ATOM 1140 CE1 PHE A 44 67.445 11.819 13.258 1.00 0.00 C ATOM 1141 CE2 PHE A 44 67.807 11.189 10.945 1.00 0.00 C ATOM 1142 CZ PHE A 44 68.317 11.579 12.189 1.00 0.00 C ATOM 0 H PHE A 44 61.697 12.241 10.040 1.00 0.00 H new ATOM 0 HA PHE A 44 63.643 13.223 11.978 1.00 0.00 H new ATOM 0 HB2 PHE A 44 63.598 10.805 12.585 1.00 0.00 H new ATOM 0 HB3 PHE A 44 63.852 10.361 10.909 1.00 0.00 H new ATOM 0 HD1 PHE A 44 65.392 11.860 13.908 1.00 0.00 H new ATOM 0 HD2 PHE A 44 66.031 10.741 9.811 1.00 0.00 H new ATOM 0 HE1 PHE A 44 67.838 12.119 14.218 1.00 0.00 H new ATOM 0 HE2 PHE A 44 68.479 11.003 10.120 1.00 0.00 H new ATOM 0 HZ PHE A 44 69.382 11.695 12.324 1.00 0.00 H new ATOM 1152 N LEU A 45 63.685 12.485 8.778 1.00 0.00 N ATOM 1153 CA LEU A 45 64.357 12.922 7.525 1.00 0.00 C ATOM 1154 C LEU A 45 64.293 14.452 7.487 1.00 0.00 C ATOM 1155 O LEU A 45 63.243 15.037 7.665 1.00 0.00 O ATOM 1156 CB LEU A 45 63.641 12.332 6.293 1.00 0.00 C ATOM 1157 CG LEU A 45 64.013 10.843 6.106 1.00 0.00 C ATOM 1158 CD1 LEU A 45 65.502 10.694 5.743 1.00 0.00 C ATOM 1159 CD2 LEU A 45 63.714 10.078 7.402 1.00 0.00 C ATOM 0 H LEU A 45 62.884 11.864 8.662 1.00 0.00 H new ATOM 0 HA LEU A 45 65.390 12.574 7.505 1.00 0.00 H new ATOM 0 HB2 LEU A 45 62.562 12.430 6.412 1.00 0.00 H new ATOM 0 HB3 LEU A 45 63.916 12.896 5.402 1.00 0.00 H new ATOM 0 HG LEU A 45 63.419 10.432 5.290 1.00 0.00 H new ATOM 0 HD11 LEU A 45 65.742 9.638 5.616 1.00 0.00 H new ATOM 0 HD12 LEU A 45 65.705 11.226 4.814 1.00 0.00 H new ATOM 0 HD13 LEU A 45 66.115 11.112 6.542 1.00 0.00 H new ATOM 0 HD21 LEU A 45 63.975 9.028 7.273 1.00 0.00 H new ATOM 0 HD22 LEU A 45 64.301 10.501 8.218 1.00 0.00 H new ATOM 0 HD23 LEU A 45 62.653 10.162 7.637 1.00 0.00 H new ATOM 1171 N ASP A 46 65.395 15.111 7.263 1.00 0.00 N ATOM 1172 CA ASP A 46 65.410 16.603 7.217 1.00 0.00 C ATOM 1173 C ASP A 46 65.680 17.038 5.787 1.00 0.00 C ATOM 1174 O ASP A 46 66.451 16.430 5.074 1.00 0.00 O ATOM 1175 CB ASP A 46 66.537 17.117 8.118 1.00 0.00 C ATOM 1176 CG ASP A 46 66.188 16.841 9.582 1.00 0.00 C ATOM 1177 OD1 ASP A 46 65.011 16.725 9.881 1.00 0.00 O ATOM 1178 OD2 ASP A 46 67.107 16.750 10.380 1.00 0.00 O ATOM 0 H ASP A 46 66.303 14.672 7.107 1.00 0.00 H new ATOM 0 HA ASP A 46 64.455 17.002 7.558 1.00 0.00 H new ATOM 0 HB2 ASP A 46 67.476 16.628 7.859 1.00 0.00 H new ATOM 0 HB3 ASP A 46 66.681 18.186 7.963 1.00 0.00 H new ATOM 1183 N VAL A 47 65.069 18.115 5.382 1.00 0.00 N ATOM 1184 CA VAL A 47 65.277 18.650 4.008 1.00 0.00 C ATOM 1185 C VAL A 47 65.039 20.168 4.044 1.00 0.00 C ATOM 1186 O VAL A 47 65.597 20.919 3.279 1.00 0.00 O ATOM 1187 CB VAL A 47 64.289 17.984 3.009 1.00 0.00 C ATOM 1188 CG1 VAL A 47 64.133 16.496 3.321 1.00 0.00 C ATOM 1189 CG2 VAL A 47 62.903 18.637 3.089 1.00 0.00 C ATOM 0 H VAL A 47 64.423 18.657 5.956 1.00 0.00 H new ATOM 0 HA VAL A 47 66.292 18.432 3.677 1.00 0.00 H new ATOM 0 HB VAL A 47 64.701 18.117 2.009 1.00 0.00 H new ATOM 0 HG11 VAL A 47 63.438 16.046 2.612 1.00 0.00 H new ATOM 0 HG12 VAL A 47 65.102 16.004 3.241 1.00 0.00 H new ATOM 0 HG13 VAL A 47 63.747 16.375 4.333 1.00 0.00 H new ATOM 0 HG21 VAL A 47 62.231 18.153 2.380 1.00 0.00 H new ATOM 0 HG22 VAL A 47 62.507 18.527 4.098 1.00 0.00 H new ATOM 0 HG23 VAL A 47 62.985 19.696 2.845 1.00 0.00 H new ATOM 1199 N GLN A 48 64.184 20.618 4.918 1.00 0.00 N ATOM 1200 CA GLN A 48 63.877 22.076 4.983 1.00 0.00 C ATOM 1201 C GLN A 48 64.961 22.840 5.748 1.00 0.00 C ATOM 1202 O GLN A 48 65.702 23.620 5.183 1.00 0.00 O ATOM 1203 CB GLN A 48 62.540 22.252 5.705 1.00 0.00 C ATOM 1204 CG GLN A 48 61.393 21.822 4.790 1.00 0.00 C ATOM 1205 CD GLN A 48 61.222 22.849 3.669 1.00 0.00 C ATOM 1206 OE1 GLN A 48 61.545 24.007 3.838 1.00 0.00 O ATOM 1207 NE2 GLN A 48 60.713 22.473 2.527 1.00 0.00 N ATOM 0 H GLN A 48 63.683 20.039 5.592 1.00 0.00 H new ATOM 0 HA GLN A 48 63.833 22.473 3.969 1.00 0.00 H new ATOM 0 HB2 GLN A 48 62.530 21.658 6.619 1.00 0.00 H new ATOM 0 HB3 GLN A 48 62.411 23.293 6.000 1.00 0.00 H new ATOM 0 HG2 GLN A 48 61.599 20.838 4.368 1.00 0.00 H new ATOM 0 HG3 GLN A 48 60.470 21.736 5.363 1.00 0.00 H new ATOM 0 HE21 GLN A 48 60.442 21.500 2.385 1.00 0.00 H new ATOM 0 HE22 GLN A 48 60.587 23.152 1.777 1.00 0.00 H new ATOM 1216 N LYS A 49 65.039 22.646 7.033 1.00 0.00 N ATOM 1217 CA LYS A 49 66.049 23.386 7.840 1.00 0.00 C ATOM 1218 C LYS A 49 67.469 23.060 7.373 1.00 0.00 C ATOM 1219 O LYS A 49 68.357 23.885 7.462 1.00 0.00 O ATOM 1220 CB LYS A 49 65.883 23.017 9.312 1.00 0.00 C ATOM 1221 CG LYS A 49 66.044 21.508 9.488 1.00 0.00 C ATOM 1222 CD LYS A 49 65.729 21.136 10.938 1.00 0.00 C ATOM 1223 CE LYS A 49 65.892 19.629 11.128 1.00 0.00 C ATOM 1224 NZ LYS A 49 65.885 19.313 12.584 1.00 0.00 N ATOM 0 H LYS A 49 64.446 22.006 7.561 1.00 0.00 H new ATOM 0 HA LYS A 49 65.890 24.456 7.708 1.00 0.00 H new ATOM 0 HB2 LYS A 49 66.623 23.544 9.914 1.00 0.00 H new ATOM 0 HB3 LYS A 49 64.901 23.331 9.667 1.00 0.00 H new ATOM 0 HG2 LYS A 49 65.376 20.977 8.810 1.00 0.00 H new ATOM 0 HG3 LYS A 49 67.060 21.206 9.235 1.00 0.00 H new ATOM 0 HD2 LYS A 49 66.395 21.672 11.614 1.00 0.00 H new ATOM 0 HD3 LYS A 49 64.711 21.436 11.188 1.00 0.00 H new ATOM 0 HE2 LYS A 49 65.084 19.098 10.625 1.00 0.00 H new ATOM 0 HE3 LYS A 49 66.825 19.293 10.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 65.996 18.288 12.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 66.671 19.810 13.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 64.984 19.621 13.002 1.00 0.00 H new ATOM 1238 N ASP A 50 67.703 21.872 6.883 1.00 0.00 N ATOM 1239 CA ASP A 50 69.080 21.516 6.423 1.00 0.00 C ATOM 1240 C ASP A 50 69.206 21.775 4.918 1.00 0.00 C ATOM 1241 O ASP A 50 68.929 20.917 4.104 1.00 0.00 O ATOM 1242 CB ASP A 50 69.337 20.037 6.709 1.00 0.00 C ATOM 1243 CG ASP A 50 69.358 19.808 8.222 1.00 0.00 C ATOM 1244 OD1 ASP A 50 69.523 20.776 8.945 1.00 0.00 O ATOM 1245 OD2 ASP A 50 69.210 18.668 8.630 1.00 0.00 O ATOM 0 H ASP A 50 67.005 21.135 6.781 1.00 0.00 H new ATOM 0 HA ASP A 50 69.811 22.127 6.954 1.00 0.00 H new ATOM 0 HB2 ASP A 50 68.561 19.426 6.248 1.00 0.00 H new ATOM 0 HB3 ASP A 50 70.286 19.730 6.270 1.00 0.00 H new ATOM 1250 N ALA A 51 69.634 22.953 4.548 1.00 0.00 N ATOM 1251 CA ALA A 51 69.793 23.282 3.100 1.00 0.00 C ATOM 1252 C ALA A 51 70.963 22.484 2.525 1.00 0.00 C ATOM 1253 O ALA A 51 70.914 22.004 1.411 1.00 0.00 O ATOM 1254 CB ALA A 51 70.069 24.780 2.947 1.00 0.00 C ATOM 0 H ALA A 51 69.882 23.706 5.190 1.00 0.00 H new ATOM 0 HA ALA A 51 68.880 23.025 2.563 1.00 0.00 H new ATOM 0 HB1 ALA A 51 70.185 25.022 1.891 1.00 0.00 H new ATOM 0 HB2 ALA A 51 69.235 25.348 3.360 1.00 0.00 H new ATOM 0 HB3 ALA A 51 70.983 25.038 3.481 1.00 0.00 H new ATOM 1260 N ASP A 52 72.015 22.337 3.282 1.00 0.00 N ATOM 1261 CA ASP A 52 73.188 21.568 2.790 1.00 0.00 C ATOM 1262 C ASP A 52 72.741 20.144 2.480 1.00 0.00 C ATOM 1263 O ASP A 52 73.158 19.547 1.513 1.00 0.00 O ATOM 1264 CB ASP A 52 74.279 21.555 3.862 1.00 0.00 C ATOM 1265 CG ASP A 52 74.879 22.957 3.994 1.00 0.00 C ATOM 1266 OD1 ASP A 52 74.698 23.746 3.080 1.00 0.00 O ATOM 1267 OD2 ASP A 52 75.516 23.216 5.002 1.00 0.00 O ATOM 0 H ASP A 52 72.111 22.718 4.223 1.00 0.00 H new ATOM 0 HA ASP A 52 73.590 22.031 1.889 1.00 0.00 H new ATOM 0 HB2 ASP A 52 73.862 21.234 4.817 1.00 0.00 H new ATOM 0 HB3 ASP A 52 75.056 20.838 3.597 1.00 0.00 H new ATOM 1272 N ALA A 53 71.893 19.599 3.302 1.00 0.00 N ATOM 1273 CA ALA A 53 71.393 18.215 3.087 1.00 0.00 C ATOM 1274 C ALA A 53 70.618 18.090 1.770 1.00 0.00 C ATOM 1275 O ALA A 53 70.699 17.090 1.096 1.00 0.00 O ATOM 1276 CB ALA A 53 70.459 17.862 4.242 1.00 0.00 C ATOM 0 H ALA A 53 71.518 20.063 4.129 1.00 0.00 H new ATOM 0 HA ALA A 53 72.247 17.539 3.041 1.00 0.00 H new ATOM 0 HB1 ALA A 53 70.079 16.849 4.106 1.00 0.00 H new ATOM 0 HB2 ALA A 53 71.006 17.921 5.183 1.00 0.00 H new ATOM 0 HB3 ALA A 53 69.625 18.563 4.262 1.00 0.00 H new ATOM 1282 N VAL A 54 69.825 19.062 1.427 1.00 0.00 N ATOM 1283 CA VAL A 54 69.015 18.955 0.180 1.00 0.00 C ATOM 1284 C VAL A 54 69.882 19.027 -1.071 1.00 0.00 C ATOM 1285 O VAL A 54 69.818 18.174 -1.921 1.00 0.00 O ATOM 1286 CB VAL A 54 68.020 20.113 0.125 1.00 0.00 C ATOM 1287 CG1 VAL A 54 67.248 20.069 -1.197 1.00 0.00 C ATOM 1288 CG2 VAL A 54 67.044 20.000 1.288 1.00 0.00 C ATOM 0 H VAL A 54 69.701 19.927 1.954 1.00 0.00 H new ATOM 0 HA VAL A 54 68.508 17.990 0.203 1.00 0.00 H new ATOM 0 HB VAL A 54 68.561 21.057 0.194 1.00 0.00 H new ATOM 0 HG11 VAL A 54 66.539 20.897 -1.232 1.00 0.00 H new ATOM 0 HG12 VAL A 54 67.947 20.154 -2.029 1.00 0.00 H new ATOM 0 HG13 VAL A 54 66.708 19.125 -1.272 1.00 0.00 H new ATOM 0 HG21 VAL A 54 66.334 20.826 1.249 1.00 0.00 H new ATOM 0 HG22 VAL A 54 66.505 19.055 1.220 1.00 0.00 H new ATOM 0 HG23 VAL A 54 67.593 20.038 2.229 1.00 0.00 H new ATOM 1298 N ASP A 55 70.645 20.057 -1.231 1.00 0.00 N ATOM 1299 CA ASP A 55 71.453 20.182 -2.476 1.00 0.00 C ATOM 1300 C ASP A 55 72.479 19.059 -2.568 1.00 0.00 C ATOM 1301 O ASP A 55 72.748 18.539 -3.628 1.00 0.00 O ATOM 1302 CB ASP A 55 72.184 21.525 -2.473 1.00 0.00 C ATOM 1303 CG ASP A 55 71.172 22.656 -2.663 1.00 0.00 C ATOM 1304 OD1 ASP A 55 70.028 22.357 -2.963 1.00 0.00 O ATOM 1305 OD2 ASP A 55 71.555 23.802 -2.493 1.00 0.00 O ATOM 0 H ASP A 55 70.750 20.819 -0.561 1.00 0.00 H new ATOM 0 HA ASP A 55 70.782 20.119 -3.333 1.00 0.00 H new ATOM 0 HB2 ASP A 55 72.721 21.657 -1.534 1.00 0.00 H new ATOM 0 HB3 ASP A 55 72.926 21.549 -3.271 1.00 0.00 H new ATOM 1310 N LYS A 56 73.085 18.713 -1.478 1.00 0.00 N ATOM 1311 CA LYS A 56 74.128 17.654 -1.518 1.00 0.00 C ATOM 1312 C LYS A 56 73.523 16.268 -1.771 1.00 0.00 C ATOM 1313 O LYS A 56 74.088 15.456 -2.476 1.00 0.00 O ATOM 1314 CB LYS A 56 74.871 17.639 -0.184 1.00 0.00 C ATOM 1315 CG LYS A 56 75.727 18.898 -0.062 1.00 0.00 C ATOM 1316 CD LYS A 56 76.471 18.881 1.274 1.00 0.00 C ATOM 1317 CE LYS A 56 77.328 20.142 1.397 1.00 0.00 C ATOM 1318 NZ LYS A 56 77.805 20.281 2.802 1.00 0.00 N ATOM 0 H LYS A 56 72.907 19.115 -0.558 1.00 0.00 H new ATOM 0 HA LYS A 56 74.808 17.879 -2.339 1.00 0.00 H new ATOM 0 HB2 LYS A 56 74.159 17.589 0.640 1.00 0.00 H new ATOM 0 HB3 LYS A 56 75.500 16.751 -0.116 1.00 0.00 H new ATOM 0 HG2 LYS A 56 76.439 18.948 -0.886 1.00 0.00 H new ATOM 0 HG3 LYS A 56 75.098 19.786 -0.129 1.00 0.00 H new ATOM 0 HD2 LYS A 56 75.759 18.830 2.098 1.00 0.00 H new ATOM 0 HD3 LYS A 56 77.100 17.993 1.341 1.00 0.00 H new ATOM 0 HE2 LYS A 56 78.178 20.085 0.717 1.00 0.00 H new ATOM 0 HE3 LYS A 56 76.748 21.019 1.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 78.761 20.689 2.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 77.160 20.905 3.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 77.827 19.345 3.255 1.00 0.00 H new ATOM 1332 N ILE A 57 72.400 15.976 -1.173 1.00 0.00 N ATOM 1333 CA ILE A 57 71.791 14.629 -1.339 1.00 0.00 C ATOM 1334 C ILE A 57 71.113 14.532 -2.700 1.00 0.00 C ATOM 1335 O ILE A 57 71.372 13.640 -3.476 1.00 0.00 O ATOM 1336 CB ILE A 57 70.762 14.414 -0.218 1.00 0.00 C ATOM 1337 CG1 ILE A 57 71.478 14.341 1.134 1.00 0.00 C ATOM 1338 CG2 ILE A 57 69.975 13.127 -0.446 1.00 0.00 C ATOM 1339 CD1 ILE A 57 70.443 14.377 2.265 1.00 0.00 C ATOM 0 H ILE A 57 71.878 16.616 -0.575 1.00 0.00 H new ATOM 0 HA ILE A 57 72.562 13.861 -1.282 1.00 0.00 H new ATOM 0 HB ILE A 57 70.067 15.254 -0.222 1.00 0.00 H new ATOM 0 HG12 ILE A 57 72.068 13.427 1.196 1.00 0.00 H new ATOM 0 HG13 ILE A 57 72.172 15.175 1.235 1.00 0.00 H new ATOM 0 HG21 ILE A 57 69.252 12.995 0.359 1.00 0.00 H new ATOM 0 HG22 ILE A 57 69.449 13.186 -1.399 1.00 0.00 H new ATOM 0 HG23 ILE A 57 70.660 12.279 -0.461 1.00 0.00 H new ATOM 0 HD11 ILE A 57 70.953 14.325 3.227 1.00 0.00 H new ATOM 0 HD12 ILE A 57 69.872 15.304 2.207 1.00 0.00 H new ATOM 0 HD13 ILE A 57 69.767 13.528 2.167 1.00 0.00 H new ATOM 1351 N MET A 58 70.232 15.439 -2.980 1.00 0.00 N ATOM 1352 CA MET A 58 69.500 15.409 -4.269 1.00 0.00 C ATOM 1353 C MET A 58 70.459 15.505 -5.461 1.00 0.00 C ATOM 1354 O MET A 58 70.345 14.768 -6.419 1.00 0.00 O ATOM 1355 CB MET A 58 68.503 16.578 -4.307 1.00 0.00 C ATOM 1356 CG MET A 58 67.959 16.784 -5.727 1.00 0.00 C ATOM 1357 SD MET A 58 67.563 15.186 -6.477 1.00 0.00 S ATOM 1358 CE MET A 58 67.183 15.801 -8.134 1.00 0.00 C ATOM 0 H MET A 58 69.983 16.212 -2.363 1.00 0.00 H new ATOM 0 HA MET A 58 68.970 14.459 -4.344 1.00 0.00 H new ATOM 0 HB2 MET A 58 67.678 16.381 -3.622 1.00 0.00 H new ATOM 0 HB3 MET A 58 68.992 17.490 -3.964 1.00 0.00 H new ATOM 0 HG2 MET A 58 67.068 17.411 -5.696 1.00 0.00 H new ATOM 0 HG3 MET A 58 68.697 17.308 -6.335 1.00 0.00 H new ATOM 0 HE1 MET A 58 67.325 15.001 -8.860 1.00 0.00 H new ATOM 0 HE2 MET A 58 66.148 16.142 -8.167 1.00 0.00 H new ATOM 0 HE3 MET A 58 67.847 16.632 -8.375 1.00 0.00 H new ATOM 1368 N LYS A 59 71.379 16.422 -5.424 1.00 0.00 N ATOM 1369 CA LYS A 59 72.313 16.575 -6.575 1.00 0.00 C ATOM 1370 C LYS A 59 73.206 15.338 -6.697 1.00 0.00 C ATOM 1371 O LYS A 59 73.488 14.873 -7.782 1.00 0.00 O ATOM 1372 CB LYS A 59 73.179 17.819 -6.375 1.00 0.00 C ATOM 1373 CG LYS A 59 74.050 18.056 -7.610 1.00 0.00 C ATOM 1374 CD LYS A 59 74.903 19.305 -7.385 1.00 0.00 C ATOM 1375 CE LYS A 59 75.786 19.552 -8.606 1.00 0.00 C ATOM 1376 NZ LYS A 59 76.602 20.779 -8.384 1.00 0.00 N ATOM 0 H LYS A 59 71.527 17.071 -4.651 1.00 0.00 H new ATOM 0 HA LYS A 59 71.731 16.683 -7.491 1.00 0.00 H new ATOM 0 HB2 LYS A 59 72.546 18.688 -6.195 1.00 0.00 H new ATOM 0 HB3 LYS A 59 73.809 17.696 -5.494 1.00 0.00 H new ATOM 0 HG2 LYS A 59 74.689 17.192 -7.792 1.00 0.00 H new ATOM 0 HG3 LYS A 59 73.424 18.182 -8.494 1.00 0.00 H new ATOM 0 HD2 LYS A 59 74.261 20.168 -7.208 1.00 0.00 H new ATOM 0 HD3 LYS A 59 75.522 19.179 -6.496 1.00 0.00 H new ATOM 0 HE2 LYS A 59 76.437 18.695 -8.778 1.00 0.00 H new ATOM 0 HE3 LYS A 59 75.170 19.668 -9.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 77.205 20.950 -9.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 75.972 21.594 -8.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 77.200 20.651 -7.543 1.00 0.00 H new ATOM 1390 N GLU A 60 73.659 14.803 -5.596 1.00 0.00 N ATOM 1391 CA GLU A 60 74.541 13.601 -5.659 1.00 0.00 C ATOM 1392 C GLU A 60 73.683 12.338 -5.669 1.00 0.00 C ATOM 1393 O GLU A 60 74.148 11.274 -6.026 1.00 0.00 O ATOM 1394 CB GLU A 60 75.483 13.580 -4.452 1.00 0.00 C ATOM 1395 CG GLU A 60 76.349 14.841 -4.460 1.00 0.00 C ATOM 1396 CD GLU A 60 77.350 14.767 -5.614 1.00 0.00 C ATOM 1397 OE1 GLU A 60 77.692 13.663 -6.006 1.00 0.00 O ATOM 1398 OE2 GLU A 60 77.761 15.815 -6.085 1.00 0.00 O ATOM 0 H GLU A 60 73.457 15.145 -4.656 1.00 0.00 H new ATOM 0 HA GLU A 60 75.136 13.640 -6.571 1.00 0.00 H new ATOM 0 HB2 GLU A 60 74.907 13.527 -3.528 1.00 0.00 H new ATOM 0 HB3 GLU A 60 76.114 12.692 -4.485 1.00 0.00 H new ATOM 0 HG2 GLU A 60 75.721 15.725 -4.566 1.00 0.00 H new ATOM 0 HG3 GLU A 60 76.878 14.937 -3.512 1.00 0.00 H new ATOM 1405 N LEU A 61 72.420 12.452 -5.291 1.00 0.00 N ATOM 1406 CA LEU A 61 71.544 11.230 -5.303 1.00 0.00 C ATOM 1407 C LEU A 61 70.999 11.099 -6.722 1.00 0.00 C ATOM 1408 O LEU A 61 70.636 10.028 -7.167 1.00 0.00 O ATOM 1409 CB LEU A 61 70.435 11.308 -4.249 1.00 0.00 C ATOM 1410 CG LEU A 61 69.549 10.062 -4.312 1.00 0.00 C ATOM 1411 CD1 LEU A 61 70.369 8.816 -3.953 1.00 0.00 C ATOM 1412 CD2 LEU A 61 68.401 10.230 -3.318 1.00 0.00 C ATOM 0 H LEU A 61 71.972 13.315 -4.983 1.00 0.00 H new ATOM 0 HA LEU A 61 72.114 10.340 -5.035 1.00 0.00 H new ATOM 0 HB2 LEU A 61 70.875 11.399 -3.256 1.00 0.00 H new ATOM 0 HB3 LEU A 61 69.831 12.200 -4.413 1.00 0.00 H new ATOM 0 HG LEU A 61 69.154 9.940 -5.321 1.00 0.00 H new ATOM 0 HD11 LEU A 61 69.730 7.934 -4.000 1.00 0.00 H new ATOM 0 HD12 LEU A 61 71.192 8.706 -4.659 1.00 0.00 H new ATOM 0 HD13 LEU A 61 70.768 8.921 -2.944 1.00 0.00 H new ATOM 0 HD21 LEU A 61 67.760 9.349 -3.351 1.00 0.00 H new ATOM 0 HD22 LEU A 61 68.805 10.348 -2.312 1.00 0.00 H new ATOM 0 HD23 LEU A 61 67.819 11.113 -3.581 1.00 0.00 H new ATOM 1424 N ASP A 62 71.052 12.176 -7.477 1.00 0.00 N ATOM 1425 CA ASP A 62 70.663 12.107 -8.915 1.00 0.00 C ATOM 1426 C ASP A 62 71.973 11.800 -9.619 1.00 0.00 C ATOM 1427 O ASP A 62 72.378 12.395 -10.586 1.00 0.00 O ATOM 1428 CB ASP A 62 70.062 13.418 -9.413 1.00 0.00 C ATOM 1429 CG ASP A 62 69.551 13.217 -10.836 1.00 0.00 C ATOM 1430 OD1 ASP A 62 70.280 12.649 -11.631 1.00 0.00 O ATOM 1431 OD2 ASP A 62 68.436 13.618 -11.104 1.00 0.00 O ATOM 0 H ASP A 62 71.349 13.097 -7.154 1.00 0.00 H new ATOM 0 HA ASP A 62 69.890 11.361 -9.100 1.00 0.00 H new ATOM 0 HB2 ASP A 62 69.247 13.731 -8.760 1.00 0.00 H new ATOM 0 HB3 ASP A 62 70.811 14.209 -9.390 1.00 0.00 H new ATOM 1436 N GLU A 63 72.620 10.863 -9.023 1.00 0.00 N ATOM 1437 CA GLU A 63 73.949 10.386 -9.466 1.00 0.00 C ATOM 1438 C GLU A 63 74.014 10.320 -10.998 1.00 0.00 C ATOM 1439 O GLU A 63 75.082 10.316 -11.577 1.00 0.00 O ATOM 1440 CB GLU A 63 74.168 9.008 -8.869 1.00 0.00 C ATOM 1441 CG GLU A 63 75.599 8.529 -9.141 1.00 0.00 C ATOM 1442 CD GLU A 63 76.596 9.430 -8.408 1.00 0.00 C ATOM 1443 OE1 GLU A 63 76.193 10.076 -7.456 1.00 0.00 O ATOM 1444 OE2 GLU A 63 77.748 9.453 -8.810 1.00 0.00 O ATOM 0 H GLU A 63 72.265 10.378 -8.199 1.00 0.00 H new ATOM 0 HA GLU A 63 74.727 11.073 -9.132 1.00 0.00 H new ATOM 0 HB2 GLU A 63 73.985 9.037 -7.795 1.00 0.00 H new ATOM 0 HB3 GLU A 63 73.454 8.303 -9.295 1.00 0.00 H new ATOM 0 HG2 GLU A 63 75.716 7.497 -8.810 1.00 0.00 H new ATOM 0 HG3 GLU A 63 75.800 8.545 -10.212 1.00 0.00 H new ATOM 1451 N ASN A 64 72.892 10.285 -11.669 1.00 0.00 N ATOM 1452 CA ASN A 64 72.919 10.238 -13.163 1.00 0.00 C ATOM 1453 C ASN A 64 72.969 11.674 -13.686 1.00 0.00 C ATOM 1454 O ASN A 64 73.006 11.925 -14.873 1.00 0.00 O ATOM 1455 CB ASN A 64 71.666 9.527 -13.679 1.00 0.00 C ATOM 1456 CG ASN A 64 71.752 8.040 -13.330 1.00 0.00 C ATOM 1457 OD1 ASN A 64 70.896 7.511 -12.648 1.00 0.00 O ATOM 1458 ND2 ASN A 64 72.760 7.339 -13.772 1.00 0.00 N ATOM 0 H ASN A 64 71.962 10.287 -11.250 1.00 0.00 H new ATOM 0 HA ASN A 64 73.793 9.688 -13.511 1.00 0.00 H new ATOM 0 HB2 ASN A 64 70.774 9.967 -13.233 1.00 0.00 H new ATOM 0 HB3 ASN A 64 71.579 9.655 -14.758 1.00 0.00 H new ATOM 0 HD21 ASN A 64 72.830 6.347 -13.545 1.00 0.00 H new ATOM 0 HD22 ASN A 64 73.478 7.783 -14.344 1.00 0.00 H new ATOM 1465 N GLY A 65 73.004 12.607 -12.781 1.00 0.00 N ATOM 1466 CA GLY A 65 73.091 14.051 -13.157 1.00 0.00 C ATOM 1467 C GLY A 65 71.880 14.496 -13.988 1.00 0.00 C ATOM 1468 O GLY A 65 72.009 15.313 -14.877 1.00 0.00 O ATOM 0 H GLY A 65 72.976 12.431 -11.777 1.00 0.00 H new ATOM 0 HA2 GLY A 65 73.156 14.659 -12.254 1.00 0.00 H new ATOM 0 HA3 GLY A 65 74.005 14.225 -13.725 1.00 0.00 H new ATOM 1472 N ASP A 66 70.706 13.986 -13.710 1.00 0.00 N ATOM 1473 CA ASP A 66 69.496 14.407 -14.499 1.00 0.00 C ATOM 1474 C ASP A 66 68.660 15.425 -13.705 1.00 0.00 C ATOM 1475 O ASP A 66 67.811 16.095 -14.258 1.00 0.00 O ATOM 1476 CB ASP A 66 68.643 13.183 -14.839 1.00 0.00 C ATOM 1477 CG ASP A 66 68.150 12.527 -13.556 1.00 0.00 C ATOM 1478 OD1 ASP A 66 67.138 12.970 -13.049 1.00 0.00 O ATOM 1479 OD2 ASP A 66 68.787 11.590 -13.106 1.00 0.00 O ATOM 0 H ASP A 66 70.529 13.300 -12.976 1.00 0.00 H new ATOM 0 HA ASP A 66 69.831 14.879 -15.423 1.00 0.00 H new ATOM 0 HB2 ASP A 66 67.795 13.479 -15.456 1.00 0.00 H new ATOM 0 HB3 ASP A 66 69.228 12.471 -15.421 1.00 0.00 H new ATOM 1484 N GLY A 67 68.901 15.575 -12.431 1.00 0.00 N ATOM 1485 CA GLY A 67 68.125 16.585 -11.639 1.00 0.00 C ATOM 1486 C GLY A 67 66.772 16.011 -11.198 1.00 0.00 C ATOM 1487 O GLY A 67 66.031 16.638 -10.448 1.00 0.00 O ATOM 0 H GLY A 67 69.596 15.048 -11.903 1.00 0.00 H new ATOM 0 HA2 GLY A 67 68.700 16.886 -10.763 1.00 0.00 H new ATOM 0 HA3 GLY A 67 67.966 17.481 -12.240 1.00 0.00 H new ATOM 1491 N GLU A 68 66.452 14.818 -11.641 1.00 0.00 N ATOM 1492 CA GLU A 68 65.177 14.167 -11.257 1.00 0.00 C ATOM 1493 C GLU A 68 65.525 12.826 -10.616 1.00 0.00 C ATOM 1494 O GLU A 68 66.484 12.176 -10.981 1.00 0.00 O ATOM 1495 CB GLU A 68 64.312 13.989 -12.508 1.00 0.00 C ATOM 1496 CG GLU A 68 63.826 15.365 -12.974 1.00 0.00 C ATOM 1497 CD GLU A 68 63.020 15.222 -14.264 1.00 0.00 C ATOM 1498 OE1 GLU A 68 63.037 14.145 -14.834 1.00 0.00 O ATOM 1499 OE2 GLU A 68 62.397 16.193 -14.660 1.00 0.00 O ATOM 0 H GLU A 68 67.039 14.264 -12.265 1.00 0.00 H new ATOM 0 HA GLU A 68 64.610 14.769 -10.546 1.00 0.00 H new ATOM 0 HB2 GLU A 68 64.886 13.505 -13.298 1.00 0.00 H new ATOM 0 HB3 GLU A 68 63.462 13.343 -12.290 1.00 0.00 H new ATOM 0 HG2 GLU A 68 63.211 15.825 -12.200 1.00 0.00 H new ATOM 0 HG3 GLU A 68 64.678 16.025 -13.138 1.00 0.00 H new ATOM 1506 N VAL A 69 64.786 12.435 -9.626 1.00 0.00 N ATOM 1507 CA VAL A 69 65.093 11.172 -8.903 1.00 0.00 C ATOM 1508 C VAL A 69 64.062 10.104 -9.254 1.00 0.00 C ATOM 1509 O VAL A 69 62.873 10.313 -9.169 1.00 0.00 O ATOM 1510 CB VAL A 69 65.040 11.503 -7.413 1.00 0.00 C ATOM 1511 CG1 VAL A 69 65.343 10.267 -6.559 1.00 0.00 C ATOM 1512 CG2 VAL A 69 66.087 12.574 -7.115 1.00 0.00 C ATOM 0 H VAL A 69 63.971 12.941 -9.279 1.00 0.00 H new ATOM 0 HA VAL A 69 66.072 10.781 -9.180 1.00 0.00 H new ATOM 0 HB VAL A 69 64.037 11.855 -7.169 1.00 0.00 H new ATOM 0 HG11 VAL A 69 65.298 10.534 -5.503 1.00 0.00 H new ATOM 0 HG12 VAL A 69 64.607 9.491 -6.769 1.00 0.00 H new ATOM 0 HG13 VAL A 69 66.340 9.896 -6.797 1.00 0.00 H new ATOM 0 HG21 VAL A 69 66.062 12.822 -6.054 1.00 0.00 H new ATOM 0 HG22 VAL A 69 67.076 12.199 -7.377 1.00 0.00 H new ATOM 0 HG23 VAL A 69 65.871 13.467 -7.701 1.00 0.00 H new ATOM 1522 N ASP A 70 64.515 8.946 -9.640 1.00 0.00 N ATOM 1523 CA ASP A 70 63.560 7.863 -9.980 1.00 0.00 C ATOM 1524 C ASP A 70 63.095 7.223 -8.674 1.00 0.00 C ATOM 1525 O ASP A 70 63.666 7.454 -7.626 1.00 0.00 O ATOM 1526 CB ASP A 70 64.247 6.819 -10.867 1.00 0.00 C ATOM 1527 CG ASP A 70 65.321 6.088 -10.061 1.00 0.00 C ATOM 1528 OD1 ASP A 70 65.695 6.596 -9.019 1.00 0.00 O ATOM 1529 OD2 ASP A 70 65.745 5.030 -10.498 1.00 0.00 O ATOM 0 H ASP A 70 65.502 8.705 -9.734 1.00 0.00 H new ATOM 0 HA ASP A 70 62.707 8.264 -10.528 1.00 0.00 H new ATOM 0 HB2 ASP A 70 63.513 6.107 -11.243 1.00 0.00 H new ATOM 0 HB3 ASP A 70 64.695 7.303 -11.735 1.00 0.00 H new ATOM 1534 N PHE A 71 62.062 6.443 -8.715 1.00 0.00 N ATOM 1535 CA PHE A 71 61.561 5.814 -7.466 1.00 0.00 C ATOM 1536 C PHE A 71 62.641 4.929 -6.823 1.00 0.00 C ATOM 1537 O PHE A 71 62.727 4.841 -5.620 1.00 0.00 O ATOM 1538 CB PHE A 71 60.329 4.965 -7.784 1.00 0.00 C ATOM 1539 CG PHE A 71 60.737 3.770 -8.611 1.00 0.00 C ATOM 1540 CD1 PHE A 71 61.114 2.582 -7.976 1.00 0.00 C ATOM 1541 CD2 PHE A 71 60.734 3.848 -10.008 1.00 0.00 C ATOM 1542 CE1 PHE A 71 61.491 1.471 -8.739 1.00 0.00 C ATOM 1543 CE2 PHE A 71 61.112 2.738 -10.771 1.00 0.00 C ATOM 1544 CZ PHE A 71 61.491 1.549 -10.137 1.00 0.00 C ATOM 0 H PHE A 71 61.539 6.211 -9.560 1.00 0.00 H new ATOM 0 HA PHE A 71 61.299 6.604 -6.762 1.00 0.00 H new ATOM 0 HB2 PHE A 71 59.854 4.635 -6.860 1.00 0.00 H new ATOM 0 HB3 PHE A 71 59.594 5.561 -8.325 1.00 0.00 H new ATOM 0 HD1 PHE A 71 61.114 2.522 -6.898 1.00 0.00 H new ATOM 0 HD2 PHE A 71 60.440 4.765 -10.497 1.00 0.00 H new ATOM 0 HE1 PHE A 71 61.782 0.553 -8.249 1.00 0.00 H new ATOM 0 HE2 PHE A 71 61.111 2.798 -11.849 1.00 0.00 H new ATOM 0 HZ PHE A 71 61.783 0.692 -10.726 1.00 0.00 H new ATOM 1554 N GLN A 72 63.442 4.245 -7.597 1.00 0.00 N ATOM 1555 CA GLN A 72 64.476 3.355 -6.978 1.00 0.00 C ATOM 1556 C GLN A 72 65.465 4.175 -6.125 1.00 0.00 C ATOM 1557 O GLN A 72 65.851 3.767 -5.050 1.00 0.00 O ATOM 1558 CB GLN A 72 65.238 2.602 -8.074 1.00 0.00 C ATOM 1559 CG GLN A 72 66.257 1.658 -7.432 1.00 0.00 C ATOM 1560 CD GLN A 72 66.937 0.820 -8.516 1.00 0.00 C ATOM 1561 OE1 GLN A 72 66.503 0.804 -9.651 1.00 0.00 O ATOM 1562 NE2 GLN A 72 67.998 0.124 -8.213 1.00 0.00 N ATOM 0 H GLN A 72 63.429 4.261 -8.617 1.00 0.00 H new ATOM 0 HA GLN A 72 63.970 2.640 -6.329 1.00 0.00 H new ATOM 0 HB2 GLN A 72 64.541 2.036 -8.692 1.00 0.00 H new ATOM 0 HB3 GLN A 72 65.745 3.309 -8.731 1.00 0.00 H new ATOM 0 HG2 GLN A 72 67.002 2.232 -6.881 1.00 0.00 H new ATOM 0 HG3 GLN A 72 65.761 1.006 -6.713 1.00 0.00 H new ATOM 0 HE21 GLN A 72 68.362 0.138 -7.260 1.00 0.00 H new ATOM 0 HE22 GLN A 72 68.464 -0.434 -8.929 1.00 0.00 H new ATOM 1571 N GLU A 73 65.886 5.316 -6.597 1.00 0.00 N ATOM 1572 CA GLU A 73 66.850 6.147 -5.807 1.00 0.00 C ATOM 1573 C GLU A 73 66.174 6.744 -4.563 1.00 0.00 C ATOM 1574 O GLU A 73 66.766 6.851 -3.507 1.00 0.00 O ATOM 1575 CB GLU A 73 67.346 7.304 -6.681 1.00 0.00 C ATOM 1576 CG GLU A 73 68.298 6.791 -7.765 1.00 0.00 C ATOM 1577 CD GLU A 73 68.625 7.942 -8.722 1.00 0.00 C ATOM 1578 OE1 GLU A 73 68.110 9.028 -8.506 1.00 0.00 O ATOM 1579 OE2 GLU A 73 69.379 7.723 -9.655 1.00 0.00 O ATOM 0 H GLU A 73 65.607 5.712 -7.494 1.00 0.00 H new ATOM 0 HA GLU A 73 67.675 5.507 -5.494 1.00 0.00 H new ATOM 0 HB2 GLU A 73 66.497 7.807 -7.144 1.00 0.00 H new ATOM 0 HB3 GLU A 73 67.855 8.042 -6.062 1.00 0.00 H new ATOM 0 HG2 GLU A 73 69.212 6.405 -7.313 1.00 0.00 H new ATOM 0 HG3 GLU A 73 67.839 5.966 -8.310 1.00 0.00 H new ATOM 1586 N PHE A 74 64.955 7.179 -4.708 1.00 0.00 N ATOM 1587 CA PHE A 74 64.222 7.835 -3.580 1.00 0.00 C ATOM 1588 C PHE A 74 63.906 6.870 -2.428 1.00 0.00 C ATOM 1589 O PHE A 74 63.986 7.227 -1.275 1.00 0.00 O ATOM 1590 CB PHE A 74 62.914 8.393 -4.144 1.00 0.00 C ATOM 1591 CG PHE A 74 62.109 9.033 -3.046 1.00 0.00 C ATOM 1592 CD1 PHE A 74 62.280 10.388 -2.755 1.00 0.00 C ATOM 1593 CD2 PHE A 74 61.182 8.269 -2.329 1.00 0.00 C ATOM 1594 CE1 PHE A 74 61.522 10.986 -1.742 1.00 0.00 C ATOM 1595 CE2 PHE A 74 60.424 8.865 -1.315 1.00 0.00 C ATOM 1596 CZ PHE A 74 60.594 10.223 -1.021 1.00 0.00 C ATOM 0 H PHE A 74 64.422 7.108 -5.575 1.00 0.00 H new ATOM 0 HA PHE A 74 64.858 8.617 -3.165 1.00 0.00 H new ATOM 0 HB2 PHE A 74 63.128 9.125 -4.923 1.00 0.00 H new ATOM 0 HB3 PHE A 74 62.338 7.592 -4.608 1.00 0.00 H new ATOM 0 HD1 PHE A 74 62.997 10.974 -3.311 1.00 0.00 H new ATOM 0 HD2 PHE A 74 61.052 7.222 -2.558 1.00 0.00 H new ATOM 0 HE1 PHE A 74 61.652 12.034 -1.516 1.00 0.00 H new ATOM 0 HE2 PHE A 74 59.708 8.277 -0.759 1.00 0.00 H new ATOM 0 HZ PHE A 74 60.009 10.683 -0.238 1.00 0.00 H new ATOM 1606 N VAL A 75 63.532 5.672 -2.737 1.00 0.00 N ATOM 1607 CA VAL A 75 63.181 4.681 -1.674 1.00 0.00 C ATOM 1608 C VAL A 75 64.441 4.150 -0.978 1.00 0.00 C ATOM 1609 O VAL A 75 64.417 3.787 0.183 1.00 0.00 O ATOM 1610 CB VAL A 75 62.429 3.514 -2.321 1.00 0.00 C ATOM 1611 CG1 VAL A 75 63.381 2.681 -3.177 1.00 0.00 C ATOM 1612 CG2 VAL A 75 61.818 2.635 -1.226 1.00 0.00 C ATOM 0 H VAL A 75 63.450 5.322 -3.692 1.00 0.00 H new ATOM 0 HA VAL A 75 62.559 5.171 -0.925 1.00 0.00 H new ATOM 0 HB VAL A 75 61.638 3.909 -2.959 1.00 0.00 H new ATOM 0 HG11 VAL A 75 62.834 1.855 -3.631 1.00 0.00 H new ATOM 0 HG12 VAL A 75 63.808 3.307 -3.960 1.00 0.00 H new ATOM 0 HG13 VAL A 75 64.181 2.286 -2.551 1.00 0.00 H new ATOM 0 HG21 VAL A 75 61.282 1.804 -1.684 1.00 0.00 H new ATOM 0 HG22 VAL A 75 62.611 2.247 -0.586 1.00 0.00 H new ATOM 0 HG23 VAL A 75 61.126 3.228 -0.628 1.00 0.00 H new ATOM 1622 N VAL A 76 65.521 4.060 -1.692 1.00 0.00 N ATOM 1623 CA VAL A 76 66.771 3.505 -1.098 1.00 0.00 C ATOM 1624 C VAL A 76 67.382 4.456 -0.055 1.00 0.00 C ATOM 1625 O VAL A 76 67.613 4.076 1.076 1.00 0.00 O ATOM 1626 CB VAL A 76 67.777 3.267 -2.231 1.00 0.00 C ATOM 1627 CG1 VAL A 76 69.156 2.929 -1.658 1.00 0.00 C ATOM 1628 CG2 VAL A 76 67.292 2.104 -3.101 1.00 0.00 C ATOM 0 H VAL A 76 65.597 4.347 -2.668 1.00 0.00 H new ATOM 0 HA VAL A 76 66.531 2.573 -0.586 1.00 0.00 H new ATOM 0 HB VAL A 76 67.856 4.174 -2.830 1.00 0.00 H new ATOM 0 HG11 VAL A 76 69.859 2.763 -2.475 1.00 0.00 H new ATOM 0 HG12 VAL A 76 69.506 3.756 -1.041 1.00 0.00 H new ATOM 0 HG13 VAL A 76 69.086 2.027 -1.050 1.00 0.00 H new ATOM 0 HG21 VAL A 76 68.004 1.931 -3.908 1.00 0.00 H new ATOM 0 HG22 VAL A 76 67.209 1.204 -2.492 1.00 0.00 H new ATOM 0 HG23 VAL A 76 66.317 2.348 -3.524 1.00 0.00 H new ATOM 1638 N LEU A 77 67.711 5.656 -0.439 1.00 0.00 N ATOM 1639 CA LEU A 77 68.381 6.586 0.524 1.00 0.00 C ATOM 1640 C LEU A 77 67.459 7.040 1.663 1.00 0.00 C ATOM 1641 O LEU A 77 67.888 7.175 2.793 1.00 0.00 O ATOM 1642 CB LEU A 77 68.900 7.810 -0.240 1.00 0.00 C ATOM 1643 CG LEU A 77 69.606 8.802 0.731 1.00 0.00 C ATOM 1644 CD1 LEU A 77 70.861 9.381 0.070 1.00 0.00 C ATOM 1645 CD2 LEU A 77 68.661 9.963 1.086 1.00 0.00 C ATOM 0 H LEU A 77 67.548 6.036 -1.371 1.00 0.00 H new ATOM 0 HA LEU A 77 69.203 6.039 0.986 1.00 0.00 H new ATOM 0 HB2 LEU A 77 69.597 7.493 -1.015 1.00 0.00 H new ATOM 0 HB3 LEU A 77 68.072 8.311 -0.742 1.00 0.00 H new ATOM 0 HG LEU A 77 69.879 8.258 1.635 1.00 0.00 H new ATOM 0 HD11 LEU A 77 71.348 10.073 0.757 1.00 0.00 H new ATOM 0 HD12 LEU A 77 71.548 8.572 -0.177 1.00 0.00 H new ATOM 0 HD13 LEU A 77 70.581 9.910 -0.841 1.00 0.00 H new ATOM 0 HD21 LEU A 77 69.167 10.649 1.765 1.00 0.00 H new ATOM 0 HD22 LEU A 77 68.380 10.494 0.177 1.00 0.00 H new ATOM 0 HD23 LEU A 77 67.766 9.569 1.568 1.00 0.00 H new ATOM 1657 N VAL A 78 66.224 7.314 1.385 1.00 0.00 N ATOM 1658 CA VAL A 78 65.303 7.800 2.459 1.00 0.00 C ATOM 1659 C VAL A 78 65.064 6.706 3.505 1.00 0.00 C ATOM 1660 O VAL A 78 64.965 6.966 4.688 1.00 0.00 O ATOM 1661 CB VAL A 78 63.963 8.177 1.824 1.00 0.00 C ATOM 1662 CG1 VAL A 78 64.186 9.178 0.680 1.00 0.00 C ATOM 1663 CG2 VAL A 78 63.285 6.908 1.289 1.00 0.00 C ATOM 0 H VAL A 78 65.803 7.225 0.460 1.00 0.00 H new ATOM 0 HA VAL A 78 65.756 8.662 2.949 1.00 0.00 H new ATOM 0 HB VAL A 78 63.323 8.643 2.573 1.00 0.00 H new ATOM 0 HG11 VAL A 78 63.227 9.440 0.234 1.00 0.00 H new ATOM 0 HG12 VAL A 78 64.663 10.077 1.071 1.00 0.00 H new ATOM 0 HG13 VAL A 78 64.827 8.728 -0.078 1.00 0.00 H new ATOM 0 HG21 VAL A 78 62.329 7.170 0.835 1.00 0.00 H new ATOM 0 HG22 VAL A 78 63.926 6.441 0.541 1.00 0.00 H new ATOM 0 HG23 VAL A 78 63.118 6.211 2.110 1.00 0.00 H new ATOM 1673 N ALA A 79 64.950 5.491 3.065 1.00 0.00 N ATOM 1674 CA ALA A 79 64.690 4.364 4.012 1.00 0.00 C ATOM 1675 C ALA A 79 65.959 4.003 4.797 1.00 0.00 C ATOM 1676 O ALA A 79 65.883 3.518 5.908 1.00 0.00 O ATOM 1677 CB ALA A 79 64.181 3.142 3.247 1.00 0.00 C ATOM 0 H ALA A 79 65.025 5.221 2.084 1.00 0.00 H new ATOM 0 HA ALA A 79 63.928 4.684 4.723 1.00 0.00 H new ATOM 0 HB1 ALA A 79 63.995 2.327 3.946 1.00 0.00 H new ATOM 0 HB2 ALA A 79 63.255 3.396 2.730 1.00 0.00 H new ATOM 0 HB3 ALA A 79 64.930 2.831 2.518 1.00 0.00 H new ATOM 1683 N ALA A 80 67.122 4.241 4.255 1.00 0.00 N ATOM 1684 CA ALA A 80 68.361 3.909 5.021 1.00 0.00 C ATOM 1685 C ALA A 80 68.406 4.790 6.275 1.00 0.00 C ATOM 1686 O ALA A 80 68.588 4.321 7.372 1.00 0.00 O ATOM 1687 CB ALA A 80 69.608 4.167 4.142 1.00 0.00 C ATOM 0 H ALA A 80 67.270 4.644 3.330 1.00 0.00 H new ATOM 0 HA ALA A 80 68.355 2.857 5.308 1.00 0.00 H new ATOM 0 HB1 ALA A 80 70.508 3.923 4.707 1.00 0.00 H new ATOM 0 HB2 ALA A 80 69.559 3.543 3.249 1.00 0.00 H new ATOM 0 HB3 ALA A 80 69.636 5.217 3.850 1.00 0.00 H new ATOM 1693 N LEU A 81 68.245 6.069 6.096 1.00 0.00 N ATOM 1694 CA LEU A 81 68.282 7.019 7.245 1.00 0.00 C ATOM 1695 C LEU A 81 67.104 6.752 8.192 1.00 0.00 C ATOM 1696 O LEU A 81 67.200 6.941 9.381 1.00 0.00 O ATOM 1697 CB LEU A 81 68.175 8.447 6.702 1.00 0.00 C ATOM 1698 CG LEU A 81 69.343 8.745 5.750 1.00 0.00 C ATOM 1699 CD1 LEU A 81 69.038 10.022 4.965 1.00 0.00 C ATOM 1700 CD2 LEU A 81 70.643 8.942 6.541 1.00 0.00 C ATOM 0 H LEU A 81 68.087 6.506 5.188 1.00 0.00 H new ATOM 0 HA LEU A 81 69.214 6.888 7.794 1.00 0.00 H new ATOM 0 HB2 LEU A 81 67.228 8.574 6.177 1.00 0.00 H new ATOM 0 HB3 LEU A 81 68.180 9.158 7.528 1.00 0.00 H new ATOM 0 HG LEU A 81 69.466 7.903 5.069 1.00 0.00 H new ATOM 0 HD11 LEU A 81 69.864 10.239 4.287 1.00 0.00 H new ATOM 0 HD12 LEU A 81 68.123 9.885 4.389 1.00 0.00 H new ATOM 0 HD13 LEU A 81 68.910 10.853 5.658 1.00 0.00 H new ATOM 0 HD21 LEU A 81 71.460 9.152 5.851 1.00 0.00 H new ATOM 0 HD22 LEU A 81 70.526 9.778 7.231 1.00 0.00 H new ATOM 0 HD23 LEU A 81 70.867 8.036 7.104 1.00 0.00 H new ATOM 1712 N THR A 82 65.985 6.368 7.658 1.00 0.00 N ATOM 1713 CA THR A 82 64.783 6.132 8.518 1.00 0.00 C ATOM 1714 C THR A 82 65.045 5.029 9.562 1.00 0.00 C ATOM 1715 O THR A 82 64.874 5.227 10.753 1.00 0.00 O ATOM 1716 CB THR A 82 63.611 5.708 7.627 1.00 0.00 C ATOM 1717 OG1 THR A 82 63.277 6.769 6.744 1.00 0.00 O ATOM 1718 CG2 THR A 82 62.391 5.351 8.487 1.00 0.00 C ATOM 0 H THR A 82 65.843 6.205 6.661 1.00 0.00 H new ATOM 0 HA THR A 82 64.553 7.056 9.048 1.00 0.00 H new ATOM 0 HB THR A 82 63.905 4.831 7.050 1.00 0.00 H new ATOM 0 HG1 THR A 82 63.788 6.676 5.913 1.00 0.00 H new ATOM 0 HG21 THR A 82 61.566 5.052 7.841 1.00 0.00 H new ATOM 0 HG22 THR A 82 62.645 4.529 9.156 1.00 0.00 H new ATOM 0 HG23 THR A 82 62.094 6.219 9.076 1.00 0.00 H new ATOM 1726 N VAL A 83 65.453 3.872 9.124 1.00 0.00 N ATOM 1727 CA VAL A 83 65.714 2.743 10.070 1.00 0.00 C ATOM 1728 C VAL A 83 66.997 2.978 10.854 1.00 0.00 C ATOM 1729 O VAL A 83 67.101 2.676 12.027 1.00 0.00 O ATOM 1730 CB VAL A 83 65.882 1.458 9.273 1.00 0.00 C ATOM 1731 CG1 VAL A 83 66.058 0.286 10.231 1.00 0.00 C ATOM 1732 CG2 VAL A 83 64.653 1.234 8.409 1.00 0.00 C ATOM 0 H VAL A 83 65.620 3.654 8.142 1.00 0.00 H new ATOM 0 HA VAL A 83 64.874 2.673 10.761 1.00 0.00 H new ATOM 0 HB VAL A 83 66.762 1.537 8.634 1.00 0.00 H new ATOM 0 HG11 VAL A 83 66.178 -0.635 9.661 1.00 0.00 H new ATOM 0 HG12 VAL A 83 66.942 0.449 10.847 1.00 0.00 H new ATOM 0 HG13 VAL A 83 65.180 0.204 10.871 1.00 0.00 H new ATOM 0 HG21 VAL A 83 64.773 0.313 7.838 1.00 0.00 H new ATOM 0 HG22 VAL A 83 63.771 1.155 9.045 1.00 0.00 H new ATOM 0 HG23 VAL A 83 64.532 2.073 7.724 1.00 0.00 H new ATOM 1742 N ALA A 84 67.980 3.486 10.189 1.00 0.00 N ATOM 1743 CA ALA A 84 69.289 3.719 10.838 1.00 0.00 C ATOM 1744 C ALA A 84 69.131 4.682 12.015 1.00 0.00 C ATOM 1745 O ALA A 84 69.744 4.521 13.050 1.00 0.00 O ATOM 1746 CB ALA A 84 70.270 4.316 9.823 1.00 0.00 C ATOM 0 H ALA A 84 67.934 3.755 9.206 1.00 0.00 H new ATOM 0 HA ALA A 84 69.673 2.767 11.204 1.00 0.00 H new ATOM 0 HB1 ALA A 84 71.233 4.486 10.304 1.00 0.00 H new ATOM 0 HB2 ALA A 84 70.398 3.624 8.990 1.00 0.00 H new ATOM 0 HB3 ALA A 84 69.878 5.263 9.451 1.00 0.00 H new ATOM 1752 N CYS A 85 68.308 5.678 11.864 1.00 0.00 N ATOM 1753 CA CYS A 85 68.098 6.655 12.966 1.00 0.00 C ATOM 1754 C CYS A 85 67.492 5.944 14.177 1.00 0.00 C ATOM 1755 O CYS A 85 67.840 6.220 15.305 1.00 0.00 O ATOM 1756 CB CYS A 85 67.147 7.758 12.501 1.00 0.00 C ATOM 1757 SG CYS A 85 66.898 8.941 13.848 1.00 0.00 S ATOM 0 H CYS A 85 67.767 5.859 11.018 1.00 0.00 H new ATOM 0 HA CYS A 85 69.057 7.093 13.243 1.00 0.00 H new ATOM 0 HB2 CYS A 85 67.559 8.265 11.628 1.00 0.00 H new ATOM 0 HB3 CYS A 85 66.192 7.327 12.199 1.00 0.00 H new ATOM 0 HG CYS A 85 66.831 10.145 13.362 1.00 0.00 H new ATOM 1763 N ASN A 86 66.574 5.040 13.951 1.00 0.00 N ATOM 1764 CA ASN A 86 65.934 4.322 15.096 1.00 0.00 C ATOM 1765 C ASN A 86 66.985 3.562 15.909 1.00 0.00 C ATOM 1766 O ASN A 86 66.926 3.521 17.122 1.00 0.00 O ATOM 1767 CB ASN A 86 64.903 3.328 14.557 1.00 0.00 C ATOM 1768 CG ASN A 86 64.243 2.590 15.726 1.00 0.00 C ATOM 1769 OD1 ASN A 86 64.196 1.377 15.742 1.00 0.00 O ATOM 1770 ND2 ASN A 86 63.730 3.273 16.713 1.00 0.00 N ATOM 0 H ASN A 86 66.240 4.768 13.026 1.00 0.00 H new ATOM 0 HA ASN A 86 65.449 5.054 15.741 1.00 0.00 H new ATOM 0 HB2 ASN A 86 64.148 3.853 13.972 1.00 0.00 H new ATOM 0 HB3 ASN A 86 65.385 2.615 13.889 1.00 0.00 H new ATOM 0 HD21 ASN A 86 63.291 2.787 17.495 1.00 0.00 H new ATOM 0 HD22 ASN A 86 63.768 4.292 16.702 1.00 0.00 H new ATOM 1777 N ASN A 87 67.935 2.946 15.263 1.00 0.00 N ATOM 1778 CA ASN A 87 68.968 2.182 16.023 1.00 0.00 C ATOM 1779 C ASN A 87 69.730 3.114 16.971 1.00 0.00 C ATOM 1780 O ASN A 87 70.003 2.771 18.104 1.00 0.00 O ATOM 1781 CB ASN A 87 69.947 1.541 15.038 1.00 0.00 C ATOM 1782 CG ASN A 87 69.241 0.414 14.280 1.00 0.00 C ATOM 1783 OD1 ASN A 87 68.319 -0.190 14.791 1.00 0.00 O ATOM 1784 ND2 ASN A 87 69.636 0.107 13.075 1.00 0.00 N ATOM 0 H ASN A 87 68.042 2.937 14.249 1.00 0.00 H new ATOM 0 HA ASN A 87 68.476 1.408 16.613 1.00 0.00 H new ATOM 0 HB2 ASN A 87 70.317 2.289 14.337 1.00 0.00 H new ATOM 0 HB3 ASN A 87 70.813 1.149 15.572 1.00 0.00 H new ATOM 0 HD21 ASN A 87 69.171 -0.641 12.561 1.00 0.00 H new ATOM 0 HD22 ASN A 87 70.410 0.615 12.647 1.00 0.00 H new ATOM 1905 N SER B 2 48.813 10.321 6.119 1.00 0.00 N ATOM 1906 CA SER B 2 49.215 9.439 7.263 1.00 0.00 C ATOM 1907 C SER B 2 49.569 8.046 6.728 1.00 0.00 C ATOM 1908 O SER B 2 49.918 7.154 7.475 1.00 0.00 O ATOM 1909 CB SER B 2 48.051 9.324 8.250 1.00 0.00 C ATOM 1910 OG SER B 2 46.927 8.760 7.589 1.00 0.00 O ATOM 0 HA SER B 2 50.080 9.867 7.769 1.00 0.00 H new ATOM 0 HB2 SER B 2 48.338 8.702 9.098 1.00 0.00 H new ATOM 0 HB3 SER B 2 47.798 10.307 8.647 1.00 0.00 H new ATOM 0 HG SER B 2 46.906 9.068 6.659 1.00 0.00 H new ATOM 1916 N GLU B 3 49.462 7.851 5.441 1.00 0.00 N ATOM 1917 CA GLU B 3 49.771 6.512 4.856 1.00 0.00 C ATOM 1918 C GLU B 3 51.246 6.163 5.064 1.00 0.00 C ATOM 1919 O GLU B 3 51.584 5.097 5.524 1.00 0.00 O ATOM 1920 CB GLU B 3 49.489 6.550 3.352 1.00 0.00 C ATOM 1921 CG GLU B 3 47.980 6.654 3.103 1.00 0.00 C ATOM 1922 CD GLU B 3 47.506 8.081 3.393 1.00 0.00 C ATOM 1923 OE1 GLU B 3 48.350 8.940 3.590 1.00 0.00 O ATOM 1924 OE2 GLU B 3 46.304 8.289 3.424 1.00 0.00 O ATOM 0 H GLU B 3 49.174 8.561 4.768 1.00 0.00 H new ATOM 0 HA GLU B 3 49.151 5.762 5.348 1.00 0.00 H new ATOM 0 HB2 GLU B 3 50.000 7.400 2.899 1.00 0.00 H new ATOM 0 HB3 GLU B 3 49.883 5.651 2.877 1.00 0.00 H new ATOM 0 HG2 GLU B 3 47.753 6.388 2.071 1.00 0.00 H new ATOM 0 HG3 GLU B 3 47.447 5.947 3.739 1.00 0.00 H new ATOM 1931 N LEU B 4 52.116 7.041 4.668 1.00 0.00 N ATOM 1932 CA LEU B 4 53.578 6.754 4.773 1.00 0.00 C ATOM 1933 C LEU B 4 53.969 6.506 6.237 1.00 0.00 C ATOM 1934 O LEU B 4 54.757 5.630 6.535 1.00 0.00 O ATOM 1935 CB LEU B 4 54.363 7.930 4.180 1.00 0.00 C ATOM 1936 CG LEU B 4 55.883 7.694 4.258 1.00 0.00 C ATOM 1937 CD1 LEU B 4 56.245 6.295 3.742 1.00 0.00 C ATOM 1938 CD2 LEU B 4 56.576 8.725 3.372 1.00 0.00 C ATOM 0 H LEU B 4 51.882 7.952 4.273 1.00 0.00 H new ATOM 0 HA LEU B 4 53.818 5.851 4.211 1.00 0.00 H new ATOM 0 HB2 LEU B 4 54.070 8.077 3.140 1.00 0.00 H new ATOM 0 HB3 LEU B 4 54.108 8.845 4.715 1.00 0.00 H new ATOM 0 HG LEU B 4 56.202 7.783 5.297 1.00 0.00 H new ATOM 0 HD11 LEU B 4 57.324 6.151 3.807 1.00 0.00 H new ATOM 0 HD12 LEU B 4 55.741 5.542 4.348 1.00 0.00 H new ATOM 0 HD13 LEU B 4 55.928 6.197 2.704 1.00 0.00 H new ATOM 0 HD21 LEU B 4 57.655 8.574 3.414 1.00 0.00 H new ATOM 0 HD22 LEU B 4 56.233 8.610 2.344 1.00 0.00 H new ATOM 0 HD23 LEU B 4 56.336 9.728 3.725 1.00 0.00 H new ATOM 1950 N GLU B 5 53.414 7.248 7.149 1.00 0.00 N ATOM 1951 CA GLU B 5 53.738 7.036 8.592 1.00 0.00 C ATOM 1952 C GLU B 5 53.483 5.572 8.957 1.00 0.00 C ATOM 1953 O GLU B 5 54.304 4.900 9.559 1.00 0.00 O ATOM 1954 CB GLU B 5 52.787 7.907 9.422 1.00 0.00 C ATOM 1955 CG GLU B 5 53.119 7.768 10.912 1.00 0.00 C ATOM 1956 CD GLU B 5 52.167 8.639 11.730 1.00 0.00 C ATOM 1957 OE1 GLU B 5 51.451 9.425 11.131 1.00 0.00 O ATOM 1958 OE2 GLU B 5 52.167 8.505 12.943 1.00 0.00 O ATOM 0 H GLU B 5 52.747 7.996 6.961 1.00 0.00 H new ATOM 0 HA GLU B 5 54.780 7.292 8.785 1.00 0.00 H new ATOM 0 HB2 GLU B 5 52.875 8.950 9.117 1.00 0.00 H new ATOM 0 HB3 GLU B 5 51.755 7.608 9.241 1.00 0.00 H new ATOM 0 HG2 GLU B 5 53.030 6.726 11.219 1.00 0.00 H new ATOM 0 HG3 GLU B 5 54.151 8.068 11.095 1.00 0.00 H new ATOM 1965 N THR B 6 52.336 5.083 8.593 1.00 0.00 N ATOM 1966 CA THR B 6 51.977 3.679 8.906 1.00 0.00 C ATOM 1967 C THR B 6 52.907 2.716 8.182 1.00 0.00 C ATOM 1968 O THR B 6 53.157 1.630 8.645 1.00 0.00 O ATOM 1969 CB THR B 6 50.552 3.413 8.438 1.00 0.00 C ATOM 1970 OG1 THR B 6 50.432 3.771 7.073 1.00 0.00 O ATOM 1971 CG2 THR B 6 49.573 4.233 9.276 1.00 0.00 C ATOM 0 H THR B 6 51.622 5.605 8.085 1.00 0.00 H new ATOM 0 HA THR B 6 52.066 3.528 9.982 1.00 0.00 H new ATOM 0 HB THR B 6 50.322 2.354 8.557 1.00 0.00 H new ATOM 0 HG1 THR B 6 51.214 4.296 6.803 1.00 0.00 H new ATOM 0 HG21 THR B 6 48.555 4.040 8.938 1.00 0.00 H new ATOM 0 HG22 THR B 6 49.667 3.951 10.325 1.00 0.00 H new ATOM 0 HG23 THR B 6 49.798 5.294 9.164 1.00 0.00 H new ATOM 1979 N ALA B 7 53.362 3.077 7.019 1.00 0.00 N ATOM 1980 CA ALA B 7 54.215 2.141 6.234 1.00 0.00 C ATOM 1981 C ALA B 7 55.434 1.707 7.061 1.00 0.00 C ATOM 1982 O ALA B 7 55.741 0.550 7.165 1.00 0.00 O ATOM 1983 CB ALA B 7 54.674 2.838 4.952 1.00 0.00 C ATOM 0 H ALA B 7 53.182 3.978 6.576 1.00 0.00 H new ATOM 0 HA ALA B 7 53.637 1.252 5.982 1.00 0.00 H new ATOM 0 HB1 ALA B 7 55.299 2.159 4.372 1.00 0.00 H new ATOM 0 HB2 ALA B 7 53.803 3.123 4.361 1.00 0.00 H new ATOM 0 HB3 ALA B 7 55.247 3.729 5.208 1.00 0.00 H new ATOM 1989 N MET B 8 56.127 2.642 7.657 1.00 0.00 N ATOM 1990 CA MET B 8 57.322 2.290 8.478 1.00 0.00 C ATOM 1991 C MET B 8 56.893 1.366 9.617 1.00 0.00 C ATOM 1992 O MET B 8 57.578 0.422 9.960 1.00 0.00 O ATOM 1993 CB MET B 8 57.929 3.567 9.069 1.00 0.00 C ATOM 1994 CG MET B 8 59.122 3.207 9.957 1.00 0.00 C ATOM 1995 SD MET B 8 60.027 4.716 10.391 1.00 0.00 S ATOM 1996 CE MET B 8 60.458 4.263 12.091 1.00 0.00 C ATOM 0 H MET B 8 55.915 3.639 7.610 1.00 0.00 H new ATOM 0 HA MET B 8 58.061 1.789 7.852 1.00 0.00 H new ATOM 0 HB2 MET B 8 58.248 4.234 8.268 1.00 0.00 H new ATOM 0 HB3 MET B 8 57.179 4.103 9.651 1.00 0.00 H new ATOM 0 HG2 MET B 8 58.778 2.704 10.861 1.00 0.00 H new ATOM 0 HG3 MET B 8 59.781 2.512 9.436 1.00 0.00 H new ATOM 0 HE1 MET B 8 61.029 5.071 12.549 1.00 0.00 H new ATOM 0 HE2 MET B 8 59.547 4.092 12.664 1.00 0.00 H new ATOM 0 HE3 MET B 8 61.058 3.353 12.084 1.00 0.00 H new ATOM 2006 N GLU B 9 55.764 1.636 10.203 1.00 0.00 N ATOM 2007 CA GLU B 9 55.268 0.781 11.322 1.00 0.00 C ATOM 2008 C GLU B 9 55.075 -0.656 10.840 1.00 0.00 C ATOM 2009 O GLU B 9 55.328 -1.604 11.552 1.00 0.00 O ATOM 2010 CB GLU B 9 53.924 1.325 11.820 1.00 0.00 C ATOM 2011 CG GLU B 9 53.498 0.590 13.099 1.00 0.00 C ATOM 2012 CD GLU B 9 52.950 -0.801 12.753 1.00 0.00 C ATOM 2013 OE1 GLU B 9 52.570 -1.003 11.612 1.00 0.00 O ATOM 2014 OE2 GLU B 9 52.920 -1.640 13.639 1.00 0.00 O ATOM 0 H GLU B 9 55.156 2.417 9.956 1.00 0.00 H new ATOM 0 HA GLU B 9 56.000 0.795 12.130 1.00 0.00 H new ATOM 0 HB2 GLU B 9 54.006 2.394 12.016 1.00 0.00 H new ATOM 0 HB3 GLU B 9 53.164 1.199 11.049 1.00 0.00 H new ATOM 0 HG2 GLU B 9 54.349 0.496 13.774 1.00 0.00 H new ATOM 0 HG3 GLU B 9 52.737 1.168 13.623 1.00 0.00 H new ATOM 2021 N THR B 10 54.570 -0.813 9.653 1.00 0.00 N ATOM 2022 CA THR B 10 54.289 -2.170 9.120 1.00 0.00 C ATOM 2023 C THR B 10 55.580 -2.936 8.797 1.00 0.00 C ATOM 2024 O THR B 10 55.722 -4.097 9.123 1.00 0.00 O ATOM 2025 CB THR B 10 53.469 -2.011 7.841 1.00 0.00 C ATOM 2026 OG1 THR B 10 54.090 -1.060 6.993 1.00 0.00 O ATOM 2027 CG2 THR B 10 52.052 -1.541 8.180 1.00 0.00 C ATOM 0 H THR B 10 54.337 -0.048 9.020 1.00 0.00 H new ATOM 0 HA THR B 10 53.748 -2.740 9.876 1.00 0.00 H new ATOM 0 HB THR B 10 53.415 -2.974 7.334 1.00 0.00 H new ATOM 0 HG1 THR B 10 54.878 -0.688 7.441 1.00 0.00 H new ATOM 0 HG21 THR B 10 51.476 -1.431 7.261 1.00 0.00 H new ATOM 0 HG22 THR B 10 51.570 -2.275 8.825 1.00 0.00 H new ATOM 0 HG23 THR B 10 52.100 -0.582 8.695 1.00 0.00 H new ATOM 2035 N LEU B 11 56.502 -2.296 8.131 1.00 0.00 N ATOM 2036 CA LEU B 11 57.780 -2.962 7.738 1.00 0.00 C ATOM 2037 C LEU B 11 58.545 -3.445 8.972 1.00 0.00 C ATOM 2038 O LEU B 11 59.163 -4.488 8.961 1.00 0.00 O ATOM 2039 CB LEU B 11 58.675 -1.935 7.030 1.00 0.00 C ATOM 2040 CG LEU B 11 57.994 -1.389 5.767 1.00 0.00 C ATOM 2041 CD1 LEU B 11 58.803 -0.190 5.251 1.00 0.00 C ATOM 2042 CD2 LEU B 11 57.913 -2.483 4.673 1.00 0.00 C ATOM 0 H LEU B 11 56.423 -1.323 7.837 1.00 0.00 H new ATOM 0 HA LEU B 11 57.539 -3.808 7.094 1.00 0.00 H new ATOM 0 HB2 LEU B 11 58.900 -1.113 7.710 1.00 0.00 H new ATOM 0 HB3 LEU B 11 59.625 -2.398 6.764 1.00 0.00 H new ATOM 0 HG LEU B 11 56.978 -1.078 6.010 1.00 0.00 H new ATOM 0 HD11 LEU B 11 58.330 0.208 4.353 1.00 0.00 H new ATOM 0 HD12 LEU B 11 58.836 0.584 6.018 1.00 0.00 H new ATOM 0 HD13 LEU B 11 59.818 -0.510 5.015 1.00 0.00 H new ATOM 0 HD21 LEU B 11 57.427 -2.076 3.786 1.00 0.00 H new ATOM 0 HD22 LEU B 11 58.919 -2.815 4.415 1.00 0.00 H new ATOM 0 HD23 LEU B 11 57.336 -3.329 5.046 1.00 0.00 H new ATOM 2054 N ILE B 12 58.555 -2.663 10.013 1.00 0.00 N ATOM 2055 CA ILE B 12 59.320 -3.037 11.239 1.00 0.00 C ATOM 2056 C ILE B 12 58.527 -4.030 12.105 1.00 0.00 C ATOM 2057 O ILE B 12 59.099 -4.852 12.784 1.00 0.00 O ATOM 2058 CB ILE B 12 59.660 -1.766 12.016 1.00 0.00 C ATOM 2059 CG1 ILE B 12 60.406 -0.807 11.074 1.00 0.00 C ATOM 2060 CG2 ILE B 12 60.547 -2.120 13.210 1.00 0.00 C ATOM 2061 CD1 ILE B 12 60.641 0.531 11.767 1.00 0.00 C ATOM 0 H ILE B 12 58.062 -1.772 10.070 1.00 0.00 H new ATOM 0 HA ILE B 12 60.244 -3.538 10.952 1.00 0.00 H new ATOM 0 HB ILE B 12 58.750 -1.291 12.383 1.00 0.00 H new ATOM 0 HG12 ILE B 12 61.359 -1.244 10.778 1.00 0.00 H new ATOM 0 HG13 ILE B 12 59.827 -0.657 10.163 1.00 0.00 H new ATOM 0 HG21 ILE B 12 60.790 -1.213 13.764 1.00 0.00 H new ATOM 0 HG22 ILE B 12 60.018 -2.814 13.863 1.00 0.00 H new ATOM 0 HG23 ILE B 12 61.467 -2.585 12.855 1.00 0.00 H new ATOM 0 HD11 ILE B 12 61.170 1.203 11.091 1.00 0.00 H new ATOM 0 HD12 ILE B 12 59.683 0.972 12.041 1.00 0.00 H new ATOM 0 HD13 ILE B 12 61.239 0.376 12.665 1.00 0.00 H new ATOM 2073 N ASN B 13 57.237 -3.952 12.115 1.00 0.00 N ATOM 2074 CA ASN B 13 56.460 -4.902 12.960 1.00 0.00 C ATOM 2075 C ASN B 13 56.765 -6.327 12.496 1.00 0.00 C ATOM 2076 O ASN B 13 56.901 -7.248 13.278 1.00 0.00 O ATOM 2077 CB ASN B 13 54.962 -4.626 12.809 1.00 0.00 C ATOM 2078 CG ASN B 13 54.172 -5.606 13.681 1.00 0.00 C ATOM 2079 OD1 ASN B 13 53.770 -6.657 13.226 1.00 0.00 O ATOM 2080 ND2 ASN B 13 53.934 -5.302 14.930 1.00 0.00 N ATOM 0 H ASN B 13 56.683 -3.281 11.583 1.00 0.00 H new ATOM 0 HA ASN B 13 56.738 -4.779 14.007 1.00 0.00 H new ATOM 0 HB2 ASN B 13 54.739 -3.600 13.102 1.00 0.00 H new ATOM 0 HB3 ASN B 13 54.665 -4.731 11.765 1.00 0.00 H new ATOM 0 HD21 ASN B 13 53.411 -5.948 15.521 1.00 0.00 H new ATOM 0 HD22 ASN B 13 54.271 -4.419 15.313 1.00 0.00 H new ATOM 2087 N VAL B 14 56.859 -6.492 11.211 1.00 0.00 N ATOM 2088 CA VAL B 14 57.134 -7.836 10.631 1.00 0.00 C ATOM 2089 C VAL B 14 58.635 -8.164 10.662 1.00 0.00 C ATOM 2090 O VAL B 14 59.030 -9.295 10.859 1.00 0.00 O ATOM 2091 CB VAL B 14 56.635 -7.852 9.196 1.00 0.00 C ATOM 2092 CG1 VAL B 14 55.132 -7.574 9.196 1.00 0.00 C ATOM 2093 CG2 VAL B 14 57.366 -6.778 8.388 1.00 0.00 C ATOM 0 H VAL B 14 56.756 -5.744 10.526 1.00 0.00 H new ATOM 0 HA VAL B 14 56.619 -8.590 11.226 1.00 0.00 H new ATOM 0 HB VAL B 14 56.828 -8.825 8.743 1.00 0.00 H new ATOM 0 HG11 VAL B 14 54.760 -7.583 8.171 1.00 0.00 H new ATOM 0 HG12 VAL B 14 54.620 -8.343 9.774 1.00 0.00 H new ATOM 0 HG13 VAL B 14 54.943 -6.598 9.642 1.00 0.00 H new ATOM 0 HG21 VAL B 14 57.008 -6.790 7.359 1.00 0.00 H new ATOM 0 HG22 VAL B 14 57.175 -5.799 8.827 1.00 0.00 H new ATOM 0 HG23 VAL B 14 58.437 -6.979 8.401 1.00 0.00 H new ATOM 2103 N PHE B 15 59.471 -7.185 10.443 1.00 0.00 N ATOM 2104 CA PHE B 15 60.947 -7.428 10.425 1.00 0.00 C ATOM 2105 C PHE B 15 61.430 -7.981 11.763 1.00 0.00 C ATOM 2106 O PHE B 15 62.137 -8.964 11.826 1.00 0.00 O ATOM 2107 CB PHE B 15 61.652 -6.088 10.201 1.00 0.00 C ATOM 2108 CG PHE B 15 63.129 -6.333 9.992 1.00 0.00 C ATOM 2109 CD1 PHE B 15 63.621 -6.573 8.702 1.00 0.00 C ATOM 2110 CD2 PHE B 15 64.006 -6.319 11.083 1.00 0.00 C ATOM 2111 CE1 PHE B 15 64.988 -6.800 8.506 1.00 0.00 C ATOM 2112 CE2 PHE B 15 65.374 -6.546 10.886 1.00 0.00 C ATOM 2113 CZ PHE B 15 65.864 -6.786 9.598 1.00 0.00 C ATOM 0 H PHE B 15 59.194 -6.218 10.274 1.00 0.00 H new ATOM 0 HA PHE B 15 61.170 -8.146 9.636 1.00 0.00 H new ATOM 0 HB2 PHE B 15 61.229 -5.581 9.334 1.00 0.00 H new ATOM 0 HB3 PHE B 15 61.497 -5.434 11.059 1.00 0.00 H new ATOM 0 HD1 PHE B 15 62.946 -6.583 7.859 1.00 0.00 H new ATOM 0 HD2 PHE B 15 63.628 -6.133 12.077 1.00 0.00 H new ATOM 0 HE1 PHE B 15 65.367 -6.986 7.512 1.00 0.00 H new ATOM 0 HE2 PHE B 15 66.050 -6.536 11.728 1.00 0.00 H new ATOM 0 HZ PHE B 15 66.919 -6.961 9.446 1.00 0.00 H new ATOM 2123 N HIS B 16 61.062 -7.334 12.829 1.00 0.00 N ATOM 2124 CA HIS B 16 61.499 -7.776 14.179 1.00 0.00 C ATOM 2125 C HIS B 16 60.725 -9.019 14.615 1.00 0.00 C ATOM 2126 O HIS B 16 61.180 -9.774 15.451 1.00 0.00 O ATOM 2127 CB HIS B 16 61.251 -6.640 15.176 1.00 0.00 C ATOM 2128 CG HIS B 16 62.269 -5.551 14.961 1.00 0.00 C ATOM 2129 ND1 HIS B 16 62.410 -4.901 13.743 1.00 0.00 N ATOM 2130 CD2 HIS B 16 63.209 -4.996 15.794 1.00 0.00 C ATOM 2131 CE1 HIS B 16 63.406 -4.004 13.876 1.00 0.00 C ATOM 2132 NE2 HIS B 16 63.923 -4.023 15.104 1.00 0.00 N ATOM 0 H HIS B 16 60.468 -6.505 12.822 1.00 0.00 H new ATOM 0 HA HIS B 16 62.560 -8.025 14.148 1.00 0.00 H new ATOM 0 HB2 HIS B 16 60.244 -6.242 15.047 1.00 0.00 H new ATOM 0 HB3 HIS B 16 61.316 -7.017 16.197 1.00 0.00 H new ATOM 0 HD2 HIS B 16 63.369 -5.273 16.826 1.00 0.00 H new ATOM 0 HE1 HIS B 16 63.744 -3.350 13.085 1.00 0.00 H new ATOM 0 HE2 HIS B 16 64.683 -3.445 15.462 1.00 0.00 H new ATOM 2141 N ALA B 17 59.555 -9.237 14.084 1.00 0.00 N ATOM 2142 CA ALA B 17 58.778 -10.429 14.514 1.00 0.00 C ATOM 2143 C ALA B 17 59.418 -11.722 13.993 1.00 0.00 C ATOM 2144 O ALA B 17 59.755 -12.598 14.765 1.00 0.00 O ATOM 2145 CB ALA B 17 57.337 -10.317 14.008 1.00 0.00 C ATOM 0 H ALA B 17 59.109 -8.649 13.380 1.00 0.00 H new ATOM 0 HA ALA B 17 58.779 -10.465 15.603 1.00 0.00 H new ATOM 0 HB1 ALA B 17 56.771 -11.193 14.325 1.00 0.00 H new ATOM 0 HB2 ALA B 17 56.876 -9.419 14.418 1.00 0.00 H new ATOM 0 HB3 ALA B 17 57.337 -10.260 12.919 1.00 0.00 H new ATOM 2151 N HIS B 18 59.552 -11.889 12.704 1.00 0.00 N ATOM 2152 CA HIS B 18 60.124 -13.171 12.194 1.00 0.00 C ATOM 2153 C HIS B 18 61.618 -13.295 12.537 1.00 0.00 C ATOM 2154 O HIS B 18 62.096 -14.359 12.879 1.00 0.00 O ATOM 2155 CB HIS B 18 59.940 -13.247 10.674 1.00 0.00 C ATOM 2156 CG HIS B 18 60.054 -14.678 10.222 1.00 0.00 C ATOM 2157 ND1 HIS B 18 61.213 -15.421 10.404 1.00 0.00 N ATOM 2158 CD2 HIS B 18 59.162 -15.519 9.604 1.00 0.00 C ATOM 2159 CE1 HIS B 18 60.988 -16.651 9.905 1.00 0.00 C ATOM 2160 NE2 HIS B 18 59.756 -16.760 9.407 1.00 0.00 N ATOM 0 H HIS B 18 59.295 -11.206 11.991 1.00 0.00 H new ATOM 0 HA HIS B 18 59.595 -13.993 12.676 1.00 0.00 H new ATOM 0 HB2 HIS B 18 58.967 -12.843 10.395 1.00 0.00 H new ATOM 0 HB3 HIS B 18 60.693 -12.637 10.176 1.00 0.00 H new ATOM 0 HD1 HIS B 18 62.077 -15.094 10.837 1.00 0.00 H new ATOM 0 HD2 HIS B 18 58.155 -15.257 9.316 1.00 0.00 H new ATOM 0 HE1 HIS B 18 61.715 -17.450 9.908 1.00 0.00 H new ATOM 2169 N SER B 19 62.364 -12.223 12.435 1.00 0.00 N ATOM 2170 CA SER B 19 63.830 -12.266 12.734 1.00 0.00 C ATOM 2171 C SER B 19 64.091 -12.529 14.212 1.00 0.00 C ATOM 2172 O SER B 19 65.191 -12.857 14.608 1.00 0.00 O ATOM 2173 CB SER B 19 64.424 -10.898 12.414 1.00 0.00 C ATOM 2174 OG SER B 19 65.768 -10.857 12.877 1.00 0.00 O ATOM 0 H SER B 19 62.015 -11.307 12.153 1.00 0.00 H new ATOM 0 HA SER B 19 64.274 -13.065 12.140 1.00 0.00 H new ATOM 0 HB2 SER B 19 64.390 -10.715 11.340 1.00 0.00 H new ATOM 0 HB3 SER B 19 63.838 -10.112 12.890 1.00 0.00 H new ATOM 0 HG SER B 19 65.872 -11.472 13.633 1.00 0.00 H new ATOM 2180 N GLY B 20 63.104 -12.350 15.036 1.00 0.00 N ATOM 2181 CA GLY B 20 63.301 -12.546 16.503 1.00 0.00 C ATOM 2182 C GLY B 20 62.931 -13.971 16.907 1.00 0.00 C ATOM 2183 O GLY B 20 62.842 -14.281 18.080 1.00 0.00 O ATOM 0 H GLY B 20 62.161 -12.075 14.760 1.00 0.00 H new ATOM 0 HA2 GLY B 20 64.339 -12.345 16.766 1.00 0.00 H new ATOM 0 HA3 GLY B 20 62.688 -11.834 17.056 1.00 0.00 H new ATOM 2187 N LYS B 21 62.750 -14.859 15.965 1.00 0.00 N ATOM 2188 CA LYS B 21 62.431 -16.264 16.341 1.00 0.00 C ATOM 2189 C LYS B 21 63.750 -16.978 16.577 1.00 0.00 C ATOM 2190 O LYS B 21 64.056 -17.400 17.675 1.00 0.00 O ATOM 2191 CB LYS B 21 61.661 -16.954 15.209 1.00 0.00 C ATOM 2192 CG LYS B 21 60.430 -16.123 14.826 1.00 0.00 C ATOM 2193 CD LYS B 21 59.386 -16.173 15.945 1.00 0.00 C ATOM 2194 CE LYS B 21 58.059 -15.619 15.425 1.00 0.00 C ATOM 2195 NZ LYS B 21 57.498 -16.550 14.404 1.00 0.00 N ATOM 0 H LYS B 21 62.809 -14.674 14.964 1.00 0.00 H new ATOM 0 HA LYS B 21 61.809 -16.289 17.236 1.00 0.00 H new ATOM 0 HB2 LYS B 21 62.309 -17.079 14.342 1.00 0.00 H new ATOM 0 HB3 LYS B 21 61.353 -17.951 15.523 1.00 0.00 H new ATOM 0 HG2 LYS B 21 60.724 -15.090 14.639 1.00 0.00 H new ATOM 0 HG3 LYS B 21 59.999 -16.504 13.900 1.00 0.00 H new ATOM 0 HD2 LYS B 21 59.255 -17.199 16.290 1.00 0.00 H new ATOM 0 HD3 LYS B 21 59.726 -15.590 16.801 1.00 0.00 H new ATOM 0 HE2 LYS B 21 57.355 -15.498 16.249 1.00 0.00 H new ATOM 0 HE3 LYS B 21 58.211 -14.632 14.988 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 56.465 -16.434 14.359 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 57.912 -16.336 13.474 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 57.725 -17.530 14.666 1.00 0.00 H new ATOM 2265 N TYR B 26 67.627 -9.174 16.056 1.00 0.00 N ATOM 2266 CA TYR B 26 67.039 -8.697 14.774 1.00 0.00 C ATOM 2267 C TYR B 26 67.993 -8.945 13.601 1.00 0.00 C ATOM 2268 O TYR B 26 67.912 -8.286 12.583 1.00 0.00 O ATOM 2269 CB TYR B 26 66.699 -7.209 14.875 1.00 0.00 C ATOM 2270 CG TYR B 26 66.074 -6.920 16.227 1.00 0.00 C ATOM 2271 CD1 TYR B 26 64.969 -7.665 16.669 1.00 0.00 C ATOM 2272 CD2 TYR B 26 66.601 -5.907 17.040 1.00 0.00 C ATOM 2273 CE1 TYR B 26 64.397 -7.395 17.917 1.00 0.00 C ATOM 2274 CE2 TYR B 26 66.027 -5.640 18.287 1.00 0.00 C ATOM 2275 CZ TYR B 26 64.925 -6.383 18.726 1.00 0.00 C ATOM 2276 OH TYR B 26 64.360 -6.118 19.956 1.00 0.00 O ATOM 0 HA TYR B 26 66.125 -9.261 14.588 1.00 0.00 H new ATOM 0 HB2 TYR B 26 67.600 -6.610 14.744 1.00 0.00 H new ATOM 0 HB3 TYR B 26 66.011 -6.928 14.078 1.00 0.00 H new ATOM 0 HD1 TYR B 26 64.561 -8.447 16.046 1.00 0.00 H new ATOM 0 HD2 TYR B 26 67.451 -5.332 16.703 1.00 0.00 H new ATOM 0 HE1 TYR B 26 63.547 -7.968 18.256 1.00 0.00 H new ATOM 0 HE2 TYR B 26 66.435 -4.859 18.912 1.00 0.00 H new ATOM 0 HH TYR B 26 64.848 -5.387 20.389 1.00 0.00 H new ATOM 2286 N LYS B 27 68.860 -9.923 13.705 1.00 0.00 N ATOM 2287 CA LYS B 27 69.765 -10.233 12.553 1.00 0.00 C ATOM 2288 C LYS B 27 69.076 -11.337 11.757 1.00 0.00 C ATOM 2289 O LYS B 27 68.452 -12.211 12.328 1.00 0.00 O ATOM 2290 CB LYS B 27 71.138 -10.718 13.039 1.00 0.00 C ATOM 2291 CG LYS B 27 72.140 -10.688 11.861 1.00 0.00 C ATOM 2292 CD LYS B 27 72.803 -9.296 11.757 1.00 0.00 C ATOM 2293 CE LYS B 27 74.066 -9.248 12.626 1.00 0.00 C ATOM 2294 NZ LYS B 27 74.733 -7.926 12.456 1.00 0.00 N ATOM 0 H LYS B 27 68.980 -10.514 14.527 1.00 0.00 H new ATOM 0 HA LYS B 27 69.938 -9.342 11.949 1.00 0.00 H new ATOM 0 HB2 LYS B 27 71.494 -10.083 13.850 1.00 0.00 H new ATOM 0 HB3 LYS B 27 71.059 -11.729 13.438 1.00 0.00 H new ATOM 0 HG2 LYS B 27 72.904 -11.452 12.005 1.00 0.00 H new ATOM 0 HG3 LYS B 27 71.624 -10.923 10.930 1.00 0.00 H new ATOM 0 HD2 LYS B 27 73.058 -9.083 10.719 1.00 0.00 H new ATOM 0 HD3 LYS B 27 72.102 -8.526 12.078 1.00 0.00 H new ATOM 0 HE2 LYS B 27 73.807 -9.405 13.673 1.00 0.00 H new ATOM 0 HE3 LYS B 27 74.747 -10.051 12.342 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 75.590 -7.891 13.044 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 74.993 -7.794 11.458 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 74.082 -7.169 12.747 1.00 0.00 H new ATOM 2308 N LEU B 28 69.141 -11.306 10.448 1.00 0.00 N ATOM 2309 CA LEU B 28 68.439 -12.355 9.642 1.00 0.00 C ATOM 2310 C LEU B 28 69.408 -13.453 9.227 1.00 0.00 C ATOM 2311 O LEU B 28 70.605 -13.276 9.168 1.00 0.00 O ATOM 2312 CB LEU B 28 67.828 -11.729 8.371 1.00 0.00 C ATOM 2313 CG LEU B 28 66.538 -10.948 8.694 1.00 0.00 C ATOM 2314 CD1 LEU B 28 65.363 -11.909 8.955 1.00 0.00 C ATOM 2315 CD2 LEU B 28 66.751 -10.074 9.924 1.00 0.00 C ATOM 0 H LEU B 28 69.646 -10.605 9.905 1.00 0.00 H new ATOM 0 HA LEU B 28 67.651 -12.782 10.262 1.00 0.00 H new ATOM 0 HB2 LEU B 28 68.554 -11.061 7.908 1.00 0.00 H new ATOM 0 HB3 LEU B 28 67.609 -12.513 7.646 1.00 0.00 H new ATOM 0 HG LEU B 28 66.299 -10.323 7.833 1.00 0.00 H new ATOM 0 HD11 LEU B 28 64.465 -11.333 9.180 1.00 0.00 H new ATOM 0 HD12 LEU B 28 65.189 -12.520 8.069 1.00 0.00 H new ATOM 0 HD13 LEU B 28 65.602 -12.555 9.800 1.00 0.00 H new ATOM 0 HD21 LEU B 28 65.835 -9.526 10.144 1.00 0.00 H new ATOM 0 HD22 LEU B 28 67.012 -10.702 10.776 1.00 0.00 H new ATOM 0 HD23 LEU B 28 67.559 -9.368 9.733 1.00 0.00 H new ATOM 2327 N SER B 29 68.860 -14.586 8.929 1.00 0.00 N ATOM 2328 CA SER B 29 69.661 -15.755 8.487 1.00 0.00 C ATOM 2329 C SER B 29 69.013 -16.291 7.219 1.00 0.00 C ATOM 2330 O SER B 29 67.884 -15.965 6.908 1.00 0.00 O ATOM 2331 CB SER B 29 69.647 -16.833 9.571 1.00 0.00 C ATOM 2332 OG SER B 29 70.534 -17.879 9.201 1.00 0.00 O ATOM 0 H SER B 29 67.856 -14.759 8.974 1.00 0.00 H new ATOM 0 HA SER B 29 70.696 -15.468 8.303 1.00 0.00 H new ATOM 0 HB2 SER B 29 69.947 -16.407 10.528 1.00 0.00 H new ATOM 0 HB3 SER B 29 68.638 -17.224 9.699 1.00 0.00 H new ATOM 0 HG SER B 29 70.530 -18.572 9.894 1.00 0.00 H new ATOM 2338 N LYS B 30 69.704 -17.097 6.477 1.00 0.00 N ATOM 2339 CA LYS B 30 69.107 -17.630 5.222 1.00 0.00 C ATOM 2340 C LYS B 30 67.677 -18.142 5.474 1.00 0.00 C ATOM 2341 O LYS B 30 66.801 -17.958 4.651 1.00 0.00 O ATOM 2342 CB LYS B 30 69.998 -18.769 4.719 1.00 0.00 C ATOM 2343 CG LYS B 30 69.407 -19.395 3.457 1.00 0.00 C ATOM 2344 CD LYS B 30 70.372 -20.458 2.929 1.00 0.00 C ATOM 2345 CE LYS B 30 69.655 -21.342 1.915 1.00 0.00 C ATOM 2346 NZ LYS B 30 68.646 -22.183 2.618 1.00 0.00 N ATOM 0 H LYS B 30 70.653 -17.412 6.679 1.00 0.00 H new ATOM 0 HA LYS B 30 69.047 -16.839 4.475 1.00 0.00 H new ATOM 0 HB2 LYS B 30 70.998 -18.390 4.510 1.00 0.00 H new ATOM 0 HB3 LYS B 30 70.100 -19.528 5.495 1.00 0.00 H new ATOM 0 HG2 LYS B 30 68.438 -19.843 3.677 1.00 0.00 H new ATOM 0 HG3 LYS B 30 69.240 -18.629 2.700 1.00 0.00 H new ATOM 0 HD2 LYS B 30 71.235 -19.981 2.465 1.00 0.00 H new ATOM 0 HD3 LYS B 30 70.748 -21.064 3.753 1.00 0.00 H new ATOM 0 HE2 LYS B 30 69.168 -20.726 1.159 1.00 0.00 H new ATOM 0 HE3 LYS B 30 70.374 -21.975 1.395 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 68.477 -23.052 2.072 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 69.000 -22.431 3.564 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 67.756 -21.653 2.709 1.00 0.00 H new ATOM 2360 N LYS B 31 67.427 -18.793 6.579 1.00 0.00 N ATOM 2361 CA LYS B 31 66.051 -19.320 6.839 1.00 0.00 C ATOM 2362 C LYS B 31 65.105 -18.234 7.396 1.00 0.00 C ATOM 2363 O LYS B 31 63.904 -18.321 7.228 1.00 0.00 O ATOM 2364 CB LYS B 31 66.136 -20.474 7.840 1.00 0.00 C ATOM 2365 CG LYS B 31 64.761 -21.125 7.983 1.00 0.00 C ATOM 2366 CD LYS B 31 64.839 -22.278 8.982 1.00 0.00 C ATOM 2367 CE LYS B 31 63.436 -22.838 9.206 1.00 0.00 C ATOM 2368 NZ LYS B 31 62.661 -21.900 10.068 1.00 0.00 N ATOM 0 H LYS B 31 68.111 -18.983 7.311 1.00 0.00 H new ATOM 0 HA LYS B 31 65.641 -19.661 5.888 1.00 0.00 H new ATOM 0 HB2 LYS B 31 66.865 -21.210 7.502 1.00 0.00 H new ATOM 0 HB3 LYS B 31 66.479 -20.106 8.807 1.00 0.00 H new ATOM 0 HG2 LYS B 31 64.032 -20.388 8.320 1.00 0.00 H new ATOM 0 HG3 LYS B 31 64.419 -21.492 7.015 1.00 0.00 H new ATOM 0 HD2 LYS B 31 65.500 -23.058 8.605 1.00 0.00 H new ATOM 0 HD3 LYS B 31 65.261 -21.931 9.925 1.00 0.00 H new ATOM 0 HE2 LYS B 31 62.930 -22.974 8.250 1.00 0.00 H new ATOM 0 HE3 LYS B 31 63.495 -23.819 9.678 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 61.831 -22.392 10.458 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 63.263 -21.567 10.847 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 62.347 -21.087 9.501 1.00 0.00 H new ATOM 2382 N GLU B 32 65.607 -17.219 8.056 1.00 0.00 N ATOM 2383 CA GLU B 32 64.682 -16.179 8.600 1.00 0.00 C ATOM 2384 C GLU B 32 64.208 -15.249 7.477 1.00 0.00 C ATOM 2385 O GLU B 32 63.108 -14.733 7.512 1.00 0.00 O ATOM 2386 CB GLU B 32 65.382 -15.370 9.690 1.00 0.00 C ATOM 2387 CG GLU B 32 65.587 -16.247 10.930 1.00 0.00 C ATOM 2388 CD GLU B 32 66.500 -15.522 11.918 1.00 0.00 C ATOM 2389 OE1 GLU B 32 65.989 -14.744 12.705 1.00 0.00 O ATOM 2390 OE2 GLU B 32 67.697 -15.759 11.871 1.00 0.00 O ATOM 0 H GLU B 32 66.599 -17.067 8.239 1.00 0.00 H new ATOM 0 HA GLU B 32 63.814 -16.677 9.033 1.00 0.00 H new ATOM 0 HB2 GLU B 32 66.343 -15.006 9.326 1.00 0.00 H new ATOM 0 HB3 GLU B 32 64.786 -14.494 9.946 1.00 0.00 H new ATOM 0 HG2 GLU B 32 64.627 -16.465 11.398 1.00 0.00 H new ATOM 0 HG3 GLU B 32 66.027 -17.203 10.645 1.00 0.00 H new ATOM 2397 N LEU B 33 65.026 -15.022 6.481 1.00 0.00 N ATOM 2398 CA LEU B 33 64.607 -14.117 5.366 1.00 0.00 C ATOM 2399 C LEU B 33 63.767 -14.887 4.344 1.00 0.00 C ATOM 2400 O LEU B 33 62.864 -14.344 3.739 1.00 0.00 O ATOM 2401 CB LEU B 33 65.843 -13.511 4.677 1.00 0.00 C ATOM 2402 CG LEU B 33 66.733 -14.617 4.043 1.00 0.00 C ATOM 2403 CD1 LEU B 33 66.427 -14.761 2.539 1.00 0.00 C ATOM 2404 CD2 LEU B 33 68.218 -14.243 4.207 1.00 0.00 C ATOM 0 H LEU B 33 65.960 -15.421 6.391 1.00 0.00 H new ATOM 0 HA LEU B 33 64.004 -13.311 5.784 1.00 0.00 H new ATOM 0 HB2 LEU B 33 65.525 -12.810 3.905 1.00 0.00 H new ATOM 0 HB3 LEU B 33 66.425 -12.944 5.403 1.00 0.00 H new ATOM 0 HG LEU B 33 66.521 -15.559 4.548 1.00 0.00 H new ATOM 0 HD11 LEU B 33 67.059 -15.540 2.112 1.00 0.00 H new ATOM 0 HD12 LEU B 33 65.379 -15.030 2.405 1.00 0.00 H new ATOM 0 HD13 LEU B 33 66.626 -13.815 2.035 1.00 0.00 H new ATOM 0 HD21 LEU B 33 68.840 -15.020 3.762 1.00 0.00 H new ATOM 0 HD22 LEU B 33 68.411 -13.293 3.708 1.00 0.00 H new ATOM 0 HD23 LEU B 33 68.455 -14.151 5.267 1.00 0.00 H new ATOM 2416 N LYS B 34 64.056 -16.144 4.138 1.00 0.00 N ATOM 2417 CA LYS B 34 63.277 -16.944 3.149 1.00 0.00 C ATOM 2418 C LYS B 34 61.803 -17.030 3.583 1.00 0.00 C ATOM 2419 O LYS B 34 60.898 -16.924 2.776 1.00 0.00 O ATOM 2420 CB LYS B 34 63.882 -18.350 3.089 1.00 0.00 C ATOM 2421 CG LYS B 34 63.285 -19.132 1.921 1.00 0.00 C ATOM 2422 CD LYS B 34 63.906 -20.532 1.884 1.00 0.00 C ATOM 2423 CE LYS B 34 63.317 -21.332 0.717 1.00 0.00 C ATOM 2424 NZ LYS B 34 64.210 -22.484 0.407 1.00 0.00 N ATOM 0 H LYS B 34 64.801 -16.653 4.614 1.00 0.00 H new ATOM 0 HA LYS B 34 63.321 -16.470 2.168 1.00 0.00 H new ATOM 0 HB2 LYS B 34 64.964 -18.284 2.976 1.00 0.00 H new ATOM 0 HB3 LYS B 34 63.691 -18.876 4.024 1.00 0.00 H new ATOM 0 HG2 LYS B 34 62.203 -19.204 2.031 1.00 0.00 H new ATOM 0 HG3 LYS B 34 63.476 -18.611 0.983 1.00 0.00 H new ATOM 0 HD2 LYS B 34 64.988 -20.457 1.776 1.00 0.00 H new ATOM 0 HD3 LYS B 34 63.715 -21.049 2.824 1.00 0.00 H new ATOM 0 HE2 LYS B 34 62.320 -21.689 0.973 1.00 0.00 H new ATOM 0 HE3 LYS B 34 63.211 -20.693 -0.160 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 63.812 -23.028 -0.385 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 65.153 -22.132 0.146 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 64.289 -23.097 1.243 1.00 0.00 H new ATOM 2438 N ASP B 35 61.559 -17.217 4.855 1.00 0.00 N ATOM 2439 CA ASP B 35 60.155 -17.308 5.358 1.00 0.00 C ATOM 2440 C ASP B 35 59.541 -15.911 5.461 1.00 0.00 C ATOM 2441 O ASP B 35 58.348 -15.733 5.315 1.00 0.00 O ATOM 2442 CB ASP B 35 60.148 -17.979 6.736 1.00 0.00 C ATOM 2443 CG ASP B 35 60.497 -19.461 6.584 1.00 0.00 C ATOM 2444 OD1 ASP B 35 60.335 -19.977 5.490 1.00 0.00 O ATOM 2445 OD2 ASP B 35 60.914 -20.055 7.563 1.00 0.00 O ATOM 0 H ASP B 35 62.278 -17.311 5.572 1.00 0.00 H new ATOM 0 HA ASP B 35 59.564 -17.902 4.661 1.00 0.00 H new ATOM 0 HB2 ASP B 35 60.867 -17.491 7.394 1.00 0.00 H new ATOM 0 HB3 ASP B 35 59.168 -17.871 7.200 1.00 0.00 H new ATOM 2450 N LEU B 36 60.341 -14.932 5.736 1.00 0.00 N ATOM 2451 CA LEU B 36 59.827 -13.541 5.883 1.00 0.00 C ATOM 2452 C LEU B 36 59.247 -12.979 4.569 1.00 0.00 C ATOM 2453 O LEU B 36 58.263 -12.266 4.578 1.00 0.00 O ATOM 2454 CB LEU B 36 60.977 -12.649 6.358 1.00 0.00 C ATOM 2455 CG LEU B 36 60.514 -11.194 6.518 1.00 0.00 C ATOM 2456 CD1 LEU B 36 59.322 -11.115 7.484 1.00 0.00 C ATOM 2457 CD2 LEU B 36 61.681 -10.373 7.075 1.00 0.00 C ATOM 0 H LEU B 36 61.347 -15.032 5.869 1.00 0.00 H new ATOM 0 HA LEU B 36 59.013 -13.556 6.607 1.00 0.00 H new ATOM 0 HB2 LEU B 36 61.360 -13.019 7.309 1.00 0.00 H new ATOM 0 HB3 LEU B 36 61.798 -12.697 5.643 1.00 0.00 H new ATOM 0 HG LEU B 36 60.201 -10.802 5.551 1.00 0.00 H new ATOM 0 HD11 LEU B 36 59.005 -10.077 7.587 1.00 0.00 H new ATOM 0 HD12 LEU B 36 58.496 -11.709 7.092 1.00 0.00 H new ATOM 0 HD13 LEU B 36 59.617 -11.503 8.459 1.00 0.00 H new ATOM 0 HD21 LEU B 36 61.371 -9.335 7.196 1.00 0.00 H new ATOM 0 HD22 LEU B 36 61.981 -10.777 8.042 1.00 0.00 H new ATOM 0 HD23 LEU B 36 62.523 -10.422 6.384 1.00 0.00 H new ATOM 2469 N LEU B 37 59.862 -13.256 3.450 1.00 0.00 N ATOM 2470 CA LEU B 37 59.357 -12.694 2.151 1.00 0.00 C ATOM 2471 C LEU B 37 58.220 -13.525 1.555 1.00 0.00 C ATOM 2472 O LEU B 37 57.290 -12.991 0.985 1.00 0.00 O ATOM 2473 CB LEU B 37 60.508 -12.627 1.146 1.00 0.00 C ATOM 2474 CG LEU B 37 61.503 -11.536 1.562 1.00 0.00 C ATOM 2475 CD1 LEU B 37 62.818 -11.732 0.800 1.00 0.00 C ATOM 2476 CD2 LEU B 37 60.936 -10.137 1.242 1.00 0.00 C ATOM 0 H LEU B 37 60.691 -13.845 3.373 1.00 0.00 H new ATOM 0 HA LEU B 37 58.964 -11.699 2.359 1.00 0.00 H new ATOM 0 HB2 LEU B 37 61.013 -13.591 1.094 1.00 0.00 H new ATOM 0 HB3 LEU B 37 60.120 -12.416 0.149 1.00 0.00 H new ATOM 0 HG LEU B 37 61.677 -11.610 2.635 1.00 0.00 H new ATOM 0 HD11 LEU B 37 63.527 -10.958 1.093 1.00 0.00 H new ATOM 0 HD12 LEU B 37 63.232 -12.712 1.036 1.00 0.00 H new ATOM 0 HD13 LEU B 37 62.631 -11.665 -0.272 1.00 0.00 H new ATOM 0 HD21 LEU B 37 61.655 -9.375 1.544 1.00 0.00 H new ATOM 0 HD22 LEU B 37 60.750 -10.056 0.171 1.00 0.00 H new ATOM 0 HD23 LEU B 37 60.002 -9.990 1.785 1.00 0.00 H new ATOM 2488 N GLN B 38 58.293 -14.816 1.639 1.00 0.00 N ATOM 2489 CA GLN B 38 57.229 -15.651 1.036 1.00 0.00 C ATOM 2490 C GLN B 38 55.920 -15.458 1.782 1.00 0.00 C ATOM 2491 O GLN B 38 54.850 -15.456 1.209 1.00 0.00 O ATOM 2492 CB GLN B 38 57.653 -17.120 1.136 1.00 0.00 C ATOM 2493 CG GLN B 38 57.617 -17.581 2.593 1.00 0.00 C ATOM 2494 CD GLN B 38 58.301 -18.943 2.709 1.00 0.00 C ATOM 2495 OE1 GLN B 38 59.257 -19.217 2.010 1.00 0.00 O ATOM 2496 NE2 GLN B 38 57.854 -19.809 3.576 1.00 0.00 N ATOM 0 H GLN B 38 59.044 -15.330 2.099 1.00 0.00 H new ATOM 0 HA GLN B 38 57.085 -15.362 -0.005 1.00 0.00 H new ATOM 0 HB2 GLN B 38 56.988 -17.740 0.534 1.00 0.00 H new ATOM 0 HB3 GLN B 38 58.658 -17.245 0.732 1.00 0.00 H new ATOM 0 HG2 GLN B 38 58.120 -16.853 3.229 1.00 0.00 H new ATOM 0 HG3 GLN B 38 56.586 -17.648 2.940 1.00 0.00 H new ATOM 0 HE21 GLN B 38 57.052 -19.577 4.161 1.00 0.00 H new ATOM 0 HE22 GLN B 38 58.307 -20.718 3.669 1.00 0.00 H new ATOM 2505 N THR B 39 56.003 -15.368 3.083 1.00 0.00 N ATOM 2506 CA THR B 39 54.772 -15.260 3.899 1.00 0.00 C ATOM 2507 C THR B 39 54.237 -13.828 3.949 1.00 0.00 C ATOM 2508 O THR B 39 53.137 -13.540 3.518 1.00 0.00 O ATOM 2509 CB THR B 39 55.093 -15.714 5.324 1.00 0.00 C ATOM 2510 OG1 THR B 39 55.764 -16.966 5.281 1.00 0.00 O ATOM 2511 CG2 THR B 39 53.799 -15.855 6.131 1.00 0.00 C ATOM 0 H THR B 39 56.875 -15.365 3.611 1.00 0.00 H new ATOM 0 HA THR B 39 54.007 -15.887 3.442 1.00 0.00 H new ATOM 0 HB THR B 39 55.733 -14.972 5.801 1.00 0.00 H new ATOM 0 HG1 THR B 39 56.733 -16.819 5.298 1.00 0.00 H new ATOM 0 HG21 THR B 39 54.036 -16.179 7.145 1.00 0.00 H new ATOM 0 HG22 THR B 39 53.286 -14.894 6.167 1.00 0.00 H new ATOM 0 HG23 THR B 39 53.153 -16.593 5.656 1.00 0.00 H new ATOM 2519 N GLU B 40 54.995 -12.945 4.545 1.00 0.00 N ATOM 2520 CA GLU B 40 54.538 -11.539 4.715 1.00 0.00 C ATOM 2521 C GLU B 40 54.487 -10.766 3.395 1.00 0.00 C ATOM 2522 O GLU B 40 53.573 -9.990 3.193 1.00 0.00 O ATOM 2523 CB GLU B 40 55.490 -10.817 5.670 1.00 0.00 C ATOM 2524 CG GLU B 40 55.428 -11.471 7.052 1.00 0.00 C ATOM 2525 CD GLU B 40 54.066 -11.195 7.687 1.00 0.00 C ATOM 2526 OE1 GLU B 40 53.409 -10.265 7.248 1.00 0.00 O ATOM 2527 OE2 GLU B 40 53.703 -11.918 8.599 1.00 0.00 O ATOM 0 H GLU B 40 55.921 -13.143 4.924 1.00 0.00 H new ATOM 0 HA GLU B 40 53.524 -11.576 5.114 1.00 0.00 H new ATOM 0 HB2 GLU B 40 56.508 -10.857 5.283 1.00 0.00 H new ATOM 0 HB3 GLU B 40 55.218 -9.764 5.743 1.00 0.00 H new ATOM 0 HG2 GLU B 40 55.589 -12.545 6.965 1.00 0.00 H new ATOM 0 HG3 GLU B 40 56.223 -11.080 7.687 1.00 0.00 H new ATOM 2534 N LEU B 41 55.451 -10.926 2.500 1.00 0.00 N ATOM 2535 CA LEU B 41 55.412 -10.128 1.219 1.00 0.00 C ATOM 2536 C LEU B 41 54.864 -10.984 0.073 1.00 0.00 C ATOM 2537 O LEU B 41 55.233 -10.816 -1.071 1.00 0.00 O ATOM 2538 CB LEU B 41 56.811 -9.574 0.881 1.00 0.00 C ATOM 2539 CG LEU B 41 56.711 -8.162 0.283 1.00 0.00 C ATOM 2540 CD1 LEU B 41 58.117 -7.649 -0.035 1.00 0.00 C ATOM 2541 CD2 LEU B 41 55.888 -8.191 -1.010 1.00 0.00 C ATOM 0 H LEU B 41 56.244 -11.560 2.599 1.00 0.00 H new ATOM 0 HA LEU B 41 54.742 -9.280 1.357 1.00 0.00 H new ATOM 0 HB2 LEU B 41 57.424 -9.549 1.782 1.00 0.00 H new ATOM 0 HB3 LEU B 41 57.309 -10.238 0.175 1.00 0.00 H new ATOM 0 HG LEU B 41 56.224 -7.506 1.004 1.00 0.00 H new ATOM 0 HD11 LEU B 41 58.051 -6.647 -0.460 1.00 0.00 H new ATOM 0 HD12 LEU B 41 58.708 -7.617 0.880 1.00 0.00 H new ATOM 0 HD13 LEU B 41 58.594 -8.317 -0.752 1.00 0.00 H new ATOM 0 HD21 LEU B 41 55.825 -7.185 -1.424 1.00 0.00 H new ATOM 0 HD22 LEU B 41 56.369 -8.851 -1.732 1.00 0.00 H new ATOM 0 HD23 LEU B 41 54.885 -8.558 -0.795 1.00 0.00 H new ATOM 2553 N SER B 42 53.943 -11.863 0.359 1.00 0.00 N ATOM 2554 CA SER B 42 53.331 -12.671 -0.728 1.00 0.00 C ATOM 2555 C SER B 42 52.879 -11.700 -1.820 1.00 0.00 C ATOM 2556 O SER B 42 52.253 -10.706 -1.515 1.00 0.00 O ATOM 2557 CB SER B 42 52.096 -13.384 -0.170 1.00 0.00 C ATOM 2558 OG SER B 42 52.510 -14.396 0.739 1.00 0.00 O ATOM 0 H SER B 42 53.590 -12.055 1.297 1.00 0.00 H new ATOM 0 HA SER B 42 54.039 -13.402 -1.119 1.00 0.00 H new ATOM 0 HB2 SER B 42 51.446 -12.669 0.335 1.00 0.00 H new ATOM 0 HB3 SER B 42 51.517 -13.823 -0.982 1.00 0.00 H new ATOM 0 HG SER B 42 53.402 -14.716 0.488 1.00 0.00 H new ATOM 2564 N SER B 43 53.158 -11.974 -3.072 1.00 0.00 N ATOM 2565 CA SER B 43 52.714 -11.044 -4.170 1.00 0.00 C ATOM 2566 C SER B 43 53.593 -11.220 -5.417 1.00 0.00 C ATOM 2567 O SER B 43 53.094 -11.333 -6.520 1.00 0.00 O ATOM 2568 CB SER B 43 52.800 -9.570 -3.710 1.00 0.00 C ATOM 2569 OG SER B 43 53.834 -9.444 -2.741 1.00 0.00 O ATOM 0 H SER B 43 53.672 -12.798 -3.385 1.00 0.00 H new ATOM 0 HA SER B 43 51.680 -11.292 -4.410 1.00 0.00 H new ATOM 0 HB2 SER B 43 53.002 -8.921 -4.562 1.00 0.00 H new ATOM 0 HB3 SER B 43 51.847 -9.252 -3.287 1.00 0.00 H new ATOM 0 HG SER B 43 53.446 -9.477 -1.842 1.00 0.00 H new ATOM 2575 N PHE B 44 54.892 -11.229 -5.267 1.00 0.00 N ATOM 2576 CA PHE B 44 55.760 -11.381 -6.468 1.00 0.00 C ATOM 2577 C PHE B 44 57.157 -11.852 -6.068 1.00 0.00 C ATOM 2578 O PHE B 44 57.784 -12.604 -6.786 1.00 0.00 O ATOM 2579 CB PHE B 44 55.866 -10.041 -7.198 1.00 0.00 C ATOM 2580 CG PHE B 44 56.754 -10.202 -8.409 1.00 0.00 C ATOM 2581 CD1 PHE B 44 56.201 -10.589 -9.636 1.00 0.00 C ATOM 2582 CD2 PHE B 44 58.132 -9.978 -8.302 1.00 0.00 C ATOM 2583 CE1 PHE B 44 57.025 -10.748 -10.756 1.00 0.00 C ATOM 2584 CE2 PHE B 44 58.956 -10.139 -9.423 1.00 0.00 C ATOM 2585 CZ PHE B 44 58.402 -10.523 -10.649 1.00 0.00 C ATOM 0 H PHE B 44 55.382 -11.139 -4.377 1.00 0.00 H new ATOM 0 HA PHE B 44 55.313 -12.127 -7.126 1.00 0.00 H new ATOM 0 HB2 PHE B 44 54.876 -9.700 -7.501 1.00 0.00 H new ATOM 0 HB3 PHE B 44 56.275 -9.282 -6.531 1.00 0.00 H new ATOM 0 HD1 PHE B 44 55.139 -10.765 -9.718 1.00 0.00 H new ATOM 0 HD2 PHE B 44 58.559 -9.681 -7.356 1.00 0.00 H new ATOM 0 HE1 PHE B 44 56.598 -11.044 -11.703 1.00 0.00 H new ATOM 0 HE2 PHE B 44 60.019 -9.967 -9.341 1.00 0.00 H new ATOM 0 HZ PHE B 44 59.038 -10.646 -11.513 1.00 0.00 H new ATOM 2595 N LEU B 45 57.665 -11.423 -4.942 1.00 0.00 N ATOM 2596 CA LEU B 45 59.029 -11.878 -4.563 1.00 0.00 C ATOM 2597 C LEU B 45 58.997 -13.408 -4.493 1.00 0.00 C ATOM 2598 O LEU B 45 58.140 -13.984 -3.851 1.00 0.00 O ATOM 2599 CB LEU B 45 59.435 -11.291 -3.194 1.00 0.00 C ATOM 2600 CG LEU B 45 59.840 -9.805 -3.334 1.00 0.00 C ATOM 2601 CD1 LEU B 45 61.142 -9.668 -4.144 1.00 0.00 C ATOM 2602 CD2 LEU B 45 58.709 -9.034 -4.025 1.00 0.00 C ATOM 0 H LEU B 45 57.206 -10.793 -4.285 1.00 0.00 H new ATOM 0 HA LEU B 45 59.760 -11.539 -5.297 1.00 0.00 H new ATOM 0 HB2 LEU B 45 58.605 -11.382 -2.493 1.00 0.00 H new ATOM 0 HB3 LEU B 45 60.266 -11.862 -2.780 1.00 0.00 H new ATOM 0 HG LEU B 45 60.012 -9.391 -2.340 1.00 0.00 H new ATOM 0 HD11 LEU B 45 61.408 -8.614 -4.230 1.00 0.00 H new ATOM 0 HD12 LEU B 45 61.944 -10.205 -3.637 1.00 0.00 H new ATOM 0 HD13 LEU B 45 60.997 -10.088 -5.139 1.00 0.00 H new ATOM 0 HD21 LEU B 45 58.991 -7.986 -4.125 1.00 0.00 H new ATOM 0 HD22 LEU B 45 58.531 -9.458 -5.013 1.00 0.00 H new ATOM 0 HD23 LEU B 45 57.800 -9.109 -3.428 1.00 0.00 H new ATOM 2614 N ASP B 46 59.909 -14.078 -5.142 1.00 0.00 N ATOM 2615 CA ASP B 46 59.937 -15.570 -5.123 1.00 0.00 C ATOM 2616 C ASP B 46 61.155 -16.020 -4.333 1.00 0.00 C ATOM 2617 O ASP B 46 62.211 -15.423 -4.401 1.00 0.00 O ATOM 2618 CB ASP B 46 60.060 -16.083 -6.560 1.00 0.00 C ATOM 2619 CG ASP B 46 58.764 -15.790 -7.321 1.00 0.00 C ATOM 2620 OD1 ASP B 46 57.737 -15.664 -6.676 1.00 0.00 O ATOM 2621 OD2 ASP B 46 58.822 -15.697 -8.537 1.00 0.00 O ATOM 0 H ASP B 46 60.650 -13.647 -5.695 1.00 0.00 H new ATOM 0 HA ASP B 46 59.026 -15.959 -4.667 1.00 0.00 H new ATOM 0 HB2 ASP B 46 60.903 -15.603 -7.058 1.00 0.00 H new ATOM 0 HB3 ASP B 46 60.259 -17.155 -6.559 1.00 0.00 H new ATOM 2626 N VAL B 47 61.015 -17.095 -3.613 1.00 0.00 N ATOM 2627 CA VAL B 47 62.146 -17.644 -2.818 1.00 0.00 C ATOM 2628 C VAL B 47 61.938 -19.161 -2.672 1.00 0.00 C ATOM 2629 O VAL B 47 62.867 -19.923 -2.548 1.00 0.00 O ATOM 2630 CB VAL B 47 62.197 -16.980 -1.414 1.00 0.00 C ATOM 2631 CG1 VAL B 47 61.863 -15.490 -1.510 1.00 0.00 C ATOM 2632 CG2 VAL B 47 61.189 -17.637 -0.462 1.00 0.00 C ATOM 0 H VAL B 47 60.148 -17.627 -3.541 1.00 0.00 H new ATOM 0 HA VAL B 47 63.088 -17.437 -3.325 1.00 0.00 H new ATOM 0 HB VAL B 47 63.208 -17.112 -1.029 1.00 0.00 H new ATOM 0 HG11 VAL B 47 61.904 -15.043 -0.517 1.00 0.00 H new ATOM 0 HG12 VAL B 47 62.585 -14.996 -2.160 1.00 0.00 H new ATOM 0 HG13 VAL B 47 60.861 -15.367 -1.922 1.00 0.00 H new ATOM 0 HG21 VAL B 47 61.243 -17.155 0.514 1.00 0.00 H new ATOM 0 HG22 VAL B 47 60.182 -17.527 -0.865 1.00 0.00 H new ATOM 0 HG23 VAL B 47 61.424 -18.696 -0.358 1.00 0.00 H new ATOM 2642 N GLN B 48 60.709 -19.598 -2.657 1.00 0.00 N ATOM 2643 CA GLN B 48 60.435 -21.053 -2.481 1.00 0.00 C ATOM 2644 C GLN B 48 60.622 -21.819 -3.793 1.00 0.00 C ATOM 2645 O GLN B 48 61.534 -22.608 -3.940 1.00 0.00 O ATOM 2646 CB GLN B 48 58.990 -21.215 -2.010 1.00 0.00 C ATOM 2647 CG GLN B 48 58.867 -20.782 -0.550 1.00 0.00 C ATOM 2648 CD GLN B 48 59.540 -21.821 0.347 1.00 0.00 C ATOM 2649 OE1 GLN B 48 59.627 -22.981 -0.008 1.00 0.00 O ATOM 2650 NE2 GLN B 48 60.015 -21.457 1.506 1.00 0.00 N ATOM 0 H GLN B 48 59.882 -19.010 -2.759 1.00 0.00 H new ATOM 0 HA GLN B 48 61.135 -21.458 -1.750 1.00 0.00 H new ATOM 0 HB2 GLN B 48 58.326 -20.616 -2.633 1.00 0.00 H new ATOM 0 HB3 GLN B 48 58.677 -22.254 -2.118 1.00 0.00 H new ATOM 0 HG2 GLN B 48 59.333 -19.807 -0.408 1.00 0.00 H new ATOM 0 HG3 GLN B 48 57.817 -20.676 -0.278 1.00 0.00 H new ATOM 0 HE21 GLN B 48 59.942 -20.484 1.804 1.00 0.00 H new ATOM 0 HE22 GLN B 48 60.459 -22.145 2.114 1.00 0.00 H new ATOM 2659 N LYS B 49 59.747 -21.615 -4.735 1.00 0.00 N ATOM 2660 CA LYS B 49 59.851 -22.354 -6.024 1.00 0.00 C ATOM 2661 C LYS B 49 61.173 -22.043 -6.730 1.00 0.00 C ATOM 2662 O LYS B 49 61.713 -22.874 -7.433 1.00 0.00 O ATOM 2663 CB LYS B 49 58.676 -21.969 -6.921 1.00 0.00 C ATOM 2664 CG LYS B 49 58.666 -20.457 -7.141 1.00 0.00 C ATOM 2665 CD LYS B 49 57.430 -20.077 -7.957 1.00 0.00 C ATOM 2666 CE LYS B 49 57.407 -18.565 -8.185 1.00 0.00 C ATOM 2667 NZ LYS B 49 56.336 -18.231 -9.165 1.00 0.00 N ATOM 0 H LYS B 49 58.962 -20.967 -4.669 1.00 0.00 H new ATOM 0 HA LYS B 49 59.823 -23.424 -5.818 1.00 0.00 H new ATOM 0 HB2 LYS B 49 58.753 -22.484 -7.878 1.00 0.00 H new ATOM 0 HB3 LYS B 49 57.739 -22.285 -6.464 1.00 0.00 H new ATOM 0 HG2 LYS B 49 58.658 -19.938 -6.183 1.00 0.00 H new ATOM 0 HG3 LYS B 49 59.571 -20.147 -7.664 1.00 0.00 H new ATOM 0 HD2 LYS B 49 57.440 -20.599 -8.914 1.00 0.00 H new ATOM 0 HD3 LYS B 49 56.527 -20.389 -7.433 1.00 0.00 H new ATOM 0 HE2 LYS B 49 57.229 -18.046 -7.243 1.00 0.00 H new ATOM 0 HE3 LYS B 49 58.374 -18.227 -8.557 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 56.318 -17.203 -9.322 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 56.526 -18.716 -10.065 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 55.416 -18.541 -8.792 1.00 0.00 H new ATOM 2681 N ASP B 50 61.702 -20.860 -6.562 1.00 0.00 N ATOM 2682 CA ASP B 50 62.990 -20.516 -7.241 1.00 0.00 C ATOM 2683 C ASP B 50 64.160 -20.790 -6.293 1.00 0.00 C ATOM 2684 O ASP B 50 64.565 -19.938 -5.527 1.00 0.00 O ATOM 2685 CB ASP B 50 62.979 -19.034 -7.623 1.00 0.00 C ATOM 2686 CG ASP B 50 61.900 -18.795 -8.679 1.00 0.00 C ATOM 2687 OD1 ASP B 50 61.480 -19.760 -9.296 1.00 0.00 O ATOM 2688 OD2 ASP B 50 61.515 -17.652 -8.856 1.00 0.00 O ATOM 0 H ASP B 50 61.302 -20.119 -5.987 1.00 0.00 H new ATOM 0 HA ASP B 50 63.103 -21.125 -8.138 1.00 0.00 H new ATOM 0 HB2 ASP B 50 62.785 -18.421 -6.743 1.00 0.00 H new ATOM 0 HB3 ASP B 50 63.954 -18.738 -8.009 1.00 0.00 H new ATOM 2693 N ALA B 51 64.711 -21.972 -6.350 1.00 0.00 N ATOM 2694 CA ALA B 51 65.861 -22.310 -5.466 1.00 0.00 C ATOM 2695 C ALA B 51 67.091 -21.526 -5.916 1.00 0.00 C ATOM 2696 O ALA B 51 67.875 -21.061 -5.110 1.00 0.00 O ATOM 2697 CB ALA B 51 66.147 -23.811 -5.556 1.00 0.00 C ATOM 0 H ALA B 51 64.412 -22.721 -6.974 1.00 0.00 H new ATOM 0 HA ALA B 51 65.621 -22.049 -4.435 1.00 0.00 H new ATOM 0 HB1 ALA B 51 66.988 -24.060 -4.910 1.00 0.00 H new ATOM 0 HB2 ALA B 51 65.267 -24.369 -5.237 1.00 0.00 H new ATOM 0 HB3 ALA B 51 66.390 -24.074 -6.586 1.00 0.00 H new ATOM 2703 N ASP B 52 67.272 -21.378 -7.199 1.00 0.00 N ATOM 2704 CA ASP B 52 68.452 -20.627 -7.702 1.00 0.00 C ATOM 2705 C ASP B 52 68.393 -19.204 -7.158 1.00 0.00 C ATOM 2706 O ASP B 52 69.389 -18.617 -6.802 1.00 0.00 O ATOM 2707 CB ASP B 52 68.442 -20.609 -9.231 1.00 0.00 C ATOM 2708 CG ASP B 52 68.741 -22.014 -9.756 1.00 0.00 C ATOM 2709 OD1 ASP B 52 69.267 -22.810 -8.996 1.00 0.00 O ATOM 2710 OD2 ASP B 52 68.446 -22.270 -10.913 1.00 0.00 O ATOM 0 H ASP B 52 66.652 -21.746 -7.920 1.00 0.00 H new ATOM 0 HA ASP B 52 69.371 -21.109 -7.368 1.00 0.00 H new ATOM 0 HB2 ASP B 52 67.472 -20.271 -9.596 1.00 0.00 H new ATOM 0 HB3 ASP B 52 69.185 -19.904 -9.603 1.00 0.00 H new ATOM 2715 N ALA B 53 67.219 -18.647 -7.103 1.00 0.00 N ATOM 2716 CA ALA B 53 67.039 -17.260 -6.595 1.00 0.00 C ATOM 2717 C ALA B 53 67.430 -17.132 -5.120 1.00 0.00 C ATOM 2718 O ALA B 53 67.964 -16.126 -4.708 1.00 0.00 O ATOM 2719 CB ALA B 53 65.563 -16.890 -6.735 1.00 0.00 C ATOM 0 H ALA B 53 66.356 -19.105 -7.396 1.00 0.00 H new ATOM 0 HA ALA B 53 67.683 -16.598 -7.174 1.00 0.00 H new ATOM 0 HB1 ALA B 53 65.406 -15.876 -6.368 1.00 0.00 H new ATOM 0 HB2 ALA B 53 65.272 -16.946 -7.784 1.00 0.00 H new ATOM 0 HB3 ALA B 53 64.957 -17.584 -6.153 1.00 0.00 H new ATOM 2725 N VAL B 54 67.153 -18.117 -4.315 1.00 0.00 N ATOM 2726 CA VAL B 54 67.495 -18.013 -2.869 1.00 0.00 C ATOM 2727 C VAL B 54 68.997 -18.097 -2.638 1.00 0.00 C ATOM 2728 O VAL B 54 69.577 -17.250 -2.008 1.00 0.00 O ATOM 2729 CB VAL B 54 66.835 -19.166 -2.117 1.00 0.00 C ATOM 2730 CG1 VAL B 54 67.246 -19.127 -0.642 1.00 0.00 C ATOM 2731 CG2 VAL B 54 65.322 -19.042 -2.221 1.00 0.00 C ATOM 0 H VAL B 54 66.705 -18.990 -4.594 1.00 0.00 H new ATOM 0 HA VAL B 54 67.138 -17.047 -2.511 1.00 0.00 H new ATOM 0 HB VAL B 54 67.156 -20.110 -2.557 1.00 0.00 H new ATOM 0 HG11 VAL B 54 66.772 -19.952 -0.110 1.00 0.00 H new ATOM 0 HG12 VAL B 54 68.329 -19.219 -0.564 1.00 0.00 H new ATOM 0 HG13 VAL B 54 66.930 -18.182 -0.201 1.00 0.00 H new ATOM 0 HG21 VAL B 54 64.852 -19.866 -1.684 1.00 0.00 H new ATOM 0 HG22 VAL B 54 65.004 -18.095 -1.785 1.00 0.00 H new ATOM 0 HG23 VAL B 54 65.025 -19.076 -3.269 1.00 0.00 H new ATOM 2741 N ASP B 55 69.625 -19.137 -3.077 1.00 0.00 N ATOM 2742 CA ASP B 55 71.083 -19.278 -2.807 1.00 0.00 C ATOM 2743 C ASP B 55 71.870 -18.163 -3.486 1.00 0.00 C ATOM 2744 O ASP B 55 72.828 -17.656 -2.947 1.00 0.00 O ATOM 2745 CB ASP B 55 71.567 -20.628 -3.341 1.00 0.00 C ATOM 2746 CG ASP B 55 70.991 -21.756 -2.480 1.00 0.00 C ATOM 2747 OD1 ASP B 55 70.419 -21.452 -1.445 1.00 0.00 O ATOM 2748 OD2 ASP B 55 71.119 -22.902 -2.878 1.00 0.00 O ATOM 0 H ASP B 55 69.202 -19.897 -3.610 1.00 0.00 H new ATOM 0 HA ASP B 55 71.244 -19.216 -1.731 1.00 0.00 H new ATOM 0 HB2 ASP B 55 71.256 -20.753 -4.378 1.00 0.00 H new ATOM 0 HB3 ASP B 55 72.656 -20.667 -3.328 1.00 0.00 H new ATOM 2753 N LYS B 56 71.505 -17.808 -4.677 1.00 0.00 N ATOM 2754 CA LYS B 56 72.267 -16.758 -5.401 1.00 0.00 C ATOM 2755 C LYS B 56 72.043 -15.370 -4.785 1.00 0.00 C ATOM 2756 O LYS B 56 72.950 -14.568 -4.706 1.00 0.00 O ATOM 2757 CB LYS B 56 71.817 -16.738 -6.858 1.00 0.00 C ATOM 2758 CG LYS B 56 72.294 -18.008 -7.561 1.00 0.00 C ATOM 2759 CD LYS B 56 71.838 -17.980 -9.021 1.00 0.00 C ATOM 2760 CE LYS B 56 72.312 -19.250 -9.730 1.00 0.00 C ATOM 2761 NZ LYS B 56 71.647 -19.350 -11.060 1.00 0.00 N ATOM 0 H LYS B 56 70.711 -18.198 -5.185 1.00 0.00 H new ATOM 0 HA LYS B 56 73.329 -16.992 -5.327 1.00 0.00 H new ATOM 0 HB2 LYS B 56 70.731 -16.667 -6.912 1.00 0.00 H new ATOM 0 HB3 LYS B 56 72.220 -15.859 -7.361 1.00 0.00 H new ATOM 0 HG2 LYS B 56 73.380 -18.080 -7.509 1.00 0.00 H new ATOM 0 HG3 LYS B 56 71.892 -18.888 -7.059 1.00 0.00 H new ATOM 0 HD2 LYS B 56 70.752 -17.907 -9.072 1.00 0.00 H new ATOM 0 HD3 LYS B 56 72.241 -17.100 -9.522 1.00 0.00 H new ATOM 0 HE2 LYS B 56 73.395 -19.229 -9.853 1.00 0.00 H new ATOM 0 HE3 LYS B 56 72.077 -20.127 -9.126 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 72.326 -19.710 -11.761 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 70.838 -20.000 -10.996 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 71.313 -18.410 -11.353 1.00 0.00 H new ATOM 2775 N ILE B 57 70.837 -15.065 -4.387 1.00 0.00 N ATOM 2776 CA ILE B 57 70.553 -13.716 -3.830 1.00 0.00 C ATOM 2777 C ILE B 57 71.073 -13.629 -2.400 1.00 0.00 C ATOM 2778 O ILE B 57 71.821 -12.745 -2.051 1.00 0.00 O ATOM 2779 CB ILE B 57 69.035 -13.485 -3.854 1.00 0.00 C ATOM 2780 CG1 ILE B 57 68.549 -13.422 -5.305 1.00 0.00 C ATOM 2781 CG2 ILE B 57 68.670 -12.184 -3.144 1.00 0.00 C ATOM 2782 CD1 ILE B 57 67.014 -13.430 -5.342 1.00 0.00 C ATOM 0 H ILE B 57 70.036 -15.695 -4.425 1.00 0.00 H new ATOM 0 HA ILE B 57 71.051 -12.953 -4.428 1.00 0.00 H new ATOM 0 HB ILE B 57 68.553 -14.313 -3.334 1.00 0.00 H new ATOM 0 HG12 ILE B 57 68.928 -12.521 -5.786 1.00 0.00 H new ATOM 0 HG13 ILE B 57 68.940 -14.271 -5.866 1.00 0.00 H new ATOM 0 HG21 ILE B 57 67.590 -12.043 -3.175 1.00 0.00 H new ATOM 0 HG22 ILE B 57 69.000 -12.231 -2.106 1.00 0.00 H new ATOM 0 HG23 ILE B 57 69.159 -11.347 -3.643 1.00 0.00 H new ATOM 0 HD11 ILE B 57 66.675 -13.385 -6.377 1.00 0.00 H new ATOM 0 HD12 ILE B 57 66.644 -14.344 -4.878 1.00 0.00 H new ATOM 0 HD13 ILE B 57 66.632 -12.566 -4.797 1.00 0.00 H new ATOM 2794 N MET B 58 70.656 -14.535 -1.572 1.00 0.00 N ATOM 2795 CA MET B 58 71.082 -14.514 -0.150 1.00 0.00 C ATOM 2796 C MET B 58 72.605 -14.625 -0.019 1.00 0.00 C ATOM 2797 O MET B 58 73.226 -13.897 0.729 1.00 0.00 O ATOM 2798 CB MET B 58 70.415 -15.684 0.590 1.00 0.00 C ATOM 2799 CG MET B 58 71.056 -15.893 1.971 1.00 0.00 C ATOM 2800 SD MET B 58 71.344 -14.298 2.776 1.00 0.00 S ATOM 2801 CE MET B 58 72.279 -14.925 4.191 1.00 0.00 C ATOM 0 H MET B 58 70.030 -15.300 -1.821 1.00 0.00 H new ATOM 0 HA MET B 58 70.776 -13.564 0.288 1.00 0.00 H new ATOM 0 HB2 MET B 58 69.349 -15.487 0.705 1.00 0.00 H new ATOM 0 HB3 MET B 58 70.509 -16.595 -0.001 1.00 0.00 H new ATOM 0 HG2 MET B 58 70.406 -16.510 2.592 1.00 0.00 H new ATOM 0 HG3 MET B 58 71.998 -16.430 1.865 1.00 0.00 H new ATOM 0 HE1 MET B 58 72.788 -14.098 4.686 1.00 0.00 H new ATOM 0 HE2 MET B 58 71.598 -15.405 4.894 1.00 0.00 H new ATOM 0 HE3 MET B 58 73.016 -15.651 3.847 1.00 0.00 H new ATOM 2811 N LYS B 59 73.207 -15.544 -0.711 1.00 0.00 N ATOM 2812 CA LYS B 59 74.682 -15.712 -0.591 1.00 0.00 C ATOM 2813 C LYS B 59 75.400 -14.484 -1.153 1.00 0.00 C ATOM 2814 O LYS B 59 76.384 -14.029 -0.607 1.00 0.00 O ATOM 2815 CB LYS B 59 75.118 -16.969 -1.343 1.00 0.00 C ATOM 2816 CG LYS B 59 76.613 -17.214 -1.136 1.00 0.00 C ATOM 2817 CD LYS B 59 77.019 -18.477 -1.900 1.00 0.00 C ATOM 2818 CE LYS B 59 78.513 -18.738 -1.710 1.00 0.00 C ATOM 2819 NZ LYS B 59 78.903 -19.944 -2.494 1.00 0.00 N ATOM 0 H LYS B 59 72.746 -16.187 -1.355 1.00 0.00 H new ATOM 0 HA LYS B 59 74.946 -15.816 0.461 1.00 0.00 H new ATOM 0 HB2 LYS B 59 74.549 -17.829 -0.990 1.00 0.00 H new ATOM 0 HB3 LYS B 59 74.903 -16.859 -2.406 1.00 0.00 H new ATOM 0 HG2 LYS B 59 77.188 -16.358 -1.490 1.00 0.00 H new ATOM 0 HG3 LYS B 59 76.833 -17.329 -0.075 1.00 0.00 H new ATOM 0 HD2 LYS B 59 76.443 -19.330 -1.543 1.00 0.00 H new ATOM 0 HD3 LYS B 59 76.792 -18.361 -2.960 1.00 0.00 H new ATOM 0 HE2 LYS B 59 79.090 -17.874 -2.039 1.00 0.00 H new ATOM 0 HE3 LYS B 59 78.737 -18.888 -0.654 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 79.919 -20.126 -2.368 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 78.360 -20.766 -2.160 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 78.702 -19.783 -3.502 1.00 0.00 H new ATOM 2833 N GLU B 60 74.922 -13.947 -2.242 1.00 0.00 N ATOM 2834 CA GLU B 60 75.586 -12.750 -2.838 1.00 0.00 C ATOM 2835 C GLU B 60 75.017 -11.483 -2.205 1.00 0.00 C ATOM 2836 O GLU B 60 75.609 -10.425 -2.294 1.00 0.00 O ATOM 2837 CB GLU B 60 75.357 -12.726 -4.352 1.00 0.00 C ATOM 2838 CG GLU B 60 75.948 -13.994 -4.976 1.00 0.00 C ATOM 2839 CD GLU B 60 77.475 -13.933 -4.899 1.00 0.00 C ATOM 2840 OE1 GLU B 60 78.005 -12.835 -4.869 1.00 0.00 O ATOM 2841 OE2 GLU B 60 78.089 -14.988 -4.873 1.00 0.00 O ATOM 0 H GLU B 60 74.101 -14.284 -2.745 1.00 0.00 H new ATOM 0 HA GLU B 60 76.658 -12.799 -2.644 1.00 0.00 H new ATOM 0 HB2 GLU B 60 74.291 -12.664 -4.569 1.00 0.00 H new ATOM 0 HB3 GLU B 60 75.823 -11.842 -4.787 1.00 0.00 H new ATOM 0 HG2 GLU B 60 75.581 -14.876 -4.451 1.00 0.00 H new ATOM 0 HG3 GLU B 60 75.628 -14.085 -6.014 1.00 0.00 H new ATOM 2848 N LEU B 61 73.872 -11.583 -1.551 1.00 0.00 N ATOM 2849 CA LEU B 61 73.292 -10.354 -0.907 1.00 0.00 C ATOM 2850 C LEU B 61 73.943 -10.234 0.467 1.00 0.00 C ATOM 2851 O LEU B 61 74.026 -9.167 1.042 1.00 0.00 O ATOM 2852 CB LEU B 61 71.764 -10.411 -0.834 1.00 0.00 C ATOM 2853 CG LEU B 61 71.213 -9.160 -0.146 1.00 0.00 C ATOM 2854 CD1 LEU B 61 71.517 -7.918 -0.992 1.00 0.00 C ATOM 2855 CD2 LEU B 61 69.699 -9.318 0.008 1.00 0.00 C ATOM 0 H LEU B 61 73.329 -12.439 -1.439 1.00 0.00 H new ATOM 0 HA LEU B 61 73.504 -9.466 -1.503 1.00 0.00 H new ATOM 0 HB2 LEU B 61 71.349 -10.493 -1.839 1.00 0.00 H new ATOM 0 HB3 LEU B 61 71.453 -11.301 -0.287 1.00 0.00 H new ATOM 0 HG LEU B 61 71.681 -9.040 0.831 1.00 0.00 H new ATOM 0 HD11 LEU B 61 71.121 -7.033 -0.494 1.00 0.00 H new ATOM 0 HD12 LEU B 61 72.595 -7.815 -1.112 1.00 0.00 H new ATOM 0 HD13 LEU B 61 71.051 -8.022 -1.972 1.00 0.00 H new ATOM 0 HD21 LEU B 61 69.289 -8.434 0.497 1.00 0.00 H new ATOM 0 HD22 LEU B 61 69.243 -9.433 -0.975 1.00 0.00 H new ATOM 0 HD23 LEU B 61 69.485 -10.200 0.612 1.00 0.00 H new ATOM 2867 N ASP B 62 74.514 -11.318 0.946 1.00 0.00 N ATOM 2868 CA ASP B 62 75.284 -11.259 2.221 1.00 0.00 C ATOM 2869 C ASP B 62 76.702 -10.966 1.761 1.00 0.00 C ATOM 2870 O ASP B 62 77.674 -11.570 2.138 1.00 0.00 O ATOM 2871 CB ASP B 62 75.211 -12.571 2.996 1.00 0.00 C ATOM 2872 CG ASP B 62 75.891 -12.380 4.352 1.00 0.00 C ATOM 2873 OD1 ASP B 62 76.976 -11.826 4.374 1.00 0.00 O ATOM 2874 OD2 ASP B 62 75.310 -12.775 5.343 1.00 0.00 O ATOM 0 H ASP B 62 74.477 -12.237 0.505 1.00 0.00 H new ATOM 0 HA ASP B 62 74.893 -10.510 2.910 1.00 0.00 H new ATOM 0 HB2 ASP B 62 74.172 -12.871 3.134 1.00 0.00 H new ATOM 0 HB3 ASP B 62 75.701 -13.368 2.437 1.00 0.00 H new ATOM 2879 N GLU B 63 76.730 -10.030 0.881 1.00 0.00 N ATOM 2880 CA GLU B 63 77.974 -9.566 0.228 1.00 0.00 C ATOM 2881 C GLU B 63 79.125 -9.512 1.241 1.00 0.00 C ATOM 2882 O GLU B 63 80.282 -9.522 0.869 1.00 0.00 O ATOM 2883 CB GLU B 63 77.707 -8.185 -0.341 1.00 0.00 C ATOM 2884 CG GLU B 63 78.895 -7.716 -1.188 1.00 0.00 C ATOM 2885 CD GLU B 63 79.043 -8.618 -2.417 1.00 0.00 C ATOM 2886 OE1 GLU B 63 78.068 -9.257 -2.779 1.00 0.00 O ATOM 2887 OE2 GLU B 63 80.127 -8.651 -2.976 1.00 0.00 O ATOM 0 H GLU B 63 75.895 -9.536 0.567 1.00 0.00 H new ATOM 0 HA GLU B 63 78.265 -10.255 -0.565 1.00 0.00 H new ATOM 0 HB2 GLU B 63 76.803 -8.204 -0.950 1.00 0.00 H new ATOM 0 HB3 GLU B 63 77.529 -7.479 0.470 1.00 0.00 H new ATOM 0 HG2 GLU B 63 78.746 -6.682 -1.500 1.00 0.00 H new ATOM 0 HG3 GLU B 63 79.809 -7.741 -0.595 1.00 0.00 H new ATOM 2894 N ASN B 64 78.834 -9.475 2.515 1.00 0.00 N ATOM 2895 CA ASN B 64 79.934 -9.442 3.528 1.00 0.00 C ATOM 2896 C ASN B 64 80.334 -10.882 3.847 1.00 0.00 C ATOM 2897 O ASN B 64 81.220 -11.145 4.637 1.00 0.00 O ATOM 2898 CB ASN B 64 79.450 -8.731 4.793 1.00 0.00 C ATOM 2899 CG ASN B 64 79.277 -7.240 4.496 1.00 0.00 C ATOM 2900 OD1 ASN B 64 78.199 -6.699 4.641 1.00 0.00 O ATOM 2901 ND2 ASN B 64 80.303 -6.548 4.078 1.00 0.00 N ATOM 0 H ASN B 64 77.889 -9.466 2.898 1.00 0.00 H new ATOM 0 HA ASN B 64 80.794 -8.898 3.138 1.00 0.00 H new ATOM 0 HB2 ASN B 64 78.505 -9.160 5.127 1.00 0.00 H new ATOM 0 HB3 ASN B 64 80.167 -8.872 5.601 1.00 0.00 H new ATOM 0 HD21 ASN B 64 80.199 -5.554 3.874 1.00 0.00 H new ATOM 0 HD22 ASN B 64 81.208 -7.001 3.956 1.00 0.00 H new ATOM 2908 N GLY B 65 79.692 -11.808 3.200 1.00 0.00 N ATOM 2909 CA GLY B 65 80.012 -13.254 3.392 1.00 0.00 C ATOM 2910 C GLY B 65 79.763 -13.708 4.838 1.00 0.00 C ATOM 2911 O GLY B 65 80.480 -14.541 5.354 1.00 0.00 O ATOM 0 H GLY B 65 78.943 -11.625 2.532 1.00 0.00 H new ATOM 0 HA2 GLY B 65 79.405 -13.853 2.714 1.00 0.00 H new ATOM 0 HA3 GLY B 65 81.055 -13.433 3.130 1.00 0.00 H new ATOM 2915 N ASP B 66 78.764 -13.176 5.501 1.00 0.00 N ATOM 2916 CA ASP B 66 78.493 -13.601 6.921 1.00 0.00 C ATOM 2917 C ASP B 66 77.328 -14.603 6.974 1.00 0.00 C ATOM 2918 O ASP B 66 77.129 -15.272 7.968 1.00 0.00 O ATOM 2919 CB ASP B 66 78.165 -12.373 7.774 1.00 0.00 C ATOM 2920 CG ASP B 66 76.901 -11.703 7.245 1.00 0.00 C ATOM 2921 OD1 ASP B 66 75.832 -12.133 7.631 1.00 0.00 O ATOM 2922 OD2 ASP B 66 77.027 -10.768 6.474 1.00 0.00 O ATOM 0 H ASP B 66 78.127 -12.472 5.129 1.00 0.00 H new ATOM 0 HA ASP B 66 79.385 -14.088 7.316 1.00 0.00 H new ATOM 0 HB2 ASP B 66 78.024 -12.668 8.814 1.00 0.00 H new ATOM 0 HB3 ASP B 66 78.998 -11.670 7.752 1.00 0.00 H new ATOM 2927 N GLY B 67 76.577 -14.745 5.916 1.00 0.00 N ATOM 2928 CA GLY B 67 75.458 -15.741 5.926 1.00 0.00 C ATOM 2929 C GLY B 67 74.215 -15.156 6.603 1.00 0.00 C ATOM 2930 O GLY B 67 73.154 -15.777 6.620 1.00 0.00 O ATOM 0 H GLY B 67 76.685 -14.220 5.048 1.00 0.00 H new ATOM 0 HA2 GLY B 67 75.217 -16.034 4.904 1.00 0.00 H new ATOM 0 HA3 GLY B 67 75.773 -16.643 6.451 1.00 0.00 H new ATOM 2934 N GLU B 68 74.323 -13.960 7.146 1.00 0.00 N ATOM 2935 CA GLU B 68 73.163 -13.308 7.804 1.00 0.00 C ATOM 2936 C GLU B 68 72.947 -11.961 7.115 1.00 0.00 C ATOM 2937 O GLU B 68 73.882 -11.313 6.684 1.00 0.00 O ATOM 2938 CB GLU B 68 73.467 -13.135 9.295 1.00 0.00 C ATOM 2939 CG GLU B 68 73.451 -14.510 9.968 1.00 0.00 C ATOM 2940 CD GLU B 68 73.842 -14.375 11.441 1.00 0.00 C ATOM 2941 OE1 GLU B 68 74.284 -13.305 11.823 1.00 0.00 O ATOM 2942 OE2 GLU B 68 73.690 -15.346 12.164 1.00 0.00 O ATOM 0 H GLU B 68 75.182 -13.410 7.155 1.00 0.00 H new ATOM 0 HA GLU B 68 72.257 -13.908 7.718 1.00 0.00 H new ATOM 0 HB2 GLU B 68 74.440 -12.661 9.429 1.00 0.00 H new ATOM 0 HB3 GLU B 68 72.728 -12.481 9.757 1.00 0.00 H new ATOM 0 HG2 GLU B 68 72.459 -14.953 9.886 1.00 0.00 H new ATOM 0 HG3 GLU B 68 74.143 -15.181 9.459 1.00 0.00 H new ATOM 2949 N VAL B 69 71.727 -11.563 6.956 1.00 0.00 N ATOM 2950 CA VAL B 69 71.430 -10.293 6.239 1.00 0.00 C ATOM 2951 C VAL B 69 70.987 -9.218 7.230 1.00 0.00 C ATOM 2952 O VAL B 69 70.102 -9.414 8.031 1.00 0.00 O ATOM 2953 CB VAL B 69 70.313 -10.609 5.250 1.00 0.00 C ATOM 2954 CG1 VAL B 69 69.917 -9.366 4.447 1.00 0.00 C ATOM 2955 CG2 VAL B 69 70.812 -11.685 4.284 1.00 0.00 C ATOM 0 H VAL B 69 70.907 -12.066 7.295 1.00 0.00 H new ATOM 0 HA VAL B 69 72.311 -9.911 5.723 1.00 0.00 H new ATOM 0 HB VAL B 69 69.439 -10.953 5.804 1.00 0.00 H new ATOM 0 HG11 VAL B 69 69.119 -9.622 3.750 1.00 0.00 H new ATOM 0 HG12 VAL B 69 69.569 -8.589 5.128 1.00 0.00 H new ATOM 0 HG13 VAL B 69 70.781 -9.002 3.891 1.00 0.00 H new ATOM 0 HG21 VAL B 69 70.026 -11.924 3.568 1.00 0.00 H new ATOM 0 HG22 VAL B 69 71.688 -11.317 3.751 1.00 0.00 H new ATOM 0 HG23 VAL B 69 71.078 -12.582 4.844 1.00 0.00 H new ATOM 2965 N ASP B 70 71.596 -8.068 7.172 1.00 0.00 N ATOM 2966 CA ASP B 70 71.195 -6.983 8.102 1.00 0.00 C ATOM 2967 C ASP B 70 69.937 -6.326 7.541 1.00 0.00 C ATOM 2968 O ASP B 70 69.569 -6.546 6.403 1.00 0.00 O ATOM 2969 CB ASP B 70 72.321 -5.950 8.220 1.00 0.00 C ATOM 2970 CG ASP B 70 72.491 -5.216 6.889 1.00 0.00 C ATOM 2971 OD1 ASP B 70 71.996 -5.720 5.897 1.00 0.00 O ATOM 2972 OD2 ASP B 70 73.107 -4.163 6.888 1.00 0.00 O ATOM 0 H ASP B 70 72.349 -7.835 6.525 1.00 0.00 H new ATOM 0 HA ASP B 70 71.000 -7.387 9.095 1.00 0.00 H new ATOM 0 HB2 ASP B 70 72.092 -5.237 9.012 1.00 0.00 H new ATOM 0 HB3 ASP B 70 73.253 -6.444 8.495 1.00 0.00 H new ATOM 2977 N PHE B 71 69.266 -5.539 8.319 1.00 0.00 N ATOM 2978 CA PHE B 71 68.023 -4.895 7.819 1.00 0.00 C ATOM 2979 C PHE B 71 68.315 -4.012 6.594 1.00 0.00 C ATOM 2980 O PHE B 71 67.505 -3.915 5.703 1.00 0.00 O ATOM 2981 CB PHE B 71 67.413 -4.038 8.929 1.00 0.00 C ATOM 2982 CG PHE B 71 68.308 -2.856 9.206 1.00 0.00 C ATOM 2983 CD1 PHE B 71 68.123 -1.663 8.498 1.00 0.00 C ATOM 2984 CD2 PHE B 71 69.316 -2.948 10.172 1.00 0.00 C ATOM 2985 CE1 PHE B 71 68.946 -0.561 8.755 1.00 0.00 C ATOM 2986 CE2 PHE B 71 70.141 -1.848 10.429 1.00 0.00 C ATOM 2987 CZ PHE B 71 69.957 -0.653 9.721 1.00 0.00 C ATOM 0 H PHE B 71 69.520 -5.311 9.280 1.00 0.00 H new ATOM 0 HA PHE B 71 67.324 -5.677 7.523 1.00 0.00 H new ATOM 0 HB2 PHE B 71 66.421 -3.695 8.634 1.00 0.00 H new ATOM 0 HB3 PHE B 71 67.288 -4.632 9.834 1.00 0.00 H new ATOM 0 HD1 PHE B 71 67.344 -1.593 7.753 1.00 0.00 H new ATOM 0 HD2 PHE B 71 69.457 -3.868 10.719 1.00 0.00 H new ATOM 0 HE1 PHE B 71 68.802 0.360 8.209 1.00 0.00 H new ATOM 0 HE2 PHE B 71 70.920 -1.920 11.173 1.00 0.00 H new ATOM 0 HZ PHE B 71 70.594 0.196 9.920 1.00 0.00 H new ATOM 2997 N GLN B 72 69.436 -3.339 6.547 1.00 0.00 N ATOM 2998 CA GLN B 72 69.710 -2.449 5.371 1.00 0.00 C ATOM 2999 C GLN B 72 69.767 -3.267 4.067 1.00 0.00 C ATOM 3000 O GLN B 72 69.266 -2.849 3.043 1.00 0.00 O ATOM 3001 CB GLN B 72 71.039 -1.716 5.575 1.00 0.00 C ATOM 3002 CG GLN B 72 71.267 -0.740 4.417 1.00 0.00 C ATOM 3003 CD GLN B 72 72.546 0.061 4.663 1.00 0.00 C ATOM 3004 OE1 GLN B 72 73.069 0.072 5.761 1.00 0.00 O ATOM 3005 NE2 GLN B 72 73.077 0.735 3.681 1.00 0.00 N ATOM 0 H GLN B 72 70.166 -3.363 7.259 1.00 0.00 H new ATOM 0 HA GLN B 72 68.900 -1.724 5.292 1.00 0.00 H new ATOM 0 HB2 GLN B 72 71.027 -1.177 6.522 1.00 0.00 H new ATOM 0 HB3 GLN B 72 71.858 -2.433 5.627 1.00 0.00 H new ATOM 0 HG2 GLN B 72 71.344 -1.287 3.477 1.00 0.00 H new ATOM 0 HG3 GLN B 72 70.416 -0.065 4.324 1.00 0.00 H new ATOM 0 HE21 GLN B 72 72.638 0.726 2.760 1.00 0.00 H new ATOM 0 HE22 GLN B 72 73.931 1.271 3.834 1.00 0.00 H new ATOM 3014 N GLU B 73 70.384 -4.416 4.088 1.00 0.00 N ATOM 3015 CA GLU B 73 70.469 -5.246 2.843 1.00 0.00 C ATOM 3016 C GLU B 73 69.096 -5.828 2.473 1.00 0.00 C ATOM 3017 O GLU B 73 68.737 -5.924 1.315 1.00 0.00 O ATOM 3018 CB GLU B 73 71.433 -6.414 3.085 1.00 0.00 C ATOM 3019 CG GLU B 73 72.880 -5.917 3.145 1.00 0.00 C ATOM 3020 CD GLU B 73 73.784 -7.079 3.571 1.00 0.00 C ATOM 3021 OE1 GLU B 73 73.260 -8.157 3.797 1.00 0.00 O ATOM 3022 OE2 GLU B 73 74.984 -6.874 3.666 1.00 0.00 O ATOM 0 H GLU B 73 70.834 -4.820 4.910 1.00 0.00 H new ATOM 0 HA GLU B 73 70.819 -4.609 2.031 1.00 0.00 H new ATOM 0 HB2 GLU B 73 71.177 -6.916 4.018 1.00 0.00 H new ATOM 0 HB3 GLU B 73 71.329 -7.150 2.288 1.00 0.00 H new ATOM 0 HG2 GLU B 73 73.189 -5.536 2.172 1.00 0.00 H new ATOM 0 HG3 GLU B 73 72.967 -5.092 3.852 1.00 0.00 H new ATOM 3029 N PHE B 74 68.355 -6.256 3.454 1.00 0.00 N ATOM 3030 CA PHE B 74 67.024 -6.896 3.207 1.00 0.00 C ATOM 3031 C PHE B 74 65.984 -5.919 2.640 1.00 0.00 C ATOM 3032 O PHE B 74 65.201 -6.269 1.787 1.00 0.00 O ATOM 3033 CB PHE B 74 66.523 -7.452 4.540 1.00 0.00 C ATOM 3034 CG PHE B 74 65.164 -8.076 4.362 1.00 0.00 C ATOM 3035 CD1 PHE B 74 65.057 -9.430 4.033 1.00 0.00 C ATOM 3036 CD2 PHE B 74 64.013 -7.301 4.541 1.00 0.00 C ATOM 3037 CE1 PHE B 74 63.795 -10.014 3.881 1.00 0.00 C ATOM 3038 CE2 PHE B 74 62.750 -7.883 4.386 1.00 0.00 C ATOM 3039 CZ PHE B 74 62.640 -9.239 4.057 1.00 0.00 C ATOM 0 H PHE B 74 68.616 -6.190 4.438 1.00 0.00 H new ATOM 0 HA PHE B 74 67.154 -7.679 2.460 1.00 0.00 H new ATOM 0 HB2 PHE B 74 67.225 -8.194 4.921 1.00 0.00 H new ATOM 0 HB3 PHE B 74 66.471 -6.653 5.280 1.00 0.00 H new ATOM 0 HD1 PHE B 74 65.948 -10.025 3.896 1.00 0.00 H new ATOM 0 HD2 PHE B 74 64.099 -6.256 4.798 1.00 0.00 H new ATOM 0 HE1 PHE B 74 63.710 -11.061 3.628 1.00 0.00 H new ATOM 0 HE2 PHE B 74 61.860 -7.286 4.520 1.00 0.00 H new ATOM 0 HZ PHE B 74 61.665 -9.688 3.939 1.00 0.00 H new ATOM 3049 N VAL B 75 65.962 -4.720 3.124 1.00 0.00 N ATOM 3050 CA VAL B 75 64.963 -3.718 2.645 1.00 0.00 C ATOM 3051 C VAL B 75 65.333 -3.188 1.256 1.00 0.00 C ATOM 3052 O VAL B 75 64.482 -2.818 0.471 1.00 0.00 O ATOM 3053 CB VAL B 75 64.925 -2.552 3.639 1.00 0.00 C ATOM 3054 CG1 VAL B 75 66.217 -1.738 3.550 1.00 0.00 C ATOM 3055 CG2 VAL B 75 63.729 -1.654 3.319 1.00 0.00 C ATOM 0 H VAL B 75 66.600 -4.378 3.843 1.00 0.00 H new ATOM 0 HA VAL B 75 63.987 -4.198 2.576 1.00 0.00 H new ATOM 0 HB VAL B 75 64.828 -2.948 4.650 1.00 0.00 H new ATOM 0 HG11 VAL B 75 66.177 -0.913 4.261 1.00 0.00 H new ATOM 0 HG12 VAL B 75 67.067 -2.378 3.785 1.00 0.00 H new ATOM 0 HG13 VAL B 75 66.329 -1.342 2.541 1.00 0.00 H new ATOM 0 HG21 VAL B 75 63.699 -0.823 4.024 1.00 0.00 H new ATOM 0 HG22 VAL B 75 63.826 -1.266 2.305 1.00 0.00 H new ATOM 0 HG23 VAL B 75 62.808 -2.232 3.399 1.00 0.00 H new ATOM 3065 N VAL B 76 66.598 -3.111 0.971 1.00 0.00 N ATOM 3066 CA VAL B 76 67.038 -2.561 -0.343 1.00 0.00 C ATOM 3067 C VAL B 76 66.696 -3.503 -1.508 1.00 0.00 C ATOM 3068 O VAL B 76 66.041 -3.114 -2.454 1.00 0.00 O ATOM 3069 CB VAL B 76 68.555 -2.338 -0.290 1.00 0.00 C ATOM 3070 CG1 VAL B 76 69.091 -2.003 -1.685 1.00 0.00 C ATOM 3071 CG2 VAL B 76 68.860 -1.179 0.661 1.00 0.00 C ATOM 0 H VAL B 76 67.352 -3.405 1.591 1.00 0.00 H new ATOM 0 HA VAL B 76 66.510 -1.624 -0.520 1.00 0.00 H new ATOM 0 HB VAL B 76 69.037 -3.249 0.065 1.00 0.00 H new ATOM 0 HG11 VAL B 76 70.169 -1.847 -1.633 1.00 0.00 H new ATOM 0 HG12 VAL B 76 68.876 -2.827 -2.365 1.00 0.00 H new ATOM 0 HG13 VAL B 76 68.610 -1.096 -2.051 1.00 0.00 H new ATOM 0 HG21 VAL B 76 69.937 -1.016 0.702 1.00 0.00 H new ATOM 0 HG22 VAL B 76 68.370 -0.274 0.301 1.00 0.00 H new ATOM 0 HG23 VAL B 76 68.491 -1.420 1.658 1.00 0.00 H new ATOM 3081 N LEU B 77 67.186 -4.710 -1.484 1.00 0.00 N ATOM 3082 CA LEU B 77 66.944 -5.632 -2.636 1.00 0.00 C ATOM 3083 C LEU B 77 65.478 -6.065 -2.756 1.00 0.00 C ATOM 3084 O LEU B 77 64.952 -6.193 -3.844 1.00 0.00 O ATOM 3085 CB LEU B 77 67.842 -6.867 -2.488 1.00 0.00 C ATOM 3086 CG LEU B 77 67.617 -7.853 -3.672 1.00 0.00 C ATOM 3087 CD1 LEU B 77 68.956 -8.451 -4.122 1.00 0.00 C ATOM 3088 CD2 LEU B 77 66.692 -9.005 -3.243 1.00 0.00 C ATOM 0 H LEU B 77 67.741 -5.100 -0.722 1.00 0.00 H new ATOM 0 HA LEU B 77 67.186 -5.087 -3.549 1.00 0.00 H new ATOM 0 HB2 LEU B 77 68.888 -6.561 -2.456 1.00 0.00 H new ATOM 0 HB3 LEU B 77 67.627 -7.368 -1.544 1.00 0.00 H new ATOM 0 HG LEU B 77 67.160 -7.298 -4.491 1.00 0.00 H new ATOM 0 HD11 LEU B 77 68.787 -9.139 -4.950 1.00 0.00 H new ATOM 0 HD12 LEU B 77 69.622 -7.651 -4.445 1.00 0.00 H new ATOM 0 HD13 LEU B 77 69.412 -8.989 -3.291 1.00 0.00 H new ATOM 0 HD21 LEU B 77 66.545 -9.685 -4.082 1.00 0.00 H new ATOM 0 HD22 LEU B 77 67.146 -9.546 -2.413 1.00 0.00 H new ATOM 0 HD23 LEU B 77 65.729 -8.601 -2.930 1.00 0.00 H new ATOM 3100 N VAL B 78 64.824 -6.335 -1.670 1.00 0.00 N ATOM 3101 CA VAL B 78 63.408 -6.806 -1.749 1.00 0.00 C ATOM 3102 C VAL B 78 62.500 -5.700 -2.294 1.00 0.00 C ATOM 3103 O VAL B 78 61.571 -5.948 -3.037 1.00 0.00 O ATOM 3104 CB VAL B 78 62.936 -7.190 -0.346 1.00 0.00 C ATOM 3105 CG1 VAL B 78 63.911 -8.198 0.278 1.00 0.00 C ATOM 3106 CG2 VAL B 78 62.866 -5.925 0.521 1.00 0.00 C ATOM 0 H VAL B 78 65.202 -6.252 -0.726 1.00 0.00 H new ATOM 0 HA VAL B 78 63.358 -7.664 -2.419 1.00 0.00 H new ATOM 0 HB VAL B 78 61.949 -7.650 -0.405 1.00 0.00 H new ATOM 0 HG11 VAL B 78 63.567 -8.466 1.277 1.00 0.00 H new ATOM 0 HG12 VAL B 78 63.956 -9.093 -0.343 1.00 0.00 H new ATOM 0 HG13 VAL B 78 64.903 -7.752 0.343 1.00 0.00 H new ATOM 0 HG21 VAL B 78 62.530 -6.189 1.524 1.00 0.00 H new ATOM 0 HG22 VAL B 78 63.854 -5.468 0.578 1.00 0.00 H new ATOM 0 HG23 VAL B 78 62.164 -5.218 0.078 1.00 0.00 H new ATOM 3116 N ALA B 79 62.756 -4.489 -1.908 1.00 0.00 N ATOM 3117 CA ALA B 79 61.903 -3.353 -2.371 1.00 0.00 C ATOM 3118 C ALA B 79 62.215 -2.988 -3.830 1.00 0.00 C ATOM 3119 O ALA B 79 61.360 -2.493 -4.538 1.00 0.00 O ATOM 3120 CB ALA B 79 62.116 -2.139 -1.469 1.00 0.00 C ATOM 0 H ALA B 79 63.523 -4.228 -1.288 1.00 0.00 H new ATOM 0 HA ALA B 79 60.860 -3.664 -2.315 1.00 0.00 H new ATOM 0 HB1 ALA B 79 61.491 -1.316 -1.814 1.00 0.00 H new ATOM 0 HB2 ALA B 79 61.847 -2.395 -0.444 1.00 0.00 H new ATOM 0 HB3 ALA B 79 63.163 -1.839 -1.504 1.00 0.00 H new ATOM 3126 N ALA B 80 63.406 -3.241 -4.307 1.00 0.00 N ATOM 3127 CA ALA B 80 63.693 -2.907 -5.737 1.00 0.00 C ATOM 3128 C ALA B 80 62.771 -3.778 -6.600 1.00 0.00 C ATOM 3129 O ALA B 80 62.055 -3.303 -7.443 1.00 0.00 O ATOM 3130 CB ALA B 80 65.178 -3.189 -6.057 1.00 0.00 C ATOM 0 H ALA B 80 64.178 -3.655 -3.784 1.00 0.00 H new ATOM 0 HA ALA B 80 63.510 -1.851 -5.939 1.00 0.00 H new ATOM 0 HB1 ALA B 80 65.379 -2.943 -7.100 1.00 0.00 H new ATOM 0 HB2 ALA B 80 65.811 -2.579 -5.412 1.00 0.00 H new ATOM 0 HB3 ALA B 80 65.393 -4.244 -5.885 1.00 0.00 H new ATOM 3136 N LEU B 81 62.847 -5.057 -6.404 1.00 0.00 N ATOM 3137 CA LEU B 81 62.022 -6.014 -7.205 1.00 0.00 C ATOM 3138 C LEU B 81 60.523 -5.728 -7.000 1.00 0.00 C ATOM 3139 O LEU B 81 59.723 -5.906 -7.890 1.00 0.00 O ATOM 3140 CB LEU B 81 62.323 -7.438 -6.737 1.00 0.00 C ATOM 3141 CG LEU B 81 63.811 -7.754 -6.928 1.00 0.00 C ATOM 3142 CD1 LEU B 81 64.153 -9.039 -6.171 1.00 0.00 C ATOM 3143 CD2 LEU B 81 64.127 -7.949 -8.412 1.00 0.00 C ATOM 0 H LEU B 81 63.455 -5.496 -5.712 1.00 0.00 H new ATOM 0 HA LEU B 81 62.266 -5.899 -8.261 1.00 0.00 H new ATOM 0 HB2 LEU B 81 62.052 -7.549 -5.687 1.00 0.00 H new ATOM 0 HB3 LEU B 81 61.718 -8.149 -7.299 1.00 0.00 H new ATOM 0 HG LEU B 81 64.402 -6.922 -6.545 1.00 0.00 H new ATOM 0 HD11 LEU B 81 65.210 -9.269 -6.303 1.00 0.00 H new ATOM 0 HD12 LEU B 81 63.941 -8.904 -5.110 1.00 0.00 H new ATOM 0 HD13 LEU B 81 63.552 -9.861 -6.559 1.00 0.00 H new ATOM 0 HD21 LEU B 81 65.187 -8.173 -8.532 1.00 0.00 H new ATOM 0 HD22 LEU B 81 63.535 -8.776 -8.804 1.00 0.00 H new ATOM 0 HD23 LEU B 81 63.884 -7.038 -8.958 1.00 0.00 H new ATOM 3155 N THR B 82 60.137 -5.338 -5.821 1.00 0.00 N ATOM 3156 CA THR B 82 58.685 -5.087 -5.549 1.00 0.00 C ATOM 3157 C THR B 82 58.121 -3.977 -6.461 1.00 0.00 C ATOM 3158 O THR B 82 57.137 -4.163 -7.157 1.00 0.00 O ATOM 3159 CB THR B 82 58.526 -4.663 -4.087 1.00 0.00 C ATOM 3160 OG1 THR B 82 58.921 -5.731 -3.239 1.00 0.00 O ATOM 3161 CG2 THR B 82 57.067 -4.293 -3.810 1.00 0.00 C ATOM 0 H THR B 82 60.760 -5.180 -5.029 1.00 0.00 H new ATOM 0 HA THR B 82 58.132 -6.004 -5.751 1.00 0.00 H new ATOM 0 HB THR B 82 59.156 -3.795 -3.892 1.00 0.00 H new ATOM 0 HG1 THR B 82 59.875 -5.648 -3.031 1.00 0.00 H new ATOM 0 HG21 THR B 82 56.960 -3.992 -2.768 1.00 0.00 H new ATOM 0 HG22 THR B 82 56.771 -3.468 -4.458 1.00 0.00 H new ATOM 0 HG23 THR B 82 56.429 -5.155 -4.006 1.00 0.00 H new ATOM 3169 N VAL B 83 58.732 -2.827 -6.453 1.00 0.00 N ATOM 3170 CA VAL B 83 58.236 -1.692 -7.294 1.00 0.00 C ATOM 3171 C VAL B 83 58.552 -1.924 -8.763 1.00 0.00 C ATOM 3172 O VAL B 83 57.782 -1.607 -9.647 1.00 0.00 O ATOM 3173 CB VAL B 83 58.939 -0.413 -6.863 1.00 0.00 C ATOM 3174 CG1 VAL B 83 58.365 0.766 -7.639 1.00 0.00 C ATOM 3175 CG2 VAL B 83 58.730 -0.200 -5.374 1.00 0.00 C ATOM 0 H VAL B 83 59.561 -2.618 -5.897 1.00 0.00 H new ATOM 0 HA VAL B 83 57.157 -1.616 -7.163 1.00 0.00 H new ATOM 0 HB VAL B 83 60.006 -0.493 -7.069 1.00 0.00 H new ATOM 0 HG11 VAL B 83 58.867 1.683 -7.332 1.00 0.00 H new ATOM 0 HG12 VAL B 83 58.519 0.608 -8.707 1.00 0.00 H new ATOM 0 HG13 VAL B 83 57.298 0.851 -7.435 1.00 0.00 H new ATOM 0 HG21 VAL B 83 59.233 0.716 -5.063 1.00 0.00 H new ATOM 0 HG22 VAL B 83 57.664 -0.117 -5.164 1.00 0.00 H new ATOM 0 HG23 VAL B 83 59.143 -1.045 -4.824 1.00 0.00 H new ATOM 3185 N ALA B 84 59.703 -2.446 -9.014 1.00 0.00 N ATOM 3186 CA ALA B 84 60.139 -2.682 -10.408 1.00 0.00 C ATOM 3187 C ALA B 84 59.167 -3.631 -11.109 1.00 0.00 C ATOM 3188 O ALA B 84 58.845 -3.462 -12.268 1.00 0.00 O ATOM 3189 CB ALA B 84 61.541 -3.296 -10.410 1.00 0.00 C ATOM 0 H ALA B 84 60.377 -2.726 -8.301 1.00 0.00 H new ATOM 0 HA ALA B 84 60.155 -1.731 -10.940 1.00 0.00 H new ATOM 0 HB1 ALA B 84 61.861 -3.469 -11.438 1.00 0.00 H new ATOM 0 HB2 ALA B 84 62.238 -2.614 -9.923 1.00 0.00 H new ATOM 0 HB3 ALA B 84 61.524 -4.243 -9.871 1.00 0.00 H new ATOM 3195 N CYS B 85 58.697 -4.624 -10.412 1.00 0.00 N ATOM 3196 CA CYS B 85 57.742 -5.587 -11.022 1.00 0.00 C ATOM 3197 C CYS B 85 56.459 -4.859 -11.417 1.00 0.00 C ATOM 3198 O CYS B 85 55.876 -5.131 -12.443 1.00 0.00 O ATOM 3199 CB CYS B 85 57.411 -6.692 -10.015 1.00 0.00 C ATOM 3200 SG CYS B 85 56.249 -7.860 -10.765 1.00 0.00 S ATOM 0 H CYS B 85 58.935 -4.812 -9.438 1.00 0.00 H new ATOM 0 HA CYS B 85 58.196 -6.028 -11.909 1.00 0.00 H new ATOM 0 HB2 CYS B 85 58.322 -7.210 -9.715 1.00 0.00 H new ATOM 0 HB3 CYS B 85 56.978 -6.260 -9.113 1.00 0.00 H new ATOM 0 HG CYS B 85 56.403 -9.033 -10.225 1.00 0.00 H new ATOM 3206 N ASN B 86 56.001 -3.949 -10.595 1.00 0.00 N ATOM 3207 CA ASN B 86 54.738 -3.218 -10.920 1.00 0.00 C ATOM 3208 C ASN B 86 54.882 -2.458 -12.242 1.00 0.00 C ATOM 3209 O ASN B 86 53.965 -2.407 -13.038 1.00 0.00 O ATOM 3210 CB ASN B 86 54.426 -2.222 -9.803 1.00 0.00 C ATOM 3211 CG ASN B 86 53.132 -1.470 -10.131 1.00 0.00 C ATOM 3212 OD1 ASN B 86 53.103 -0.255 -10.109 1.00 0.00 O ATOM 3213 ND2 ASN B 86 52.055 -2.141 -10.436 1.00 0.00 N ATOM 0 H ASN B 86 56.445 -3.681 -9.716 1.00 0.00 H new ATOM 0 HA ASN B 86 53.929 -3.943 -11.013 1.00 0.00 H new ATOM 0 HB2 ASN B 86 54.323 -2.746 -8.853 1.00 0.00 H new ATOM 0 HB3 ASN B 86 55.250 -1.517 -9.690 1.00 0.00 H new ATOM 0 HD21 ASN B 86 51.191 -1.646 -10.655 1.00 0.00 H new ATOM 0 HD22 ASN B 86 52.078 -3.161 -10.455 1.00 0.00 H new ATOM 3220 N ASN B 87 56.013 -1.855 -12.482 1.00 0.00 N ATOM 3221 CA ASN B 87 56.186 -1.091 -13.752 1.00 0.00 C ATOM 3222 C ASN B 87 56.013 -2.019 -14.958 1.00 0.00 C ATOM 3223 O ASN B 87 55.380 -1.669 -15.935 1.00 0.00 O ATOM 3224 CB ASN B 87 57.581 -0.465 -13.781 1.00 0.00 C ATOM 3225 CG ASN B 87 57.656 0.659 -12.746 1.00 0.00 C ATOM 3226 OD1 ASN B 87 56.657 1.279 -12.435 1.00 0.00 O ATOM 3227 ND2 ASN B 87 58.801 0.951 -12.196 1.00 0.00 N ATOM 0 H ASN B 87 56.821 -1.857 -11.859 1.00 0.00 H new ATOM 0 HA ASN B 87 55.430 -0.307 -13.801 1.00 0.00 H new ATOM 0 HB2 ASN B 87 58.336 -1.222 -13.567 1.00 0.00 H new ATOM 0 HB3 ASN B 87 57.795 -0.073 -14.775 1.00 0.00 H new ATOM 0 HD21 ASN B 87 58.859 1.699 -11.505 1.00 0.00 H new ATOM 0 HD22 ASN B 87 59.639 0.431 -12.456 1.00 0.00 H new