REMARK   1 CREATED WITH OPENMM 7.7, 2022-11-04
ATOM      1  N   CYS A   1       3.326   1.548   0.000  1.00  0.00           N  
ATOM      2  H2  CYS A   1       2.643   1.448  -0.987  1.00  0.00           H  
ATOM      3  H3  CYS A   1       2.495   1.314   0.839  1.00  0.00           H  
ATOM      4  H   CYS A   1       3.909   0.724   0.000  1.00  0.00           H  
ATOM      5  CA  CYS A   1       3.970   2.846   0.000  1.00  0.00           C  
ATOM      6  HA  CYS A   1       3.672   3.400  -0.890  1.00  0.00           H  
ATOM      7  CB  CYS A   1       3.577   3.654   1.232  1.00  0.00           C  
ATOM      8  HB2 CYS A   1       2.497   3.801   1.241  1.00  0.00           H  
ATOM      9  HB3 CYS A   1       3.877   3.116   2.131  1.00  0.00           H  
ATOM     10  SG  CYS A   1       4.310   5.304   1.366  1.00  0.00           S  
ATOM     11  HG  CYS A   1       3.725   5.622   2.518  1.00  0.00           H  
ATOM     12  C   CYS A   1       5.486   2.705   0.000  1.00  0.00           C  
ATOM     13  O   CYS A   1       6.009   1.593   0.000  1.00  0.00           O  
ATOM     14  N   HIS A   2       6.191   3.839   0.000  1.00  0.00           N  
ATOM     15  H   HIS A   2       5.715   4.730   0.000  1.00  0.00           H  
ATOM     16  CA  HIS A   2       7.640   3.839   0.000  1.00  0.00           C  
ATOM     17  HA  HIS A   2       8.004   3.325   0.890  1.00  0.00           H  
ATOM     18  CB  HIS A   2       8.189   3.127  -1.232  1.00  0.00           C  
ATOM     19  HB2 HIS A   2       7.841   2.094  -1.241  1.00  0.00           H  
ATOM     20  HB3 HIS A   2       7.841   3.636  -2.131  1.00  0.00           H  
ATOM     21  CG  HIS A   2       9.696   3.076  -1.321  1.00  0.00           C  
ATOM     22  ND1 HIS A   2      10.350   2.463  -2.383  1.00  0.00           N  
ATOM     23  CE1 HIS A   2      11.650   2.579  -2.183  1.00  0.00           C  
ATOM     24  HE1 HIS A   2      12.352   2.162  -2.905  1.00  0.00           H  
ATOM     25  NE2 HIS A   2      11.852   3.226  -1.062  1.00  0.00           N  
ATOM     26  HE2 HIS A   2      12.759   3.448  -0.677  1.00  0.00           H  
ATOM     27  CD2 HIS A   2      10.662   3.554  -0.492  1.00  0.00           C  
ATOM     28  HD2 HIS A   2      10.641   4.099   0.451  1.00  0.00           H  
ATOM     29  C   HIS A   2       8.188   5.259   0.000  1.00  0.00           C  
ATOM     30  O   HIS A   2       7.425   6.222   0.000  1.00  0.00           O  
ATOM     31  OXT HIS A   2       9.436   5.328   0.090  1.00  0.00           O  
TER      32      HIS A   2
END