PDB Code: SHP

X-PLOR files

Heterogen file generated from the PDB Het Group Dictionary



RESIDUE   SHP     63
CONECT      N      3 CA  1HN  2HN
CONECT      CA     4 N    C    C1*  HA
CONECT      C      3 CA   O    OXT
CONECT      O      1 C    
CONECT      OXT    2 C    HXT
CONECT      C1*    3 CA   C2*  C6*
CONECT      C2*    3 C1*  C3*  H2*
CONECT      C3*    3 C2*  C4*  H3*
CONECT      C4*    3 C3*  C5*  O4*
CONECT      O4*    2 C4*  C1
CONECT      C5*    3 C4*  C6*  H5*
CONECT      C6*    3 C1*  C5*  H6*
CONECT      C1     4 C2   O4*  O5   H1                           
CONECT      C2     4 C1   C3   O1   H2                           
CONECT      C3     4 C2   C4   O3   H3                           
CONECT      C4     4 C3   C5   O4   H4                           
CONECT      C5     4 C4   C6   O5   H5                           
CONECT      C6     4 C5   O6  1H6  2H6                           
CONECT      O1     2 C1'  C2
CONECT      O3     2 C3   HO3                                    
CONECT      O4     2 C4   HO4                                    
CONECT      O5     2 C1   C5                                     
CONECT      O6     2 C6   HO6                                    
CONECT      C1'    4 C2'  O1   O5'  H1'                          
CONECT      C2'    4 C1'  C3'  O2'  H2'                          
CONECT      C3'    4 C2'  C4'  O3'  H3'                          
CONECT      C4'    4 C3'  C5'  O4'  H4'                          
CONECT      C5'    4 C4'  C6'  O5'  H5'                          
CONECT      C6'    4 C5'  O6' 1H6' 2H6'                          
CONECT      O2'    2 C2' 'HO2                                    
CONECT      O3'    2 C3' 'HO3
CONECT      O4'    2 C4' 'HO4                                    
CONECT      O5'    2 C1'  C5'                                    
CONECT      O6'    2 C6' 'HO6
CONECT     1HN     1 N
CONECT     2HN     1 N
CONECT      HA     1 CA
CONECT      HXT    1 OXT 
CONECT      H2*    1 C2*
CONECT      H3*    1 C3*
CONECT      H5*    1 C5*
CONECT      H6*    1 C6*                                         
CONECT      H1     1 C1                                          
CONECT      H2     1 C2                                          
CONECT      H3     1 C3                                          
CONECT      H4     1 C4                                          
CONECT      H5     1 C5                                          
CONECT     1H6     1 C6                                          
CONECT     2H6     1 C6                                          
CONECT      HO3    1 O3                                          
CONECT      HO4    1 O4                                          
CONECT      HO6    1 O6                                          
CONECT      H1'    1 C1'                                         
CONECT      H2'    1 C2'                                         
CONECT      H3'    1 C3'                                         
CONECT      H4'    1 C4'                                         
CONECT      H5'    1 C5'                                         
CONECT     1H6'    1 C6'                                         
CONECT     2H6'    1 C6'                                         
CONECT     'HO2    1 O2'                                         
CONECT     'HO3    1 O3'
CONECT     'HO4    1 O4'                                         
CONECT     'HO6    1 O6'                                         
END
HET    SHP             63
HETNAM     SHP (4-HYDROXYMALTOSEPHENYL)GLYCINE  
FORMUL      SHP    C20 H29 N1 O13
RENELM      'HO2 SHP  H
RENELM      'HO3 SHP  H
RENELM      'HO4 SHP  H
RENELM      'HO6 SHP  H