NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type subtype subsubtype
2310 1bnx cing 1-original 8 XPLOR/CNS distance NOE simple


!HN(i)-HA(i)                                                                    
assign (resid    2 and name HN   )(resid    2 and name HA   ) 2.5 2.5 0.4       
assign (resid    3 and name HN   )(resid    3 and name HA   ) 2.5 2.5 0.4       
assign (resid    5 and name HN   )(resid    5 and name HA   ) 2.5 2.5 0.4       
assign (resid    6 and name HN   )(resid    6 and name HA   ) 2.5 2.5 0.4       
assign (resid    7 and name HN   )(resid    7 and name HA   ) 2.5 2.5 0.4       
assign (resid    8 and name HN   )(resid    8 and name HA   ) 2.5 2.5 0.4       
assign (resid    9 and name HN   )(resid    9 and name HA   ) 2.5 2.5 0.4       
assign (resid   10 and name HN   )(resid   10 and name HA   ) 2.5 2.5 0.4       
assign (resid   11 and name HN   )(resid   11 and name HA   ) 2.5 2.5 0.4       
assign (resid   12 and name HN   )(resid   12 and name HA   ) 2.5 2.5 0.4       
assign (resid   13 and name HN   )(resid   13 and name HA   ) 3.0 3.0 0.5       
assign (resid   14 and name HN   )(resid   14 and name HA   ) 2.5 2.5 0.4       
assign (resid   15 and name HN   )(resid   15 and name HA   ) 2.5 2.5 0.4       
assign (resid   16 and name HN   )(resid   16 and name HA   ) 2.5 2.5 0.4       
assign (resid   17 and name HN   )(resid   17 and name HA   ) 2.5 2.5 0.4       
assign (resid   18 and name HN   )(resid   18 and name HA   ) 2.5 2.5 0.4       
assign (resid   19 and name HN   )(resid   19 and name HA   ) 2.5 2.5 0.4       
assign (resid   20 and name HN   )(resid   20 and name HA   ) 2.5 2.5 0.4       
assign (resid   21 and name HN   )(resid   21 and name HA   ) 2.5 2.5 0.4       
assign (resid   22 and name HN   )(resid   22 and name HA   ) 2.5 2.5 0.4       
assign (resid   24 and name HN   )(resid   24 and name HA   ) 2.5 2.5 0.4       
assign (resid   25 and name HN   )(resid   25 and name HA   ) 2.5 2.5 0.4       
assign (resid   26 and name HN   )(resid   26 and name HA   ) 2.5 2.5 0.4       
assign (resid   27 and name HN   )(resid   27 and name HA   ) 2.5 2.5 0.4       
assign (resid   28 and name HN   )(resid   28 and name HA1  ) 2.5 2.5 0.4       
assign (resid   28 and name HN   )(resid   28 and name HA2  ) 2.5 2.5 0.4       
assign (resid   29 and name HN   )(resid   29 and name HA1  ) 2.5 2.5 0.4       
assign (resid   29 and name HN   )(resid   29 and name HA2  ) 2.5 2.5 0.4       
assign (resid   30 and name HN   )(resid   30 and name HA   ) 3.0 3.0 0.5       
assign (resid   31 and name HN   )(resid   31 and name HA   ) 3.0 3.0 0.5       
assign (resid   32 and name HN   )(resid   32 and name HA   ) 2.5 2.5 0.4       
assign (resid   33 and name HN   )(resid   33 and name HA   ) 2.5 2.5 0.4       
assign (resid   34 and name HN   )(resid   34 and name HA   ) 2.5 2.5 0.4       
!HN(i)-HB(i)                                                                    
!assign (resid    2 and name HN   )(resid    2 and name HB1  ) 3.0 3.0 0.5      
assign (resid    3 and name HN   )(resid    3 and name HB*  ) 3.0 3.0 0.5       
assign (resid    5 and name HN   )(resid    5 and name HB1  ) 2.5 2.5 0.4       
assign (resid    5 and name HN   )(resid    5 and name HB2  ) 2.5 2.5 0.4       
assign (resid    6 and name HN   )(resid    6 and name HB1  ) 2.5 2.5 0.4       
assign (resid    6 and name HN   )(resid    6 and name HB2  ) 2.5 2.5 0.4       
assign (resid   10 and name HN   )(resid   10 and name HB   ) 2.5 2.5 0.4       
assign (resid   11 and name HN   )(resid   11 and name HB   ) 3.0 3.0 0.5       
assign (resid   12 and name HN   )(resid   12 and name HB1  ) 3.0 3.0 0.5       
assign (resid   12 and name HN   )(resid   12 and name HB2  ) 3.0 3.0 0.5       
assign (resid   13 and name HN   )(resid   13 and name HB   ) 2.5 2.5 0.4       
assign (resid   14 and name HN   )(resid   14 and name HB   ) 2.5 2.5 0.4       
assign (resid   15 and name HN   )(resid   15 and name HB1  ) 2.5 2.5 0.4       
assign (resid   15 and name HN   )(resid   15 and name HB2  ) 2.5 2.5 0.4       
assign (resid   16 and name HN   )(resid   16 and name HB   ) 2.5 2.5 0.4       
assign (resid   17 and name HN   )(resid   17 and name HB*  ) 2.5 2.5 0.4       
assign (resid   18 and name HN   )(resid   18 and name HB*  ) 2.5 2.5 0.4       
assign (resid   19 and name HN   )(resid   19 and name HB*  ) 2.5 2.5 0.4       
assign (resid   20 and name HN   )(resid   20 and name HB*  ) 2.5 2.5 0.4       
assign (resid   21 and name HN   )(resid   21 and name HB*  ) 2.5 2.5 0.4       
assign (resid   22 and name HN   )(resid   22 and name HB*  ) 3.0 3.0 0.5       
assign (resid   24 and name HN   )(resid   24 and name HB*  ) 2.5 2.5 0.4       
assign (resid   25 and name HN   )(resid   25 and name HB   ) 2.5 2.5 0.4       
assign (resid   26 and name HN   )(resid   26 and name HB   ) 2.5 2.5 0.4       
assign (resid   27 and name HN   )(resid   27 and name HB*  ) 2.5 2.5 0.4       
assign (resid   33 and name HN   )(resid   33 and name HB*  ) 3.0 3.0 0.5       
assign (resid   34 and name HN   )(resid   34 and name HB*  ) 3.0 3.0 0.5       
!HA(i)-HB(i)                                                                    
assign (resid   11 and name HA   )(resid   11 and name HB   ) 3.0 3.0 0.5       
assign (resid   18 and name HA   )(resid   18 and name HB*  ) 2.5 2.5 0.4       
assign (resid   13 and name HA   )(resid   13 and name HB   ) 2.5 2.5 0.4       
!LYs                                                                            
assign (resid   34 and name HN   )(resid   34 and name HG*  ) 4.0 4.0 1.0       
assign (resid   34 and name HN   )(resid   34 and name HB*  ) 3.0 3.0 0.5       
!assign (resid   34 and nameHE*  )(resid   34 and name HZ*  ) 3.0 3.0 0.5       
!Val                                                                            
assign (resid   13 and name HA   )(resid   13 and name HG1* ) 4.0 4.0 1.0       
assign (resid   13 and name HA   )(resid   13 and name HG2* ) 4.0 4.0 1.0       
assign (resid   13 and name HN   )(resid   13 and name HG1* ) 4.0 4.0 1.0       
assign (resid   13 and name HN   )(resid   13 and name HG2* ) 4.0 4.0 1.0       
assign (resid   13 and name HB   )(resid   13 and name HG1* ) 2.5 2.5 1.0       
assign (resid   13 and name HB   )(resid   13 and name HG2* ) 2.5 2.5 1.0       
assign (resid   13 and name HG1* )(resid   13 and name HG2* ) 2.5 2.5 1.0       
!Leu                                                                            
assign (resid    7 and  name HN   )(resid    7 and  name HD*  ) 4.0 4.0 2.0     
assign (resid    7 and  name HA   )(resid    7 and  name HD*  ) 4.0 4.0 2.0     
assign (resid    7 and  name HG   )(resid    7 and  name HD1* ) 2.5 2.5 1.5     
assign (resid    7 and  name HG   )(resid    7 and  name HD2* ) 2.5 2.5 1.5     
assign (resid   21 and  name HN   )(resid   21 and  name HG   ) 4.0 4.0 1.0     
assign (resid   21 and  name HA   )(resid   21 and  name HG   ) 3.5 3.5 1.0     
assign (resid   21 and  name HB1  )(resid   21 and  name HB2  ) 2.5 2.5 0.5     
assign (resid   21 and  name HB*  )(resid   21 and  name HG   ) 3.5 3.5 1.0     
assign (resid   30 and  name HG   )(resid   30 and  name HD2* ) 2.5 2.5 1.5     
assign (resid   30 and  name HG   )(resid   30 and  name HD1* ) 2.5 2.5 1.5     
assign (resid   31 and  name HG   )(resid   31 and  name HD1* ) 2.5 2.5 0.5     
assign (resid   31 and  name HG   )(resid   31 and  name HD2* ) 2.5 2.5 0.5     
!ile                                                                            
assign (resid   10 and  name HN   )(resid   10 and  name HG1* ) 3.5 3.5 1.5     
assign (resid   10 and  name HN   )(resid   10 and  name HG2* ) 3.5 3.5 1.5     
assign (resid   10 and  name HA   )(resid   10 and  name HG1* ) 3.5 3.5 1.0     
assign (resid   10 and  name HA   )(resid   10 and  name HG2* ) 3.5 3.5 1.5     
assign (resid   10 and  name HG11 )(resid   10 and  name HG12 ) 2.5 2.5 0.5     
assign (resid   14 and  name HN   )(resid   14 and  name HG1* ) 3.5 3.5 1.5     
assign (resid   14 and  name HN   )(resid   14 and  name HG2* ) 3.5 3.5 1.5     
assign (resid   14 and  name HA   )(resid   14 and  name HG1* ) 3.5 3.5 1.5     
assign (resid   14 and  name HA   )(resid   14 and  name HG2* ) 3.5 3.5 1.5     
assign (resid   14 and  name HG11 )(resid   14 and  name HG12 ) 2.5 2.5 0.5     
assign (resid   16 and  name HN   )(resid   16 and  name HG1* ) 3.5 3.5 1.5     
assign (resid   16 and  name HN   )(resid   16 and  name HG2* ) 3.5 3.5 1.5     
assign (resid   16 and  name HA   )(resid   16 and  name HG1* ) 3.5 3.5 1.5     
assign (resid   16 and  name HA   )(resid   16 and  name HG2* ) 3.5 3.5 1.5     
assign (resid   16 and  name HG11 )(resid   16 and  name HG12 ) 2.5 2.5 0.5     
assign (resid   25 and  name HN   )(resid   25 and  name HG1* ) 3.5 3.5 1.5     
!Pro                                                                            
assign (resid    4 and name HB1  )(resid    4 and name HB2  ) 2.5 2.5 0.4       
assign (resid    4 and name HD1  )(resid    4 and name HD2  ) 2.5 2.5 0.4       
assign (resid   23 and name HB1  )(resid   23 and name HB2  ) 2.5 2.5 0.4       
assign (resid   23 and name HD1  )(resid   23 and name HD2  ) 2.5 2.5 0.4       
! aromatics                                                                     
assign (resid    3 and name HB*  )(resid    3 and name HD*  ) 3.5 3.5 0.5       
assign (resid    5 and name HB*  )(resid    5 and name HD*  ) 3.5 3.5 0.5       
assign (resid    6 and name HA   )(resid    6 and name HD*  ) 3.5 3.5 0.5       
assign (resid    5 and name HA   )(resid    5 and name HD*  ) 4.0 4.0 1.0       
! glycine                                                                       
assign (resid   28 and  name HA1  )(resid   28 and  name HA2  ) 1.8 1.8 0.2     
assign (resid   29 and  name HA1  )(resid   29 and  name HA2  ) 1.8 1.8 0.2     
assign (resid   32 and  name HA1  )(resid   32 and  name HA2  ) 1.8 1.8 0.2     
!threonines                                                                     
assign (resid   11 and  name HN   )(resid   11 and  name HG2* ) 3.5 3.5 1.0     
assign (resid   26 and  name HN   )(resid   26 and  name HG2* ) 3.5 3.5 1.0     
!hydrogen bonds                                                                 


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