NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
562288 2luc 18425 cing 1-original 3 XPLOR/CNS distance hydrogen bond simple


!For b-sheet
assign (segid "   A" and resid 34 and name HN) (segid "   A" and resid 75 and name O) 1.8 0.0 0.5
assign (segid "   A" and resid 34 and name N) (segid "   A" and resid 75 and name O) 2.8 0.0 0.5

assign (segid "   A" and resid 75 and name HN) (segid "   A" and resid 34 and name O) 1.8 0.0 0.5
assign (segid "   A" and resid 75 and name N) (segid "   A" and resid 34 and name O) 2.8 0.0 0.5
 
!For a-helix
assign (segid "   A" and resid  13 and name N) (segid "   A" and resid   9 and name O) 2.8 0.0 0.5 
assign (segid "   A" and resid  13 and name HN) (segid "   A" and resid   9 and name O) 1.8 0.0 0.5 

assign (segid "   A" and resid  15 and name N) (segid "   A" and resid  11 and name O) 2.8 0.0 0.5 
assign (segid "   A" and resid  15 and name HN) (segid "   A" and resid  11 and name O) 1.8 0.0 0.5 

assign (segid "   A" and resid  19 and name N) (segid "   A" and resid  15 and name O) 2.8 0.0 0.5 
assign (segid "   A" and resid  19 and name HN) (segid "   A" and resid  15 and name O) 1.8 0.0 0.5 

assign (segid "   A" and resid  20 and name N) (segid "   A" and resid  16 and name O) 2.8 0.0 0.5 
assign (segid "   A" and resid  20 and name HN) (segid "   A" and resid  16 and name O) 1.8 0.0 0.5 

assign (segid "   A" and resid  21 and name N) (segid "   A" and resid  17 and name O) 2.8 0.0 0.5 
assign (segid "   A" and resid  21 and name HN) (segid "   A" and resid  17 and name O) 1.8 0.0 0.5 

assign (segid "   A" and resid  22 and name N) (segid "   A" and resid  18 and name O) 2.8 0.0 0.5 
assign (segid "   A" and resid  22 and name HN) (segid "   A" and resid  18 and name O) 1.8 0.0 0.5 

assign (segid "   A" and resid  23 and name N) (segid "   A" and resid  19 and name O) 2.8 0.0 0.5 
assign (segid "   A" and resid  23 and name HN) (segid "   A" and resid  19 and name O) 1.8 0.0 0.5 

assign (segid "   A" and resid  24 and name N) (segid "   A" and resid  20 and name O) 2.8 0.0 0.5 
assign (segid "   A" and resid  24 and name HN) (segid "   A" and resid  20 and name O) 1.8 0.0 0.5 

assign (segid "   A" and resid  25 and name N) (segid "   A" and resid  21 and name O) 2.8 0.0 0.5 
assign (segid "   A" and resid  25 and name HN) (segid "   A" and resid  21 and name O) 1.8 0.0 0.5 

assign (segid "   A" and resid  41 and name N) (segid "   A" and resid  37 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  41 and name HN) (segid "   A" and resid  37 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  42 and name N) (segid "   A" and resid  38 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  42 and name HN) (segid "   A" and resid  38 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  44 and name N) (segid "   A" and resid  40 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  44 and name HN) (segid "   A" and resid  40 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  46 and name N) (segid "   A" and resid  42 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  46 and name HN) (segid "   A" and resid  42 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  63 and name N) (segid "   A" and resid  59 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  63 and name HN) (segid "   A" and resid  59 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  83 and name N) (segid "   A" and resid  79 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  83 and name HN) (segid "   A" and resid  79 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  84 and name N) (segid "   A" and resid  80 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  84 and name HN) (segid "   A" and resid  80 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  85 and name N) (segid "   A" and resid  81 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  85 and name HN) (segid "   A" and resid  81 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  86 and name N) (segid "   A" and resid  82 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  86 and name HN) (segid "   A" and resid  82 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  87 and name N) (segid "   A" and resid  83 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  87 and name HN) (segid "   A" and resid  83 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  88 and name N) (segid "   A" and resid  84 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  88 and name HN) (segid "   A" and resid  84 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  89 and name N) (segid "   A" and resid  85 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  89 and name HN) (segid "   A" and resid  85 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  90 and name N) (segid "   A" and resid  87 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  90 and name HN) (segid "   A" and resid  87 and name O) 1.8 0.0 0.5 

assign (segid "   A" and resid  92 and name N) (segid "   A" and resid  88 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  92 and name HN) (segid "   A" and resid  88 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  93 and name N) (segid "   A" and resid  89 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  93 and name HN) (segid "   A" and resid  89 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  94 and name N) (segid "   A" and resid  90 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  94 and name HN) (segid "   A" and resid  90 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  95 and name N) (segid "   A" and resid  91 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  95 and name HN) (segid "   A" and resid  91 and name O) 1.8 0.0 0.5  

assign (segid "   A" and resid  96 and name N) (segid "   A" and resid  92 and name O) 2.8 0.0 0.5  
assign (segid "   A" and resid  96 and name HN) (segid "   A" and resid  92 and name O) 1.8 0.0 0.5 

!For b-sheet
assign (segid "   B" and resid 34 and name HN) (segid "   B" and resid 75 and name O) 1.8 0.0 0.5
assign (segid "   B" and resid 34 and name N) (segid "   B" and resid 75 and name O) 2.8 0.0 0.5

assign (segid "   B" and resid 75 and name HN) (segid "   B" and resid 34 and name O) 1.8 0.0 0.5
assign (segid "   B" and resid 75 and name N) (segid "   B" and resid 34 and name O) 2.8 0.0 0.5
 
!For a-helix
assign (segid "   B" and resid  13 and name N) (segid "   B" and resid   9 and name O) 2.8 0.0 0.5 
assign (segid "   B" and resid  13 and name HN) (segid "   B" and resid   9 and name O) 1.8 0.0 0.5 

assign (segid "   B" and resid  15 and name N) (segid "   B" and resid  11 and name O) 2.8 0.0 0.5 
assign (segid "   B" and resid  15 and name HN) (segid "   B" and resid  11 and name O) 1.8 0.0 0.5 

assign (segid "   B" and resid  19 and name N) (segid "   B" and resid  15 and name O) 2.8 0.0 0.5 
assign (segid "   B" and resid  19 and name HN) (segid "   B" and resid  15 and name O) 1.8 0.0 0.5 

assign (segid "   B" and resid  20 and name N) (segid "   B" and resid  16 and name O) 2.8 0.0 0.5 
assign (segid "   B" and resid  20 and name HN) (segid "   B" and resid  16 and name O) 1.8 0.0 0.5 

assign (segid "   B" and resid  21 and name N) (segid "   B" and resid  17 and name O) 2.8 0.0 0.5 
assign (segid "   B" and resid  21 and name HN) (segid "   B" and resid  17 and name O) 1.8 0.0 0.5 

assign (segid "   B" and resid  22 and name N) (segid "   B" and resid  18 and name O) 2.8 0.0 0.5 
assign (segid "   B" and resid  22 and name HN) (segid "   B" and resid  18 and name O) 1.8 0.0 0.5 

assign (segid "   B" and resid  23 and name N) (segid "   B" and resid  19 and name O) 2.8 0.0 0.5 
assign (segid "   B" and resid  23 and name HN) (segid "   B" and resid  19 and name O) 1.8 0.0 0.5 

assign (segid "   B" and resid  24 and name N) (segid "   B" and resid  20 and name O) 2.8 0.0 0.5 
assign (segid "   B" and resid  24 and name HN) (segid "   B" and resid  20 and name O) 1.8 0.0 0.5 

assign (segid "   B" and resid  25 and name N) (segid "   B" and resid  21 and name O) 2.8 0.0 0.5 
assign (segid "   B" and resid  25 and name HN) (segid "   B" and resid  21 and name O) 1.8 0.0 0.5 

assign (segid "   B" and resid  41 and name N) (segid "   B" and resid  37 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  41 and name HN) (segid "   B" and resid  37 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  42 and name N) (segid "   B" and resid  38 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  42 and name HN) (segid "   B" and resid  38 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  44 and name N) (segid "   B" and resid  40 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  44 and name HN) (segid "   B" and resid  40 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  46 and name N) (segid "   B" and resid  42 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  46 and name HN) (segid "   B" and resid  42 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  63 and name N) (segid "   B" and resid  59 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  63 and name HN) (segid "   B" and resid  59 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  83 and name N) (segid "   B" and resid  79 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  83 and name HN) (segid "   B" and resid  79 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  84 and name N) (segid "   B" and resid  80 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  84 and name HN) (segid "   B" and resid  80 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  85 and name N) (segid "   B" and resid  81 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  85 and name HN) (segid "   B" and resid  81 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  86 and name N) (segid "   B" and resid  82 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  86 and name HN) (segid "   B" and resid  82 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  87 and name N) (segid "   B" and resid  83 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  87 and name HN) (segid "   B" and resid  83 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  88 and name N) (segid "   B" and resid  84 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  88 and name HN) (segid "   B" and resid  84 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  89 and name N) (segid "   B" and resid  85 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  89 and name HN) (segid "   B" and resid  85 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  90 and name N) (segid "   B" and resid  87 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  90 and name HN) (segid "   B" and resid  87 and name O) 1.8 0.0 0.5 

assign (segid "   B" and resid  92 and name N) (segid "   B" and resid  88 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  92 and name HN) (segid "   B" and resid  88 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  93 and name N) (segid "   B" and resid  89 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  93 and name HN) (segid "   B" and resid  89 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  94 and name N) (segid "   B" and resid  90 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  94 and name HN) (segid "   B" and resid  90 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  95 and name N) (segid "   B" and resid  91 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  95 and name HN) (segid "   B" and resid  91 and name O) 1.8 0.0 0.5  

assign (segid "   B" and resid  96 and name N) (segid "   B" and resid  92 and name O) 2.8 0.0 0.5  
assign (segid "   B" and resid  96 and name HN) (segid "   B" and resid  92 and name O) 1.8 0.0 0.5 




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