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
522191 2lgi 17810 cing 1-original 7 XPLOR/CNS peak


  class HNHN_i1
 
 assign (resid    2 and name HN   ) ( resid    2 and name N    )
        (resid    3 and name HN   ) ( resid    3 and name N   )
           56.90   9.00
          123.10   9.00

assign (resid    3 and name HN   ) ( resid    3 and name N    )
       (resid    4 and name HN   ) ( resid    4 and name N   )
       28.4 3.2 
      151.6 3.2 

assign (resid    4 and name HN   ) ( resid    4 and name N    )
       (resid    5 and name HN   ) ( resid    5 and name N   ) 
       30.6 13.9
      149.4 13.9
 
assign (resid    6 and name HN   ) ( resid    6 and name N    )
       (resid    7 and name HN   ) ( resid    7 and name N   ) 
       17.50   3.90
      162.50   3.90

assign (resid    7 and name HN   ) ( resid    7 and name N    )
       (resid    8 and name HN   ) ( resid    8 and name N   )
       27.60   2.00
      152.40   2.00

assign (resid    8 and name HN   ) ( resid    8 and name N    )
       (resid    9 and name HN   ) ( resid    9 and name N   ) 
      53.20   6.20
     126.80   6.20

assign (resid   10 and name HN   ) ( resid   10 and name N    )
       (resid   11 and name HN   ) ( resid   11 and name N   )
       17.70   5.20
      162.30   5.20

assign (resid   13 and name HN   ) ( resid   13 and name N    )
       (resid   14 and name HN   ) ( resid   14 and name N   ) 
       8.70   6.00
     171.30   6.00

assign (resid   14 and name HN   ) ( resid   14 and name N    )
       (resid   15 and name HN   ) ( resid   15 and name N   )
       11.10   4.50
      168.90   4.50

assign (resid   15 and name HN   ) ( resid   15 and name N    )
       (resid   16 and name HN   ) ( resid   16 and name N   )
       10.20   3.20
      169.80   3.20

assign (resid   22 and name HN   ) ( resid   22 and name N    )
       (resid   23 and name HN   ) ( resid   23 and name N   )
       16.90   9.20
      163.10   9.20

assign (resid   23 and name HN   ) ( resid   23 and name N    )
       (resid   24 and name HN   ) ( resid   24 and name N   ) 
       29.60   2.0  
      150.40   2.0  

assign (resid   24 and name HN   ) ( resid   24 and name N    )
       (resid   25 and name HN   ) ( resid   25 and name N   )
       25.50   2.00  
      154.50   2.00  
      
assign (resid   25 and name HN   ) ( resid   25 and name N    )
       (resid   26 and name HN   ) ( resid   26 and name N   )
       22.50   2.20
      157.50   2.20
      
assign (resid   26 and name HN   ) ( resid   26 and name N    )
       (resid   27 and name HN   ) ( resid   27 and name N   )
       21.10   2.00  
      158.90   2.00  
      

assign (resid   27 and name HN   ) ( resid   27 and name N    )
       (resid   28 and name HN   ) ( resid   28 and name N   )
       29.20   14.0  
      150.80   14.0  

assign (resid   28 and name HN   ) ( resid   28 and name N    )
       (resid   29 and name HN   ) ( resid   29 and name N   )
       21.90   2.00  
      158.10   2.00  
      
assign (resid   33 and name HN   ) ( resid   33 and name N    )
       (resid   34 and name HN   ) ( resid   34 and name N   )
       17.50   2.00  
      162.50   2.00  
      
assign (resid   34 and name HN   ) ( resid   34 and name N    )
       (resid   35 and name HN   ) ( resid   35 and name N   )
       17.80   2.00 
      162.20   2.00
      
assign (resid   35 and name HN   ) ( resid   35 and name N    )
       (resid   36 and name HN   ) ( resid   36 and name N   )
       18.60   2.00  
      161.40   2.00  


assign (resid   36 and name HN   ) ( resid   36 and name N    )
       (resid   37 and name HN   ) ( resid   37 and name N   )
       42.1   19.6
      137.9   19.6 

assign (resid   37 and name HN   ) ( resid   37 and name N   )
       (resid   38 and name HN   ) ( resid   38 and name N   )
       60.8 3.8 
      119.2 3.8

assign (resid   38 and name HN   ) ( resid   38 and name N   )
       (resid   39 and name HN   ) ( resid   39 and name N   )
      54.2   17.5
     125.8   17.5
 
assign (resid   39 and name HN   ) ( resid   39 and name N    )
       (resid   40 and name HN   ) ( resid   40 and name N   )
       54.70   9.00
      125.30   9.00

assign (resid   40 and name HN   ) ( resid   40 and name N    )
       (resid   41 and name HN   ) ( resid   41 and name N   )
       27.4 5.7
      152.6 5.7


assign (resid   41 and name HN   ) ( resid   41 and name N    )
       (resid   42 and name HN   ) ( resid   42 and name N   )
       48.5 2.5
      131.5 2.5


assign (resid   42 and name HN   ) ( resid   42 and name N    )
       (resid   43 and name HN   ) ( resid   43 and name N   )
        45.60   6.10
       134.40   6.10


assign (resid   43 and name HN   ) ( resid   43 and name N    )
       (resid   44 and name HN   ) ( resid   44 and name N   )
       25.00   5.10 
      155.00   5.10 
      

assign (resid   45 and name HN   ) ( resid   45 and name N    )
       (resid   46 and name HN   ) ( resid   46 and name N   )
       11.70   5.0
      168.30   5.0

      
assign (resid   46 and name HN   ) ( resid   46 and name N    )
       (resid   47 and name HN   ) ( resid   47 and name N   )
       25.10   2.3
      154.90   2.3
 

assign (resid   47 and name HN   ) ( resid   47 and name N    )
       (resid   48 and name HN   ) ( resid   48 and name N   )
      48.80   13.6
     131.20   13.6
      

assign (resid   48 and name HN   ) ( resid   48 and name N    )
       (resid   49 and name HN   ) ( resid   49 and name N   )
       26.80    4 !061407  2.00   !       26.80   1.70
      153.20    4 !061407 2.00   !      153.20   1.70
      

assign (resid   49 and name HN   ) ( resid   49 and name N    )
       (resid   50 and name HN   ) ( resid   50 and name N   )
     48.90   13.80
    131.10   13.80


assign (resid   50 and name HN   ) ( resid   50 and name N    )
       (resid   51 and name HN   ) ( resid   51 and name N   )
       27.00   4.00  
      153.00   4.00  
      

assign (resid   53 and name HN   ) ( resid   53 and name N    )
       (resid   54 and name HN   ) ( resid   54 and name N   )
       6.70   3.30
     173.30   3.30
     

assign (resid   54 and name HN   ) ( resid   54 and name N    )
       (resid   55 and name HN   ) ( resid   55 and name N   )
       10.70   2.80
      169.30   2.80
      

assign (resid   55 and name HN   ) ( resid   55 and name N    )
       (resid   56 and name HN   ) ( resid   56 and name N   )
       11.80   12.00 
      168.20   12.00 
      
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
! i-i+2 constraints.
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!

  class HNHN_i2
  FORCeconstant 20.0 10.0

assign (resid   23 and name HN   ) ( resid   23 and name N   )
       (resid   25 and name HN   ) ( resid   25 and name N   )
       49.8  17.0
      130.2  17.0
     
assign (resid   24 and name HN   ) ( resid   24 and name N   )
       (resid   26 and name HN   ) ( resid   26 and name N   )
     9.30   7.10
   170.70   7.10
 
assign (resid   27 and name HN   ) ( resid   27 and name N    )
       (resid   29 and name HN   ) ( resid   29 and name N   )
      19.20   7.00
     160.80   7.00
 
assign (resid   29 and name HN   ) ( resid   29 and name N    )
       (resid   31 and name HN   ) ( resid   31 and name N   )
      27.90   7.0  
     152.10   7.0  

assign (resid   32 and name HN   ) ( resid   32 and name N    )
       (resid   34 and name HN   ) ( resid   34 and name N   )
       29.60   7.0
      150.40   7.0

assign (resid   36 and name HN   ) ( resid   36 and name N    )
       (resid   38 and name HN   ) ( resid   38 and name N   )
       66.80   7.0
      114.20   7.0

assign (resid   37 and name HN   ) ( resid   37 and name N    )
       (resid   39 and name HN   ) ( resid   39 and name N   )
     55.40   8.70
    124.60   8.70


assign (resid   47 and name HN   ) ( resid   47 and name N    )
       (resid   49 and name HN   ) ( resid   49 and name N   )
       54.80    18.40  
      127.20    18.40  

assign (resid   49 and name HN   ) ( resid   49 and name N    )
       (resid   51 and name HN   ) ( resid   51 and name N   )
       61.90   9.50
      118.10   9.50




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