NMR Restraints Grid

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

image mrblock_id pdb_id cing in_recoord stage position program type subtype subsubtype
2187 1bip cing recoord 1-original 6 XPLOR/CNS distance hydrogen bond simple


!=========== Hydrogen Bonds of the a-Helices H1 ======================

!HN(i))-O(i-4)
!assign (resid  21 and name HN ) (resid  17 and name O  )  1.9 0.6 0.3  
assign (resid  22 and name HN ) (resid  18 and name O  )  1.9 0.6 0.3  
assign (resid  23 and name HN ) (resid  19 and name O  )  1.9 0.6 0.3  
assign (resid  24 and name HN ) (resid  20 and name O  )  1.9 0.6 0.3  
assign (resid  25 and name HN ) (resid  21 and name O  )  1.9 0.6 0.3  
assign (resid  26 and name HN ) (resid  22 and name O  )  1.9 0.6 0.3  
assign (resid  27 and name HN ) (resid  23 and name O  )  1.9 0.6 0.3  
assign (resid  28 and name HN ) (resid  24 and name O  )  1.9 0.6 0.3  
assign (resid  29 and name HN ) (resid  25 and name O  )  1.9 0.6 0.3  

!N(i))-O(i-4)
!assign (resid  21 and name  N ) (resid  17 and name O  )  2.8 0.6 0.2  
assign (resid  22 and name  N ) (resid  18 and name O  )  2.8 0.6 0.2  
assign (resid  23 and name  N ) (resid  19 and name O  )  2.8 0.6 0.2  
assign (resid  24 and name  N ) (resid  20 and name O  )  2.8 0.6 0.2  
assign (resid  25 and name  N ) (resid  21 and name O  )  2.8 0.6 0.2  
assign (resid  26 and name  N ) (resid  22 and name O  )  2.8 0.6 0.2  
assign (resid  27 and name  N ) (resid  23 and name O  )  2.8 0.6 0.2  
assign (resid  28 and name  N ) (resid  24 and name O  )  2.8 0.6 0.2  
assign (resid  29 and name  N ) (resid  25 and name O  )  2.8 0.6 0.2  

!==============Hydrogen Bonds of the a-Helices H2=====================

!HN(i))-O(i-4)
assign (resid  41 and name HN ) (resid  37 and name O  )  1.9 0.6 0.3  
assign (resid  42 and name HN ) (resid  38 and name O  )  1.9 0.6 0.3  
assign (resid  43 and name HN ) (resid  39 and name O  )  1.9 0.6 0.3  
assign (resid  44 and name HN ) (resid  40 and name O  )  1.9 0.6 0.3  
assign (resid  45 and name HN ) (resid  41 and name O  )  1.9 0.6 0.3  
assign (resid  46 and name HN ) (resid  42 and name O  )  1.9 0.6 0.3  
assign (resid  47 and name HN ) (resid  43 and name O  )  1.9 0.6 0.3  
assign (resid  48 and name HN ) (resid  44 and name O  )  1.9 0.6 0.3  
assign (resid  49 and name HN ) (resid  45 and name O  )  1.9 0.6 0.3  
assign (resid  50 and name HN ) (resid  46 and name O  )  1.9 0.6 0.3  
assign (resid  51 and name HN ) (resid  47 and name O  )  1.9 0.6 0.3  

!N(i))-O(i-4)
assign (resid  41 and name  N ) (resid  37 and name O  )  2.8 0.6 0.2  
assign (resid  42 and name  N ) (resid  38 and name O  )  2.8 0.6 0.2  
assign (resid  43 and name  N ) (resid  39 and name O  )  2.8 0.6 0.2  
assign (resid  44 and name  N ) (resid  40 and name O  )  2.8 0.6 0.2  
assign (resid  45 and name  N ) (resid  41 and name O  )  2.8 0.6 0.2  
assign (resid  46 and name  N ) (resid  42 and name O  )  2.8 0.6 0.2  
assign (resid  47 and name  N ) (resid  43 and name O  )  2.8 0.6 0.2  
assign (resid  48 and name  N ) (resid  44 and name O  )  2.8 0.6 0.2  
assign (resid  49 and name  N ) (resid  45 and name O  )  2.8 0.6 0.2  
assign (resid  50 and name  N ) (resid  46 and name O  )  2.8 0.6 0.2  
assign (resid  51 and name  N ) (resid  47 and name O  )  2.8 0.6 0.2  

!==============Hydrogen Bonds of the a-Helices H3 ====================

!HN(i))-O(i-4)
!assign (resid  62 and name HN ) (resid  58 and name O  )  1.9 0.6 0.3  
assign (resid  63 and name HN ) (resid  59 and name O  )  1.9 0.6 0.3  
assign (resid  64 and name HN ) (resid  60 and name O  )  1.9 0.6 0.3  
assign (resid  65 and name HN ) (resid  61 and name O  )  1.9 0.6 0.3  
assign (resid  66 and name HN ) (resid  62 and name O  )  1.9 0.6 0.3

!N(i))-O(i-4)
!assign (resid  62 and name  N ) (resid  58 and name O  )  2.8 0.6 0.2  
assign (resid  63 and name  N ) (resid  59 and name O  )  2.8 0.6 0.2  
assign (resid  64 and name  N ) (resid  60 and name O  )  2.8 0.6 0.2  
assign (resid  65 and name  N ) (resid  61 and name O  )  2.8 0.6 0.2  
assign (resid  66 and name HN ) (resid  62 and name O  )  2.8 0.6 0.2 

!==============Hydrogen Bonds of the a-Helices H4====================
!HN(i))-O(i-4)
assign (resid  91 and name HN ) (resid  87 and name O  )  1.9 0.6 0.3  
assign (resid  92 and name HN ) (resid  88 and name O  )  1.9 0.6 0.3  
assign (resid  93 and name HN ) (resid  89 and name O  )  1.9 0.6 0.3  
assign (resid  94 and name HN ) (resid  90 and name O  )  1.9 0.6 0.3  

!N(i))-O(i-4)
assign (resid  91 and name  N ) (resid  87 and name O  )  2.8 0.6 0.2  
assign (resid  92 and name  N ) (resid  88 and name O  )  2.8 0.6 0.2  
assign (resid  93 and name  N ) (resid  89 and name O  )  2.8 0.6 0.2  
assign (resid  94 and name  N ) (resid  90 and name O  )  2.8 0.6 0.2  

!==============Hydrogen Bonds of the a-Helices H4====================

!HN(i))-O(i-4)
!assign (resid  73 and name HN ) (resid  69 and name O  )  1.9 0.6 0.3  
assign (resid  69 and name HN ) (resid  73 and name O  )  1.9 0.6 0.3  
assign (resid  75 and name HN ) (resid  67 and name O  )  1.9 0.6 0.3  
!N(i))-O(i-4)
!assign (resid  73 and name  N ) (resid  69 and name O  )  2.8 0.6 0.2  
assign (resid  69 and name  N ) (resid  73 and name O  )  2.8 0.6 0.2  
assign (resid  75 and name  N ) (resid  67 and name O  )  2.8 0.6 0.2  



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