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
6116 1ih9 4993 cing 1-original 2 DYANA/DIANA distance hydrogen bond simple 

#Upl restraints for hydrogen bonds
#HN5 alpha
  1 GLY 
         O       5 IVA  HN      2.30
         C       5 IVA  HN      3.52
         O       5 IVA  N       3.30
#HN6 alpha
  2 TRP
      O       6 ILE  HN      2.30
         C       6 ILE  HN      3.52
      O       6 ILE  N       3.30
#HN7 alpha
  3 ILE
      O       7 THR  HN      2.30
         C       7 THR  HN      3.52
      O       7 THR  N       3.30
#HN8 alpha
  4 GLN
        O       8 AIB  HN      2.30
         C       8 AIB  HN      3.52
        O       8 AIB  N       3.30
#HN9 alpha
  5 IVA
        O       9 LEU  HN      2.30
         C       9 LEU  HN      3.52
        O       9 LEU  N       3.30
#HN10
#3-10 not bifurcated
  7 THR 
         O      10 AIB  HN      2.40
         C      10 AIB  HN      3.52
         O      10 AIB  N       3.39
#HN12
#3-10 not bifurcated
  9 LEU 
         O      12 GLN  HN      2.40
         C      12 GLN  HN      3.52
         O      12 GLN  N       3.39
#HN13
#3-10 not bifurcated
 10 AIB 
         O      13 AIB  HN      2.40
         C      13 AIB  HN      3.52
         O      13 AIB  N       3.39
#HN15 alpha
 11 HYP
        O      15 AIB  HN      2.30
         C      15 AIB  HN      3.52
        O      15 AIB  N       3.30
#HN17 alpha
 13 AIB
        O      17 PHE  HN      2.30
         C      17 PHE  HN      3.52
        O      17 PHE  N       3.30

#Lol restraints for hydrogen bonds
#Recomended constraint for restriction 5->1 bonds:
#min_H-O 1.80  max_H-O 2.30  min_N-O 2.56  max_N-O 3.30  min_H-C 2.64  max_H-C 3.52
#Recomended constraint for restriction 4->1 bonds:
#min_H-O 1.90  max_H-O 2.40  min_N-O 2.66  max_N-O 3.39  min_H-C 2.26  max_H-C 3.52
#Recomended constraint for restriction bifurcated 4->1 bonds:
#min_H-O 1.90  max_H-O 2.50  min_N-O 2.43  max_N-O 3.49  min_H-C 2.26  max_H-C 3.62

#HN5 alpa
  1 GLY
         O       5 IVA  HN      1.80
         C       5 IVA  HN      2.64
         O       5 IVA  N       2.56
#HN6 alpha
  2 TRP
  O       6 ILE  HN      1.80
         C       6 ILE  HN      2.64
  O       6 ILE  N       2.56
#HN7 alpha
  3 ILE
  O       7 THR  HN      1.80
         C       7 THR  HN      2.64
  O       7 THR  N       2.56
#HN8 alpha
  4 GLN
  O       8 AIB  HN      1.80
         C       8 AIB  HN      2.64
  O       8 AIB  N       2.56
#HN9 alpha
  5 IVA
  O       9 LEU  HN      1.80
         C       9 LEU  HN      2.64
  O       9 LEU  N       2.56
#HN10
#3-10 not bifurcated
  7 THR 
         O      10 AIB  HN      1.90
         C      10 AIB  HN      2.26
         O      10 AIB  N       2.66
#HN12
#3-10 not bifurcated
  9 LEU 
         O      12 GLN  HN      1.90
         C      12 GLN  HN      2.26
         O      12 GLN  N       2.66
#HN13
#3-10 not bifurcated
 10 AIB 
         O      13 AIB  HN      1.90
         C      13 AIB  HN      2.26
         O      13 AIB  N       2.66
#HN15 alpha
 11 HYP
  O      15 AIB  HN      1.80
         C      15 AIB  HN      2.64
  O      15 AIB  N       2.56
#HN17 alpha
 13 AIB
  O      17 PHE  HN      1.80
         C      17 PHE  HN      2.64
  O      17 PHE  N       2.56

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