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
25700 2kb8 cing 1-original 1 XPLOR/CNS distance hydrogen bond simple


!!
! HYDROGEN BONDS
!
!!

Assign (resid {S} 28 and Name HN ) (resid {G} 24 and name O) 1.5 0.0 1.0
Assign (resid {S} 28 and Name N ) (resid {G} 24 and name O) 2.5 0.0 1.0 
Assign (resid {L} 27 and Name HN ) (resid {F} 23 and name O) 1.5 0.0 1.0
Assign (resid {L} 27 and Name N ) (resid {F} 23 and name O) 2.5 0.0 1.0
Assign (resid {I} 26 and Name HN ) (resid {N} 22 and name O) 1.5 0.0 1.0
Assign (resid {I} 26 and Name N ) (resid {N} 22 and name O) 2.5 0.0 1.0
Assign (resid {A} 13 and Name HN ) (resid {T} 9 and name O) 1.5 0.0 1.0
Assign (resid {A} 13 and Name N ) (resid {T} 9 and name O) 2.5 0.0 1.0
Assign (resid {L} 12 and Name HN ) (resid {A} 8 and name O) 1.5 0.0 1.0
Assign (resid {L} 12 and Name N ) (resid {A} 8 and name O) 2.5 0.0 1.0
Assign (resid {R} 11 and Name HN ) (resid {C} 7 and name O) 1.5 0.0 1.0
Assign (resid {R} 11 and Name N ) (resid {C} 7 and name O) 2.5 0.0 1.0
Assign (resid {Q} 10 and Name HN ) (resid {T} 6 and name O) 1.5 0.0 1.0
Assign (resid {Q} 10 and Name N ) (resid {T} 6 and name O) 2.5 0.0 1.0
Assign (resid {T} 9 and Name HN ) (resid {A} 5 and name O) 1.5 0.0 1.0
Assign (resid {T} 9 and Name N ) (resid {A} 5 and name O) 2.5 0.0 1.0
Assign (resid {A} 8 and Name HN ) (resid {T} 4 and name O) 1.5 0.0 1.0
Assign (resid {A} 8 and Name N ) (resid {T} 4 and name O) 2.5 0.0 1.0

! Possible fraying because one 3JHNHA is not in range
Assign (resid {S} 19 and Name HN ) (resid {F} 15 and name O) 1.5 0.0 1.0
Assign (resid {S} 19 and Name N ) (resid {F} 15 and name O) 2.5 0.0 1.0
!
!new H-bonds
!
Assign (resid {A} 25 and Name HN ) (resid {N} 21 and name O) 1.5 0.0 1.0
Assign (resid {A} 25 and Name N ) (resid {N} 21 and name O) 2.5 0.0 1.0
Assign (resid {N} 21 and Name HN ) (resid {V} 17 and name O) 1.5 0.0 1.0
Assign (resid {N} 21 and Name N ) (resid {V} 17 and name O) 2.5 0.0 1.0
Assign (resid {S} 20 and Name HN ) (resid {L} 16 and name O) 1.5 0.0 1.0
Assign (resid {S} 20 and Name N ) (resid {L} 16 and name O) 2.5 0.0 1.0
Assign (resid {H} 18 and Name HN ) (resid {N} 14 and name O) 1.5 0.0 1.0
Assign (resid {H} 18 and Name N ) (resid {N} 14 and name O) 2.5 0.0 1.0

!!
! Less sure HYDROGEN BONDS
!!

Assign (resid {L} 16 and Name HN ) (resid {L} 12 and name O) 1.5 0.0 1.0
Assign (resid {L} 16 and Name N ) (resid {L} 12 and name O) 2.5 0.0 1.0
Assign (resid {F} 15 and Name HN ) (resid {R} 11 and name O) 1.5 0.0 1.0
Assign (resid {F} 15 and Name N ) (resid {R} 11 and name O) 2.5 0.0 1.0
Assign (resid {N} 14 and Name HN ) (resid {Q} 10 and name O) 1.5 0.0 1.0
Assign (resid {N} 14 and Name N ) (resid {Q} 10 and name O) 2.5 0.0 1.0



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