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
6919 1jp0 cing 1-original 1 XPLOR/CNS distance NOE ambi


!P5.1 noes Best V, table without extensive comments.
!
assign (resid 1 and  name  H8  ) (resid 1  and  name H1' ) 3.2 1.0 1.0
assign (resid 1 and  name  H8  ) (resid 1  and  name H3' ) 2.5 0.7 0.7 
assign (resid 1 and  name  H1' ) (resid 2  and  name H8  ) 4.2 0.8 0.8
assign (resid 1 and  name  H1' ) (resid 1  and  name H4' ) 3.2 1.0 1.0
assign (resid 1  and  name H2' ) (resid 1  and  name H8  ) 4.2 0.8 0.8
assign (resid 1  and  name H2' ) (resid 2  and  name H8  ) 2.4 0.6 0.6
assign (resid 1  and  name H2' ) (resid 2  and  name H5' ) 3.2 1.0 1.0 
assign (resid 1  and  name H2' ) (resid 2  and  name H5'') 3.2 0.8 0.8 
assign (resid 1  and  name H2' ) (resid 2  and  name H4' ) 3.2 0.8 0.8 
assign (resid 1  and  name H2' ) (resid 2  and  name H3' ) 3.2 1.0 1.0 
assign (resid 1  and  name H2' ) (resid 2  and  name H1' ) 3.2 1.0 1.0 
assign (resid 1  and  name H3' ) (resid 2  and  name H5' ) 4.2 0.8 0.8 
assign (resid 1  and  name H3' ) (resid 2  and  name H5'') 4.2 0.8 0.8 
!
assign (resid 2  and  name H8  ) (resid 3  and  name H5  ) 4.0 1.2 1.2
assign (resid 2  and  name H8  ) (resid 2  and  name H2' ) 4.2 0.8 0.8
assign (resid 2  and  name H8  ) (resid 2  and  name H3' ) 2.5 0.7 0.7
assign (resid 2  and  name H8  ) (resid 3  and  name H6  ) 4.2 0.8 0.8 
assign (resid 2  and  name H1' ) (resid 3  and  name H5' ) 4.2 0.8 0.8 
assign (resid 2  and  name H2' ) (resid 3  and  name H5'') 4.2 1.0 1.0 
assign (resid 2  and  name H2' ) (resid 3  and  name H5' ) 2.5 0.7 0.7 
assign (resid 2  and  name H2' ) (resid 3  and  name H4' ) 3.2 1.0 1.0 
assign (resid 2  and  name H2' ) (resid 3  and  name H3' ) 4.2 0.8 0.8 
assign (resid 2  and  name H3' ) (resid 3  and  name H6  ) 2.5 0.7 0.7
assign (resid 2  and  name H3' ) (resid 3  and  name H5  ) 3.5 1.0 1.0 
assign (resid 2  and  name H5'#) (resid 2  and  name H3' ) 3.5 1.7 1.7 
assign (resid 2  and  name H5'#) (resid 2  and  name H4' ) 3.0 1.2 1.2 
assign (resid 2  and  name H5'#) (resid 3  and  name H5  ) 4.2 0.8 0.8 
assign (resid 2  and  name H5'#) (resid 3  and  name H6  ) 4.2 0.8 0.8 
!
assign (resid 3  and  name H6  ) (resid 2  and  name H1' ) 4.2 0.8 0.8
assign (resid 3  and  name H6  ) (resid 2  and  name H2' ) 2.4 0.6 0.6
assign (resid 3  and  name H6  ) (resid 2  and  name H4' ) 4.0 1.2 1.2
assign (resid 3  and  name H5  ) (resid 2  and  name H2' ) 4.0 1.2 1.2
assign (resid 3  and  name H1' ) (resid 3  and  name H6  ) 3.2 1.0 1.0
assign (resid 3  and  name H1' ) (resid 4  and  name H8  ) 4.2 0.8 0.8
assign (resid 3  and  name H1' ) (resid 2  and  name H2' ) 4.2 0.8 0.8
assign (resid 3  and  name H1' ) (resid 4  and  name H5'') 4.2 0.8 0.8 
assign (resid 3  and  name H2' ) (resid 3  and  name H6  ) 4.2 0.8 0.8
assign (resid 3  and  name H2' ) (resid 4  and  name H8  ) 2.5 0.7 0.7
assign (resid 3  and  name H2' ) (resid 4  and  name H1' ) 4.2 0.8 0.8
assign (resid 3  and  name H2' ) (resid 3  and  name H5  ) 4.0 1.2 2.0 !likely caused by S.D.
assign (resid 3  and  name H2' ) (resid 4  and  name H5' ) 2.5 0.7 0.7 
assign (resid 3  and  name H2' ) (resid 4  and  name H4' ) 3.4 0.8 0.8 
assign (resid 3  and  name H2' ) (resid 4  and  name H5'') 3.4 0.8 0.8 
assign (resid 3  and  name H3' ) (resid 3  and  name H6  ) 2.5 0.7 0.7
assign (resid 3  and  name H3' ) (resid 4  and  name H5' ) 2.5 0.7 0.7 
assign (resid 3  and  name H3' ) (resid 4  and  name H5'') 4.2 0.8 0.8 
assign (resid 3  and  name H3' ) (resid 4  and  name H8  ) 4.2 0.8 0.8 
assign (resid 3  and  name H5'#) (resid 3  and  name H3' ) 3.5 1.7 1.7 
assign (resid 3  and  name H5'#) (resid 3  and  name H4' ) 3.0 1.2 1.2 
!
assign (resid 4  and  name H8  ) (resid 4  and  name H1' ) 4.2 0.8 0.8
assign (resid 4  and  name H2' ) (resid 4  and  name H8  ) 4.2 0.8 0.8
assign (resid 4  and  name H2' ) (resid 5  and  name H8  ) 2.4 0.6 0.6
assign (resid 4  and  name H2' ) (resid 5  and  name H1' ) 4.2 0.8 0.8
assign (resid 4  and  name H3' ) (resid 5  and  name H8  ) 3.2 0.8 0.8
assign (resid 4  and  name H3' ) (resid 5  and  name H2' ) 4.0 1.2 1.2
assign (resid 4  and  name H3' ) (resid 4  and  name H8  ) 2.8 0.8 0.8
assign (resid 4  and  name H4' ) (resid 4  and  name H8  ) 4.0 1.2 1.2
assign (resid 4  and  name H4' ) (resid 4  and  name H1' ) 4.0 1.2 1.2
assign (resid 4  and  name H5'#) (resid 4  and  name H3' ) 3.5 1.7 1.7 
assign (resid 4  and  name H5'#) (resid 4  and  name H4' ) 3.0 1.2 1.2 
!
assign (resid 5  and  name H8  ) (resid 5  and  name H1' ) 3.2 1.0 1.0
assign (resid 5  and  name H8  ) (resid 4  and  name H1' ) 4.2 0.8 0.8
assign (resid 5  and  name H8  ) (resid 5  and  name H3' ) 2.5 0.7 0.7
assign (resid 5  and  name H1' ) (resid 7  and  name H3' ) 4.2 1.0 1.0 !Wild
assign (resid 5  and  name H2' ) (resid 7  and  name H8  ) 2.5 0.7 0.7 !Wild
assign (resid 5  and  name H2' ) (resid 5  and  name H8  ) 4.2 1.2 0.8 
assign (resid 5  and  name H5'#) (resid 5  and  name H3' ) 3.5 1.7 1.7 
assign (resid 5  and  name H5'#) (resid 5  and  name H4' ) 3.5 1.7 1.2 
assign (resid 5  and  name H5'#) (resid 6  and  name H2' ) 3.5 1.7 1.7 
assign (resid 5  and  name H5'#) (resid 7  and  name H8  ) 4.0 1.2 2.0 !Wild, likely caused by S.D.
!
assign (resid 6  and  name H6  ) (resid 6  and  name H1' ) 4.2 1.0 1.0
assign (resid 6  and  name H6  ) (resid 6  and  name H3' ) 2.5 0.7 0.7
assign (resid 6  and  name H6  ) (resid 5  and  name H2' ) 4.2 1.0 1.0
assign (resid 6  and  name H6  ) (resid 6  and  name H2' ) 3.2 1.0 1.0 
assign (resid 6  and  name H5  ) (resid 5  and  name H2' ) 4.2 1.0 1.0
assign (resid 6  and  name H5  ) (resid 6  and  name H2' ) 4.2 1.0 1.0
assign (resid 6  and  name H5  ) (resid 6  and  name H1' ) 4.2 1.0 1.0 
assign (resid 6  and  name H1' ) (resid 6  and  name H4' ) 3.2 1.0 1.0
assign (resid 6  and  name H2' ) (resid 5  and  name H1' ) 2.5 0.7 0.7 
assign (resid 6  and  name H3' ) (resid 5  and  name H1' ) 2.5 0.7 0.7 
assign (resid 6  and  name H4' ) (resid 6  and  name H6  ) 4.2 1.0 1.0
!
assign (resid 7  and  name H8  ) (resid 7  and  name H2' ) 4.2 0.8 0.8
assign (resid 7  and  name H8  ) (resid 7  and  name H3' ) 2.5 0.7 0.7
assign (resid 7  and  name H8  ) (resid 6  and  name H2' ) 4.2 1.0 1.0
assign (resid 7  and  name H1' ) (resid 7  and  name H8  ) 4.2 0.8 0.8
assign (resid 7  and  name H1' ) (resid 5  and  name H2' ) 4.0 1.2 2.0 !Wild, likely caused by S.D.
assign (resid 7  and  name H2' ) (resid 8  and  name H6  ) 2.5 0.7 0.7
assign (resid 7  and  name H2' ) (resid 6  and  name H3' ) 4.2 1.0 1.0
assign (resid 7  and  name H3' ) (resid 8  and  name H6  ) 3.2 1.0 1.0 
assign (resid 7  and  name H4' ) (resid 7  and  name H8  ) 4.2 0.8 0.8
assign (resid 7  and  name H4' ) (resid 6  and  name H2' ) 3.2 1.0 1.0 
assign (resid 7  and  name H4' ) (resid 7  and  name H1' ) 3.2 1.0 1.0
assign (resid 7  and  name H5'#) (resid 7  and  name H3' ) 3.5 1.7 1.7 
assign (resid 7  and  name H5'#) (resid 7  and  name H4' ) 3.0 1.2 1.2 
assign (resid 7  and  name H5'#) (resid 7  and  name H2' ) 3.5 1.7 1.7 
!
assign (resid 8  and  name H6  ) (resid 7  and  name H1' ) 4.2 0.8 0.8
assign (resid 8  and  name H6  ) (resid 8  and  name H1' ) 3.2 1.0 1.0 
assign (resid 8  and  name H6  ) (resid 8  and  name H2' ) 4.2 0.8 0.8 
assign (resid 8  and  name H6  ) (resid 8  and  name H3' ) 2.5 0.7 0.7
assign (resid 8  and  name H6  ) (resid 9  and  name H6  ) 4.2 1.0 1.0 
assign (resid 8  and  name H5  ) (resid 7  and  name H3' ) 4.2 0.8 0.8
assign (resid 8  and  name H5  ) (resid 7  and  name H1' ) 4.2 0.8 0.8 
assign (resid 8  and  name H5  ) (resid 7  and  name H2' ) 4.2 0.8 0.8 
assign (resid 8  and  name H1' ) (resid 9  and  name H6  ) 4.2 1.0 1.0 
assign (resid 8  and  name H1' ) (resid 7  and  name H2' ) 4.2 0.8 0.8
assign (resid 8  and  name H2' ) (resid 9  and  name H6  ) 2.8 1.0 1.0 
assign (resid 8  and  name H2' ) (resid 7  and  name H2' ) 4.2 0.8 0.8 
assign (resid 8  and  name H2' ) (resid 9  and  name H5  ) 4.2 1.0 1.0 
assign (resid 8  and  name H2' ) (resid 9  and  name H3' ) 3.5 1.7 1.7 
assign (resid 8  and  name H2' ) (resid 9  and  name H2' ) 3.5 1.0 1.0 
assign (resid 8  and  name H3' ) (resid 9  and  name H2' ) 4.2 1.0 1.0 
assign (resid 8  and  name H4' ) (resid 8  and  name H6  ) 4.2 1.0 1.0 
!
assign (resid 9  and  name H6  ) (resid 9  and  name H3' ) 3.6 1.0 1.0 
assign (resid 9  and  name H6  ) (resid 8  and  name H3' ) 4.2 0.8 0.8 
assign (resid 9  and  name H5  ) (resid 9  and  name H2' ) 4.2 1.0 1.0 
assign (resid 9  and  name H5  ) (resid 8  and  name H3' ) 3.6 1.0 1.0 
!assign (resid 9  and  name H5  ) (resid 8  and  name H3' ) 3.6 1.0 1.0 !Duplicate
assign (resid 9  and  name H1' ) (resid 9  and  name H6  ) 3.6 1.0 1.0 
assign (resid 9  and  name H1' ) (resid 9  and  name H4' ) 3.6 1.0 1.0 
assign (resid 9  and  name H2' ) (resid 9  and  name H6  ) 3.6 1.0 1.0 
!assign (resid 9  and  name H2' ) (resid 10 and  name H8  ) 3.6 1.0 1.0 !Duplicate
assign (resid 9  and  name H2' ) (resid 8  and  name H6  ) 4.2 0.8 1.2 
!assign (resid 9  and  name H2' ) (resid 10 and  name H4' ) 4.2 0.8 1.0 !Duplicate
assign (resid 9  and  name H2' ) (resid 9  and  name H5'#) 3.5 1.7 1.7 
!
assign (resid 10 and  name H8  ) (resid 13 and  name H1' ) 4.2 1.0 1.0 
assign (resid 10 and  name H8  ) (resid 9  and  name H2' ) 3.6 1.0 1.0 
assign (resid 10 and  name H8  ) (resid 13 and  name H2' ) 4.2 1.0 1.0 
assign (resid 10 and  name H8  ) (resid 9  and  name H3' ) 3.6 1.0 1.0 
assign (resid 10 and  name H8  ) (resid 14  and  name H5 ) 3.5 1.7 1.7 
assign (resid 10 and  name H1' ) (resid 10 and  name H2# ) 3.5 1.7 1.7 
assign (resid 10 and  name H1' ) (resid 11 and  name H1' ) 3.5 1.7 1.7 
assign (resid 10 and  name H1' ) (resid 11 and  name H2' ) 3.5 1.7 1.7 
assign (resid 10 and  name H1' ) (resid 11 and  name H3' ) 3.5 1.7 1.7 
assign (resid 10 and  name H1' ) (resid 9  and  name H5'#) 3.5 1.7 1.7 
assign (resid 10 and  name H2' ) (resid 9  and  name H4' ) 3.2 1.0 1.0 
assign (resid 10 and  name H2' ) (resid 9  and  name H3' ) 3.5 1.0 1.0 
assign (resid 10 and  name H2' ) (resid 9  and  name H2' ) 3.2 1.0 1.0 
assign (resid 10 and  name H2' ) (resid 10 and  name H5'#) 4.2 0.8 0.8 
assign (resid 10 and  name H4' ) (resid 13 and  name H1' ) 3.8 1.7 2.0 
assign (resid 10 and  name H4' ) (resid 9  and  name H2' ) 3.5 1.7 1.7 
assign (resid 10 and  name H4' ) (resid 9  and  name H3' ) 3.5 1.7 1.7 
assign (resid 10 and  name H4' ) (resid 12 and  name H2' ) 3.5 1.7 1.7 
assign (resid 10 and  name H4' ) (resid 11 and  name H8  ) 4.2 1.0 1.0 
assign (resid 10 and  name H4' ) (resid 13 and  name H2' ) 3.2 1.0 1.0 
assign (resid 10 and  name H4' ) (resid 11 and  name H4' ) 4.2 1.0 1.0 
assign (resid 10 and  name H4' ) (resid 11 and  name H3' ) 4.2 1.0 1.0 
assign (resid 10 and  name H5' ) (resid 10 and  name H4' ) 2.8 1.0 1.0 
assign (resid 10 and  name H5'') (resid 10 and  name H4' ) 2.8 1.0 1.0 
assign (resid 10 and  name H5' ) (resid 13 and  name H2' ) 3.5 1.7 1.7 
assign (resid 10 and  name H5'') (resid 13 and  name H2' ) 3.5 1.7 1.7 
assign (resid 10 and  name H5'#) (resid 9  and  name H4' ) 4.2 0.8 0.8 
assign (resid 10 and  name H5'#) (resid 9  and  name H3' ) 2.8 1.0 1.0 
!
assign (resid 11 and  name H8  ) (resid 11 and  name H61 ) 4.2 1.0 1.0 
assign (resid 11 and  name H8  ) (resid 11 and  name H1' ) 2.4 0.5 0.5 
assign (resid 11 and  name H8  ) (resid 13 and  name H1' ) 4.2 1.0 1.0 
assign (resid 11 and  name H8  ) (resid 12 and  name H2' ) 2.8 1.0 1.0 
assign (resid 11 and  name H8  ) (resid 11 and  name H2' ) 2.8 1.0 1.0 
assign (resid 11 and  name H8  ) (resid 11 and  name H3' ) 3.2 1.0 1.0 
assign (resid 11 and  name H8  ) (resid 12 and  name H4' ) 4.2 1.0 1.0 
assign (resid 11 and  name H8  ) (resid 12 and  name H5'#) 4.2 1.0 1.0 
assign (resid 11 and  name H8  ) (resid 12 and  name H8  ) 4.2 1.0 1.0 
assign (resid 11 and  name H1' ) (resid 12 and  name H8  ) 2.8 1.0 1.0 
assign (resid 11 and  name H1' ) (resid 10 and  name H3' ) 3.5 1.0 1.0 
assign (resid 11 and  name H1' ) (resid 10 and  name H4' ) 3.5 1.3 1.0 
assign (resid 11 and  name H1' ) ((resid 13 and  name H3' ) or (resid 12 and  name H4' )) 4.0 1.2 1.2 
assign (resid 11 and  name H1' ) (resid 12 and  name H5'#) 3.8 1.0 1.0 
assign (resid 11 and  name H1' ) (resid 10 and  name H5'#) 4.2 1.0 1.0 
assign (resid 11 and  name H1' ) (resid 12 and  name H2' ) 2.8 1.0 1.0 
assign (resid 11 and  name H1' ) (resid 12 and  name H5'#) 4.0 1.2 1.2 
assign (resid 11 and  name H2' ) (resid 12 and  name H8  ) 3.5 1.7 1.7 
assign (resid 11 and  name H2' ) (resid 12 and  name H3' ) 4.2 1.0 0.8 
assign (resid 11 and  name H3' ) (resid 12 and  name H5'#) 3.5 1.0 1.0 
assign (resid 11 and  name H4' ) (resid 12 and  name H5'#) 4.2 0.8 0.8 
assign (resid 11 and  name H5' ) (resid 11 and  name H3' ) 3.5 0.7 0.7 
assign (resid 11 and  name H5'') (resid 11 and  name H3' ) 2.5 0.7 0.7 
assign (resid 11 and  name H5' ) (resid 10 and  name H4' ) 4.0 1.2 1.2 
assign (resid 11 and  name H5'') (resid 10 and  name H4' ) 4.0 1.2 1.2 
assign (resid 11 and  name H5' ) (resid 12 and  name H5'#) 4.2 1.0 1.0 
assign (resid 11 and  name H5'') (resid 12 and  name H5'#) 4.2 1.0 1.0 
assign (resid 11 and  name H2  ) (resid 11 and  name H3' ) 3.5 0.8 0.8 
assign (resid 11 and  name H2  ) (resid 11 and  name H5'#) 3.5 1.0 1.0 
!
!assign (resid 12 and  name H8  ) (resid 12 and  name H1' ) 3.2 1.0 1.0 !Duplicate
assign (resid 12 and  name H8  ) (resid 13 and  name H1' ) 4.2 1.0 1.0 
assign (resid 12 and  name H8  ) (resid 12 and  name H3' ) 3.5 1.0 1.0 
assign (resid 12 and  name H8  ) (resid 12 and  name H2' ) 2.8 1.0 1.0 
assign (resid 12 and  name H8  ) (resid 12 and  name H5'#) 3.5 1.0 1.0 
assign (resid 12 and  name H1' ) (resid 11 and  name H8  ) 4.2 1.0 1.0 
assign (resid 12 and  name H1' ) (resid 13 and  name H2  ) 3.6 1.7 1.7 
assign (resid 12 and  name H1' ) (resid 12 and  name H8  ) 3.2 1.0 1.0 
assign (resid 12 and  name H2' ) (resid 13 and  name H5'#) 4.2 0.8 0.8 
assign (resid 12 and  name H2' ) (resid 13 and  name H2' ) 4.2 1.0 0.8 
assign (resid 12 and  name H3' ) (resid 13 and  name H5'#) 4.2 0.8 0.8 
assign (resid 12 and  name H3' ) (resid 13 and  name H2' ) 4.2 0.8 1.2 
assign (resid 12 and  name H4' ) (resid 11 and  name H3' ) 3.6 1.7 1.7 
assign (resid 12 and  name H4' ) ((resid 10 and  name H3' ) or (resid 11 and  name H3' )) 3.6 1.7 1.7 
assign (resid 12 and  name H4' ) (resid 11 and  name H2' ) 3.6 1.7 1.7 
assign (resid 12 and  name H4' ) (resid 12 and  name H5' ) 2.8 1.0 1.0 
assign (resid 12 and  name H4' ) (resid 12 and  name H5'') 2.8 1.0 1.0 
!
assign (resid 13 and  name H8  ) (resid 14 and  name H1' ) 3.6 1.0 1.0 
assign (resid 13 and  name H8  ) (resid 13 and  name H2' ) 4.2 0.8 0.8
!
assign (resid 14 and  name H6  ) (resid 14 and  name H3' ) 2.8 1.0 1.0 
assign (resid 14 and  name H6  ) (resid 13 and  name H4' ) 4.2 1.0 1.0 
assign (resid 14 and  name H5  ) (resid 13 and  name H4' ) 4.2 1.0 1.0 
assign (resid 14 and  name H5  ) (resid 14 and  name H3' ) 3.6 1.0 1.0 
assign (resid 14 and  name H5  ) (resid 13 and  name H3' ) 4.2 1.0 1.0 
assign (resid 14 and  name H5  ) (resid 9  and  name H2' ) 4.6 0.8 0.8 
assign (resid 14 and  name H1' ) (resid 14 and  name H6  ) 4.2 1.0 1.0 
assign (resid 14 and  name H1' ) (resid 13 and  name H2  ) 4.2 1.0 1.0 
assign (resid 14 and  name H1' ) (resid 13 and  name H4' ) 4.2 1.0 1.0 
assign (resid 14 and  name H2' ) (resid 15 and  name H8  ) 3.6 1.0 1.0 
assign (resid 14 and  name H3' ) (resid 15 and  name H8  ) 3.6 1.0 1.0 
!
assign (resid 15 and  name H8  ) (resid 14 and  name H6  ) 4.2 0.8 0.8
assign (resid 15 and  name H8  ) (resid 15 and  name H1' ) 3.2 1.0 1.0 
assign (resid 15 and  name H8  ) (resid 15 and  name H3' ) 2.5 0.7 0.7 
assign (resid 15 and  name H8  ) (resid 16 and  name H5  ) 4.2 1.0 0.8 
assign (resid 15 and  name H1' ) (resid 16 and  name H6  ) 4.2 0.8 0.8 
assign (resid 15 and  name H1' ) (resid 14 and  name H2' ) 2.5 0.7 0.7
assign (resid 15 and  name H1' ) (resid 14 and  name H5  ) 4.2 1.0 1.0 
assign (resid 15 and  name H1' ) (resid 14 and  name H1' ) 4.2 1.0 0.8 
assign (resid 15 and  name H2' ) (resid 16 and  name H6  ) 2.5 0.7 0.7 
assign (resid 15 and  name H2' ) (resid 15 and  name H8  ) 4.2 0.8 0.8 
assign (resid 15 and  name H2' ) (resid 14 and  name H1' ) 5.0 1.0 1.0 !likely caused by S.D.
assign (resid 15 and  name H2' ) (resid 16 and  name H4' ) 2.8 1.0 1.0 
assign (resid 15 and  name H2' ) (resid 16 and  name H1' ) 4.2 1.0 0.8 
assign (resid 15 and  name H3' ) (resid 16 and  name H6  ) 3.2 1.0 1.0 
assign (resid 15 and  name H3' ) (resid 16 and  name H5  ) 4.2 0.8 0.8
assign (resid 15 and  name H3' ) (resid 14 and  name H2' ) 3.2 0.8 0.8 
assign (resid 15 and  name H4' ) (resid 16 and  name H6  ) 4.0 1.2 1.2
assign (resid 15 and  name H4' ) (resid 14 and  name H2' ) 3.2 0.8 0.8 
assign (resid 15 and  name H4' ) (resid 15 and  name H8  ) 4.2 1.0 0.8 
assign (resid 15 and  name H5'#) (resid 15 and  name H8  ) 4.2 0.8 0.8 
assign (resid 15 and  name H5'#) (resid 15 and  name H3' ) 2.8 1.0 1.0 
assign (resid 15 and  name H5'#) (resid 14 and  name H2' ) 2.5 0.7 0.7 
!
assign (resid 16 and  name H6  ) (resid 15 and  name H8  ) 3.2 1.0 1.0 
assign (resid 16 and  name H6  ) (resid 16 and  name H3' ) 2.5 0.7 0.7 
assign (resid 16 and  name H6  ) (resid 16 and  name H1' ) 3.2 1.0 1.0 
assign (resid 16 and  name H1' ) (resid 15 and  name H3' ) 4.2 0.8 0.8 
assign (resid 16 and  name H2' ) (resid 17 and  name H6  ) 2.5 0.7 0.7 
assign (resid 16 and  name H2' ) (resid 16 and  name H6  ) 4.2 0.8 0.8
assign (resid 16 and  name H2' ) (resid 17 and  name H1' ) 3.2 1.0 1.0 
assign (resid 16 and  name H3' ) (resid 17 and  name H5  ) 4.2 0.8 0.8
assign (resid 16 and  name H3' ) (resid 17 and  name H6  ) 3.6 0.6 0.6 
!
assign (resid 17 and  name H6  ) (resid 18 and  name H1' ) 4.2 0.8 1.0 
assign (resid 17 and  name H6  ) (resid 17 and  name H3' ) 2.5 0.7 0.7 
assign (resid 17 and  name H6  ) (resid 17 and  name H2' ) 4.2 0.8 0.8
assign (resid 17 and  name H2' ) (resid 18 and  name H6  ) 2.5 0.7 0.7 
assign (resid 17 and  name H3' ) (resid 18 and  name H6  ) 2.5 0.8 0.8 
assign (resid 17 and  name H5'#) (resid 17 and  name H3' ) 3.5 1.7 1.7 
assign (resid 17 and  name H5'#) (resid 17 and  name H4' ) 3.0 1.2 1.2 
!
assign (resid 18 and  name H6  ) (resid 18 and  name H2' ) 4.2 0.8 0.8
assign (resid 18 and  name H6  ) (resid 18 and  name H3' ) 2.5 0.7 0.7   
assign (resid 18 and  name H5  ) (resid 17 and  name H3' ) 3.5 0.8 0.8
assign (resid 18 and  name H1' ) (resid 19 and  name H8  ) 4.2 0.8 0.8
assign (resid 18 and  name H1' ) (resid 17 and  name H3' ) 4.2 0.8 0.8 
assign (resid 18 and  name H1' ) (resid 17 and  name H2' ) 3.2 1.0 1.0 
assign (resid 18 and  name H2' ) (resid 19 and  name H8  ) 2.5 0.7 0.7
assign (resid 18 and  name H2' ) (resid 19 and  name H1' ) 4.2 0.8 0.8 
assign (resid 18 and  name H2' ) (resid 17 and  name H2' ) 4.2 0.8 1.0 
assign (resid 18 and  name H3' ) (resid 19 and  name H8  ) 2.6 0.8 0.8 
assign (resid 18 and  name H3' ) (resid 18 and  name H5  ) 3.2 1.0 1.0 
assign (resid 18 and  name H3' ) (resid 17 and  name H2' ) 4.2 0.8 0.8 
!
assign (resid 19 and  name H8  ) (resid 18 and  name H6  ) 4.2 0.8 0.8
assign (resid 19 and  name H8  ) (resid 19 and  name H1' ) 3.2 1.0 1.0 
assign (resid 19 and  name H8  ) (resid 19 and  name H3' ) 3.2 0.7 0.7 
assign (resid 19 and  name H1' ) (resid 20 and  name H6  ) 4.2 0.8 0.8
assign (resid 19 and  name H2' ) (resid 20 and  name H6  ) 2.5 0.7 0.7
assign (resid 19 and  name H2' ) (resid 19 and  name H8  ) 4.2 0.8 0.8
assign (resid 19 and  name H3' ) (resid 20 and  name H6  ) 2.6 0.8 0.8
assign (resid 19 and  name H3' ) (resid 20 and  name H5  ) 4.2 0.8 0.8 
assign (resid 19 and  name H3' ) (resid 20 and  name H1' ) 4.2 0.8 0.8
assign (resid 19 and  name H4' ) (resid 20 and  name H6  ) 4.2 1.0 1.0
assign (resid 19 and  name H4' ) (resid 19 and  name H8  ) 4.2 1.0 1.0
assign (resid 19 and  name H4' ) (resid 19 and  name H1' ) 3.2 0.7 0.7 
assign (resid 19 and  name H5'#) (resid 19 and  name H3' ) 3.5 1.7 1.7 
!
assign (resid 20 and  name H6  ) (resid 20 and  name H1' ) 3.2 1.0 1.0
assign (resid 20 and  name H5  ) (resid 19 and  name H2' ) 4.2 1.0 1.0
assign (resid 20 and  name H5  ) (resid 19 and  name H8  ) 4.2 1.0 1.0
assign (resid 20 and  name H5  ) (resid 20 and  name H3' ) 4.2 0.8 0.8 
assign (resid 20 and  name H5  ) (resid 20 and  name H2' ) 4.2 1.0 1.0
assign (resid 20 and  name H2' ) (resid 20 and  name H6  ) 4.2 0.8 0.8
assign (resid 20 and  name H2' ) (resid 21 and  name H3' ) 3.2 1.0 1.0
assign (resid 20 and  name H2' ) (resid 21 and  name H1' ) 4.2 1.0 0.8
assign (resid 20 and  name H3' ) (resid 20 and  name H6  ) 2.5 0.7 0.7 
assign (resid 20 and  name H3' ) (resid 21 and  name H5' ) 3.2 0.7 0.7
assign (resid 20 and  name H4' ) (resid 20 and  name H6  ) 4.0 1.2 1.2
assign (resid 20 and  name H4' ) (resid 20 and  name H1' ) 3.2 0.7 0.7
!
assign (resid 21 and  name H6  ) (resid 21 and  name H1' ) 4.0 1.2 1.2
assign (resid 21 and  name H6  ) (resid 21 and  name H3' ) 2.5 0.7 0.7
assign (resid 21 and  name H6  ) (resid 20 and  name H2' ) 2.5 0.7 0.7
assign (resid 21 and  name H6  ) (resid 21 and  name H2' ) 4.2 0.8 0.8
assign (resid 21 and  name H5  ) (resid 20 and  name H3' ) 4.2 0.8 0.8
assign (resid 21 and  name H5  ) (resid 20 and  name H2' ) 4.2 0.8 0.8
assign (resid 21 and  name H1' ) (resid 20 and  name H3' ) 4.2 0.8 0.8 
assign (resid 21 and  name H3' ) (resid 20 and  name H3' ) 4.0 1.2 1.2
assign (resid 21 and  name H4' ) (resid 21 and  name H6  ) 4.0 1.2 1.2
assign (resid 21 and  name H4' ) (resid 21 and  name H1' ) 3.2 0.7 0.7
assign (resid 21 and  name H5'#) (resid 21 and  name H3' ) 3.5 1.7 1.7 
assign (resid 21 and  name H5'#) (resid 21 and  name H4' ) 3.0 1.2 1.2 
!
!H2O NOESY restraints
assign (resid 2  and  name H1  ) (resid 3  and  name H1' ) 3.6 0.5 0.5
assign (resid 2  and  name H1  ) (resid 3  and  name H42 ) 3.5 1.7 1.7 
assign (resid 2  and  name H1  ) (resid 3  and  name H41 ) 3.5 1.7 1.7 
assign (resid 2  and  name H1  ) (resid 19 and  name H1  ) 3.5 1.7 1.7 
assign (resid 2  and  name H1  ) (resid 20 and  name H3  ) 2.5 0.7 0.7
assign (resid 2  and  name H1  ) (resid 21 and  name H42 ) 3.5 1.7 1.7 
assign (resid 2  and  name H1  ) (resid 21 and  name H6  ) 3.5 1.7 1.7 
assign (resid 2  and  name H22 ) (resid 3  and  name H6  ) 3.5 1.7 1.7 
assign (resid 2  and  name H22 ) (resid 20 and  name H1' ) 4.2 0.8 0.8
assign (resid 2  and  name H21 ) (resid 21 and  name H2' ) 3.5 1.7 1.7 
assign (resid 2  and  name H21 ) (resid 21 and  name H3' ) 3.5 1.7 1.7 
!
assign (resid 3  and  name H42 ) (resid 20 and  name H3  ) 3.5 1.7 1.7 
assign (resid 3  and  name H41 ) (resid 20 and  name H3  ) 3.5 1.7 1.7 
!
assign (resid 4  and  name H1  ) (resid 17 and  name H42 ) 3.2 1.0 1.0
assign (resid 4  and  name H1  ) (resid 17 and  name H41 ) 3.2 1.0 1.0
assign (resid 4  and  name H1  ) (resid 18 and  name H42 ) 2.5 0.7 0.7
assign (resid 4  and  name H1  ) (resid 18 and  name H41 ) 3.2 1.0 1.0
assign (resid 4  and  name H1  ) (resid 19 and  name H1' ) 3.3 0.8 0.8 
assign (resid 4  and  name H1  ) (resid 19 and  name H2' ) 3.5 1.7 1.7 
assign (resid 4  and  name H1  ) (resid 19 and  name H8  ) 3.5 1.7 1.7 
assign (resid 4  and  name H8  ) (resid 19 and  name H1  ) 3.5 1.7 1.7  
!
assign (resid 5  and  name H1  ) (resid 7  and  name H1  ) 3.3 0.7 0.7 !Wild
assign (resid 5  and  name H1  ) (resid 18 and  name H1' ) 3.3 0.8 0.8
assign (resid 5  and  name H1  ) (resid 16 and  name H42 ) 4.2 0.8 0.8
assign (resid 5  and  name H1  ) (resid 17 and  name H42 ) 2.5 0.7 0.7
assign (resid 5  and  name H1  ) (resid 17 and  name H41 ) 3.2 1.0 1.0
!
assign (resid 7  and  name H1  ) (resid 8  and  name H1' ) 3.5 1.7 1.7 
assign (resid 7  and  name H1  ) (resid 17 and  name H1' ) 4.2 0.8 0.8
assign (resid 7  and  name H1  ) (resid 8  and  name H42 ) 3.5 1.7 1.7 
assign (resid 7  and  name H1  ) (resid 8  and  name H41 ) 3.2 1.0 1.0
assign (resid 7  and  name H1  ) (resid 15 and  name H1  ) 3.5 1.7 1.7 
assign (resid 7  and  name H1  ) (resid 16 and  name H42 ) 3.3 0.8 0.8
assign (resid 7  and  name H1  ) (resid 16 and  name H41 ) 4.2 0.8 0.8
assign (resid 7  and  name H1  ) (resid 17 and  name H41 ) 4.0 1.2 1.0
assign (resid 7  and  name H1  ) (resid 17 and  name H42 ) 4.2 0.8 0.8
!
assign (resid 8  and  name H42 ) (resid 15 and  name H22 ) 4.2 0.8 0.8 
assign (resid 8  and  name H42 ) (resid 9  and  name H1' ) 4.2 0.8 0.8 
assign (resid 8  and  name H41 ) (resid 9  and  name H1' ) 4.2 1.0 1.0
!
assign (resid 11 and  name H6# ) (resid 10 and  name H8  ) 3.5 1.7 1.7  
assign (resid 11 and  name H6# ) (resid 12 and  name H2' ) 3.5 1.7 1.7  
assign (resid 11 and  name H6# ) (resid 12 and  name H3' ) 3.5 1.7 1.7  
!
assign (resid 15 and  name H1  ) (resid 16 and  name H5  ) 3.5 1.7 1.7 
assign (resid 15 and  name H1  ) (resid 8  and  name H42 ) 3.2 1.0 1.0
assign (resid 15 and  name H1  ) (resid 8  and  name H41 ) 4.2 0.8 0.8
assign (resid 15 and  name H1  ) (resid 9  and  name H1' ) 3.6 1.0 1.0
!
assign (resid 16 and  name H1' ) (resid 15 and  name H1  ) 3.5 1.7 1.7  
assign (resid 16 and  name H42 ) (resid 5  and  name H22 ) 4.2 0.8 0.8 
!
assign (resid 17 and  name H41 ) (resid 16 and  name H5  ) 3.5 1.7 1.7 
!
assign (resid 18 and  name H6  ) (resid 4  and  name H1  ) 3.5 1.7 1.7 
assign (resid 18 and  name H42 ) (resid 19 and  name H8  ) 4.4 0.8 0.8
assign (resid 18 and  name H42 ) (resid 17 and  name H6  ) 4.2 0.6 0.6
!
assign (resid 19 and  name H1  ) (resid 20 and  name H3  ) 3.5 1.7 1.7 
assign (resid 19 and  name H1  ) (resid 3  and  name H42 ) 2.5 0.7 0.7
assign (resid 19 and  name H1  ) (resid 3  and  name H41 ) 3.2 1.0 1.0
!
assign (resid 20 and  name H3  ) (resid 3  and  name H1' ) 3.5 1.7 1.7 
assign (resid 20 and  name H3  ) (resid 20 and  name H2' ) 3.5 1.7 1.7 
assign (resid 20 and  name H3  ) (resid 20 and  name H3' ) 3.5 1.7 1.7 
assign (resid 20 and  name H3  ) (resid 2  and  name H22 ) 4.2 0.8 0.8
assign (resid 20 and  name H3  ) (resid 21 and  name H42 ) 3.5 1.7 1.7 
assign (resid 20 and  name H3  ) (resid 21 and  name H41 ) 3.5 1.7 1.7 
assign (resid 20 and  name H3  ) (resid 21 and  name H6  ) 3.5 1.7 1.7 
!
assign (resid 21 and  name H42 ) (resid 20 and  name H5  ) 3.5 1.7 1.7  
assign (resid 21 and  name H1' ) (resid 2  and  name H1  ) 3.5 1.7 1.7  
!
!UNOEs, close contacts in low energy structures, verified to be unobservable in NOESY at 250 msec
assign (resid 8  and  name H5  ) (resid 9  and  name H6  ) 4.4 0.8 10.0
assign (resid 8  and  name H6  ) (resid 9  and  name H5  ) 4.4 0.8 10.0
assign (resid 11 and  name H8  ) (resid 12 and  name H3' ) 4.4 0.8 10.0
assign (resid 12 and  name H8  ) (resid 13 and  name H2' ) 4.4 0.8 10.0
assign (resid 13 and  name H1' ) (resid 13 and  name H8  ) 4.4 0.8 10.0
assign (resid 10 and  name H1' ) (resid 11 and  name H8  ) 4.4 0.8 10.0
!
!H-bonds
!
! for G1/ C21  base pair
assign (resid 1 and name N1)  (resid 21 and name N3)    2.91   0.5     0.5  
assign (resid 1 and name O6)  (resid 21 and name N4)    2.71   0.5     0.5  
assign (resid 1 and name N2)  (resid 21 and name O2)    3.08   0.5     0.5  
assign (resid 1 and name H1)  (resid 21 and name N3)    1.89   0.5     0.5  
assign (resid 1 and name O6)  (resid 21 and name H42)   1.71   0.5     0.5  
assign (resid 1 and name H22) (resid 21 and name O2)    2.08   0.5     0.5  
!
! for G2/ U20  base pair; find more accurate distances for this GU pair.
assign (resid 2 and name O6)  (resid 20 and name N3)    2.71   0.5    0.5  
assign (resid 2 and name O6)  (resid 20 and name H3)    1.71   0.5    0.5  
assign (resid 2 and name N1)  (resid 20 and name O2)    2.71   0.5    0.5  
assign (resid 2 and name H1)  (resid 20 and name O2)    1.71   0.5    0.5  
! 
! for C3/ G19 base pair
assign (resid 19 and name N1)  (resid 3 and name N3)    2.91   0.5     0.5  
assign (resid 19 and name O6)  (resid 3 and name N4)    2.71   0.5     0.5  
assign (resid 19 and name N2)  (resid 3 and name O2)    3.08   0.5     0.5  
assign (resid 19 and name H1)  (resid 3 and name N3)    1.89   0.5     0.5  
assign (resid 19 and name O6)  (resid 3 and name H42)   1.71   0.5     0.5  
assign (resid 19 and name H22) (resid 3 and name O2)    2.08   0.5     0.5  
!
! for G4/ C18  base pair
assign (resid 4 and name N1)  (resid 18 and name N3)    2.91   0.5     0.5  
assign (resid 4 and name O6)  (resid 18 and name N4)    2.71   0.5     0.5  
assign (resid 4 and name N2)  (resid 18 and name O2)    3.08   0.5     0.5  
assign (resid 4 and name H1)  (resid 18 and name N3)    1.89   0.5     0.5  
assign (resid 4 and name O6)  (resid 18 and name H42)   1.71   0.5     0.5  
assign (resid 4 and name H22) (resid 18 and name O2)    2.08   0.5     0.5  
!
! for G5/ C17 base pair
assign (resid 5 and name N1)  (resid 17 and name N3)    2.91   0.5     0.5  
assign (resid 5 and name O6)  (resid 17 and name N4)    2.71   0.5     0.5  
assign (resid 5 and name N2)  (resid 17 and name O2)    3.08   0.5     0.5  
assign (resid 5 and name H1)  (resid 17 and name N3)    1.89   0.5     0.5  
assign (resid 5 and name O6)  (resid 17 and name H42)   1.71   0.5     0.5  
assign (resid 5 and name H22) (resid 17 and name O2)    2.08   0.5     0.5  
!
! for G7/ C16  base pair
assign (resid 7 and name N1)  (resid 16 and name N3)    2.91   0.5     0.5  
assign (resid 7 and name O6)  (resid 16 and name N4)    2.71   0.5     0.5  
assign (resid 7 and name N2)  (resid 16 and name O2)    3.08   0.5     0.5  
assign (resid 7 and name H1)  (resid 16 and name N3)    1.89   0.5     0.5  
assign (resid 7 and name O6)  (resid 16 and name H42)   1.71   0.5     0.5  
assign (resid 7 and name H22) (resid 16 and name O2)    2.08   0.5     0.5  
!
! for C8/ G15  base pair
assign (resid 15 and name N1)  (resid 8 and name N3)    2.91   0.5     0.5  
assign (resid 15 and name O6)  (resid 8 and name N4)    2.71   0.5     0.5  
assign (resid 15 and name N2)  (resid 8 and name O2)    3.08   0.5     0.5  
assign (resid 15 and name H1)  (resid 8 and name N3)    1.89   0.5     0.5  
assign (resid 15 and name O6)  (resid 8 and name H42)   1.71   0.5     0.5  
assign (resid 15 and name H22) (resid 8 and name O2)    2.08   0.5     0.5  


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