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
	641594	6qys	34370	cing	1-original	2	XPLOR/CNS	distance	NOE	ambi

# Restraints file 2: noe_NisB_v2.tbl
set echo=false end

set wrnlev=0 end

!Interresidue
!i-i+1
assign (resid 2 and name HB1 )((resid 3 and name HN) or (resid 5 and name HN)) 3.6 1.8 1.4
assign (resid 2 and name HB2 )((resid 3 and name HN) or (resid 5 and name HN)) 3.6 1.8 1.4
assign (resid 4 and name HN  )((resid 3 and name HN) or (resid 5 and name HN)) 2.9 1.1 0.7
assign ((resid 3 and name HN) or (resid 5 and name HN))(resid 4 and name HB# ) 2.9 1.1 0.7
assign (resid 2 and name HA  )((resid 3 and name HN) or (resid 5 and name HN)) 2.3 0.5 0.9
assign ((resid 3 and name HN) or (resid 5 and name HN))(resid 4 and name HA  ) 2.3 0.5 0.8
assign (resid 4 and name HN  )(resid 3 and name HA2 ) 3.6 1.8 1.4
assign (resid 4 and name HN  )(resid 3 and name HA1 ) 3.6 1.8 1.4
assign (resid 5 and name HG# )(resid 4 and name HA  ) 3.6 1.8 2.8 
assign (resid 5 and name HB1 )(resid 4 and name HA  ) 3.6 1.8 2.9 
assign (resid 1 and name HG# )(resid 2 and name HA  ) 3.6 1.8 2.9 
assign (resid 1 and name HG# )(resid 2 and name HD# ) 3.6 1.8 1.4
assign (resid 2 and name HA  )(resid 1 and name HB1 ) 3.6 1.8 2.6 
assign (resid 2 and name HA  )(resid 1 and name HA  ) 2.3 0.5 2.7
assign (resid 4 and name HA  )(resid 3 and name HA1 ) 3.6 1.8 1.4
!i-i+2
assign (resid 1 and name HT# )(resid 3 and name HA1 ) 3.6 1.8 2.4 
assign ((resid 3 and name HN) or (resid 5 and name HN))(resid 1 and name HA  ) 3.6 1.8 1.4
assign (resid 2 and name HA  )(resid 4 and name HN  ) 3.6 1.8 1.4
!i-i+3
assign (resid 1 and name HG# )(resid 4 and name HN  ) 3.6 1.8 1.4
assign (resid 4 and name HN  )(resid 1 and name HA  ) 2.9 1.1 0.8
assign (resid 1 and name HG# )(resid 4 and name HA  ) 2.9 1.1 1.3
assign (resid 1 and name HG# )(resid 4 and name HB1 ) 3.6 1.8 1.4
!i-i+4
assign (resid 1 and name HG# )((resid 3 and name HN) or (resid 5 and name HN)) 3.6 1.8 1.7
assign ((resid 3 and name HN) or (resid 5 and name HN))(resid 1 and name HT# ) 3.6 1.8 1.4
assign (resid 5 and name HE# )(resid 1 and name HT# ) 3.6 1.8 1.7
set echo=true end

set wrnlev=5 end

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