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
641577 6qtf 34363 cing 1-original 1 XPLOR/CNS distance NOE simple


# Restraints file 1: noe_nointra.tbl
set echo=false end

set wrnlev=0 end
!Interresidue
!i-i+1
assign (resid 2 and name HA  )(resid 3 and name HN  ) 3.3 0.7 0.7
assign (resid 4 and name HN  )(resid 3 and name HN  ) 3.2 0.6 0.6
assign (resid 5 and name HN  )(resid 4 and name HN  ) 3.6 0.7 0.7
assign (resid 4 and name HB1 )(resid 5 and name HN  ) 3.5 0.7 0.7
assign (resid 5 and name HN  )(resid 4 and name HB2 ) 4.2 0.8 0.8
assign (resid 4 and name HA  )(resid 5 and name HN  ) 2.9 0.6 0.6
assign (resid 2 and name HA  )(resid 3 and name HA1 ) 4.4 0.9 0.9
assign (resid 3 and name HA2 )(resid 4 and name HN  ) 4.1 0.8 0.8
assign (resid 4 and name HN  )(resid 3 and name HA1 ) 4.3 0.9 0.9
assign (resid 5 and name HN  )(resid 4 and name HN  ) 3.7 0.7 0.7
assign (resid 3 and name HN  )(resid 2 and name HB# ) 4.3 0.9 0.9
!i-i+2
assign (resid 1 and name HT# )(resid 3 and name HN  ) 4.3 0.9 0.9
assign (resid 2 and name HA  )(resid 4 and name HN  ) 4.3 0.9 0.9
!i-i+3/4
assign (resid 5 and name HN  )(resid 2 and name HN  ) 3.8 0.8 0.8
assign (resid 1 and name HA  )(resid 5 and name HA  ) 3.5 0.7 0.7
!across Lan
assign (resid 1 and name HB2 )(resid 4 and name HB2 ) 3.7 0.7 0.7
assign (resid 4 and name HB1 )(resid 1 and name HB2 ) 4.2 0.8 0.8
assign (resid 4 and name HA  )(resid 1 and name HA  ) 4.3 0.9 0.9
set echo=true end

set wrnlev=5 end


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