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
26261 2kgq cing 1-original 2 XPLOR/CNS distance hydrogen bond simple 

assign ( resid  6 and name O ) ( resid 49 and name HN ) 1.92 0.05 0.05
assign ( resid  6 and name O ) ( resid 49 and name N  ) 2.92 0.05 0.05
assign ( resid 49 and name O ) ( resid  6 and name HN ) 1.89 0.04 0.04
assign ( resid 49 and name O ) ( resid  6 and name N  ) 2.89 0.04 0.04

assign ( resid 47 and name O ) ( resid  8 and name HN ) 1.83 0.03 0.03
assign ( resid 47 and name O ) ( resid  8 and name N  ) 2.83 0.03 0.03

! antiparallel beta b3-b2 sheet:

assign ( resid 36 and name O ) ( resid 48 and name HN ) 1.94 0.05 0.05
assign ( resid 36 and name O ) ( resid 48 and name N  ) 2.94 0.05 0.05

assign ( resid 38 and name O ) ( resid 46 and name HN ) 1.91 0.04 0.04
assign ( resid 38 and name O ) ( resid 46 and name N  ) 2.91 0.04 0.04

! helix

assign ( resid 13  and name O ) ( resid 17  and name HN ) 1.9 0.4 0.6
assign ( resid 13  and name O ) ( resid 17  and name N  ) 2.9 0.5 0.7

! helix

assign ( resid 19  and name O ) ( resid 23  and name HN ) 1.9 0.4 0.6
assign ( resid 19  and name O ) ( resid 23  and name N  ) 2.9 0.5 0.7

assign ( resid 20  and name O ) ( resid 24  and name HN ) 1.98 0.05 0.05
assign ( resid 20  and name O ) ( resid 24  and name N  ) 2.98 0.05 0.05

assign ( resid 21  and name O ) ( resid 25  and name HN ) 1.89 0.04 0.04
assign ( resid 21  and name O ) ( resid 25  and name N  ) 2.89 0.04 0.04

assign ( resid 22  and name O ) ( resid 26  and name HN ) 1.81 0.03 0.03
assign ( resid 22  and name O ) ( resid 26  and name N  ) 2.81 0.03 0.03

assign ( resid 23  and name O ) ( resid 27  and name HN ) 1.9 0.4 0.6
assign ( resid 23  and name O ) ( resid 27  and name N  ) 2.9 0.5 0.7

assign ( resid 24  and name O ) ( resid 28  and name HN ) 1.98 0.05 0.05
assign ( resid 24  and name O ) ( resid 28  and name N  ) 2.98 0.05 0.05

assign ( resid 25  and name O ) ( resid 29  and name HN ) 1.88 0.04 0.04
assign ( resid 25  and name O ) ( resid 29  and name N  ) 2.88 0.04 0.04

assign ( resid 26  and name O ) ( resid 30  and name HN ) 1.9 0.4 0.6
assign ( resid 26  and name O ) ( resid 30  and name N  ) 2.9 0.5 0.7

!others

assign ( resid  4  and name O ) ( resid 51  and name HN ) 1.86 0.04 0.04
assign ( resid  4  and name O ) ( resid 51  and name N  ) 2.86 0.04 0.04

assign ( resid 10  and name OD1 ) ( resid 10  and name HN ) 1.9 0.4 0.6
assign ( resid 10  and name OD1 ) ( resid 10  and name N  ) 2.9 0.5 0.7

assign ( resid 23  and name OD1 ) ( resid 23  and name HN ) 1.8 0.4 0.6
assign ( resid 23  and name OD1 ) ( resid 23  and name N  ) 2.8 0.5 0.7

assign ( resid 50  and name OD1 ) ( resid 50  and name HN ) 2.2 0.4 0.7
assign ( resid 50  and name OD1 ) ( resid 50  and name N  ) 2.8 0.5 0.7

assign ( resid 50  and name OD1 ) ( resid 52  and name HN ) 2.2 0.4 0.7
assign ( resid 50  and name OD1 ) ( resid 52  and name N  ) 3.1 0.5 0.7

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