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

9284 1nnv 5779 cing 1-original 6 XPLOR/CNS distance hydrogen bond simple

!TURN!!!
!68-66 reverse gamma turn 68 may not b xchangd (overlap)
assign (resid 68 and  name N ) ( resid 66 and name O ) 3.0 0.7 0.2
assign (resid 68 and  name HN ) ( resid 66 and name O ) 2.0 0.5 0.5
!!Strands
!48-73
assign (resid 48 and  name N ) ( resid 73 and name O ) 3.0 0.7 0.2
assign (resid 48 and  name HN ) ( resid 73 and name O ) 2.0 0.5 0.5
assign (resid 73 and  name N ) ( resid 48 and name O ) 3.0 0.7 0.2
assign (resid 73 and  name HN ) ( resid 48 and name O ) 2.0 0.5 0.5
!50-71...50O-71HN were 3A in structure, but 71HN is not xchanged
assign (resid 50 and  name N ) ( resid 71 and name O ) 3.0 0.7 0.2
assign (resid 50 and  name HN ) ( resid 71 and name O ) 2.0 0.5 0.5
assign (resid 71 and  name HN ) ( resid 50 and name O ) 2.0 0.5 0.5
!70-92..70O-92HN=2.776  70HN-92O=2.358
assign (resid 70 and  name N ) ( resid 92 and name O ) 3.0 0.7 0.2
assign (resid 70 and  name HN ) ( resid 92 and name O ) 2.0 0.5 0.5
assign (resid 92 and  name N ) ( resid 70 and name O ) 3.0 0.7 0.2
assign (resid 92 and  name HN ) ( resid 70 and name O ) 2.0 0.5 0.5
!72-90..72HN-90O 1.72  72O-90HN 2.19
assign (resid 72 and  name N ) ( resid 90 and name O ) 3.0 0.7 0.2
assign (resid 72 and  name HN ) ( resid 90 and name O ) 2.0 0.5 0.5
assign (resid 90 and  name N ) ( resid 72 and name O ) 3.0 0.7 0.2
assign (resid 90 and  name HN ) ( resid 72 and name O ) 2.0 0.5 0.5
!74-88..74HN-88O 2.785  74O-88HN 2.645
assign (resid 74 and  name N ) ( resid 88 and name O ) 3.0 0.7 0.2
assign (resid 74 and  name HN ) ( resid 88 and name O ) 2.0 0.5 0.5
assign (resid 88 and  name N ) ( resid 74 and name O ) 3.0 0.7 0.2
assign (resid 88 and  name HN ) ( resid 74 and name O ) 2.0 0.5 0.5
!76-85..these atoms were consistantly close and 76 is protected
assign (resid 76 and  name N ) ( resid 85 and name O ) 3.0 0.7 0.2
assign (resid 76 and  name HN ) ( resid 85 and name O ) 2.0 0.5 0.5
!89-104..89HN-104O 
assign (resid 89 and  name N ) ( resid 104 and name O ) 3.0 0.7 0.2
assign (resid 89 and  name HN ) ( resid 104 and name O ) 2.0 0.5 0.5
assign (resid 104 and  name N ) ( resid 89 and name O ) 3.0 0.7 0.2
assign (resid 104 and  name HN ) ( resid 89 and name O ) 2.0 0.5 0.5
!91-102..91HN-102O 2.459  91O-102HN 2.549
assign (resid 91 and  name N ) ( resid 102 and name O ) 3.0 0.7 0.2
assign (resid 91 and  name HN ) ( resid 102 and name O ) 2.0 0.5 0.5
assign (resid 102 and  name N ) ( resid 91 and name O ) 3.0 0.7 0.2
assign (resid 102 and  name HN ) ( resid 91 and name O ) 2.0 0.5 0.5
!93-100..100 xchanged quickly
assign (resid 93 and  name N ) ( resid 100 and name O ) 3.0 0.7 0.2
assign (resid 93 and  name HN ) ( resid 100 and name O ) 2.0 0.5 0.5
!helix 1
assign (resid 14 and  name N ) ( resid 10 and name O ) 3.0 0.7 0.2
assign (resid 14 and  name HN ) ( resid 10 and name O ) 2.0 0.5 0.5
assign (resid 15 and  name N ) ( resid 11 and name O ) 3.0 0.7 0.2
assign (resid 15 and  name HN ) ( resid 11 and name O ) 2.0 0.5 0.5
assign (resid 16 and  name N ) ( resid 12 and name O ) 3.0 0.7 0.2
assign (resid 16 and  name HN ) ( resid 12 and name O ) 2.0 0.5 0.5

assign (resid 18 and  name N ) ( resid 14 and name O ) 3.0 0.7 0.2
assign (resid 18 and  name HN ) ( resid 14 and name O ) 2.0 0.5 0.5
assign (resid 19 and  name N ) ( resid 15 and name O ) 3.0 0.7 0.2
assign (resid 19 and  name HN ) ( resid 15 and name O ) 2.0 0.5 0.5
assign (resid 20 and  name N ) ( resid 16 and name O ) 3.0 0.7 0.2
assign (resid 20 and  name HN ) ( resid 16 and name O ) 2.0 0.5 0.5
assign (resid 21 and  name N ) ( resid 17 and name O ) 3.0 0.7 0.2
assign (resid 21 and  name HN ) ( resid 17 and name O ) 2.0 0.5 0.5
assign (resid 22 and  name N ) ( resid 18 and name O ) 3.0 0.7 0.2
assign (resid 22 and  name HN ) ( resid 18 and name O ) 2.0 0.5 0.5
assign (resid 23 and  name N ) ( resid 19 and name O ) 3.0 0.7 0.2
assign (resid 23 and  name HN ) ( resid 19 and name O ) 2.0 0.5 0.5
assign (resid 24 and  name N ) ( resid 20 and name O ) 3.0 0.7 0.2
assign (resid 24 and  name HN ) ( resid 20 and name O ) 2.0 0.5 0.5
assign (resid 25 and  name N ) ( resid 21 and name O ) 3.0 0.7 0.2
assign (resid 25 and  name HN ) ( resid 21 and name O ) 2.0 0.5 0.5
!helix 2
assign (resid 36 and  name N ) ( resid 32 and name O ) 3.0 0.7 0.2
assign (resid 36 and  name HN ) ( resid 32 and name O ) 2.0 0.5 0.5
assign (resid 37 and  name N ) ( resid 33 and name O ) 3.0 0.7 0.2
assign (resid 37 and  name HN ) ( resid 33 and name O ) 2.0 0.5 0.5

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image	mrblock_id	pdb_id	bmrb_id	cing	stage	position	program	type	subtype	subsubtype
	9284	1nnv	5779	cing	1-original	6	XPLOR/CNS	distance	hydrogen bond	simple