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
	616594	5sxy	30153	cing	1-original	2	XPLOR/CNS	distance	hydrogen bond	simple

# Restraints file 2: hbda.tbl
!* H-bonds in helix of resid 43 to resid 50
assign (resid 47 and name n)(resid 47 and name hn) (resid 43 and name o)
assign (resid 48 and name n)(resid 48 and name hn) (resid 44 and name o)
assign (resid 49 and name n)(resid 49 and name hn) (resid 45 and name o)
!* assign (resid 50 and name n)(resid 50 and name hn) (resid 46 and name o)

!* H-bonds in helix of resid 57 to resid 68
assign (resid 61 and name n)(resid 61 and name hn) (resid 57 and name o)
assign (resid 62 and name n)(resid 62 and name hn) (resid 58 and name o)
assign (resid 63 and name n)(resid 63 and name hn) (resid 59 and name o)
assign (resid 64 and name n)(resid 64 and name hn) (resid 60 and name o)
!* assign (resid 65 and name n)(resid 65 and name hn) (resid 61 and name o)
assign (resid 66 and name n)(resid 66 and name hn) (resid 62 and name o)
assign (resid 67 and name n)(resid 67 and name hn) (resid 63 and name o)
assign (resid 68 and name n)(resid 68 and name hn) (resid 64 and name o)

!* H-bonds in helix of resid 72 to resid 80
assign (resid 76 and name n)(resid 76 and name hn) (resid 72 and name o)
assign (resid 77 and name n)(resid 77 and name hn) (resid 73 and name o)
assign (resid 78 and name n)(resid 78 and name hn) (resid 74 and name o)
assign (resid 79 and name n)(resid 79 and name hn) (resid 75 and name o)
assign (resid 80 and name n)(resid 80 and name hn) (resid 76 and name o)

!* H-bonds in helix of resid 82 to resid 89
assign (resid 86 and name n)(resid 86 and name hn) (resid 82 and name o)
assign (resid 87 and name n)(resid 87 and name hn) (resid 83 and name o)
assign (resid 88 and name n)(resid 88 and name hn) (resid 84 and name o)
assign (resid 89 and name n)(resid 89 and name hn) (resid 85 and name o)



!* strands between strands type 1: 
!* assign (resid 19 and name n)(resid 19 and name hn) (resid 31 and name o)
!* assign (resid 31 and name n)(resid 31 and name hn) (resid 19 and name o)

!* assign (resid 21 and name n)(resid 21 and name hn) (resid 29 and name o)
!* assign (resid 29 and name n)(resid 29 and name hn) (resid 21 and name o)

!* assign (resid 30 and name n)(resid 30 and name hn) (resid 38 and name o)
!* assign (resid 38 and name n)(resid 38 and name hn) (resid 30 and name o)

!* assign (resid 28 and name n)(resid 28 and name hn) (resid 40 and name o)
!* assign (resid 40 and name n)(resid 40 and name hn) (resid 28 and name o)

!* strands between strands type 2: 
!* assign (resid 18 and name n)(resid 18 and name hn) (resid 32 and name o)
!* assign (resid 32 and name n)(resid 32 and name hn) (resid 18 and name o)

!* assign (resid 20 and name n)(resid 20 and name hn) (resid 30 and name o)
!* assign (resid 30 and name n)(resid 30 and name hn) (resid 20 and name o)

!* assign (resid 22 and name n)(resid 22 and name hn) (resid 28 and name o)
!* assign (resid 28 and name n)(resid 28 and name hn) (resid 22 and name o)

!* assign (resid 29 and name n)(resid 29 and name hn) (resid 40 and name o)
!* assign (resid 40 and name n)(resid 40 and name hn) (resid 29 and name o)

!* assign (resid 31 and name n)(resid 31 and name hn) (resid 38 and name o)
!* assign (resid 38 and name n)(resid 38 and name hn) (resid 31 and name o)

!* strands between strands type 3: 
assign (resid 19 and name n)(resid 19 and name hn) (resid 32 and name o)
!* assign (resid 32 and name n)(resid 32 and name hn) (resid 19 and name o)

assign (resid 21 and name n)(resid 21 and name hn) (resid 30 and name o)
assign (resid 30 and name n)(resid 30 and name hn) (resid 21 and name o)

assign (resid 23 and name n)(resid 23 and name hn) (resid 28 and name o)
assign (resid 28 and name n)(resid 28 and name hn) (resid 23 and name o)

assign (resid 28 and name n)(resid 28 and name hn) (resid 40 and name o)
assign (resid 40 and name n)(resid 40 and name hn) (resid 28 and name o)

assign (resid 30 and name n)(resid 30 and name hn) (resid 38 and name o)
assign (resid 38 and name n)(resid 38 and name hn) (resid 30 and name o)

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