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

539091 2ls5 18411 cing 1-original 2 XPLOR/CNS distance hydrogen bond simple
!H-bonds for C7
!NHs still present after lyophilising into D2O

! alpha-helices
assign (resid  52 and name N) (resid  48 and name O) 3.2 1.0 0.0
assign (resid  52 and name H) (resid  48 and name O) 2.2 1.0 0.0
assign (resid  54 and name N) (resid  50 and name O) 3.2 1.0 0.0
assign (resid  54 and name H) (resid  50 and name O) 2.2 1.0 0.0
assign (resid  55 and name N) (resid  51 and name O) 3.2 1.0 0.0
assign (resid  55 and name H) (resid  51 and name O) 2.2 1.0 0.0
assign (resid  56 and name N) (resid  52 and name O) 3.2 1.0 0.0
assign (resid  56 and name H) (resid  52 and name O) 2.2 1.0 0.0
assign (resid  57 and name N) (resid  53 and name O) 3.2 1.0 0.0
assign (resid  57 and name H) (resid  53 and name O) 2.2 1.0 0.0
assign (resid  58 and name N) (resid  54 and name O) 3.2 1.0 0.0
assign (resid  58 and name H) (resid  54 and name O) 2.2 1.0 0.0
assign (resid  59 and name N) (resid  55 and name O) 3.2 1.0 0.0
assign (resid  59 and name H) (resid  55 and name O) 2.2 1.0 0.0

assign (resid  69 and name N) (resid  65 and name O) 3.2 1.0 0.0
assign (resid  69 and name H) (resid  65 and name O) 2.2 1.0 0.0

assign (resid  83 and name N) (resid  79 and name O) 3.2 1.0 0.0
assign (resid  83 and name H) (resid  79 and name O) 2.2 1.0 0.0
assign (resid  84 and name N) (resid  80 and name O) 3.2 1.0 0.0
assign (resid  84 and name H) (resid  80 and name O) 2.2 1.0 0.0
assign (resid  86 and name N) (resid  82 and name O) 3.2 1.0 0.0
assign (resid  86 and name H) (resid  82 and name O) 2.2 1.0 0.0

assign (resid 106 and name N) (resid 102 and name O) 3.2 1.0 0.0
assign (resid 106 and name H) (resid 102 and name O) 2.2 1.0 0.0
assign (resid 107 and name N) (resid 103 and name O) 3.2 1.0 0.0
assign (resid 107 and name H) (resid 103 and name O) 2.2 1.0 0.0

assign (resid 142 and name N) (resid 138 and name O) 3.2 1.0 0.0
assign (resid 142 and name H) (resid 138 and name O) 2.2 1.0 0.0
assign (resid 143 and name N) (resid 139 and name O) 3.2 1.0 0.0
assign (resid 143 and name H) (resid 139 and name O) 2.2 1.0 0.0
assign (resid 144 and name N) (resid 140 and name O) 3.2 1.0 0.0
assign (resid 144 and name H) (resid 140 and name O) 2.2 1.0 0.0
assign (resid 145 and name N) (resid 141 and name O) 3.2 1.0 0.0
assign (resid 145 and name H) (resid 141 and name O) 2.2 1.0 0.0
assign (resid 146 and name N) (resid 142 and name O) 3.2 1.0 0.0
assign (resid 146 and name H) (resid 142 and name O) 2.2 1.0 0.0
assign (resid 147 and name N) (resid 143 and name O) 3.2 1.0 0.0
assign (resid 147 and name H) (resid 143 and name O) 2.2 1.0 0.0
assign (resid 148 and name N) (resid 144 and name O) 3.2 1.0 0.0
assign (resid 148 and name H) (resid 144 and name O) 2.2 1.0 0.0
assign (resid 149 and name N) (resid 145 and name O) 3.2 1.0 0.0
assign (resid 149 and name H) (resid 145 and name O) 2.2 1.0 0.0
assign (resid 150 and name N) (resid 146 and name O) 3.2 1.0 0.0
assign (resid 150 and name H) (resid 146 and name O) 2.2 1.0 0.0



! beta-strands
assign (resid  13 and name N) (resid 125 and name O) 3.2 1.0 0.0
assign (resid  13 and name H) (resid 125 and name O) 2.2 1.0 0.0
assign (resid  18 and name N) (resid  26 and name O) 3.2 1.0 0.0
assign (resid  18 and name H) (resid  26 and name O) 2.2 1.0 0.0
assign (resid  20 and name N) (resid  24 and name O) 3.2 1.0 0.0
assign (resid  20 and name H) (resid  24 and name O) 2.2 1.0 0.0
assign (resid  26 and name N) (resid  18 and name O) 3.2 1.0 0.0
assign (resid  26 and name H) (resid  18 and name O) 2.2 1.0 0.0
assign (resid  28 and name N) (resid  16 and name O) 3.2 1.0 0.0
assign (resid  28 and name H) (resid  16 and name O) 2.2 1.0 0.0
assign (resid  35 and name N) (resid  68 and name O) 3.2 1.0 0.0
assign (resid  35 and name H) (resid  68 and name O) 2.2 1.0 0.0
assign (resid  36 and name N) (resid 121 and name O) 3.2 1.0 0.0
assign (resid  36 and name H) (resid 121 and name O) 2.2 1.0 0.0
assign (resid  37 and name N) (resid  70 and name O) 3.2 1.0 0.0
assign (resid  37 and name H) (resid  70 and name O) 2.2 1.0 0.0
assign (resid  38 and name N) (resid 119 and name O) 3.2 1.0 0.0
assign (resid  38 and name H) (resid 119 and name O) 2.2 1.0 0.0

assign (resid  41 and name N) (resid  74 and name O) 3.2 1.0 0.0
assign (resid  41 and name H) (resid  74 and name O) 2.2 1.0 0.0
assign (resid  70 and name N) (resid  35 and name O) 3.2 1.0 0.0
assign (resid  70 and name H) (resid  35 and name O) 2.2 1.0 0.0
assign (resid  72 and name N) (resid  37 and name O) 3.2 1.0 0.0
assign (resid  72 and name H) (resid  37 and name O) 2.2 1.0 0.0
assign (resid  73 and name N) (resid  95 and name O) 3.2 1.0 0.0
assign (resid  73 and name H) (resid  95 and name O) 2.2 1.0 0.0
assign (resid  74 and name N) (resid  39 and name O) 3.2 1.0 0.0
assign (resid  74 and name H) (resid  39 and name O) 2.2 1.0 0.0
assign (resid  75 and name N) (resid  97 and name O) 3.2 1.0 0.0
assign (resid  75 and name H) (resid  97 and name O) 2.2 1.0 0.0
assign (resid  76 and name N) (resid  41 and name O) 3.2 1.0 0.0
assign (resid  76 and name H) (resid  41 and name O) 2.2 1.0 0.0

assign (resid  97 and name N) (resid  73 and name O) 3.2 1.0 0.0
assign (resid  97 and name H) (resid  73 and name O) 2.2 1.0 0.0
assign (resid  98 and name N) (resid  19 and name O) 3.2 1.0 0.0
assign (resid  98 and name H) (resid  19 and name O) 2.2 1.0 0.0
assign (resid  99 and name N) (resid  75 and name O) 3.2 1.0 0.0
assign (resid  99 and name H) (resid  75 and name O) 2.2 1.0 0.0

assign (resid 119 and name N) (resid  38 and name O) 3.2 1.0 0.0
assign (resid 119 and name H) (resid  38 and name O) 2.2 1.0 0.0
assign (resid 120 and name N) (resid 129 and name O) 3.2 1.0 0.0
assign (resid 120 and name H) (resid 129 and name O) 2.2 1.0 0.0
assign (resid 121 and name N) (resid  36 and name O) 3.2 1.0 0.0
assign (resid 121 and name H) (resid  36 and name O) 2.2 1.0 0.0
assign (resid 122 and name N) (resid 126 and name O) 3.2 1.0 0.0
assign (resid 122 and name H) (resid 126 and name O) 2.2 1.0 0.0
assign (resid 125 and name N) (resid 122 and name O) 3.2 1.0 0.0
assign (resid 125 and name H) (resid 122 and name O) 2.2 1.0 0.0
assign (resid 127 and name N) (resid  11 and name O) 3.2 1.0 0.0
assign (resid 127 and name H) (resid  11 and name O) 2.2 1.0 0.0
assign (resid 128 and name N) (resid 120 and name O) 3.2 1.0 0.0
assign (resid 128 and name H) (resid 120 and name O) 2.2 1.0 0.0
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image	mrblock_id	pdb_id	bmrb_id	cing	stage	position	program	type	subtype	subsubtype
	539091	2ls5	18411	cing	1-original	2	XPLOR/CNS	distance	hydrogen bond	simple