NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image

mrblock_id

pdb_id

bmrb_id

cing

in_recoord

in_dress

stage

position

program

type

subtype

subsubtype

1869

1b2t

4397

cing

recoord

dress

1-original

3

XPLOR/CNS

distance

hydrogen bond

ambi

!hbonds

!-------------------------------------------


assign (resid 23 and name HN and segid "    ") (resid 20 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 23 and name N and segid "    ") (resid 20 and name O and segid "    ") 2.7 0.0 0.5
        

assign (resid 24 and name HN and segid "    ") (resid 21 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 24 and name N and segid "    ") (resid 21 and name O and segid "    ") 2.7 0.0 0.5


assign (resid 25 and name HN and segid "    ") (resid 42 and name O and segid "    ")  1.7 0.0 0.5
assign (resid 25 and name N and segid "    ") (resid 42 and name O and segid "    ") 2.7 0.0 0.5


assign (resid 26 and name HN and segid "    ") (resid 42 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 26 and name N and segid "    ") (resid 42 and name O and segid "    ") 2.7 0.0 0.5

assign (resid 28 and name HN and segid "    ") (resid 40 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 28 and name N and segid "    ") (resid 40 and name O and segid "    ") 2.7 0.0 0.5
        

assign ( (resid 30 and name HD21 and segid "    ") OR (resid 30 and name HD22 and segid "    "))
((resid 12 and name SG) OR 
 (resid 34 and name O and segid "    ") OR (resid 36 and name O and segid "    ") ) 1.7 0.0 0.5
assign ( (resid 30 and name ND2 and segid "    ") OR (resid 30 and name ND2 and segid "    "))
( (resid 12 and name SG) OR
 (resid 34 and name O and segid "    ") OR (resid 36 and name O and segid "    ") ) 2.7 0.0 0.5


assign (resid 38 and name HN and segid "    ") (resid 36 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 38 and name N and segid "    ") (resid 36 and name O and segid "    ") 2.7 0.0 0.5


assign (resid 39 and name HN and segid "    ") (resid 51 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 39 and name N and segid "    ") (resid 51 and name O and segid "    ") 2.7 0.0 0.5



assign (resid 40 and name HN and segid "    ") (resid 28 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 40 and name N and segid "    ") (resid 28 and name O and segid "    ") 2.7 0.0 0.5


assign (resid 41 and name HN and segid "    ") (resid 49 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 41 and name N and segid "    ") (resid 49 and name O and segid "    ") 2.7 0.0 0.5

assign (resid 42 and name HN and segid "    ") (resid 26 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 42 and name N and segid "    ") (resid 26 and name O and segid "    ") 2.7 0.0 0.5

assign (resid 43 and name HN and segid "    ") (resid 47 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 43 and name N and segid "    ") (resid 47 and name O and segid "    ") 2.7 0.0 0.5

assign (resid 44 and name HN and segid "    ") (resid 23 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 44 and name N and segid "    ") (resid 23 and name O and segid "    ") 2.7 0.0 0.5


assign (resid 46 and name HN and segid "    ") (resid 43 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 46 and name N and segid "    ") (resid 43 and name O and segid "    ") 2.7 0.0 0.5


assign (resid 47 and name HN and segid "    ")
((resid 43 and name OG1 and segid "    ") OR (resid 43 and name O)) 1.7 0.0 0.5
assign (resid 47 and name N and segid "    ")
( (resid 43 and name OG1 and segid "    ") OR (resid 43 and name O)) 2.7 0.0 0.5


assign (resid 49 and name HN and segid "    ") (resid 41 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 49 and name N and segid "    ") (resid 41 and name O and segid "    ") 2.7 0.0 0.5


assign (resid 51 and name HN and segid "    ") (resid 39 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 51 and name N and segid "    ") (resid 39 and name O and segid "    ") 2.7 0.0 0.5


assign (resid 52 and name HN and segid "    ") (resid 55 and name OE2 and segid "    ") 1.7 0.0 0.5
assign (resid 52 and name N and segid "    ") (resid 55 and name OE2 and segid "    ") 2.7 0.0 0.5


assign (resid 55 and name HN and segid "    ") (resid 52 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 55 and name N and segid "    ") (resid 52 and name O and segid "    ") 2.7 0.0 0.5

assign (resid 57 and name HE1 and segid "    ") (resid 55 and name OE1 and segid "    ") 1.7 0.0 0.5
assign (resid 57 and name NE1 and segid "    ") (resid 55 and name OE1 and segid "    ") 2.7 0.0 0.5


assign (resid 58 and name HN and segid "    ") (resid 55 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 58 and name N and segid "    ") (resid 55 and name O and segid "    ") 2.7 0.0 0.5


assign (resid 59 and name HN and segid "    ")
( (resid 55 and name O and segid "    ") OR (resid 56 and name O and segid "    ")) 1.7 0.0 0.5
assign (resid 59 and name N and segid "    ")
( (resid 55 and name O and segid "    ") OR (resid 56 and name O and segid "    ")) 2.7 0.0 0.5

assign (resid 60 and name HN and segid "    ") (resid 56 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 60 and name N and segid "    ") (resid 56 and name O and segid "    ")  2.7 0.0 0.5


assign (resid 61 and name HN and segid "    ") (resid 57 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 61 and name N and segid "    ") (resid 57 and name O and segid "    ") 2.7 0.0 0.5

assign (resid 62 and name HN and segid "    ") (resid 58 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 62 and name N and segid "    ") (resid 58 and name O and segid "    ") 2.7 0.0 0.5

assign (resid 63 and name HN and segid "    ") (resid 59 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 63 and name N and segid "    ") (resid 59 and name O and segid "    ") 2.7 0.0 0.5

assign (resid 64 and name HN and segid "    ") (resid 60 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 64 and name N and segid "    ") (resid 60 and name O and segid "    ") 2.7 0.0 0.5

assign (resid 65 and name HN and segid "    ") (resid 61 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 65 and name N and segid "    ") (resid 61 and name O and segid "    ") 2.7 0.0 0.5

assign (resid 66 and name HN and segid "    ") (resid 62 and name O and segid "    ") 1.7 0.0 0.5
assign (resid 66 and name N and segid "    ") (resid 62 and name O and segid "    ") 2.7 0.0 0.5
        

assign (resid 67 and name HN and segid "    ")
( (resid 63 and name O and segid "    ") OR (resid 64 and name O and segid "    ")) 1.7 0.0 0.5
assign (resid 67 and name N and segid "    ")
( (resid 63 and name O and segid "    ") OR (resid 64 and name O and segid "    ")) 2.7 0.0 0.5

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