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
	15703	1yui	cing	1-original	5	XPLOR/CNS	distance	hydrogen bond	ambi

!attractive component
assign (resid 51 and name nh1) 
  (  (name o6 and (resid 104 or resid 120))
   or (name n7 and (resid 104 or resid 105 or resid 120))
   or (name o4 and resid 118) )
2.8 0.4 0.5


assign (resid 51 and name nh2) 
  (  (name o6 and (resid 104 or resid 120))
   or (name n7 and (resid 104 or resid 105 or resid 120))
   or (name o4 and resid 118) )
2.8 0.4 0.5

assign (resid 47 and name nh1) 
  (  (name o6 and (resid 106))
   or (name n7 and (resid 106 or resid 107 or resid 105))
   or (name o4 and (resid 118 or resid 116) ))
2.8 0.4 0.5

assign (resid 47 and name nh2) 
  (  (name o6 and (resid 106))
   or (name n7 and (resid 106 or resid 107 or resid 105))
   or (name o4 and (resid 118 or resid 116) ))
2.8 0.4 0.5




assign (resid 27 and name nh1) 
  (  (name o6 and (resid 108))
   or (name n7 and (resid 108 or resid 107 or resid 114))
   or (name o4 and (resid 109 or resid 116) ))
2.8 0.4 0.5

assign (resid 27 and name nh2) 
  (  (name o6 and (resid 108))
   or (name n7 and (resid 108 or resid 107 or resid 114))
   or (name o4 and (resid 109 or resid 116) ))
2.8 0.4 0.5


assign (resid 14 and name nh1) 
  (  (name n3 and ( resid 107 or resid 106 or resid 108))
   or (name o2 and (resid 115 or resid 116 or resid 117)) )
2.8 0.4 0.5

assign (resid 14 and name nh2) 
  (  (name n3 and (resid 107 or resid 106 or resid 108))
   or (name o2 and (resid 115 or resid 116 or resid 117)) )
2.8 0.4 0.5


assign (resid 48 and name nd2)
  ( (name n7 and (resid 104 or resid 105 or resid 106))
or (name o6 and (resid 104 or resid 106))
    or (name o4 and resid 118) )
2.8 0.4 0.5

assign (resid 48 and name od1)
  ( (name n6 and resid 105)
 or (name n4 and (resid 117 or resid 119)) )
2.8 0.4 0.5







!h distances

{assign (resid 48 and name od1)
   ((name hn' or name hn'') and (resid 105 or resid 117 or resid 119))
1.8 0.4 0.3



assign (resid 51 and name hh1#) 
  (  (name o6 and (resid 104 or resid 120))
   or (name n7 and (resid 104 or resid 105 or resid 120))
   or (name o4 and resid 118) )
1.8 0.4 0.4


assign (resid 51 and name hh2#) 
  (  (name o6 and (resid 104 or resid 120))
   or (name n7 and (resid 104 or resid 105 or resid 120))
   or (name o4 and resid 118) )
1.8 0.4 0.4

assign (resid 47 and name hh1#) 
  (  (name o6 and (resid 106))
   or (name n7 and (resid 106 or resid 107 or resid 105))
   or (name o4 and (resid 118 or resid 116) ))
1.8 0.4 0.4

assign (resid 47 and name hh2#) 
  (  (name o6 and (resid 106))
   or (name n7 and (resid 106 or resid 107 or resid 105))
   or (name o4 and (resid 118 or resid 116) ))
1.8 0.4 0.4




assign (resid 27 and name hh1#) 
  (  (name o6 and (resid 108))
   or (name n7 and (resid 108 or resid 107 or resid 114))
   or (name o4 and (resid 109 or resid 116) ))
1.8 0.4 0.4

assign (resid 27 and name hh2#) 
  (  (name o6 and (resid 108))
   or (name n7 and (resid 108 or resid 107 or resid 114))
   or (name o4 and (resid 109 or resid 116) ))
1.8 0.4 0.4


assign (resid 14 and name hh1#) 
  (  (name n3 and ( resid 107 or resid 106 or resid 108))
   or (name o2 and (resid 115 or resid 116 or resid 117)) )
1.8 0.4 0.4

assign (resid 14 and name hh2#) 
  (  (name n3 and (resid 107 or resid 106 or resid 108))
   or (name o2 and (resid 115 or resid 116 or resid 117)) )
1.8 0.4 0.4


assign (resid 48 and name hd2#)
  ( (name n7 and (resid 104 or resid 105 or resid 106))
or (name o6 and (resid 104 or resid 106))
  or (name o4 and resid 118) )
1.8 0.4 0.4
}

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