NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
511898 | 2yhh | 17625 | cing | 1-original | 5 | XPLOR/CNS | dihedral angle |
!!Dihedrals for interfacial side chains, MVN-mannobiose !! n44 assign (resid 44 and name N ) (resid 44 and name CA) (resid 44 and name CB) (resid 44 and name CG) 1.0 -60.0 35.0 2 !! !! i45 assign (resid 45 and name N ) (resid 45 and name CA) (resid 45 and name CB) (resid 45 and name CG1) 1.0 180.0 25.0 2 !! assign (resid 45 and name CA) (resid 45 and name CB) (resid 45 and name CG1) (resid 45 and name CD1) 1.0 60.0 25.0 2 !! !! d46 assign (resid 46 and name N) (resid 46 and name CA) (resid 46 and name CB) (resid 46 and name CG) 1.0 -60.0 25.0 2 !! !! g47 !! e48** assign (resid 48 and name N) (resid 48 and name CA) (resid 48 and name CB) (resid 48 and name CG) 1.0 -60.0 20.0 2 !assign (resid 48 and name CA) (resid 48 and name CB) ! (resid 48 and name CG) (resid 48 and name CD) 1.0 -60.0 20.0 2 !! d53** assign (resid 53 and name N) (resid 53 and name CA) (resid 53 and name CB) (resid 53 and name CG) 1.0 -60.0 20.0 2 !! q54** assign (resid 54 and name N ) (resid 54 and name CA) (resid 54 and name CB) (resid 54 and name CG) 1.0 60.0 20.0 2 !assign (resid 54 and name CA ) (resid 54 and name CB) ! (resid 54 and name CG) (resid 54 and name CD) 1.0 180.0 20.0 2 !! n55 assign (resid 55 and name N) (resid 55 and name CA) (resid 55 and name CB) (resid 55 and name CG) 1.0 -60.0 20.0 2 !assign (resid 55 and name CA) (resid 55 and name CB) ! (resid 55 and name CG) (resid 55 and name OD1) 1.0 -40.0 20.0 2 !! f56 assign (resid 56 and name N) (resid 56 and name CA) (resid 56 and name CB) (resid 56 and name CG) 1.0 60.0 20.0 2 assign (resid 56 and name CA) (resid 56 and name CB) (resid 56 and name CG) (resid 56 and name CD1) 1.0 90.0 40.0 2 !! q57 assign (resid 57 and name N ) (resid 57 and name CA) (resid 57 and name CB) (resid 57 and name CG) 1.0 60.0 20.0 2 !assign (resid 57 and name CA ) (resid 57 and name CB) ! (resid 57 and name CG) (resid 57 and name CD) 1.0 -60.0 40.0 2 !assign (resid 57 and name CB) (resid 57 and name CG) ! (resid 57 and name CD) (resid 57 and name OE1) 1.0 -20.0 40.0 2 !! e58 assign (resid 58 and name N ) (resid 58 and name CA) (resid 58 and name CB) (resid 58 and name CG) 1.0 -60.0 20.0 2 !assign (resid 58 and name CA) (resid 58 and name CB) ! (resid 58 and name CG) (resid 58 and name CD) 1.0 180.0 20.0 2 !! t59 assign (resid 59 and name N) (resid 59 and name CA) (resid 59 and name CB) (resid 59 and name OG1) 1.0 60.0 20.0 2 !! q81 assign (resid 81 and name N ) (resid 81 and name CA) (resid 81 and name CB) (resid 81 and name CG) 1.0 180.0 20.0 2 assign (resid 81 and name CA) (resid 81 and name CB) (resid 81 and name CG) (resid 81 and name CD) 1.0 180.0 20.0 2 !! t82 assign (resid 82 and name N) (resid 82 and name CA) (resid 82 and name CB) (resid 82 and name OG1) 1.0 60.0 20.0 2 !! m83** assign (resid 83 and name N) (resid 83 and name CA) (resid 83 and name CB) (resid 83 and name CG) 1.0 -60.0 20.0 2 !assign (resid 83 and name CA) (resid 83 and name CB) ! (resid 83 and name CG) (resid 83 and name SD) 1.0 180.0 20.0 2 !assign (resid 83 and name CB) (resid 83 and name CG) ! (resid 83 and name SD) (resid 83 and name CE) 1.0 60.0 20.0 2 !! d84** assign (resid 84 and name N) (resid 84 and name CA) (resid 84 and name CB) (resid 84 and name CG) 1.0 -60.0 20.0 2 !! g85 !! e86 assign (resid 86 and name N) (resid 86 and name CA) (resid 86 and name CB) (resid 86 and name CG) 1.0 -60.0 20.0 2 !assign (resid 86 and name CA) (resid 86 and name CB) ! (resid 86 and name CG) (resid 86 and name CD) 1.0 180.0 20.0 2 !Dihedrals from topology file, checked by hand assign (resid 201 and name O1 ) (resid 201 and name C1 ) (resid 201 and name C2 ) (resid 201 and name C3 ) 1.0 -60.0 20.0 2 assign (resid 201 and name O1 ) (resid 201 and name C1 ) (resid 201 and name C2 ) (resid 201 and name O2 ) 1.0 180.0 20.0 2 assign (resid 201 and name C1 ) (resid 201 and name C2 ) (resid 201 and name C3 ) (resid 201 and name C4 ) 1.0 -60.0 20.0 2 assign (resid 201 and name C1 ) (resid 201 and name C2 ) (resid 201 and name C3 ) (resid 201 and name O3 ) 1.0 180.0 20.0 2 assign (resid 201 and name O2 ) (resid 201 and name C2 ) (resid 201 and name C3 ) (resid 201 and name C4 ) 1.0 60.0 20.0 2 assign (resid 201 and name O2 ) (resid 201 and name C2 ) (resid 201 and name C3 ) (resid 201 and name O3 ) 1.0 -60.0 20.0 2 assign (resid 201 and name C2 ) (resid 201 and name C3 ) (resid 201 and name C4 ) (resid 201 and name C5 ) 1.0 60.0 20.0 2 assign (resid 201 and name C2 ) (resid 201 and name C3 ) (resid 201 and name C4 ) (resid 201 and name O4 ) 1.0 180.0 20.0 2 assign (resid 201 and name O3 ) (resid 201 and name C3 ) (resid 201 and name C4 ) (resid 201 and name C5 ) 1.0 180.0 20.0 2 assign (resid 201 and name O3 ) (resid 201 and name C3 ) (resid 201 and name C4 ) (resid 201 and name O4) 1.0 -60.0 20.0 2 assign (resid 201 and name C3 ) (resid 201 and name C4 ) (resid 201 and name C5 ) (resid 201 and name C6 ) 1.0 180.0 20.0 2 assign (resid 201 and name C3 ) (resid 201 and name C4 ) (resid 201 and name C5 ) (resid 201 and name O5 ) 1.0 -60.0 20.0 2 assign (resid 201 and name O4 ) (resid 201 and name C4 ) (resid 201 and name C5 ) (resid 201 and name C6 ) 1.0 60.0 20.0 2 assign (resid 201 and name O4 ) (resid 201 and name C4 ) (resid 201 and name C5 ) (resid 201 and name O5 ) 1.0 180.0 20.0 2 assign (resid 201 and name C4 ) (resid 201 and name C5 ) (resid 201 and name C6 ) (resid 201 and name O6 ) 1.0 -60.0 20.0 2 assign (resid 201 and name O5) (resid 201 and name C5 ) (resid 201 and name C6 ) (resid 201 and name O6 ) 1.0 180.0 20.0 2 assign (resid 201 and name C4 ) (resid 201 and name C5 ) (resid 201 and name O5 ) (resid 201 and name C1 ) 1.0 60.0 20.0 2 assign (resid 201 and name C6 ) (resid 201 and name C5 ) (resid 201 and name O5 ) (resid 201 and name C1 ) 1.0 180.0 20.0 2 assign (resid 201 and name O2 ) (resid 202 and name C1 ) (resid 202 and name C2 ) (resid 202 and name C3 ) 1.0 -60.0 20.0 2 assign (resid 201 and name O2 ) (resid 202 and name C1 ) (resid 202 and name C2 ) (resid 202 and name O2 ) 1.0 180.0 20.0 2 assign (resid 202 and name O5 ) (resid 202 and name C1 ) (resid 202 and name C2 ) (resid 202 and name C3 ) 1.0 60.0 20.0 2 assign (resid 202 and name O5 ) (resid 202 and name C1 ) (resid 202 and name C2 ) (resid 202 and name O2 ) 1.0 -60.0 20.0 2 assign (resid 201 and name O2 ) (resid 202 and name C1 ) (resid 202 and name O5 ) (resid 202 and name C5 ) 1.0 60.0 40.0 2 assign (resid 202 and name C2 ) (resid 202 and name C1 ) (resid 202 and name O5 ) (resid 202 and name C5 ) 1.0 -60.0 20.0 2 assign (resid 202 and name C1 ) (resid 202 and name C2 ) (resid 202 and name C3 ) (resid 202 and name C4 ) 1.0 -60.0 20.0 2 assign (resid 202 and name C1 ) (resid 202 and name C2 ) (resid 202 and name C3 ) (resid 202 and name O3 ) 1.0 180.0 20.0 2 assign (resid 202 and name O2 ) (resid 202 and name C2 ) (resid 202 and name C3 ) (resid 202 and name C4 ) 1.0 60.0 20.0 2 assign (resid 202 and name O2 ) (resid 202 and name C2 ) (resid 202 and name C3 ) (resid 202 and name O3 ) 1.0 -60.0 20.0 2 assign (resid 202 and name C2 ) (resid 202 and name C3 ) (resid 202 and name C4 ) (resid 202 and name C5 ) 1.0 60.0 20.0 2 assign (resid 202 and name C2 ) (resid 202 and name C3 ) (resid 202 and name C4 ) (resid 202 and name O4 ) 1.0 180.0 20.0 2 assign (resid 202 and name O3 ) (resid 202 and name C3 ) (resid 202 and name C4 ) (resid 202 and name C5 ) 1.0 180.0 20.0 2 assign (resid 202 and name O3 ) (resid 202 and name C3 ) (resid 202 and name C4 ) (resid 202 and name O4 ) 1.0 -60.0 20.0 2 assign (resid 202 and name C3 ) (resid 202 and name C4 ) (resid 202 and name C5 ) (resid 202 and name C6 ) 1.0 180.0 20.0 2 assign (resid 202 and name C3 ) (resid 202 and name C4 ) (resid 202 and name C5 ) (resid 202 and name O5 ) 1.0 -60.0 20.0 2 assign (resid 202 and name O4 ) (resid 202 and name C4 ) (resid 202 and name C5 ) (resid 202 and name C6 ) 1.0 60.0 20.0 2 assign (resid 202 and name O4 ) (resid 202 and name C4 ) (resid 202 and name C5 ) (resid 202 and name O5 ) 1.0 180.0 20.0 2 assign (resid 202 and name C4 ) (resid 202 and name C5 ) (resid 202 and name C6 ) (resid 202 and name O6 ) 1.0 -60.0 20.0 2 assign (resid 202 and name O5 ) (resid 202 and name C5 ) (resid 202 and name C6 ) (resid 202 and name O6 ) 1.0 180.0 20.0 2 assign (resid 202 and name C4 ) (resid 202 and name C5 ) (resid 202 and name O5 ) (resid 202 and name C1 ) 1.0 60.0 20.0 2 assign (resid 202 and name C6 ) (resid 202 and name C5 ) (resid 202 and name O5 ) (resid 202 and name C1 ) 1.0 180.0 20.0 2 !1-24-01 Dihedrals of Man2 based on NOEs !! Z201 assign (resid 201 and name C1 ) (resid 201 and name C2 ) (resid 201 and name O2 ) (resid 202 and name C1) 1.0 -90.0 30.0 2 assign (resid 201 and name C2 ) (resid 201 and name O2 ) (resid 202 and name C1 ) (resid 201 and name O5) 1.0 90.0 30.0 2
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