Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
592949 | 2n4j RC | 25669 | cing | 1-original | 1 | XPLOR/CNS | dihedral angle |
! Backbone DIHEDRAL restraints
! RESIDUE 1
assign (resid 1 and name C4')
(resid 1 and name C3')
(resid 1 and name O3')
(resid 2 and name P)
1.0 180 60.0 2
! RESIDUE 2
assign (resid 2 and name P)
(resid 2 and name O5')
(resid 2 and name C5')
(resid 2 and name C4')
1.0 200 40.0 2
assign (resid 2 and name O5')
(resid 2 and name C5')
(resid 2 and name C4')
(resid 2 and name C3')
1.0 270 45.0 2
assign (resid 2 and name C4')
(resid 2 and name C3')
(resid 2 and name O3')
(resid 3 and name P)
1.0 180 60.0 2
! RESIDUE 3
assign (resid 3 and name P)
(resid 3 and name O5')
(resid 3 and name C5')
(resid 3 and name C4')
1.0 180 75.0 2
assign (resid 3 and name O5')
(resid 3 and name C5')
(resid 3 and name C4')
(resid 3 and name C3')
1.0 210 35.0 2
assign (resid 3 and name C4')
(resid 3 and name C3')
(resid 3 and name O3')
(resid 4 and name P)
1.0 180 60.0 2
! RESIDUE 4
assign (resid 4 and name P)
(resid 4 and name O5')
(resid 4 and name C5')
(resid 4 and name C4')
1.0 200 40.0 2
assign (resid 4 and name O5')
(resid 4 and name C5')
(resid 4 and name C4')
(resid 4 and name C3')
1.0 270 45.0 2
assign (resid 4 and name C4')
(resid 4 and name C3')
(resid 4 and name O3')
(resid 5 and name P)
1.0 180 60.0 2
! RESIDUE 5
assign (resid 5 and name P)
(resid 5 and name O5')
(resid 5 and name C5')
(resid 5 and name C4')
1.0 180 75.0 2
assign (resid 5 and name O5')
(resid 5 and name C5')
(resid 5 and name C4')
(resid 5 and name C3')
1.0 210 35.0 2
assign (resid 5 and name C4')
(resid 5 and name C3')
(resid 5 and name O3')
(resid 6 and name P)
1.0 180 60.0 2
! RESIDUE 6
assign (resid 6 and name P)
(resid 6 and name O5')
(resid 6 and name C5')
(resid 6 and name C4')
1.0 200 40.0 2
assign (resid 6 and name O5')
(resid 6 and name C5')
(resid 6 and name C4')
(resid 6 and name C3')
1.0 270 45.0 2
assign (resid 6 and name C4')
(resid 6 and name C3')
(resid 6 and name O3')
(resid 7 and name P)
1.0 180 60.0 2
! RESIDUE 7
assign (resid 7 and name P)
(resid 7 and name O5')
(resid 7 and name C5')
(resid 7 and name C4')
1.0 180 75.0 2
assign (resid 7 and name O5')
(resid 7 and name C5')
(resid 7 and name C4')
(resid 7 and name C3')
1.0 210 35.0 2
assign (resid 7 and name C4')
(resid 7 and name C3')
(resid 7 and name O3')
(resid 8 and name P)
1.0 180 60.0 2
! RESIDUE 8
assign (resid 8 and name P)
(resid 8 and name O5')
(resid 8 and name C5')
(resid 8 and name C4')
1.0 200 40.0 2
assign (resid 8 and name O5')
(resid 8 and name C5')
(resid 8 and name C4')
(resid 8 and name C3')
1.0 270 45.0 2
! RESIDUE 9
assign (resid 9 and name C4')
(resid 9 and name C3')
(resid 9 and name O3')
(resid 10 and name P)
1.0 180 60.0 2
! RESIDUE 10
assign (resid 10 and name P)
(resid 10 and name O5')
(resid 10 and name C5')
(resid 10 and name C4')
1.0 200 40.0 2
assign (resid 10 and name O5')
(resid 10 and name C5')
(resid 10 and name C4')
(resid 10 and name C3')
1.0 270 45.0 2
assign (resid 10 and name C4')
(resid 10 and name C3')
(resid 10 and name O3')
(resid 11 and name P)
1.0 180 60.0 2
! RESIDUE 11
assign (resid 11 and name P)
(resid 11 and name O5')
(resid 11 and name C5')
(resid 11 and name C4')
1.0 180 75.0 2
assign (resid 11 and name O5')
(resid 11 and name C5')
(resid 11 and name C4')
(resid 11 and name C3')
1.0 210 35.0 2
assign (resid 11 and name C4')
(resid 11 and name C3')
(resid 11 and name O3')
(resid 12 and name P)
1.0 180 60.0 2
! RESIDUE 12
assign (resid 12 and name P)
(resid 12 and name O5')
(resid 12 and name C5')
(resid 12 and name C4')
1.0 200 40.0 2
assign (resid 12 and name O5')
(resid 12 and name C5')
(resid 12 and name C4')
(resid 12 and name C3')
1.0 270 45.0 2
assign (resid 12 and name C4')
(resid 12 and name C3')
(resid 12 and name O3')
(resid 13 and name P)
1.0 180 60.0 2
! RESIDUE 13
assign (resid 13 and name P)
(resid 13 and name O5')
(resid 13 and name C5')
(resid 13 and name C4')
1.0 180 75.0 2
assign (resid 13 and name O5')
(resid 13 and name C5')
(resid 13 and name C4')
(resid 13 and name C3')
1.0 210 35.0 2
assign (resid 13 and name C4')
(resid 13 and name C3')
(resid 13 and name O3')
(resid 14 and name P)
1.0 180 60.0 2
! RESIDUE 14
assign (resid 14 and name P)
(resid 14 and name O5')
(resid 14 and name C5')
(resid 14 and name C4')
1.0 200 40.0 2
assign (resid 14 and name O5')
(resid 14 and name C5')
(resid 14 and name C4')
(resid 14 and name C3')
1.0 270 45.0 2
assign (resid 14 and name C4')
(resid 14 and name C3')
(resid 14 and name O3')
(resid 15 and name P)
1.0 180 60.0 2
! RESIDUE 15
assign (resid 15 and name P)
(resid 15 and name O5')
(resid 15 and name C5')
(resid 15 and name C4')
1.0 180 75.0 2
assign (resid 15 and name O5')
(resid 15 and name C5')
(resid 15 and name C4')
(resid 15 and name C3')
1.0 210 35.0 2
assign (resid 15 and name C4')
(resid 15 and name C3')
(resid 15 and name O3')
(resid 16 and name P)
1.0 180 60.0 2
! RESIDUE 16
assign (resid 16 and name P)
(resid 16 and name O5')
(resid 16 and name C5')
(resid 16 and name C4')
1.0 200 40.0 2
assign (resid 16 and name O5')
(resid 16 and name C5')
(resid 16 and name C4')
(resid 16 and name C3')
1.0 270 45.0 2
! DIHEDRAL restraints for sugar pucker
! RESIDUE 1 puckering
assign (resid 1 and name H1')
(resid 1 and name C1')
(resid 1 and name C2')
(resid 1 and name H2')
1.000 99.2 20.0 2
assign (resid 1 and name H2')
(resid 1 and name C2')
(resid 1 and name C3')
(resid 1 and name O3')
1.000 35.0 25.0 2
assign (resid 1 and name O3')
(resid 1 and name C3')
(resid 1 and name C4')
(resid 1 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 2 puckering
assign (resid 2 and name H1')
(resid 2 and name C1')
(resid 2 and name C2')
(resid 2 and name H2')
1.000 99.2 20.0 2
assign (resid 2 and name H2')
(resid 2 and name C2')
(resid 2 and name C3')
(resid 2 and name O3')
1.000 35.0 25.0 2
assign (resid 2 and name O3')
(resid 2 and name C3')
(resid 2 and name C4')
(resid 2 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 3 puckering
assign (resid 3 and name H1')
(resid 3 and name C1')
(resid 3 and name C2')
(resid 3 and name H2')
1.000 99.2 20.0 2
assign (resid 3 and name H2')
(resid 3 and name C2')
(resid 3 and name C3')
(resid 3 and name O3')
1.000 35.0 25.0 2
assign (resid 3 and name O3')
(resid 3 and name C3')
(resid 3 and name C4')
(resid 3 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 4 puckering
assign (resid 4 and name H1')
(resid 4 and name C1')
(resid 4 and name C2')
(resid 4 and name H2')
1.000 99.2 20.0 2
assign (resid 4 and name H2')
(resid 4 and name C2')
(resid 4 and name C3')
(resid 4 and name O3')
1.000 35.0 25.0 2
assign (resid 4 and name O3')
(resid 4 and name C3')
(resid 4 and name C4')
(resid 4 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 5 puckering
assign (resid 5 and name H1')
(resid 5 and name C1')
(resid 5 and name C2')
(resid 5 and name H2')
1.000 99.2 20.0 2
assign (resid 5 and name H2')
(resid 5 and name C2')
(resid 5 and name C3')
(resid 5 and name O3')
1.000 35.0 25.0 2
assign (resid 5 and name O3')
(resid 5 and name C3')
(resid 5 and name C4')
(resid 5 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 6 puckering
assign (resid 6 and name H1')
(resid 6 and name C1')
(resid 6 and name C2')
(resid 6 and name H2')
1.000 99.2 20.0 2
assign (resid 6 and name H2')
(resid 6 and name C2')
(resid 6 and name C3')
(resid 6 and name O3')
1.000 35.0 25.0 2
assign (resid 6 and name O3')
(resid 6 and name C3')
(resid 6 and name C4')
(resid 6 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 7 puckering
assign (resid 7 and name H1')
(resid 7 and name C1')
(resid 7 and name C2')
(resid 7 and name H2')
1.000 99.2 20.0 2
assign (resid 7 and name H2')
(resid 7 and name C2')
(resid 7 and name C3')
(resid 7 and name O3')
1.000 35.0 25.0 2
assign (resid 7 and name O3')
(resid 7 and name C3')
(resid 7 and name C4')
(resid 7 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 8 puckering
assign (resid 8 and name H1')
(resid 8 and name C1')
(resid 8 and name C2')
(resid 8 and name H2')
1.000 99.2 20.0 2
assign (resid 8 and name H2')
(resid 8 and name C2')
(resid 8 and name C3')
(resid 8 and name O3')
1.000 35.0 25.0 2
assign (resid 8 and name O3')
(resid 8 and name C3')
(resid 8 and name C4')
(resid 8 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 9 puckering
assign (resid 9 and name H1')
(resid 9 and name C1')
(resid 9 and name C2')
(resid 9 and name H2')
1.000 99.2 20.0 2
assign (resid 9 and name H2')
(resid 9 and name C2')
(resid 9 and name C3')
(resid 9 and name O3')
1.000 35.0 25.0 2
assign (resid 9 and name O3')
(resid 9 and name C3')
(resid 9 and name C4')
(resid 9 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 10 puckering
assign (resid 10 and name H1')
(resid 10 and name C1')
(resid 10 and name C2')
(resid 10 and name H2')
1.000 99.2 20.0 2
assign (resid 10 and name H2')
(resid 10 and name C2')
(resid 10 and name C3')
(resid 10 and name O3')
1.000 35.0 25.0 2
assign (resid 10 and name O3')
(resid 10 and name C3')
(resid 10 and name C4')
(resid 10 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 11 puckering
assign (resid 11 and name H1')
(resid 11 and name C1')
(resid 11 and name C2')
(resid 11 and name H2')
1.000 99.2 20.0 2
assign (resid 11 and name H2')
(resid 11 and name C2')
(resid 11 and name C3')
(resid 11 and name O3')
1.000 35.0 25.0 2
assign (resid 11 and name O3')
(resid 11 and name C3')
(resid 11 and name C4')
(resid 11 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 12 puckering
assign (resid 12 and name H1')
(resid 12 and name C1')
(resid 12 and name C2')
(resid 12 and name H2')
1.000 99.2 20.0 2
assign (resid 12 and name H2')
(resid 12 and name C2')
(resid 12 and name C3')
(resid 12 and name O3')
1.000 35.0 25.0 2
assign (resid 12 and name O3')
(resid 12 and name C3')
(resid 12 and name C4')
(resid 12 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 13 puckering
assign (resid 13 and name H1')
(resid 13 and name C1')
(resid 13 and name C2')
(resid 13 and name H2')
1.000 99.2 20.0 2
assign (resid 13 and name H2')
(resid 13 and name C2')
(resid 13 and name C3')
(resid 13 and name O3')
1.000 35.0 25.0 2
assign (resid 13 and name O3')
(resid 13 and name C3')
(resid 13 and name C4')
(resid 13 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 14 puckering
assign (resid 14 and name H1')
(resid 14 and name C1')
(resid 14 and name C2')
(resid 14 and name H2')
1.000 99.2 20.0 2
assign (resid 14 and name H2')
(resid 14 and name C2')
(resid 14 and name C3')
(resid 14 and name O3')
1.000 35.0 25.0 2
assign (resid 14 and name O3')
(resid 14 and name C3')
(resid 14 and name C4')
(resid 14 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 15 puckering
assign (resid 15 and name H1')
(resid 15 and name C1')
(resid 15 and name C2')
(resid 15 and name H2')
1.000 99.2 20.0 2
assign (resid 15 and name H2')
(resid 15 and name C2')
(resid 15 and name C3')
(resid 15 and name O3')
1.000 35.0 25.0 2
assign (resid 15 and name O3')
(resid 15 and name C3')
(resid 15 and name C4')
(resid 15 and name H4')
1.000 -157.0 25.0 2
! RESIDUE 16 puckering
assign (resid 16 and name H1')
(resid 16 and name C1')
(resid 16 and name C2')
(resid 16 and name H2')
1.000 99.2 20.0 2
assign (resid 16 and name H2')
(resid 16 and name C2')
(resid 16 and name C3')
(resid 16 and name O3')
1.000 35.0 25.0 2
assign (resid 16 and name O3')
(resid 16 and name C3')
(resid 16 and name C4')
(resid 16 and name H4')
1.000 -157.0 25.0 2