Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
510106 | 2ky8 RC | 16936 | cing | 1-original | 1 | XPLOR/CNS | dihedral angle |
! talos_pred2xplor.nawk Table ! Date: Sun Apr 6 14:13:31 EST 2008
! Path: /raid1/dcw/dcwilljr/StructureCalc/cMBD2_dsDNA/TALOS
!
! G1 Dihedrals
! S2 Dihedrals
!assign (resid 1 and name c) (resid 2 and name n)
! (resid 2 and name ca) (resid 2 and name c) 1.0 -105 45 2 ! S2 Talos Phi
!assign (resid 2 and name n) (resid 2 and name ca)
! (resid 2 and name c) (resid 3 and name n) 1.0 -12.1 15.5 2 ! S2 Talos Psi
! D3 Dihedrals
!assign (resid 2 and name c) (resid 3 and name n)
! (resid 3 and name ca) (resid 3 and name c) 1.0 -69.0 20 2 ! D3 Talos Phi
!assign (resid 3 and name n) (resid 3 and name ca)
! (resid 3 and name c) (resid 4 and name n) 1.0 -34.4 30 2 ! D3 Talos Psi
! K4 Dihedrals
!assign (resid 3 and name c) (resid 4 and name n)
! (resid 4 and name ca) (resid 4 and name c) 1.0 -70 20 2 ! K4 Talos Phi
!assign (resid 4 and name n) (resid 4 and name ca)
! (resid 4 and name c) (resid 5 and name n) 1.0 -37 30 2 ! K4 Talos Psi
! Q5 Dihedrals
!assign (resid 4 and name c) (resid 5 and name n)
! (resid 5 and name ca) (resid 5 and name c) 1.0 -70 20.0 2 ! Q5 Talos Phi
!assign (resid 5 and name n) (resid 5 and name ca)
! (resid 5 and name c) (resid 6 and name n) 1.0 -24 40 2 ! Q5 Talos Psi
! G6 Dihedrals
!assign (resid 5 and name c) (resid 6 and name n)
! (resid 6 and name ca) (resid 6 and name c) 1.0 -104.2 38.0 2 ! G6 Talos Phi
!assign (resid 6 and name n) (resid 6 and name ca)
! (resid 6 and name c) (resid 7 and name n) 1.0 -39.4 54.4 2 ! G6 Talos Psi
! R7 Dihedrals
assign (resid 6 and name c) (resid 7 and name n)
(resid 7 and name ca) (resid 7 and name c) 1.0 -76.7 20 2 ! R7 Talos Phi
assign (resid 7 and name n) (resid 7 and name ca)
(resid 7 and name c) (resid 8 and name n) 1.0 139.4 30 2 ! R7 Talos Psi
! T8 Dihedrals
assign (resid 7 and name c) (resid 8 and name n)
(resid 8 and name ca) (resid 8 and name c) 1.0 -101.1 40 2 ! T8 Talos Phi
!assign (resid 8 and name n) (resid 8 and name ca)
! (resid 8 and name c) (resid 9 and name n) 1.0 144.9 30 2 ! T8 Talos Psi
! D9 Dihedrals
assign (resid 8 and name c) (resid 9 and name n)
(resid 9 and name ca) (resid 9 and name c) 1.0 -84.4 40 2 ! D9 Talos Phi
!assign (resid 9 and name n) (resid 9 and name ca)
! (resid 9 and name c) (resid 10 and name n) 1.0 147.1 12.7 2 ! D9 Talos Psi
! C10 Dihedrals
assign (resid 9 and name c) (resid 10 and name n)
(resid 10 and name ca) (resid 10 and name c) 1.0 -91.6 30 2 ! C10 Talos Phi
assign (resid 10 and name n) (resid 10 and name ca)
(resid 10 and name c) (resid 11 and name n) 1.0 137.2 20 2 ! C10 Talos Psi
! P11 Dihedrals
assign (resid 10 and name c) (resid 11 and name n)
(resid 11 and name ca) (resid 11 and name c) 1.0 -59.1 30 2 ! P11 Talos Phi
!assign (resid 11 and name n) (resid 11 and name ca)
! (resid 11 and name c) (resid 12 and name n) 1.0 -25.9 20 2 ! P11 Talos Psi
! A12 Dihedrals
assign (resid 11 and name c) (resid 12 and name n)
(resid 12 and name ca) (resid 12 and name c) 1.0 -80.3 30 2 ! A12 Talos Phi
assign (resid 12 and name n) (resid 12 and name ca)
(resid 12 and name c) (resid 13 and name n) 1.0 -20.4 20 2 ! A12 Talos Psi
! L13 Dihedrals
assign (resid 12 and name c) (resid 13 and name n)
(resid 13 and name ca) (resid 13 and name c) 1.0 -102.0 30 2 ! L13 Talos Phi
assign (resid 13 and name n) (resid 13 and name ca)
(resid 13 and name c) (resid 14 and name n) 1.0 114.0 40 2 ! L13 Talos Psi
! P14 Dihedrals
!assign (resid 13 and name c) (resid 14 and name n)
! (resid 14 and name ca) (resid 14 and name c) 1.0 -65.3 50.0 2 ! P14 Talos Phi
!assign (resid 14 and name n) (resid 14 and name ca)
! (resid 14 and name c) (resid 15 and name n) 1.0 151.1 7.8 2 ! P14 Talos Psi
! P15 Dihedrals
assign (resid 14 and name c) (resid 15 and name n)
(resid 15 and name ca) (resid 15 and name c) 1.0 -55.8 30 2 ! P15 Talos Phi
assign (resid 15 and name n) (resid 15 and name ca)
(resid 15 and name c) (resid 16 and name n) 1.0 139.5 20 2 ! P15 Talos Psi
! G16 Dihedrals
assign (resid 15 and name c) (resid 16 and name n)
(resid 16 and name ca) (resid 16 and name c) 1.0 92.0 30 2 ! G16 Talos Phi
!assign (resid 16 and name n) (resid 16 and name ca)
! (resid 16 and name c) (resid 17 and name n) 1.0 -12.6 20 2 ! G16 Talos Psi
! W17 Dihedrals
assign (resid 16 and name c) (resid 17 and name n)
(resid 17 and name ca) (resid 17 and name c) 1.0 -77.8 40 2 ! W17 Talos Phi
assign (resid 17 and name n) (resid 17 and name ca)
(resid 17 and name c) (resid 18 and name n) 1.0 139.1 20 2 ! W17 Talos Psi
! K18 Dihedrals
assign (resid 17 and name c) (resid 18 and name n)
(resid 18 and name ca) (resid 18 and name c) 1.0 -134.0 40 2 ! K18 Talos Phi
assign (resid 18 and name n) (resid 18 and name ca)
(resid 18 and name c) (resid 19 and name n) 1.0 147.8 20 2 ! K18 Talos Psi
! K19 Dihedrals
assign (resid 18 and name c) (resid 19 and name n)
(resid 19 and name ca) (resid 19 and name c) 1.0 -127.4 30 2 ! K19 Talos Phi
assign (resid 19 and name n) (resid 19 and name ca)
(resid 19 and name c) (resid 20 and name n) 1.0 137.5 20 2 ! K19 Talos Psi
! E20 Dihedrals
assign (resid 19 and name c) (resid 20 and name n)
(resid 20 and name ca) (resid 20 and name c) 1.0 -130.2 30 2 ! E20 Talos Phi
assign (resid 20 and name n) (resid 20 and name ca)
(resid 20 and name c) (resid 21 and name n) 1.0 140.4 30 2 ! E20 Talos Psi
! E21 Dihedrals
assign (resid 20 and name c) (resid 21 and name n)
(resid 21 and name ca) (resid 21 and name c) 1.0 -117.6 30 2 ! E21 Talos Phi
assign (resid 21 and name n) (resid 21 and name ca)
(resid 21 and name c) (resid 22 and name n) 1.0 127.7 30 2 ! E21 Talos Psi
! V22 Dihedrals
assign (resid 21 and name c) (resid 22 and name n)
(resid 22 and name ca) (resid 22 and name c) 1.0 -124.3 40 2 ! V22 Talos Phi
assign (resid 22 and name n) (resid 22 and name ca)
(resid 22 and name c) (resid 23 and name n) 1.0 122.0 30 2 ! V22 Talos Psi
! I23 Dihedrals
assign (resid 22 and name c) (resid 23 and name n)
(resid 23 and name ca) (resid 23 and name c) 1.0 -101.5 30 2 ! I23 Talos Phi
assign (resid 23 and name n) (resid 23 and name ca)
(resid 23 and name c) (resid 24 and name n) 1.0 125.6 30 2 ! I23 Talos Psi
! R24 Dihedrals
assign (resid 23 and name c) (resid 24 and name n)
(resid 24 and name ca) (resid 24 and name c) 1.0 -73.1 30.0 2 ! R24 Talos Phi
assign (resid 24 and name n) (resid 24 and name ca)
(resid 24 and name c) (resid 25 and name n) 1.0 120.7 30.0 2 ! R24 Talos Psi
! K25 Dihedrals
assign (resid 24 and name c) (resid 25 and name n)
(resid 25 and name ca) (resid 25 and name c) 1.0 -106.6 40.0 2 ! K25 Talos Phi
assign (resid 25 and name n) (resid 25 and name ca)
(resid 25 and name c) (resid 26 and name n) 1.0 -28.0 30 2 ! K25 Talos Psi
! S26 Dihedrals
assign (resid 25 and name c) (resid 26 and name n)
(resid 26 and name ca) (resid 26 and name c) 1.0 -125.0 35 2 ! S26 Talos Phi
assign (resid 26 and name n) (resid 26 and name ca)
(resid 26 and name c) (resid 27 and name n) 1.0 163.1 30 2 ! S26 Talos Psi
! G27 Dihedrals
!assign (resid 26 and name c) (resid 27 and name n)
! (resid 27 and name ca) (resid 27 and name c) 1.0 -124.7 45.3 2 ! G27 Talos Phi
assign (resid 27 and name n) (resid 27 and name ca)
(resid 27 and name c) (resid 28 and name n) 1.0 164.4 30 2 ! G27 Talos Psi
! L28 Dihedrals
assign (resid 27 and name c) (resid 28 and name n)
(resid 28 and name ca) (resid 28 and name c) 1.0 -60.2 30.0 2 ! L28 Talos Phi
assign (resid 28 and name n) (resid 28 and name ca)
(resid 28 and name c) (resid 29 and name n) 1.0 -35.1 20 2 ! L28 Talos Psi
! S29 Dihedrals
assign (resid 28 and name c) (resid 29 and name n)
(resid 29 and name ca) (resid 29 and name c) 1.0 -90.5 40 2 ! S29 Talos Phi
assign (resid 29 and name n) (resid 29 and name ca)
(resid 29 and name c) (resid 30 and name n) 1.0 -7.2 30 2 ! S29 Talos Psi
! A30 Dihedrals
assign (resid 29 and name c) (resid 30 and name n)
(resid 30 and name ca) (resid 30 and name c) 1.0 -60.0 30 2 ! A30 Talos Phi
!assign (resid 30 and name n) (resid 30 and name ca)
! (resid 30 and name c) (resid 31 and name n) 1.0 136.8 20 2 ! A30 Talos Psi
! G31 Dihedrals
assign (resid 30 and name c) (resid 31 and name n)
(resid 31 and name ca) (resid 31 and name c) 1.0 96.4 30.0 2 ! G31 Talos Phi
assign (resid 31 and name n) (resid 31 and name ca)
(resid 31 and name c) (resid 32 and name n) 1.0 -16.3 20 2 ! G31 Talos Psi
! K32 Dihedrals
assign (resid 31 and name c) (resid 32 and name n)
(resid 32 and name ca) (resid 32 and name c) 1.0 -77.9 40 2 ! K32 Talos Phi
assign (resid 32 and name n) (resid 32 and name ca)
(resid 32 and name c) (resid 33 and name n) 1.0 144.8 20 2 ! K32 Talos Psi
! S33 Dihedrals
assign (resid 32 and name c) (resid 33 and name n)
(resid 33 and name ca) (resid 33 and name c) 1.0 -124.2 30 2 ! S33 Talos Phi
assign (resid 33 and name n) (resid 33 and name ca)
(resid 33 and name c) (resid 34 and name n) 1.0 143.8 30 2 ! S33 Talos Psi
! D34 Dihedrals
assign (resid 33 and name c) (resid 34 and name n)
(resid 34 and name ca) (resid 34 and name c) 1.0 -131.0 40 2 ! D34 Talos Phi
assign (resid 34 and name n) (resid 34 and name ca)
(resid 34 and name c) (resid 35 and name n) 1.0 147.4 20 2 ! D34 Talos Psi
! V35 Dihedrals
assign (resid 34 and name c) (resid 35 and name n)
(resid 35 and name ca) (resid 35 and name c) 1.0 -116.6 40 2 ! V35 Talos Phi
assign (resid 35 and name n) (resid 35 and name ca)
(resid 35 and name c) (resid 36 and name n) 1.0 130.7 20 2 ! V35 Talos Psi
! Y36 Dihedrals
assign (resid 35 and name c) (resid 36 and name n)
(resid 36 and name ca) (resid 36 and name c) 1.0 -126.8 30 2 ! Y36 Talos Phi
assign (resid 36 and name n) (resid 36 and name ca)
(resid 36 and name c) (resid 37 and name n) 1.0 160.2 20 2 ! Y36 Talos Psi
! Y37 Dihedrals
assign (resid 36 and name c) (resid 37 and name n)
(resid 37 and name ca) (resid 37 and name c) 1.0 -129.8 40 2 ! Y37 Talos Phi
assign (resid 37 and name n) (resid 37 and name ca)
(resid 37 and name c) (resid 38 and name n) 1.0 150.1 20 2 ! Y37 Talos Psi
! F38 Dihedrals
assign (resid 37 and name c) (resid 38 and name n)
(resid 38 and name ca) (resid 38 and name c) 1.0 -136.0 30 2 ! F38 Talos Phi
assign (resid 38 and name n) (resid 38 and name ca)
(resid 38 and name c) (resid 39 and name n) 1.0 142.8 20 2 ! F38 Talos Psi
! S39 Dihedrals
assign (resid 38 and name c) (resid 39 and name n)
(resid 39 and name ca) (resid 39 and name c) 1.0 -80.9 40 2 ! S39 Talos Phi
assign (resid 39 and name n) (resid 39 and name ca)
(resid 39 and name c) (resid 40 and name n) 1.0 130.7 40 2 ! S39 Talos Psi
! P40 Dihedrals
assign (resid 39 and name c) (resid 40 and name n)
(resid 40 and name ca) (resid 40 and name c) 1.0 -57.6 30 2 ! P40 Talos Phi
!assign (resid 40 and name n) (resid 40 and name ca)
! (resid 40 and name c) (resid 41 and name n) 1.0 -15.4 17.6 2 ! P40 Talos Psi
! S41 Dihedrals
assign (resid 40 and name c) (resid 41 and name n)
(resid 41 and name ca) (resid 41 and name c) 1.0 -86.7 50 2 ! S41 Talos Phi
assign (resid 41 and name n) (resid 41 and name ca)
(resid 41 and name c) (resid 42 and name n) 1.0 -8 20 2 ! S41 Talos Psi
! G42 Dihedrals
!assign (resid 41 and name c) (resid 42 and name n)
! (resid 42 and name ca) (resid 42 and name c) 1.0 85.9 21.5 2 ! G42 Talos Phi
!assign (resid 42 and name n) (resid 42 and name ca)
! (resid 42 and name c) (resid 43 and name n) 1.0 9.2 23.8 2 ! G42 Talos Psi
! K43 Dihedrals
assign (resid 42 and name c) (resid 43 and name n)
(resid 43 and name ca) (resid 43 and name c) 1.0 -81.9 30 2 ! K43 Talos Phi
assign (resid 43 and name n) (resid 43 and name ca)
(resid 43 and name c) (resid 44 and name n) 1.0 135.2 30 2 ! K43 Talos Psi
! K44 Dihedrals
assign (resid 43 and name c) (resid 44 and name n)
(resid 44 and name ca) (resid 44 and name c) 1.0 -111.7 30 2 ! K44 Talos Phi
assign (resid 44 and name n) (resid 44 and name ca)
(resid 44 and name c) (resid 45 and name n) 1.0 128.3 20 2 ! K44 Talos Psi
! F45 Dihedrals
assign (resid 44 and name c) (resid 45 and name n)
(resid 45 and name ca) (resid 45 and name c) 1.0 -124.6 50 2 ! F45 Talos Phi
assign (resid 45 and name n) (resid 45 and name ca)
(resid 45 and name c) (resid 46 and name n) 1.0 151.0 30 2 ! F45 Talos Psi
! R46 Dihedrals
!assign (resid 45 and name c) (resid 46 and name n)
! (resid 46 and name ca) (resid 46 and name c) 1.0 -120 40 2 ! R46 Talos Phi
!assign (resid 46 and name n) (resid 46 and name ca)
! (resid 46 and name c) (resid 47 and name n) 1.0 140 60 2 ! R46 Talos Psi
! S47 Dihedrals
!assign (resid 46 and name c) (resid 47 and name n)
! (resid 47 and name ca) (resid 47 and name c) 1.0 -110 60 2 ! S47 Talos Phi
!assign (resid 47 and name n) (resid 47 and name ca)
! (resid 47 and name c) (resid 48 and name n) 1.0 160 30 2 ! S47 Talos Psi
! K48 Dihedrals
assign (resid 47 and name c) (resid 48 and name n)
(resid 48 and name ca) (resid 48 and name c) 1.0 -59.1 30 2 ! K48 Talos Phi
assign (resid 48 and name n) (resid 48 and name ca)
(resid 48 and name c) (resid 49 and name n) 1.0 -42.7 20 2 ! K48 Talos Psi
! P49 Dihedrals
assign (resid 48 and name c) (resid 49 and name n)
(resid 49 and name ca) (resid 49 and name c) 1.0 -57.1 30.0 2 ! P49 Talos Phi
assign (resid 49 and name n) (resid 49 and name ca)
(resid 49 and name c) (resid 50 and name n) 1.0 -31.8 20 2 ! P49 Talos Psi
! Q50 Dihedrals
assign (resid 49 and name c) (resid 50 and name n)
(resid 50 and name ca) (resid 50 and name c) 1.0 -69.5 35 2 ! Q50 Talos Phi
assign (resid 50 and name n) (resid 50 and name ca)
(resid 50 and name c) (resid 51 and name n) 1.0 -35.4 20 2 ! Q50 Talos Psi
! L51 Dihedrals
assign (resid 50 and name c) (resid 51 and name n)
(resid 51 and name ca) (resid 51 and name c) 1.0 -64.4 30.0 2 ! L51 Talos Phi
assign (resid 51 and name n) (resid 51 and name ca)
(resid 51 and name c) (resid 52 and name n) 1.0 -40.2 20 2 ! L51 Talos Psi
! A52 Dihedrals
assign (resid 51 and name c) (resid 52 and name n)
(resid 52 and name ca) (resid 52 and name c) 1.0 -64.1 30.0 2 ! A52 Talos Phi
assign (resid 52 and name n) (resid 52 and name ca)
(resid 52 and name c) (resid 53 and name n) 1.0 -40.8 20 2 ! A52 Talos Psi
! R53 Dihedrals
assign (resid 52 and name c) (resid 53 and name n)
(resid 53 and name ca) (resid 53 and name c) 1.0 -63.6 30.0 2 ! R53 Talos Phi
assign (resid 53 and name n) (resid 53 and name ca)
(resid 53 and name c) (resid 54 and name n) 1.0 -40.3 20 2 ! R53 Talos Psi
! Y54 Dihedrals
assign (resid 53 and name c) (resid 54 and name n)
(resid 54 and name ca) (resid 54 and name c) 1.0 -68.7 30.0 2 ! Y54 Talos Phi
assign (resid 54 and name n) (resid 54 and name ca)
(resid 54 and name c) (resid 55 and name n) 1.0 -39.9 20.0 2 ! Y54 Talos Psi
! L55 Dihedrals
assign (resid 54 and name c) (resid 55 and name n)
(resid 55 and name ca) (resid 55 and name c) 1.0 -85.0 40 2 ! L55 Talos Phi
assign (resid 55 and name n) (resid 55 and name ca)
(resid 55 and name c) (resid 56 and name n) 1.0 -20 40 2 ! L55 Talos Psi
! G56 Dihedrals
!assign (resid 55 and name c) (resid 56 and name n)
! (resid 56 and name ca) (resid 56 and name c) 1.0 92.2 20.0 2 ! G56 Talos Phi
!assign (resid 56 and name n) (resid 56 and name ca)
! (resid 56 and name c) (resid 57 and name n) 1.0 0 60 2 ! G56 Talos Psi
! N57 Dihedrals
assign (resid 56 and name c) (resid 57 and name n)
(resid 57 and name ca) (resid 57 and name c) 1.0 -67.5 40 2 ! N57 Talos Phi
!assign (resid 57 and name n) (resid 57 and name ca)
! (resid 57 and name c) (resid 58 and name n) 1.0 -33.5 30 2 ! N57 Talos Psi
! A58 Dihedrals
assign (resid 57 and name c) (resid 58 and name n)
(resid 58 and name ca) (resid 58 and name c) 1.0 -77.2 40 2 ! A58 Talos Phi
assign (resid 58 and name n) (resid 58 and name ca)
(resid 58 and name c) (resid 59 and name n) 1.0 -33.0 30 2 ! A58 Talos Psi
! V59 Dihedrals
assign (resid 58 and name c) (resid 59 and name n)
(resid 59 and name ca) (resid 59 and name c) 1.0 -132.9 40 2 ! V59 Talos Phi
!assign (resid 59 and name n) (resid 59 and name ca)
! (resid 59 and name c) (resid 60 and name n) 1.0 153.3 24.1 2 ! V59 Talos Psi
! D60 Dihedrals
assign (resid 59 and name c) (resid 60 and name n)
(resid 60 and name ca) (resid 60 and name c) 1.0 -88.2 40 2 ! D60 Talos Phi
assign (resid 60 and name n) (resid 60 and name ca)
(resid 60 and name c) (resid 61 and name n) 1.0 119.4 30 2 ! D60 Talos Psi
! L61 Dihedrals
assign (resid 60 and name c) (resid 61 and name n)
(resid 61 and name ca) (resid 61 and name c) 1.0 -90 30 2 ! L61 Talos Phi
!assign (resid 61 and name n) (resid 61 and name ca)
! (resid 61 and name c) (resid 62 and name n) 1.0 136.8 37.0 2 ! L61 Talos Psi
! S62 Dihedrals
assign (resid 61 and name c) (resid 62 and name n)
(resid 62 and name ca) (resid 62 and name c) 1.0 -65.8 30 2 ! S62 Talos Phi
assign (resid 62 and name n) (resid 62 and name ca)
(resid 62 and name c) (resid 63 and name n) 1.0 -23.4 20 2 ! S62 Talos Psi
! C63 Dihedrals
assign (resid 62 and name c) (resid 63 and name n)
(resid 63 and name ca) (resid 63 and name c) 1.0 -95.7 40 2 ! C63 Talos Phi
!assign (resid 63 and name n) (resid 63 and name ca)
! (resid 63 and name c) (resid 64 and name n) 1.0 4.6 30 2 ! C63 Talos Psi
! F64 Dihedrals
assign (resid 63 and name c) (resid 64 and name n)
(resid 64 and name ca) (resid 64 and name c) 1.0 -97.6 40 2 ! F64 Talos Phi
!assign (resid 64 and name n) (resid 64 and name ca)
! (resid 64 and name c) (resid 65 and name n) 1.0 147.1 24.3 2 ! F64 Talos Psi
! D65 Dihedrals
! F66 Dihedrals
! R67 Dihedrals
assign (resid 66 and name c) (resid 67 and name n)
(resid 67 and name ca) (resid 67 and name c) 1.0 -66.0 30 2 ! R67 Talos Phi
assign (resid 67 and name n) (resid 67 and name ca)
(resid 67 and name c) (resid 68 and name n) 1.0 -30.7 40 2 ! R67 Talos Psi
! T68 Dihedrals
assign (resid 67 and name c) (resid 68 and name n)
(resid 68 and name ca) (resid 68 and name c) 1.0 -101.3 40 2 ! T68 Talos Phi
assign (resid 68 and name n) (resid 68 and name ca)
(resid 68 and name c) (resid 69 and name n) 1.0 -7.9 30 2 ! T68 Talos Psi
! G69 Dihedrals
!assign (resid 68 and name c) (resid 69 and name n)
! (resid 69 and name ca) (resid 69 and name c) 1.0 70.1 30.0 2 ! G69 Talos Phi
!assign (resid 69 and name n) (resid 69 and name ca)
! (resid 69 and name c) (resid 70 and name n) 1.0 15.0 29.5 2 ! G69 Talos Psi
! K70 Dihedrals
assign (resid 69 and name c) (resid 70 and name n)
(resid 70 and name ca) (resid 70 and name c) 1.0 -115.4 50 2 ! K70 Talos Phi
assign (resid 70 and name n) (resid 70 and name ca)
(resid 70 and name c) (resid 71 and name n) 1.0 158.8 20 2 ! K70 Talos Psi
! M71 Dihedrals
assign (resid 70 and name c) (resid 71 and name n)
(resid 71 and name ca) (resid 71 and name c) 1.0 -92.4 40 2 ! M71 Talos Phi
assign (resid 71 and name n) (resid 71 and name ca)
(resid 71 and name c) (resid 72 and name n) 1.0 118.0 30 2 ! M71 Talos Psi
! M72 Dihedrals
!DNA
!dihedral restraints on epsilon, zeta, alpha
!STRAND 1
assign (resid 101 and name c4') (resid 101 and name c3')
(resid 101 and name o3') (resid 102 and name p ) 1.0 180.0 30.0 2
assign (resid 101 and name c3') (resid 101 and name o3')
(resid 102 and name p ) (resid 102 and name o5') 1.0 -85.0 50.0 2
assign (resid 101 and name o3') (resid 102 and name p )
(resid 102 and name o5') (resid 102 and name c5') 1.0 -70.0 50.0 2
assign (resid 102 and name c4') (resid 102 and name c3')
(resid 102 and name o3') (resid 103 and name p ) 1.0 180.0 30.0 2
assign (resid 102 and name c3') (resid 102 and name o3')
(resid 103 and name p ) (resid 103 and name o5') 1.0 -85.0 50.0 2
assign (resid 102 and name o3') (resid 103 and name p )
(resid 103 and name o5') (resid 103 and name c5') 1.0 -70.0 50.0 2
assign (resid 103 and name c4') (resid 103 and name c3')
(resid 103 and name o3') (resid 104 and name p ) 1.0 180.0 30.0 2
assign (resid 103 and name c3') (resid 103 and name o3')
(resid 104 and name p ) (resid 104 and name o5') 1.0 -85.0 50.0 2
assign (resid 103 and name o3') (resid 104 and name p )
(resid 104 and name o5') (resid 104 and name c5') 1.0 -70.0 50.0 2
assign (resid 104 and name c4') (resid 104 and name c3')
(resid 104 and name o3') (resid 105 and name p ) 1.0 180.0 30.0 2
assign (resid 104 and name c3') (resid 104 and name o3')
(resid 105 and name p ) (resid 105 and name o5') 1.0 -85.0 50.0 2
assign (resid 104 and name o3') (resid 105 and name p )
(resid 105 and name o5') (resid 105 and name c5') 1.0 -70.0 50.0 2
assign (resid 105 and name c4') (resid 105 and name c3')
(resid 105 and name o3') (resid 106 and name p ) 1.0 180.0 30.0 2
assign (resid 105 and name c3') (resid 105 and name o3')
(resid 106 and name p ) (resid 106 and name o5') 1.0 -85.0 50.0 2
assign (resid 105 and name o3') (resid 106 and name p )
(resid 106 and name o5') (resid 106 and name c5') 1.0 -70.0 50.0 2
assign (resid 106 and name c4') (resid 106 and name c3')
(resid 106 and name o3') (resid 107 and name p ) 1.0 180.0 50.0 2
assign (resid 106 and name c3') (resid 106 and name o3')
(resid 107 and name p ) (resid 107 and name o5') 1.0 -85.0 50.0 2
assign (resid 106 and name o3') (resid 107 and name p )
(resid 107 and name o5') (resid 107 and name c5') 1.0 -70.0 50.0 2
assign (resid 107 and name c4') (resid 107 and name c3')
(resid 107 and name o3') (resid 108 and name p ) 1.0 180.0 50.0 2
assign (resid 107 and name c3') (resid 107 and name o3')
(resid 108 and name p ) (resid 108 and name o5') 1.0 -85.0 50.0 2
assign (resid 107 and name o3') (resid 108 and name p )
(resid 108 and name o5') (resid 108 and name c5') 1.0 -70.0 50.0 2
assign (resid 108 and name c4') (resid 108 and name c3')
(resid 108 and name o3') (resid 109 and name p ) 1.0 180.0 50.0 2
assign (resid 108 and name c3') (resid 108 and name o3')
(resid 109 and name p ) (resid 109 and name o5') 1.0 -85.0 50.0 2
assign (resid 108 and name o3') (resid 109 and name p )
(resid 109 and name o5') (resid 109 and name c5') 1.0 -70.0 50.0 2
assign (resid 109 and name c4') (resid 109 and name c3')
(resid 109 and name o3') (resid 110 and name p ) 1.0 180.0 50.0 2
assign (resid 109 and name c3') (resid 109 and name o3')
(resid 110 and name p ) (resid 110 and name o5') 1.0 -85.0 50.0 2
assign (resid 109 and name o3') (resid 110 and name p )
(resid 110 and name o5') (resid 110 and name c5') 1.0 -70.0 50.0 2
!Strand 2
!assign (resid 110 and name c4') (resid 110 and name c3')
! (resid 110 and name o3') (resid 111 and name p ) 1.0 180.0 50.0 2
!assign (resid 110 and name c3') (resid 110 and name o3')
! (resid 111 and name p ) (resid 111 and name o5') 1.0 -85.0 50.0 2
!assign (resid 110 and name o3') (resid 111 and name p )
! (resid 111 and name o5') (resid 111 and name c5') 1.0 -70.0 50.0 2
assign (resid 111 and name c4') (resid 111 and name c3')
(resid 111 and name o3') (resid 112 and name p ) 1.0 180.0 50.0 2
assign (resid 111 and name c3') (resid 111 and name o3')
(resid 112 and name p ) (resid 112 and name o5') 1.0 -85.0 50.0 2
assign (resid 111 and name o3') (resid 112 and name p )
(resid 112 and name o5') (resid 112 and name c5') 1.0 -70.0 50.0 2
assign (resid 112 and name c4') (resid 112 and name c3')
(resid 112 and name o3') (resid 113 and name p ) 1.0 180.0 30.0 2
assign (resid 112 and name c3') (resid 112 and name o3')
(resid 113 and name p ) (resid 113 and name o5') 1.0 -85.0 50.0 2
assign (resid 112 and name o3') (resid 113 and name p )
(resid 113 and name o5') (resid 113 and name c5') 1.0 -70.0 50.0 2
assign (resid 113 and name c4') (resid 113 and name c3')
(resid 113 and name o3') (resid 114 and name p ) 1.0 180.0 30.0 2
assign (resid 113 and name c3') (resid 113 and name o3')
(resid 114 and name p ) (resid 114 and name o5') 1.0 -85.0 50.0 2
assign (resid 113 and name o3') (resid 114 and name p )
(resid 114 and name o5') (resid 114 and name c5') 1.0 -70.0 50.0 2
assign (resid 115 and name c4') (resid 115 and name c3')
(resid 115 and name o3') (resid 116 and name p ) 1.0 180.0 30.0 2
assign (resid 115 and name c3') (resid 115 and name o3')
(resid 116 and name p ) (resid 116 and name o5') 1.0 -85.0 50.0 2
assign (resid 115 and name o3') (resid 116 and name p )
(resid 116 and name o5') (resid 116 and name c5') 1.0 -70.0 50.0 2
assign (resid 116 and name c4') (resid 116 and name c3')
(resid 116 and name o3') (resid 117 and name p ) 1.0 180.0 30.0 2
assign (resid 116 and name c3') (resid 116 and name o3')
(resid 117 and name p ) (resid 117 and name o5') 1.0 -85.0 50.0 2
assign (resid 116 and name o3') (resid 117 and name p )
(resid 117 and name o5') (resid 117 and name c5') 1.0 -70.0 50.0 2
assign (resid 117 and name c4') (resid 117 and name c3')
(resid 117 and name o3') (resid 118 and name p ) 1.0 180.0 50.0 2
assign (resid 117 and name c3') (resid 117 and name o3')
(resid 118 and name p ) (resid 118 and name o5') 1.0 -85.0 50.0 2
assign (resid 117 and name o3') (resid 118 and name p )
(resid 118 and name o5') (resid 118 and name c5') 1.0 -70.0 50.0 2
assign (resid 118 and name c4') (resid 118 and name c3')
(resid 118 and name o3') (resid 119 and name p ) 1.0 180.0 50.0 2
assign (resid 118 and name c3') (resid 118 and name o3')
(resid 119 and name p ) (resid 119 and name o5') 1.0 -85.0 50.0 2
assign (resid 118 and name o3') (resid 119 and name p )
(resid 119 and name o5') (resid 119 and name c5') 1.0 -70.0 50.0 2
assign (resid 119 and name c4') (resid 119 and name c3')
(resid 119 and name o3') (resid 120 and name p ) 1.0 180.0 50.0 2
assign (resid 119 and name c3') (resid 119 and name o3')
(resid 120 and name p ) (resid 120 and name o5') 1.0 -85.0 50.0 2
assign (resid 119 and name o3') (resid 120 and name p )
(resid 120 and name o5') (resid 120 and name c5') 1.0 -70.0 50.0 2
!constraints on gamma: 60 +/-30
assign (resid 101 and name o5') (resid 101 and name c5')
(resid 101 and name c4') (resid 101 and name c3') 1.0 60.0 35.0 2
assign (resid 102 and name o5') (resid 102 and name c5')
(resid 102 and name c4') (resid 102 and name c3') 1.0 60.0 35.0 2
assign (resid 103 and name o5') (resid 103 and name c5')
(resid 103 and name c4') (resid 103 and name c3') 1.0 60.0 35.0 2
assign (resid 104 and name o5') (resid 104 and name c5')
(resid 104 and name c4') (resid 104 and name c3') 1.0 60.0 35.0 2
assign (resid 105 and name o5') (resid 105 and name c5')
(resid 105 and name c4') (resid 105 and name c3') 1.0 60.0 35.0 2
assign (resid 106 and name o5') (resid 106 and name c5')
(resid 106 and name c4') (resid 106 and name c3') 1.0 60.0 35.0 2
assign (resid 107 and name o5') (resid 107 and name c5')
(resid 107 and name c4') (resid 107 and name c3') 1.0 60.0 35.0 2
assign (resid 108 and name o5') (resid 108 and name c5')
(resid 108 and name c4') (resid 108 and name c3') 1.0 60.0 35.0 2
assign (resid 109 and name o5') (resid 109 and name c5')
(resid 109 and name c4') (resid 109 and name c3') 1.0 60.0 35.0 2
assign (resid 110 and name o5') (resid 110 and name c5')
(resid 110 and name c4') (resid 110 and name c3') 1.0 60.0 35.0 2
assign (resid 111 and name o5') (resid 111 and name c5')
(resid 111 and name c4') (resid 111 and name c3') 1.0 60.0 35.0 2
assign (resid 112 and name o5') (resid 112 and name c5')
(resid 112 and name c4') (resid 112 and name c3') 1.0 60.0 35.0 2
assign (resid 113 and name o5') (resid 113 and name c5')
(resid 113 and name c4') (resid 113 and name c3') 1.0 60.0 35.0 2
assign (resid 114 and name o5') (resid 114 and name c5')
(resid 114 and name c4') (resid 114 and name c3') 1.0 60.0 35.0 2
assign (resid 115 and name o5') (resid 115 and name c5')
(resid 115 and name c4') (resid 115 and name c3') 1.0 60.0 35.0 2
assign (resid 116 and name o5') (resid 116 and name c5')
(resid 116 and name c4') (resid 116 and name c3') 1.0 60.0 35.0 2
assign (resid 117 and name o5') (resid 117 and name c5')
(resid 117 and name c4') (resid 117 and name c3') 1.0 60.0 35.0 2
assign (resid 118 and name o5') (resid 118 and name c5')
(resid 118 and name c4') (resid 118 and name c3') 1.0 60.0 35.0 2
assign (resid 119 and name o5') (resid 119 and name c5')
(resid 119 and name c4') (resid 119 and name c3') 1.0 60.0 35.0 2
assign (resid 120 and name o5') (resid 120 and name c5')
(resid 120 and name c4') (resid 120 and name c3') 1.0 60.0 35.0 2
!restraints on beta
assign (resid 102 and name p ) (resid 102 and name o5')
(resid 102 and name c5') (resid 102 and name c4') 1.0 180.0 50.0 2
assign (resid 103 and name p ) (resid 103 and name o5')
(resid 103 and name c5') (resid 103 and name c4') 1.0 180.0 50.0 2
assign (resid 104 and name p ) (resid 104 and name o5')
(resid 104 and name c5') (resid 104 and name c4') 1.0 180.0 50.0 2
assign (resid 105 and name p ) (resid 105 and name o5')
(resid 105 and name c5') (resid 105 and name c4') 1.0 180.0 50.0 2
assign (resid 106 and name p ) (resid 106 and name o5')
(resid 106 and name c5') (resid 106 and name c4') 1.0 180.0 50.0 2
assign (resid 107 and name p ) (resid 107 and name o5')
(resid 107 and name c5') (resid 107 and name c4') 1.0 180.0 50.0 2
assign (resid 108 and name p ) (resid 108 and name o5')
(resid 108 and name c5') (resid 108 and name c4') 1.0 180.0 50.0 2
assign (resid 109 and name p ) (resid 109 and name o5')
(resid 109 and name c5') (resid 109 and name c4') 1.0 180.0 50.0 2
assign (resid 110 and name p ) (resid 110 and name o5')
(resid 110 and name c5') (resid 110 and name c4') 1.0 180.0 50.0 2
!assign (resid 111 and name p ) (resid 111 and name o5')
! (resid 111 and name c5') (resid 111 and name c4') 1.0 180.0 50.0 2
assign (resid 112 and name p ) (resid 112 and name o5')
(resid 112 and name c5') (resid 112 and name c4') 1.0 180.0 50.0 2
assign (resid 113 and name p ) (resid 113 and name o5')
(resid 113 and name c5') (resid 113 and name c4') 1.0 180.0 50.0 2
assign (resid 114 and name p ) (resid 114 and name o5')
(resid 114 and name c5') (resid 114 and name c4') 1.0 180.0 50.0 2
assign (resid 116 and name p ) (resid 116 and name o5')
(resid 116 and name c5') (resid 116 and name c4') 1.0 180.0 50.0 2
assign (resid 117 and name p ) (resid 117 and name o5')
(resid 117 and name c5') (resid 117 and name c4') 1.0 180.0 50.0 2
assign (resid 118 and name p ) (resid 118 and name o5')
(resid 118 and name c5') (resid 118 and name c4') 1.0 180.0 50.0 2
assign (resid 119 and name p ) (resid 119 and name o5')
(resid 119 and name c5') (resid 119 and name c4') 1.0 180.0 50.0 2
assign (resid 120 and name p ) (resid 120 and name o5')
(resid 120 and name c5') (resid 120 and name c4') 1.0 180.0 50.0 2
!delta
!dihedral restraints on delta 145 +/- 15
assign (resid 101 and name c5') (resid 101 and name c4')
(resid 101 and name c3') (resid 101 and name o3') 1.0 145.0 15.0 2
assign (resid 102 and name c5') (resid 102 and name c4')
(resid 102 and name c3') (resid 102 and name o3') 1.0 145.0 15.0 2
assign (resid 103 and name c5') (resid 103 and name c4')
(resid 103 and name c3') (resid 103 and name o3') 1.0 145.0 15.0 2
assign (resid 104 and name c5') (resid 104 and name c4')
(resid 104 and name c3') (resid 104 and name o3') 1.0 145.0 15.0 2
assign (resid 105 and name c5') (resid 105 and name c4')
(resid 105 and name c3') (resid 105 and name o3') 1.0 145.0 15.0 2
assign (resid 106 and name c5') (resid 106 and name c4')
(resid 106 and name c3') (resid 106 and name o3') 1.0 145.0 15.0 2
assign (resid 107 and name c5') (resid 107 and name c4')
(resid 107 and name c3') (resid 107 and name o3') 1.0 145.0 15.0 2
assign (resid 108 and name c5') (resid 108 and name c4')
(resid 108 and name c3') (resid 108 and name o3') 1.0 145.0 15.0 2
assign (resid 109 and name c5') (resid 109 and name c4')
(resid 109 and name c3') (resid 109 and name o3') 1.0 145.0 15.0 2
assign (resid 110 and name c5') (resid 110 and name c4')
(resid 110 and name c3') (resid 110 and name o3') 1.0 145.0 15.0 2
assign (resid 111 and name c5') (resid 111 and name c4')
(resid 111 and name c3') (resid 111 and name o3') 1.0 145.0 15.0 2
assign (resid 112 and name c5') (resid 112 and name c4')
(resid 112 and name c3') (resid 112 and name o3') 1.0 145.0 15.0 2
assign (resid 113 and name c5') (resid 113 and name c4')
(resid 113 and name c3') (resid 113 and name o3') 1.0 145.0 15.0 2
assign (resid 114 and name c5') (resid 114 and name c4')
(resid 114 and name c3') (resid 114 and name o3') 1.0 145.0 15.0 2
assign (resid 115 and name c5') (resid 115 and name c4')
(resid 115 and name c3') (resid 115 and name o3') 1.0 145.0 15.0 2
assign (resid 116 and name c5') (resid 116 and name c4')
(resid 116 and name c3') (resid 116 and name o3') 1.0 145.0 15.0 2
assign (resid 117 and name c5') (resid 117 and name c4')
(resid 117 and name c3') (resid 117 and name o3') 1.0 145.0 15.0 2
assign (resid 118 and name c5') (resid 118 and name c4')
(resid 118 and name c3') (resid 118 and name o3') 1.0 145.0 15.0 2
assign (resid 119 and name c5') (resid 119 and name c4')
(resid 119 and name c3') (resid 119 and name o3') 1.0 145.0 15.0 2
assign (resid 120 and name c5') (resid 120 and name c4')
(resid 120 and name c3') (resid 120 and name o3') 1.0 145.0 15.0 2
!chi restraints for those things 2'endo
!purine A+G 100-103,106-107,111-113,116-117
assign (resid 101 and name o4') (resid 101 and name c1')
(resid 101 and name n9 ) (resid 101 and name c4 ) 1.0 -105.0 20.0 2
assign (resid 102 and name o4') (resid 102 and name c1')
(resid 102 and name n9 ) (resid 102 and name c4 ) 1.0 -105.0 20.0 2
assign (resid 103 and name o4') (resid 103 and name c1')
(resid 103 and name n9 ) (resid 103 and name c4 ) 1.0 -105.0 20.0 2
assign (resid 106 and name o4') (resid 106 and name c1')
(resid 106 and name n9 ) (resid 106 and name c4 ) 1.0 -105.0 20.0 2
assign (resid 107 and name o4') (resid 107 and name c1')
(resid 107 and name n9 ) (resid 107 and name c4 ) 1.0 -105.0 20.0 2
assign (resid 111 and name o4') (resid 111 and name c1')
(resid 111 and name n9 ) (resid 111 and name c4 ) 1.0 -105.0 20.0 2
assign (resid 112 and name o4') (resid 112 and name c1')
(resid 112 and name n9 ) (resid 112 and name c4 ) 1.0 -105.0 20.0 2
assign (resid 113 and name o4') (resid 113 and name c1')
(resid 113 and name n9 ) (resid 113 and name c4 ) 1.0 -105.0 20.0 2
assign (resid 116 and name o4') (resid 116 and name c1')
(resid 116 and name n9 ) (resid 116 and name c4 ) 1.0 -105.0 20.0 2
assign (resid 117 and name o4') (resid 117 and name c1')
(resid 117 and name n9 ) (resid 117 and name c4 ) 1.0 -105.0 20.0 2
!pyrimidine C+T 104-105,108-110,114-115,118-121
assign (resid 104 and name o4') (resid 104 and name c1')
(resid 104 and name n1 ) (resid 104 and name c2 ) 1.0 -105.0 20.0 2
assign (resid 105 and name o4') (resid 105 and name c1')
(resid 105 and name n1 ) (resid 105 and name c2 ) 1.0 -105.0 20.0 2
assign (resid 108 and name o4') (resid 108 and name c1')
(resid 108 and name n1 ) (resid 108 and name c2 ) 1.0 -105.0 20.0 2
assign (resid 109 and name o4') (resid 109 and name c1')
(resid 109 and name n1 ) (resid 109 and name c2 ) 1.0 -105.0 20.0 2
assign (resid 110 and name o4') (resid 110 and name c1')
(resid 110 and name n1 ) (resid 110 and name c2 ) 1.0 -105.0 20.0 2
assign (resid 114 and name o4') (resid 114 and name c1')
(resid 114 and name n1 ) (resid 114 and name c2 ) 1.0 -105.0 20.0 2
assign (resid 115 and name o4') (resid 115 and name c1')
(resid 115 and name n1 ) (resid 115 and name c2 ) 1.0 -105.0 20.0 2
assign (resid 118 and name o4') (resid 118 and name c1')
(resid 118 and name n1 ) (resid 118 and name c2 ) 1.0 -105.0 20.0 2
assign (resid 119 and name o4') (resid 119 and name c1')
(resid 119 and name n1 ) (resid 119 and name c2 ) 1.0 -105.0 20.0 2
assign (resid 120 and name o4') (resid 120 and name c1')
(resid 120 and name n1 ) (resid 120 and name c2 ) 1.0 -105.0 20.0 2