Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
526892 | 2ldl RC | 17671 | cing | 1-original | 4 | XPLOR/CNS | dihedral angle |
! ESS3 sugar Pucker restraints; created by BST 07.26.10
!
! Pucker is defined with ribose torsion angles nu1 and nu2.
! nu1 = O4'-C1'-C2'-C3'
! nu2 = C1'-C2'-C3'-C4'
! "N" C3' endo:
! nu1 = -20 +/- 10
! nu2 = +35 +/- 5
! "S" C2' endo:
! nu1 = +35 +/- 5
! nu2 = -35 +/- 5
! See Saenger page 20.
!
! C2' endo nucleotides:
!
! Gua 11
!{
!assign (resid 11 and name O4')
! (resid 11 and name C1')
! (resid 11 and name C2')
! (resid 11 and name C3') 1.0 35.0 5.0 2
!assign (resid 11 and name C1')
! (resid 11 and name C2')
! (resid 11 and name C3')
! (resid 11 and name C4') 1.0 -35.0 5.0 2
!}
!assign (resid 11 and name c5') (resid 11 and name c4')
! (resid 11 and name c3') (resid 11 and name o3') 1.0 145.0 20.0 2
! Ade 12
!{
!assign (resid 12 and name O4')
! (resid 12 and name C1')
! (resid 12 and name C2')
! (resid 12 and name C3') 1.0 35.0 5.0 2
!assign (resid 12 and name C1')
! (resid 12 and name C2')
! (resid 12 and name C3')
! (resid 12 and name C4') 1.0 -35.0 5.0 2
!}
!assign (resid 12 and name c5') (resid 12 and name c4')
! (resid 12 and name c3') (resid 12 and name o3') 1.0 145.0 20.0 2
! Ura 13
{
assign (resid 13 and name O4')
(resid 13 and name C1')
(resid 13 and name C2')
(resid 13 and name C3') 1.0 35.0 5.0 2
assign (resid 13 and name C1')
(resid 13 and name C2')
(resid 13 and name C3')
(resid 13 and name C4') 1.0 -35.0 5.0 2
}
assign (resid 13 and name c5') (resid 13 and name c4')
(resid 13 and name c3') (resid 13 and name o3') 1.0 145.0 20.0 2
! Ura 14
{
assign (resid 14 and name O4')
(resid 14 and name C1')
(resid 14 and name C2')
(resid 14 and name C3') 1.0 35.0 5.0 2
assign (resid 14 and name C1')
(resid 14 and name C2')
(resid 14 and name C3')
(resid 14 and name C4') 1.0 -35.0 5.0 2
}
assign (resid 14 and name c5') (resid 14 and name c4')
(resid 14 and name c3') (resid 14 and name o3') 1.0 145.0 20.0 2
!
! Ade 15
{
assign (resid 15 and name O4')
(resid 15 and name C1')
(resid 15 and name C2')
(resid 15 and name C3') 1.0 35.0 5.0 2
assign (resid 15 and name C1')
(resid 15 and name C2')
(resid 15 and name C3')
(resid 15 and name C4') 1.0 -35.0 5.0 2
}
assign (resid 15 and name c5') (resid 15 and name c4')
(resid 15 and name c3') (resid 15 and name o3') 1.0 145.0 20.0 2
! Gua 16
!{
!assign (resid 16 and name O4')
! (resid 16 and name C1')
! (resid 16 and name C2')
! (resid 16 and name C3') 1.0 35.0 5.0 2
!assign (resid 16 and name C1')
! (resid 16 and name C2')
! (resid 16 and name C3')
! (resid 16 and name C4') 1.0 -35.0 5.0 2
!}
!assign (resid 16 and name c5') (resid 16 and name c4')
! (resid 16 and name c3') (resid 16 and name o3') 1.0 145.0 20.0 2
! Ura 17
{
assign (resid 17 and name O4')
(resid 17 and name C1')
(resid 17 and name C2')
(resid 17 and name C3') 1.0 35.0 5.0 2
assign (resid 17 and name C1')
(resid 17 and name C2')
(resid 17 and name C3')
(resid 17 and name C4') 1.0 -35.0 5.0 2
}
assign (resid 17 and name c5') (resid 17 and name c4')
(resid 17 and name c3') (resid 17 and name o3') 1.0 145.0 20.0 2
!
! C3' endo nucleotides: ( everybody else )
!
!
! Gua 1
{
assign (resid 1 and name O4')
(resid 1 and name C1')
(resid 1 and name C2')
(resid 1 and name C3') 1.0 -20.0 10.0 2
assign (resid 1 and name C1')
(resid 1 and name C2')
(resid 1 and name C3')
(resid 1 and name C4') 1.0 35.0 1.0 2
}
assign (resid 1 and name c5') (resid 1 and name c4')
(resid 1 and name c3') (resid 1 and name o3') 1.0 80.0 20.0 2
!
! Gua 2
{
assign (resid 2 and name O4')
(resid 2 and name C1')
(resid 2 and name C2')
(resid 2 and name C3') 1.0 -20.0 10.0 2
assign (resid 2 and name C1')
(resid 2 and name C2')
(resid 2 and name C3')
(resid 2 and name C4') 1.0 35.0 5.0 2
}
assign (resid 2 and name c5') (resid 2 and name c4')
(resid 2 and name c3') (resid 2 and name o3') 1.0 80.0 20.0 2
!
! Ade 3
{
assign (resid 3 and name O4')
(resid 3 and name C1')
(resid 3 and name C2')
(resid 3 and name C3') 1.0 -20.0 10.0 2
assign (resid 3 and name C1')
(resid 3 and name C2')
(resid 3 and name C3')
(resid 3 and name C4') 1.0 35.0 5.0 2
}
assign (resid 3 and name c5') (resid 3 and name c4')
(resid 3 and name c3') (resid 3 and name o3') 1.0 80.0 20.0 2
!
! Ura 4
{
assign (resid 4 and name O4')
(resid 4 and name C1')
(resid 4 and name C2')
(resid 4 and name C3') 1.0 -20.0 10.0 2
assign (resid 4 and name C1')
(resid 4 and name C2')
(resid 4 and name C3')
(resid 4 and name C4') 1.0 35.0 5.0 2
}
assign (resid 4 and name c5') (resid 4 and name c4')
(resid 4 and name c3') (resid 4 and name o3') 1.0 80.0 20.0 2
!
! Cyt 5
{
assign (resid 5 and name O4')
(resid 5 and name C1')
(resid 5 and name C2')
(resid 5 and name C3') 1.0 -20.0 10.0 2
assign (resid 5 and name C1')
(resid 5 and name C2')
(resid 5 and name C3')
(resid 5 and name C4') 1.0 35.0 5.0 2
}
assign (resid 5 and name c5') (resid 5 and name c4')
(resid 5 and name c3') (resid 5 and name o3') 1.0 80.0 20.0 2
! Cyt 6
{
assign (resid 6 and name O4')
(resid 6 and name C1')
(resid 6 and name C2')
(resid 6 and name C3') 1.0 -20.0 10.0 2
assign (resid 6 and name C1')
(resid 6 and name C2')
(resid 6 and name C3')
(resid 6 and name C4') 1.0 35.0 5.0 2
}
assign (resid 6 and name c5') (resid 6 and name c4')
(resid 6 and name c3') (resid 6 and name o3') 1.0 80.0 20.0 2
! Ade 7
{
assign (resid 7 and name O4')
(resid 7 and name C1')
(resid 7 and name C2')
(resid 7 and name C3') 1.0 -20.0 10.0 2
assign (resid 7 and name C1')
(resid 7 and name C2')
(resid 7 and name C3')
(resid 7 and name C4') 1.0 35.0 5.0 2
}
assign (resid 7 and name c5') (resid 7 and name c4')
(resid 7 and name c3') (resid 7 and name o3') 1.0 80.0 20.0 2
!
! Ura 8
{
assign (resid 8 and name O4')
(resid 8 and name C1')
(resid 8 and name C2')
(resid 8 and name C3') 1.0 -20.0 10.0 2
assign (resid 8 and name C1')
(resid 8 and name C2')
(resid 8 and name C3')
(resid 8 and name C4') 1.0 35.0 5.0 2
}
assign (resid 8 and name c5') (resid 8 and name c4')
(resid 8 and name c3') (resid 8 and name o3') 1.0 80.0 20.0 2
!
! Ura 9
{
assign (resid 9 and name O4')
(resid 9 and name C1')
(resid 9 and name C2')
(resid 9 and name C3') 1.0 -20.0 10.0 2
assign (resid 9 and name C1')
(resid 9 and name C2')
(resid 9 and name C3')
(resid 9 and name C4') 1.0 35.0 5.0 2
}
assign (resid 9 and name c5') (resid 9 and name c4')
(resid 9 and name c3') (resid 9 and name o3') 1.0 80.0 20.0 2
!
! Cyt 10
{
assign (resid 10 and name O4')
(resid 10 and name C1')
(resid 10 and name C2')
(resid 10 and name C3') 1.0 -20.0 10.0 2
assign (resid 10 and name C1')
(resid 10 and name C2')
(resid 10 and name C3')
(resid 10 and name C4') 1.0 35.0 5.0 2
}
assign (resid 10 and name c5') (resid 10 and name c4')
(resid 10 and name c3') (resid 10 and name o3') 1.0 80.0 20.0 2
!
! Gua 18
{
assign (resid 18 and name O4')
(resid 18 and name C1')
(resid 18 and name C2')
(resid 18 and name C3') 1.0 -20.0 10.0 2
assign (resid 18 and name C1')
(resid 18 and name C2')
(resid 18 and name C3')
(resid 18 and name C4') 1.0 35.0 5.0 2
}
assign (resid 18 and name c5') (resid 18 and name c4')
(resid 18 and name c3') (resid 18 and name o3') 1.0 80.0 20.0 2
!
! Ade 19
{
assign (resid 19 and name O4')
(resid 19 and name C1')
(resid 19 and name C2')
(resid 19 and name C3') 1.0 -20.0 10.0 2
assign (resid 19 and name C1')
(resid 19 and name C2')
(resid 19 and name C3')
(resid 19 and name C4') 1.0 35.0 5.0 2
}
assign (resid 19 and name c5') (resid 19 and name c4')
(resid 19 and name c3') (resid 19 and name o3') 1.0 80.0 20.0 2
! Ade 20
{
assign (resid 20 and name O4')
(resid 20 and name C1')
(resid 20 and name C2')
(resid 20 and name C3') 1.0 -20.0 10.0 2
assign (resid 20 and name C1')
(resid 20 and name C2')
(resid 20 and name C3')
(resid 20 and name C4') 1.0 35.0 5.0 2
}
assign (resid 20 and name c5') (resid 20 and name c4')
(resid 20 and name c3') (resid 20 and name o3') 1.0 80.0 20.0 2
!
! Cyt 21
{
assign (resid 21 and name O4')
(resid 21 and name C1')
(resid 21 and name C2')
(resid 21 and name C3') 1.0 -20.0 10.0 2
assign (resid 21 and name C1')
(resid 21 and name C2')
(resid 21 and name C3')
(resid 21 and name C4') 1.0 35.0 5.0 2
}
assign (resid 21 and name c5') (resid 21 and name c4')
(resid 21 and name c3') (resid 21 and name o3') 1.0 80.0 20.0 2
!
! Gua 22
{
assign (resid 22 and name O4')
(resid 22 and name C1')
(resid 22 and name C2')
(resid 22 and name C3') 1.0 -20.0 10.0 2
assign (resid 22 and name C1')
(resid 22 and name C2')
(resid 22 and name C3')
(resid 22 and name C4') 1.0 35.0 5.0 2
}
!assign (resid 22 and name c5') (resid 22 and name c4')
! (resid 22 and name c3') (resid 22 and name o3') 1.0 80.0 20.0 2
!
! Gua 23
{
assign (resid 23 and name O4')
(resid 23 and name C1')
(resid 23 and name C2')
(resid 23 and name C3') 1.0 -20.0 10.0 2
assign (resid 23 and name C1')
(resid 23 and name C2')
(resid 23 and name C3')
(resid 23 and name C4') 1.0 35.0 5.0 2
}
assign (resid 23 and name c5') (resid 23 and name c4')
(resid 23 and name c3') (resid 23 and name o3') 1.0 80.0 20.0 2
! Ade 24
{
assign (resid 24 and name O4')
(resid 24 and name C1')
(resid 24 and name C2')
(resid 24 and name C3') 1.0 -20.0 10.0 2
assign (resid 24 and name C1')
(resid 24 and name C2')
(resid 24 and name C3')
(resid 24 and name C4') 1.0 35.0 5.0 2
}
assign (resid 24 and name c5') (resid 24 and name c4')
(resid 24 and name c3') (resid 24 and name o3') 1.0 80.0 20.0 2
!
! Ura 25
{
assign (resid 25 and name O4')
(resid 25 and name C1')
(resid 25 and name C2')
(resid 25 and name C3') 1.0 -20.0 10.0 2
assign (resid 25 and name C1')
(resid 25 and name C2')
(resid 25 and name C3')
(resid 25 and name C4') 1.0 35.0 5.0 2
}
assign (resid 25 and name c5') (resid 25 and name c4')
(resid 25 and name c3') (resid 25 and name o3') 1.0 80.0 20.0 2
! Cyt 26
{
assign (resid 26 and name O4')
(resid 26 and name C1')
(resid 26 and name C2')
(resid 26 and name C3') 1.0 -20.0 10.0 2
assign (resid 26 and name C1')
(resid 26 and name C2')
(resid 26 and name C3')
(resid 26 and name C4') 1.0 35.0 5.0 2
}
assign (resid 26 and name c5') (resid 26 and name c4')
(resid 26 and name c3') (resid 26 and name o3') 1.0 80.0 20.0 2
!
! Cyt 27
{
assign (resid 27 and name O4')
(resid 27 and name C1')
(resid 27 and name C2')
(resid 27 and name C3') 1.0 -20.0 10.0 2
assign (resid 27 and name C1')
(resid 27 and name C2')
(resid 27 and name C3')
(resid 27 and name C4') 1.0 35.0 5.0 2
}
assign (resid 27 and name c5') (resid 27 and name c4')
(resid 27 and name c3') (resid 27 and name o3') 1.0 80.0 20.0 2
! Torsion angle restraints for the xhi torsion angle in the
! GZ33 - Theophylline RNA complex.
!
! Xhi is defined as follows...
! Purines = O4'-C1'-N9-C4
! Pyrimidines = O4'-C1'-N1-C2
! Anti:
! Xhi = 180.0 +/- 90.0
! including high-anti and excluding high-syn:
! Xhi = -150.0 +/- 90.0
! Syn:
! Xhi = 0.0 +/- 90.0
! See Saenger page 22.
!
!
assign (resid 1 and name O4') (resid 1 and name C1')
(resid 1 and name N9 ) (resid 1 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 2 and name O4') (resid 2 and name C1')
(resid 2 and name N9 ) (resid 2 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 3 and name O4') (resid 3 and name C1')
(resid 3 and name N9 ) (resid 3 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 4 and name O4') (resid 4 and name C1')
(resid 4 and name N1 ) (resid 4 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 5 and name O4') (resid 5 and name C1')
(resid 5 and name N1 ) (resid 5 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 6 and name O4') (resid 6 and name C1')
(resid 6 and name N1 ) (resid 6 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 7 and name O4') (resid 7 and name C1')
(resid 7 and name N9 ) (resid 7 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 8 and name O4') (resid 8 and name C1')
(resid 8 and name N1 ) (resid 8 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 9 and name O4') (resid 9 and name C1')
(resid 9 and name N1 ) (resid 9 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 10 and name O4') (resid 10 and name C1')
(resid 10 and name N1 ) (resid 10 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 11 and name O4') (resid 11 and name C1')
(resid 11 and name N9 ) (resid 11 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 12 and name O4') (resid 12 and name C1')
(resid 12 and name N9 ) (resid 12 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 13 and name O4') (resid 13 and name C1')
(resid 13 and name N1 ) (resid 13 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 14 and name O4') (resid 14 and name C1')
(resid 14 and name N1 ) (resid 14 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 15 and name O4') (resid 15 and name C1')
(resid 15 and name N9 ) (resid 15 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 16 and name O4') (resid 16 and name C1')
(resid 16 and name N9 ) (resid 16 and name C4 ) 1.0 0.0 90.0 2 !syn
assign (resid 17 and name O4') (resid 17 and name C1')
(resid 17 and name N1 ) (resid 17 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 18 and name O4') (resid 18 and name C1')
(resid 18 and name N9 ) (resid 18 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 19 and name O4') (resid 19 and name C1')
(resid 19 and name N9 ) (resid 19 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 20 and name O4') (resid 20 and name C1')
(resid 20 and name N9 ) (resid 20 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 21 and name O4') (resid 21 and name C1')
(resid 21 and name N1 ) (resid 21 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 22 and name O4') (resid 22 and name C1')
(resid 22 and name N9 ) (resid 22 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 23 and name O4') (resid 23 and name C1')
(resid 23 and name N9 ) (resid 23 and name C44) 1.0 -150.0 90.0 2
assign (resid 24 and name O4') (resid 24 and name C1')
(resid 24 and name N9 ) (resid 24 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 25 and name O4') (resid 25 and name C1')
(resid 25 and name N1 ) (resid 25 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 26 and name O4') (resid 26 and name C1')
(resid 26 and name N1 ) (resid 26 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 27 and name O4') (resid 27 and name C1')
(resid 27 and name N1 ) (resid 27 and name C2 ) 1.0 -150.0 90.0 2
!dihedral restraints on epsilon, zeta, alpha, beta
!!1
assign (resid 1 and name c4') (resid 1 and name c3')
(resid 1 and name o3') (resid 2 and name p ) 1.0 -160.0 10.0 2 !epsilon
assign (resid 1 and name c3') (resid 1 and name o3')
(resid 2 and name p ) (resid 2 and name o5') 1.0 -70.0 10.0 2 !zeta
!!2
assign (resid 1 and name o3') (resid 2 and name p )
(resid 2 and name o5') (resid 2 and name c5') 1.0 -60.0 20.0 2 !alpha
assign (resid 2 and name p ) (resid 2 and name o5')
(resid 2 and name c5') (resid 2 and name c4') 1.0 180.0 20.0 2 !beta
assign (resid 2 and name c4') (resid 2 and name c3')
(resid 2 and name o3') (resid 3 and name p ) 1.0 -160.0 20.0 2 !epsilon
assign (resid 2 and name c3') (resid 2 and name o3')
(resid 3 and name p ) (resid 3 and name o5') 1.0 -70.0 20.0 2 !zeta
!!3
assign (resid 2 and name o3') (resid 3 and name p )
(resid 3 and name o5') (resid 3 and name c5') 1.0 -60.0 20.0 2
assign (resid 3 and name p ) (resid 3 and name o5')
(resid 3 and name c5') (resid 3 and name c4') 1.0 180.0 20.0 2
assign (resid 3 and name c4') (resid 3 and name c3')
(resid 3 and name o3') (resid 4 and name p ) 1.0 -160.0 20.0 2
assign (resid 3 and name c3') (resid 3 and name o3')
(resid 4 and name p ) (resid 4 and name o5') 1.0 -70.0 20.0 2
!!4
assign (resid 3 and name o3') (resid 4 and name p )
(resid 4 and name o5') (resid 4 and name c5') 1.0 -60.0 20.0 2
assign (resid 4 and name p ) (resid 4 and name o5')
(resid 4 and name c5') (resid 4 and name c4') 1.0 180.0 20.0 2
assign (resid 4 and name c4') (resid 4 and name c3')
(resid 4 and name o3') (resid 5 and name p ) 1.0 -160.0 20.0 2
assign (resid 4 and name c3') (resid 4 and name o3')
(resid 5 and name p ) (resid 5 and name o5') 1.0 -70.0 20.0 2
!!5
assign (resid 4 and name o3') (resid 5 and name p )
(resid 5 and name o5') (resid 5 and name c5') 1.0 -60.0 20.0 2
assign (resid 5 and name p ) (resid 5 and name o5')
(resid 5 and name c5') (resid 5 and name c4') 1.0 180.0 20.0 2
assign (resid 5 and name c4') (resid 5 and name c3')
(resid 5 and name o3') (resid 6 and name p ) 1.0 -160.0 20.0 2
assign (resid 5 and name c3') (resid 5 and name o3')
(resid 6 and name p ) (resid 6 and name o5') 1.0 -70.0 20.0 2
!!6
assign (resid 5 and name o3') (resid 6 and name p )
(resid 6 and name o5') (resid 6 and name c5') 1.0 -60.0 20.0 2
assign (resid 6 and name p ) (resid 6 and name o5')
(resid 6 and name c5') (resid 6 and name c4') 1.0 180.0 20.0 2
assign (resid 6 and name c4') (resid 6 and name c3')
(resid 6 and name o3') (resid 7 and name p ) 1.0 -160.0 20.0 2
assign (resid 6 and name c3') (resid 6 and name o3')
(resid 7 and name p ) (resid 7 and name o5') 1.0 -70.0 20.0 2
!!7
assign (resid 6 and name o3') (resid 7 and name p )
(resid 7 and name o5') (resid 7 and name c5') 1.0 -60.0 20.0 2
assign (resid 7 and name p ) (resid 7 and name o5')
(resid 7 and name c5') (resid 7 and name c4') 1.0 180.0 20.0 2
assign (resid 7 and name c4') (resid 7 and name c3')
(resid 7 and name o3') (resid 8 and name p ) 1.0 -160.0 20.0 2
assign (resid 7 and name c3') (resid 7 and name o3')
(resid 8 and name p ) (resid 8 and name o5') 1.0 -70.0 20.0 2
!!8
assign (resid 7 and name o3') (resid 8 and name p )
(resid 8 and name o5') (resid 8 and name c5') 1.0 -60.0 20.0 2
assign (resid 8 and name p ) (resid 8 and name o5')
(resid 8 and name c5') (resid 8 and name c4') 1.0 180.0 20.0 2
assign (resid 8 and name c4') (resid 8 and name c3')
(resid 8 and name o3') (resid 9 and name p ) 1.0 -160.0 20.0 2
assign (resid 8 and name c3') (resid 8 and name o3')
(resid 9 and name p ) (resid 9 and name o5') 1.0 -70.0 20.0 2
!!9
assign (resid 8 and name o3') (resid 9 and name p )
(resid 9 and name o5') (resid 9 and name c5') 1.0 -60.0 20.0 2
assign (resid 9 and name p ) (resid 9 and name o5')
(resid 9 and name c5') (resid 9 and name c4') 1.0 180.0 20.0 2
assign (resid 9 and name c4') (resid 9 and name c3')
(resid 9 and name o3') (resid 10 and name p ) 1.0 -160.0 20.0 2
assign (resid 9 and name c3') (resid 9 and name o3')
(resid 10 and name p ) (resid 10 and name o5') 1.0 -70.0 20.0 2
!!10
assign (resid 9 and name o3') (resid 10 and name p )
(resid 10 and name o5') (resid 10 and name c5') 1.0 -60.0 20.0 2
assign (resid 10 and name p ) (resid 10 and name o5')
(resid 10 and name c5') (resid 10 and name c4') 1.0 180.0 20.0 2
assign (resid 10 and name c4') (resid 10 and name c3')
(resid 10 and name o3') (resid 11 and name p ) 1.0 -160.0 20.0 2
assign (resid 10 and name c3') (resid 10 and name o3')
(resid 11 and name p ) (resid 11 and name o5') 1.0 -70.0 20.0 2
!!11
assign (resid 10 and name o3') (resid 11 and name p )
(resid 11 and name o5') (resid 11 and name c5') 1.0 -60.0 50.0 2
assign (resid 11 and name p ) (resid 11 and name o5')
(resid 11 and name c5') (resid 11 and name c4') 1.0 180.0 60.0 2
assign (resid 11 and name c4') (resid 11 and name c3')
(resid 11 and name o3') (resid 12 and name p ) 1.0 -160.0 20.0 2
assign (resid 11 and name c3') (resid 11 and name o3')
(resid 12 and name p ) (resid 12 and name o5') 1.0 -70.0 60.0 2
!!12
assign (resid 11 and name o3') (resid 12 and name p )
(resid 12 and name o5') (resid 12 and name c5') 1.0 -60.0 20.0 2
assign (resid 12 and name p ) (resid 12 and name o5')
(resid 12 and name c5') (resid 12 and name c4') 1.0 180.0 20.0 2
assign (resid 12 and name c4') (resid 12 and name c3')
(resid 12 and name o3') (resid 13 and name p ) 1.0 -160.0 20.0 2
assign (resid 12 and name c3') (resid 12 and name o3')
(resid 13 and name p ) (resid 13 and name o5') 1.0 -70.0 20.0 2
!!13
assign (resid 12 and name o3') (resid 13 and name p )
(resid 13 and name o5') (resid 13 and name c5') 1.0 -60.0 20.0 2
assign (resid 13 and name p ) (resid 13 and name o5')
(resid 13 and name c5') (resid 13 and name c4') 1.0 180.0 20.0 2
assign (resid 13 and name c4') (resid 13 and name c3')
(resid 13 and name o3') (resid 14 and name p ) 1.0 -160.0 20.0 2
!assign (resid 13 and name c3') (resid 13 and name o3')
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!!14
!assign (resid 13 and name o3') (resid 14 and name p )
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!assign (resid 14 and name p ) (resid 14 and name o5')
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!assign (resid 14 and name c4') (resid 14 and name c3')
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!assign (resid 14 and name c3') (resid 14 and name o3')
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!!15
!assign (resid 14 and name o3') (resid 15 and name p )
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!assign (resid 15 and name p ) (resid 15 and name o5')
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!assign (resid 15 and name c4') (resid 15 and name c3')
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!assign (resid 15 and name c3') (resid 15 and name o3')
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!!16
!assign (resid 15 and name o3') (resid 16 and name p )
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!assign (resid 16 and name c3') (resid 16 and name o3')
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!!17
!assign (resid 16 and name o3') (resid 17 and name p )
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!assign (resid 17 and name p ) (resid 17 and name o5')
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!assign (resid 17 and name c4') (resid 17 and name c3')
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!assign (resid 17 and name c3') (resid 17 and name o3')
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!!18
!assign (resid 17 and name o3') (resid 18 and name p )
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assign (resid 18 and name p ) (resid 18 and name o5')
(resid 18 and name c5') (resid 18 and name c4') 1.0 180.0 20.0 2
assign (resid 18 and name c4') (resid 18 and name c3')
(resid 18 and name o3') (resid 19 and name p ) 1.0 -160.0 20.0 2
assign (resid 18 and name c3') (resid 18 and name o3')
(resid 19 and name p ) (resid 19 and name o5') 1.0 -70.0 20.0 2
!!19
assign (resid 18 and name o3') (resid 19 and name p )
(resid 19 and name o5') (resid 19 and name c5') 1.0 -60.0 20.0 2
assign (resid 19 and name p ) (resid 19 and name o5')
(resid 19 and name c5') (resid 19 and name c4') 1.0 180.0 20.0 2
assign (resid 19 and name c4') (resid 19 and name c3')
(resid 19 and name o3') (resid 20 and name p ) 1.0 -160.0 20.0 2
assign (resid 19 and name c3') (resid 19 and name o3')
(resid 20 and name p ) (resid 20 and name o5') 1.0 -70.0 20.0 2
!!20
assign (resid 19 and name o3') (resid 20 and name p )
(resid 20 and name o5') (resid 20 and name c5') 1.0 -60.0 20.0 2
assign (resid 20 and name p ) (resid 20 and name o5')
(resid 20 and name c5') (resid 20 and name c4') 1.0 180.0 20.0 2
assign (resid 20 and name c4') (resid 20 and name c3')
(resid 20 and name o3') (resid 21 and name p ) 1.0 -160.0 20.0 2
assign (resid 20 and name c3') (resid 20 and name o3')
(resid 21 and name p ) (resid 21 and name o5') 1.0 -70.0 20.0 2
!!21
assign (resid 20 and name o3') (resid 21 and name p )
(resid 21 and name o5') (resid 21 and name c5') 1.0 -60.0 20.0 2
assign (resid 21 and name p ) (resid 21 and name o5')
(resid 21 and name c5') (resid 21 and name c4') 1.0 180.0 20.0 2
assign (resid 21 and name c4') (resid 21 and name c3')
(resid 21 and name o3') (resid 22 and name p ) 1.0 -160.0 20.0 2
assign (resid 21 and name c3') (resid 21 and name o3')
(resid 22 and name p ) (resid 22 and name o5') 1.0 -70.0 20.0 2
!!22
assign (resid 21 and name o3') (resid 22 and name p )
(resid 22 and name o5') (resid 22 and name c5') 1.0 -60.0 20.0 2
assign (resid 22 and name p ) (resid 22 and name o5')
(resid 22 and name c5') (resid 22 and name c4') 1.0 180.0 20.0 2
assign (resid 22 and name c4') (resid 22 and name c3')
(resid 22 and name o3') (resid 23 and name p ) 1.0 -160.0 20.0 2
assign (resid 22 and name c3') (resid 22 and name o3')
(resid 23 and name p ) (resid 23 and name o5') 1.0 -70.0 20.0 2
!!23
assign (resid 22 and name o3') (resid 23 and name p )
(resid 23 and name o5') (resid 23 and name c5') 1.0 -60.0 20.0 2
assign (resid 23 and name p ) (resid 23 and name o5')
(resid 23 and name c5') (resid 23 and name c4') 1.0 180.0 20.0 2
assign (resid 23 and name c4') (resid 23 and name c3')
(resid 23 and name o3') (resid 24 and name p ) 1.0 -160.0 20.0 2
assign (resid 23 and name c3') (resid 23 and name o3')
(resid 24 and name p ) (resid 24 and name o5') 1.0 -70.0 20.0 2
!!24
assign (resid 23 and name o3') (resid 24 and name p )
(resid 24 and name o5') (resid 24 and name c5') 1.0 -60.0 20.0 2
assign (resid 24 and name p ) (resid 24 and name o5')
(resid 24 and name c5') (resid 24 and name c4') 1.0 180.0 20.0 2
assign (resid 24 and name c4') (resid 24 and name c3')
(resid 24 and name o3') (resid 25 and name p ) 1.0 -160.0 20.0 2
assign (resid 24 and name c3') (resid 24 and name o3')
(resid 25 and name p ) (resid 25 and name o5') 1.0 -70.0 20.0 2
!!25
assign (resid 24 and name o3') (resid 25 and name p )
(resid 25 and name o5') (resid 25 and name c5') 1.0 -60.0 20.0 2
assign (resid 25 and name p ) (resid 25 and name o5')
(resid 25 and name c5') (resid 25 and name c4') 1.0 180.0 20.0 2
assign (resid 25 and name c4') (resid 25 and name c3')
(resid 25 and name o3') (resid 26 and name p ) 1.0 -160.0 20.0 2
assign (resid 25 and name c3') (resid 25 and name o3')
(resid 26 and name p ) (resid 26 and name o5') 1.0 -70.0 20.0 2
!!26
assign (resid 25 and name o3') (resid 26 and name p )
(resid 26 and name o5') (resid 26 and name c5') 1.0 -60.0 20.0 2
assign (resid 26 and name p ) (resid 26 and name o5')
(resid 26 and name c5') (resid 26 and name c4') 1.0 180.0 20.0 2
assign (resid 26 and name c4') (resid 26 and name c3')
(resid 26 and name o3') (resid 27 and name p ) 1.0 -160.0 20.0 2
assign (resid 26 and name c3') (resid 26 and name o3')
(resid 27 and name p ) (resid 27 and name o5') 1.0 -70.0 20.0 2
!!27
assign (resid 26 and name o3') (resid 27 and name p )
(resid 27 and name o5') (resid 27 and name c5') 1.0 -60.0 20.0 2
assign (resid 27 and name p ) (resid 27 and name o5')
(resid 27 and name c5') (resid 27 and name c4') 1.0 180.0 20.0 2
!gamma
assign (resid 1 and name o5') (resid 1 and name c5')
(resid 1 and name c4') (resid 1 and name c3') 1.0 60.0 30.0 2
assign (resid 2 and name o5') (resid 2 and name c5')
(resid 2 and name c4') (resid 2 and name c3') 1.0 60.0 20.0 2
assign (resid 3 and name o5') (resid 3 and name c5')
(resid 3 and name c4') (resid 3 and name c3') 1.0 60.0 20.0 2
assign (resid 4 and name o5') (resid 4 and name c5')
(resid 4 and name c4') (resid 4 and name c3') 1.0 60.0 20.0 2
assign (resid 5 and name o5') (resid 5 and name c5')
(resid 5 and name c4') (resid 5 and name c3') 1.0 60.0 20.0 2
assign (resid 6 and name o5') (resid 6 and name c5')
(resid 6 and name c4') (resid 6 and name c3') 1.0 60.0 20.0 2
assign (resid 7 and name o5') (resid 7 and name c5')
(resid 7 and name c4') (resid 7 and name c3') 1.0 60.0 20.0 2
assign (resid 8 and name o5') (resid 8 and name c5')
(resid 8 and name c4') (resid 8 and name c3') 1.0 60.0 20.0 2
assign (resid 9 and name o5') (resid 9 and name c5')
(resid 9 and name c4') (resid 9 and name c3') 1.0 60.0 20.0 2
assign (resid 10 and name o5') (resid 10 and name c5')
(resid 10 and name c4') (resid 10 and name c3') 1.0 60.0 20.0 2
assign (resid 11 and name o5') (resid 11 and name c5')
(resid 11 and name c4') (resid 11 and name c3') 1.0 60.0 20.0 2
assign (resid 12 and name o5') (resid 12 and name c5')
(resid 12 and name c4') (resid 12 and name c3') 1.0 60.0 20.0 2
!assign (resid 13 and name o5') (resid 13 and name c5')
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!assign (resid 17 and name o5') (resid 17 and name c5')
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assign (resid 18 and name o5') (resid 18 and name c5')
(resid 18 and name c4') (resid 18 and name c3') 1.0 60.0 20.0 2
assign (resid 19 and name o5') (resid 19 and name c5')
(resid 19 and name c4') (resid 19 and name c3') 1.0 60.0 20.0 2
assign (resid 20 and name o5') (resid 20 and name c5')
(resid 20 and name c4') (resid 20 and name c3') 1.0 60.0 20.0 2
assign (resid 21 and name o5') (resid 21 and name c5')
(resid 21 and name c4') (resid 21 and name c3') 1.0 60.0 20.0 2
assign (resid 22 and name o5') (resid 22 and name c5')
(resid 22 and name c4') (resid 22 and name c3') 1.0 60.0 20.0 2
assign (resid 23 and name o5') (resid 23 and name c5')
(resid 23 and name c4') (resid 23 and name c3') 1.0 60.0 20.0 2
assign (resid 24 and name o5') (resid 24 and name c5')
(resid 24 and name c4') (resid 24 and name c3') 1.0 60.0 20.0 2
assign (resid 25 and name o5') (resid 25 and name c5')
(resid 25 and name c4') (resid 25 and name c3') 1.0 60.0 20.0 2
assign (resid 26 and name o5') (resid 26 and name c5')
(resid 26 and name c4') (resid 26 and name c3') 1.0 60.0 20.0 2
assign (resid 27 and name o5') (resid 27 and name c5')
(resid 27 and name c4') (resid 27 and name c3') 1.0 60.0 20.0 2