NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
11966 |
1saf   |
cing | 1-original | 7 | XPLOR/CNS | dihedral angle |
!phi
assign (resid 4 and name c and segid A) (resid 5 and name n and segid A)
(resid 5 and name ca and segid A) (resid 5 and name c and segid A) 1.0 -80.0 10.0 2
assign (resid 5 and name c and segid A) (resid 6 and name n and segid A)
(resid 6 and name ca and segid A) (resid 6 and name c and segid A) 1.0 -80.0 10.0 2
assign (resid 6 and name c and segid A) (resid 7 and name n and segid A)
(resid 7 and name ca and segid A) (resid 7 and name c and segid A) 1.0 -70.0 15.0 2
assign (resid 7 and name c and segid A) (resid 8 and name n and segid A)
(resid 8 and name ca and segid A) (resid 8 and name c and segid A) 1.0 -58.0 10.0 2
assign (resid 8 and name c and segid A) (resid 9 and name n and segid A)
(resid 9 and name ca and segid A) (resid 9 and name c and segid A) 1.0 -95.0 15.0 2
assign (resid 9 and name c and segid A) (resid 10 and name n and segid A)
(resid 10 and name ca and segid A) (resid 10 and name c and segid A) 1.0 -135.0 10.0 2
assign (resid 10 and name c and segid A) (resid 11 and name n and segid A)
(resid 11 and name ca and segid A) (resid 11 and name c and segid A) 1.0 -120.0 40.0 2
assign (resid 11 and name c and segid A) (resid 12 and name n and segid A)
(resid 12 and name ca and segid A) (resid 12 and name c and segid A) 1.0 -120.0 40.0 2
assign (resid 12 and name c and segid A) (resid 13 and name n and segid A)
(resid 13 and name ca and segid A) (resid 13 and name c and segid A) 1.0 -82.0 10.0 2
assign (resid 13 and name c and segid A) (resid 14 and name n and segid A)
(resid 14 and name ca and segid A) (resid 14 and name c and segid A) 1.0 -93.0 30.0 2
assign (resid 14 and name c and segid A) (resid 15 and name n and segid A)
(resid 15 and name ca and segid A) (resid 15 and name c and segid A) 1.0 -72.0 25.0 2
assign (resid 15 and name c and segid A) (resid 16 and name n and segid A)
(resid 16 and name ca and segid A) (resid 16 and name c and segid A) 1.0 100.0 30.0 2
assign (resid 16 and name c and segid A) (resid 17 and name n and segid A)
(resid 17 and name ca and segid A) (resid 17 and name c and segid A) 1.0 -60.0 25.0 2
assign (resid 17 and name c and segid A) (resid 18 and name n and segid A)
(resid 18 and name ca and segid A) (resid 18 and name c and segid A) 1.0 -58.0 10.0 2
assign (resid 18 and name c and segid A) (resid 19 and name n and segid A)
(resid 19 and name ca and segid A) (resid 19 and name c and segid A) 1.0 -62.0 10.0 2
assign (resid 19 and name c and segid A) (resid 20 and name n and segid A)
(resid 20 and name ca and segid A) (resid 20 and name c and segid A) 1.0 -55.0 10.0 2
assign (resid 20 and name c and segid A) (resid 21 and name n and segid A)
(resid 21 and name ca and segid A) (resid 21 and name c and segid A) 1.0 -50.0 10.0 2
assign (resid 21 and name c and segid A) (resid 22 and name n and segid A)
(resid 22 and name ca and segid A) (resid 22 and name c and segid A) 1.0 -62.0 10.0 2
assign (resid 22 and name c and segid A) (resid 23 and name n and segid A)
(resid 23 and name ca and segid A) (resid 23 and name c and segid A) 1.0 -60.0 10.0 2
assign (resid 23 and name c and segid A) (resid 24 and name n and segid A)
(resid 24 and name ca and segid A) (resid 24 and name c and segid A) 1.0 -48.0 10.0 2
assign (resid 24 and name c and segid A) (resid 25 and name n and segid A)
(resid 25 and name ca and segid A) (resid 25 and name c and segid A) 1.0 -59.0 10.0 2
assign (resid 25 and name c and segid A) (resid 26 and name n and segid A)
(resid 26 and name ca and segid A) (resid 26 and name c and segid A) 1.0 -62.0 10.0 2
assign (resid 26 and name c and segid A) (resid 27 and name n and segid A)
(resid 27 and name ca and segid A) (resid 27 and name c and segid A) 1.0 -58.0 10.0 2
assign (resid 27 and name c and segid A) (resid 28 and name n and segid A)
(resid 28 and name ca and segid A) (resid 28 and name c and segid A) 1.0 -61.0 10.0 2
assign (resid 28 and name c and segid A) (resid 29 and name n and segid A)
(resid 29 and name ca and segid A) (resid 29 and name c and segid A) 1.0 -58.0 10.0 2
assign (resid 29 and name c and segid A) (resid 30 and name n and segid A)
(resid 30 and name ca and segid A) (resid 30 and name c and segid A) 1.0 -61.0 10.0 2
assign (resid 30 and name c and segid A) (resid 31 and name n and segid A)
(resid 31 and name ca and segid A) (resid 31 and name c and segid A) 1.0 -58.0 10.0 2
assign (resid 31 and name c and segid A) (resid 32 and name n and segid A)
(resid 32 and name ca and segid A) (resid 32 and name c and segid A) 1.0 -62.0 10.0 2
assign (resid 32 and name c and segid A) (resid 33 and name n and segid A)
(resid 33 and name ca and segid A) (resid 33 and name c and segid A) 1.0 -60.0 10.0 2
assign (resid 33 and name c and segid A) (resid 34 and name n and segid A)
(resid 34 and name ca and segid A) (resid 34 and name c and segid A) 1.0 -55.0 10.0 2
assign (resid 34 and name c and segid A) (resid 35 and name n and segid A)
(resid 35 and name ca and segid A) (resid 35 and name c and segid A) 1.0 -68.0 10.0 2
assign (resid 35 and name c and segid A) (resid 36 and name n and segid A)
(resid 36 and name ca and segid A) (resid 36 and name c and segid A) 1.0 -80.0 10.0 2
assign (resid 36 and name c and segid A) (resid 37 and name n and segid A)
(resid 37 and name ca and segid A) (resid 37 and name c and segid A) 1.0 -70.0 10.0 2
assign (resid 37 and name c and segid A) (resid 38 and name n and segid A)
(resid 38 and name ca and segid A) (resid 38 and name c and segid A) 1.0 -60.0 25.0 2
assign (resid 38 and name c and segid A) (resid 39 and name n and segid A)
(resid 39 and name ca and segid A) (resid 39 and name c and segid A) 1.0 -85.0 10.0 2
assign (resid 39 and name c and segid A) (resid 40 and name n and segid A)
(resid 40 and name ca and segid A) (resid 40 and name c and segid A) 1.0 -50.0 10.0 2
!chi1
ASSIGN (resid 5 and name n and segid A) (resid 5 and name ca and segid A)
(resid 5 and name cb and segid A) (resid 5 and name cg and segid A) 1.0 -60.0 25.0 2
assign (resid 8 and name n and segid a) (resid 8 and name ca and segid A)
(resid 8 and name cb and segid A) (resid 8 and name cg and segid A) 1.0 -60.0 25.0 2
assign (resid 9 and name n and segid a) (resid 9 and name ca and segid A)
(resid 9 and name cb and segid A) (resid 9 and name cg and segid A) 1.0 -60.0 25.0 2
assign (resid 10 and name n and segid a) (resid 10 and name ca and segid A)
(resid 10 and name cb and segid A) (resid 10 and name cg and segid A) 1.0 -60.0 25.0 2
assign (resid 11 and name n and segid A) (resid 11 and name ca and segid A)
(resid 11 and name cb and segid A)(resid 11 and name og1 and segid A) 1.0 60.0 25.0 2
assign (resid 12 and name n and segid a) (resid 12 and name ca and segid A)
(resid 12 and name cb and segid A) (resid 12 and name cg and segid A) 1.0 180.0 25.0 2
ASSIGN (resid 13 and name n and segid A) (resid 13 and name ca and segid A)
(resid 13 and name cb and segid A) (resid 13 and name cg and segid A) 1.0 180.0 25.0 2
assign (resid 14 and name n and segid a) (resid 14 and name ca and segid A)
(resid 14 and name cb and segid A) (resid 14 and name cg1 and segid A) 1.0 -60.0 25.0 2
assign (resid 15 and name n and segid a) (resid 15 and name ca and segid A)
(resid 15 and name cb and segid A) (resid 15 and name cg and segid A) 1.0 180.0 25.0 2
ASSIGN (resid 17 and name n and segid A) (resid 17 and name ca and segid A)
(resid 17 and name cb and segid A) (resid 17 and name cg and segid A) 1.0 180.0 25.0 2
assign (resid 19 and name n and segid a) (resid 19 and name ca and segid A)
(resid 19 and name cb and segid A) (resid 19 and name cg and segid A) 1.0 -180.0 25.0 2
assign (resid 20 and name n and segid a) (resid 20 and name ca and segid A)
(resid 20 and name cb and segid A) (resid 20 and name cg and segid A) 1.0 180.0 25.0 2
ASSIGN (resid 21 and name n and segid A) (resid 21 and name ca and segid A)
(resid 21 and name cb and segid A) (resid 21 and name cg and segid A) 1.0 -60.0 25.0 2
assign (resid 22 and name n and segid a) (resid 22 and name ca and segid A)
(resid 22 and name cb and segid A) (resid 22 and name cg and segid A) 1.0 180.0 25.0 2
assign (resid 23 and name n and segid a) (resid 23 and name ca and segid A)
(resid 23 and name cb and segid A) (resid 23 and name cg and segid A) 1.0 -60.0 25.0 2
ASSIGN (resid 24 and name n and segid A) (resid 24 and name ca and segid A)
(resid 24 and name cb and segid A) (resid 24 and name cg and segid A) 1.0 180.0 25.0 2
ASSIGN (resid 26 and name n and segid A) (resid 26 and name ca and segid A)
(resid 26 and name cb and segid A) (resid 26 and name cg and segid A) 1.0 -60.0 25.0 2
assign (resid 27 and name n and segid a) (resid 27 and name ca and segid A)
(resid 27 and name cb and segid A) (resid 27 and name cg and segid A) 1.0 180.0 25.0 2
assign (resid 30 and name n and segid a) (resid 30 and name ca and segid A)
(resid 30 and name cb and segid A) (resid 30 and name cg and segid A) 1.0 -60.0 25.0 2
ASSIGN (resid 31 and name n and segid A) (resid 31 and name ca and segid A)
(resid 31 and name cb and segid A) (resid 31 and name cg and segid A) 1.0 -60.0 25.0 2
assign (resid 32 and name n and segid a) (resid 32 and name ca and segid A)
(resid 32 and name cb and segid A) (resid 32 and name cg and segid A) 1.0 180.0 25.0 2
ASSIGN (resid 33 and name n and segid A) (resid 33 and name ca and segid A)
(resid 33 and name cb and segid A) (resid 33 and name cg and segid A) 1.0 180.0 25.0 2
ASSIGN (resid 34 and name n and segid A) (resid 34 and name ca and segid A)
(resid 34 and name cb and segid A) (resid 34 and name cg and segid A) 1.0 -60.0 25.0 2
!chi2
ASSIGN (resid 6 and name n and segid A) (resid 6 and name ca and segid A)
(resid 6 and name cb and segid A) (resid 6 and name cg and segid A) 1.0 -60.0 25.0 2
assign (resid 12 and name ca and segid A) (resid 12 and name cb and segid A)
(resid 12 and name cg and segid A) (resid 12 and name cd1 and segid A) 1.0 60.0 25.0 2
assign (resid 14 and name ca and segid A) (resid 14 and name cb and segid A)
(resid 14 and name cg1 and segid A) (resid 14 and name cd1 and segid A) 1.0 180.0 25.0 2
assign (resid 22 and name ca and segid A) (resid 22 and name cb and segid A)
(resid 22 and name cg and segid A) (resid 22 and name sd and segid A) 1.0 180.0 25.0 2
assign (resid 26 and name ca and segid A) (resid 26 and name cb and segid A)
(resid 26 and name cg and segid A) (resid 26 and name cd1 and segid A) 1.0 180.0 25.0 2
assign (resid 30 and name ca and segid A) (resid 30 and name cb and segid A)
(resid 30 and name cg and segid A) (resid 30 and name cd1 and segid A) 1.0 180.0 25.0 2
!chi2 aromatic
assign (resid 9 and name ca and segid A) (resid 9 and name cb and segid A)
(resid 9 and name cg and segid A) (resid 9 and name cd1 and segid A) 1.0 90.0 50.0 2
assign (resid 10 and name ca and segid A) (resid 10 and name cb and segid A)
(resid 10 and name cg and segid A) (resid 10 and name cd1 and segid A) 1.0 90.0 50.0 2
assign (resid 20 and name ca and segid A) (resid 20 and name cb and segid A)
(resid 20 and name cg and segid A) (resid 20 and name cd1 and segid A) 1.0 90.0 50.0 2
assign (resid 23 and name ca and segid A) (resid 23 and name cb and segid A)
(resid 23 and name cg and segid A) (resid 23 and name cd1 and segid A) 1.0 90.0 50.0 2
!phi
assign (resid 4 and name c and segid b) (resid 5 and name n and segid b)
(resid 5 and name ca and segid b) (resid 5 and name c and segid b) 1.0 -80.0 10.0 2
assign (resid 5 and name c and segid b) (resid 6 and name n and segid b)
(resid 6 and name ca and segid b) (resid 6 and name c and segid b) 1.0 -80.0 10.0 2
assign (resid 6 and name c and segid b) (resid 7 and name n and segid b)
(resid 7 and name ca and segid b) (resid 7 and name c and segid b) 1.0 -70.0 15.0 2
assign (resid 7 and name c and segid b) (resid 8 and name n and segid b)
(resid 8 and name ca and segid b) (resid 8 and name c and segid b) 1.0 -58.0 10.0 2
assign (resid 8 and name c and segid b) (resid 9 and name n and segid b)
(resid 9 and name ca and segid b) (resid 9 and name c and segid b) 1.0 -95.0 15.0 2
assign (resid 9 and name c and segid b) (resid 10 and name n and segid b)
(resid 10 and name ca and segid b) (resid 10 and name c and segid b) 1.0 -135.0 10.0 2
assign (resid 10 and name c and segid b) (resid 11 and name n and segid b)
(resid 11 and name ca and segid b) (resid 11 and name c and segid b) 1.0 -120.0 40.0 2
assign (resid 11 and name c and segid b) (resid 12 and name n and segid b)
(resid 12 and name ca and segid b) (resid 12 and name c and segid b) 1.0 -120.0 40.0 2
assign (resid 12 and name c and segid b) (resid 13 and name n and segid b)
(resid 13 and name ca and segid b) (resid 13 and name c and segid b) 1.0 -82.0 10.0 2
assign (resid 13 and name c and segid b) (resid 14 and name n and segid b)
(resid 14 and name ca and segid b) (resid 14 and name c and segid b) 1.0 -93.0 30.0 2
assign (resid 14 and name c and segid b) (resid 15 and name n and segid b)
(resid 15 and name ca and segid b) (resid 15 and name c and segid b) 1.0 -72.0 25.0 2
assign (resid 15 and name c and segid b) (resid 16 and name n and segid b)
(resid 16 and name ca and segid b) (resid 16 and name c and segid b) 1.0 100.0 30.0 2
assign (resid 16 and name c and segid b) (resid 17 and name n and segid b)
(resid 17 and name ca and segid b) (resid 17 and name c and segid b) 1.0 -60.0 25.0 2
assign (resid 17 and name c and segid b) (resid 18 and name n and segid b)
(resid 18 and name ca and segid b) (resid 18 and name c and segid b) 1.0 -58.0 10.0 2
assign (resid 18 and name c and segid b) (resid 19 and name n and segid b)
(resid 19 and name ca and segid b) (resid 19 and name c and segid b) 1.0 -62.0 10.0 2
assign (resid 19 and name c and segid b) (resid 20 and name n and segid b)
(resid 20 and name ca and segid b) (resid 20 and name c and segid b) 1.0 -55.0 10.0 2
assign (resid 20 and name c and segid b) (resid 21 and name n and segid b)
(resid 21 and name ca and segid b) (resid 21 and name c and segid b) 1.0 -50.0 10.0 2
assign (resid 21 and name c and segid b) (resid 22 and name n and segid b)
(resid 22 and name ca and segid b) (resid 22 and name c and segid b) 1.0 -62.0 10.0 2
assign (resid 22 and name c and segid b) (resid 23 and name n and segid b)
(resid 23 and name ca and segid b) (resid 23 and name c and segid b) 1.0 -60.0 10.0 2
assign (resid 23 and name c and segid b) (resid 24 and name n and segid b)
(resid 24 and name ca and segid b) (resid 24 and name c and segid b) 1.0 -48.0 10.0 2
assign (resid 24 and name c and segid b) (resid 25 and name n and segid b)
(resid 25 and name ca and segid b) (resid 25 and name c and segid b) 1.0 -59.0 10.0 2
assign (resid 25 and name c and segid b) (resid 26 and name n and segid b)
(resid 26 and name ca and segid b) (resid 26 and name c and segid b) 1.0 -62.0 10.0 2
assign (resid 26 and name c and segid b) (resid 27 and name n and segid b)
(resid 27 and name ca and segid b) (resid 27 and name c and segid b) 1.0 -58.0 10.0 2
assign (resid 27 and name c and segid b) (resid 28 and name n and segid b)
(resid 28 and name ca and segid b) (resid 28 and name c and segid b) 1.0 -61.0 10.0 2
assign (resid 28 and name c and segid b) (resid 29 and name n and segid b)
(resid 29 and name ca and segid b) (resid 29 and name c and segid b) 1.0 -58.0 10.0 2
assign (resid 29 and name c and segid b) (resid 30 and name n and segid b)
(resid 30 and name ca and segid b) (resid 30 and name c and segid b) 1.0 -61.0 10.0 2
assign (resid 30 and name c and segid b) (resid 31 and name n and segid b)
(resid 31 and name ca and segid b) (resid 31 and name c and segid b) 1.0 -58.0 10.0 2
assign (resid 31 and name c and segid b) (resid 32 and name n and segid b)
(resid 32 and name ca and segid b) (resid 32 and name c and segid b) 1.0 -62.0 10.0 2
assign (resid 32 and name c and segid b) (resid 33 and name n and segid b)
(resid 33 and name ca and segid b) (resid 33 and name c and segid b) 1.0 -60.0 10.0 2
assign (resid 33 and name c and segid b) (resid 34 and name n and segid b)
(resid 34 and name ca and segid b) (resid 34 and name c and segid b) 1.0 -55.0 10.0 2
assign (resid 34 and name c and segid b) (resid 35 and name n and segid b)
(resid 35 and name ca and segid b) (resid 35 and name c and segid b) 1.0 -68.0 10.0 2
assign (resid 35 and name c and segid b) (resid 36 and name n and segid b)
(resid 36 and name ca and segid b) (resid 36 and name c and segid b) 1.0 -80.0 10.0 2
assign (resid 36 and name c and segid b) (resid 37 and name n and segid b)
(resid 37 and name ca and segid b) (resid 37 and name c and segid b) 1.0 -70.0 10.0 2
assign (resid 37 and name c and segid b) (resid 38 and name n and segid b)
(resid 38 and name ca and segid b) (resid 38 and name c and segid b) 1.0 -60.0 25.0 2
assign (resid 38 and name c and segid b) (resid 39 and name n and segid b)
(resid 39 and name ca and segid b) (resid 39 and name c and segid b) 1.0 -85.0 10.0 2
assign (resid 39 and name c and segid b) (resid 40 and name n and segid b)
(resid 40 and name ca and segid b) (resid 40 and name c and segid b) 1.0 -50.0 10.0 2
!chi1
ASSIGN (resid 5 and name n and segid b) (resid 5 and name ca and segid b)
(resid 5 and name cb and segid b) (resid 5 and name cg and segid b) 1.0 -60.0 25.0 2
assign (resid 8 and name n and segid b) (resid 8 and name ca and segid b)
(resid 8 and name cb and segid b) (resid 8 and name cg and segid b) 1.0 -60.0 25.0 2
assign (resid 9 and name n and segid b) (resid 9 and name ca and segid b)
(resid 9 and name cb and segid b) (resid 9 and name cg and segid b) 1.0 -60.0 25.0 2
assign (resid 10 and name n and segid b) (resid 10 and name ca and segid b)
(resid 10 and name cb and segid b) (resid 10 and name cg and segid b) 1.0 -60.0 25.0 2
assign (resid 11 and name n and segid b) (resid 11 and name ca and segid b)
(resid 11 and name cb and segid b)(resid 11 and name og1 and segid b) 1.0 60.0 25.0 2
assign (resid 12 and name n and segid b) (resid 12 and name ca and segid b)
(resid 12 and name cb and segid b) (resid 12 and name cg and segid b) 1.0 180.0 25.0 2
ASSIGN (resid 13 and name n and segid b) (resid 13 and name ca and segid b)
(resid 13 and name cb and segid b) (resid 13 and name cg and segid b) 1.0 180.0 25.0 2
assign (resid 14 and name n and segid b) (resid 14 and name ca and segid b)
(resid 14 and name cb and segid b) (resid 14 and name cg1 and segid b) 1.0 -60.0 25.0 2
assign (resid 15 and name n and segid b) (resid 15 and name ca and segid b)
(resid 15 and name cb and segid b) (resid 15 and name cg and segid b) 1.0 180.0 25.0 2
ASSIGN (resid 17 and name n and segid b) (resid 17 and name ca and segid b)
(resid 17 and name cb and segid b) (resid 17 and name cg and segid b) 1.0 180.0 25.0 2
assign (resid 19 and name n and segid b) (resid 19 and name ca and segid b)
(resid 19 and name cb and segid b) (resid 19 and name cg and segid b) 1.0 -180.0 25.0 2
assign (resid 20 and name n and segid b) (resid 20 and name ca and segid b)
(resid 20 and name cb and segid b) (resid 20 and name cg and segid b) 1.0 180.0 25.0 2
ASSIGN (resid 21 and name n and segid b) (resid 21 and name ca and segid b)
(resid 21 and name cb and segid b) (resid 21 and name cg and segid b) 1.0 -60.0 25.0 2
assign (resid 22 and name n and segid b) (resid 22 and name ca and segid b)
(resid 22 and name cb and segid b) (resid 22 and name cg and segid b) 1.0 180.0 25.0 2
assign (resid 23 and name n and segid b) (resid 23 and name ca and segid b)
(resid 23 and name cb and segid b) (resid 23 and name cg and segid b) 1.0 -60.0 25.0 2
ASSIGN (resid 24 and name n and segid b) (resid 24 and name ca and segid b)
(resid 24 and name cb and segid b) (resid 24 and name cg and segid b) 1.0 180.0 25.0 2
ASSIGN (resid 26 and name n and segid b) (resid 26 and name ca and segid b)
(resid 26 and name cb and segid b) (resid 26 and name cg and segid b) 1.0 -60.0 25.0 2
assign (resid 27 and name n and segid b) (resid 27 and name ca and segid b)
(resid 27 and name cb and segid b) (resid 27 and name cg and segid b) 1.0 180.0 25.0 2
assign (resid 30 and name n and segid b) (resid 30 and name ca and segid b)
(resid 30 and name cb and segid b) (resid 30 and name cg and segid b) 1.0 -60.0 25.0 2
ASSIGN (resid 31 and name n and segid b) (resid 31 and name ca and segid b)
(resid 31 and name cb and segid b) (resid 31 and name cg and segid b) 1.0 -60.0 25.0 2
assign (resid 32 and name n and segid b) (resid 32 and name ca and segid b)
(resid 32 and name cb and segid b) (resid 32 and name cg and segid b) 1.0 180.0 25.0 2
ASSIGN (resid 33 and name n and segid b) (resid 33 and name ca and segid b)
(resid 33 and name cb and segid b) (resid 33 and name cg and segid b) 1.0 180.0 25.0 2
ASSIGN (resid 34 and name n and segid b) (resid 34 and name ca and segid b)
(resid 34 and name cb and segid b) (resid 34 and name cg and segid b) 1.0 -60.0 25.0 2
!chi2
ASSIGN (resid 6 and name n and segid b) (resid 6 and name ca and segid b)
(resid 6 and name cb and segid b) (resid 6 and name cg and segid b) 1.0 -60.0 25.0 2
assign (resid 12 and name ca and segid b) (resid 12 and name cb and segid b)
(resid 12 and name cg and segid b) (resid 12 and name cd1 and segid b) 1.0 60.0 25.0 2
assign (resid 14 and name ca and segid b) (resid 14 and name cb and segid b)
(resid 14 and name cg1 and segid b) (resid 14 and name cd1 and segid b) 1.0 180.0 25.0 2
assign (resid 22 and name ca and segid b) (resid 22 and name cb and segid b)
(resid 22 and name cg and segid b) (resid 22 and name sd and segid b) 1.0 180.0 25.0 2
assign (resid 26 and name ca and segid b) (resid 26 and name cb and segid b)
(resid 26 and name cg and segid b) (resid 26 and name cd1 and segid b) 1.0 180.0 25.0 2
assign (resid 30 and name ca and segid b) (resid 30 and name cb and segid b)
(resid 30 and name cg and segid b) (resid 30 and name cd1 and segid b) 1.0 180.0 25.0 2
!chi2 aromatic
assign (resid 9 and name ca and segid b) (resid 9 and name cb and segid b)
(resid 9 and name cg and segid b) (resid 9 and name cd1 and segid b) 1.0 90.0 50.0 2
assign (resid 10 and name ca and segid b) (resid 10 and name cb and segid b)
(resid 10 and name cg and segid b) (resid 10 and name cd1 and segid b) 1.0 90.0 50.0 2
assign (resid 20 and name ca and segid b) (resid 20 and name cb and segid b)
(resid 20 and name cg and segid b) (resid 20 and name cd1 and segid b) 1.0 90.0 50.0 2
assign (resid 23 and name ca and segid b) (resid 23 and name cb and segid b)
(resid 23 and name cg and segid b) (resid 23 and name cd1 and segid b) 1.0 90.0 50.0 2
!phi
assign (resid 4 and name c and segid c) (resid 5 and name n and segid c)
(resid 5 and name ca and segid c) (resid 5 and name c and segid c) 1.0 -80.0 10.0 2
assign (resid 5 and name c and segid c) (resid 6 and name n and segid c)
(resid 6 and name ca and segid c) (resid 6 and name c and segid c) 1.0 -80.0 10.0 2
assign (resid 6 and name c and segid c) (resid 7 and name n and segid c)
(resid 7 and name ca and segid c) (resid 7 and name c and segid c) 1.0 -70.0 15.0 2
assign (resid 7 and name c and segid c) (resid 8 and name n and segid c)
(resid 8 and name ca and segid c) (resid 8 and name c and segid c) 1.0 -58.0 10.0 2
assign (resid 8 and name c and segid c) (resid 9 and name n and segid c)
(resid 9 and name ca and segid c) (resid 9 and name c and segid c) 1.0 -95.0 15.0 2
assign (resid 9 and name c and segid c) (resid 10 and name n and segid c)
(resid 10 and name ca and segid c) (resid 10 and name c and segid c) 1.0 -135.0 10.0 2
assign (resid 10 and name c and segid c) (resid 11 and name n and segid c)
(resid 11 and name ca and segid c) (resid 11 and name c and segid c) 1.0 -120.0 40.0 2
assign (resid 11 and name c and segid c) (resid 12 and name n and segid c)
(resid 12 and name ca and segid c) (resid 12 and name c and segid c) 1.0 -120.0 40.0 2
assign (resid 12 and name c and segid c) (resid 13 and name n and segid c)
(resid 13 and name ca and segid c) (resid 13 and name c and segid c) 1.0 -82.0 10.0 2
assign (resid 13 and name c and segid c) (resid 14 and name n and segid c)
(resid 14 and name ca and segid c) (resid 14 and name c and segid c) 1.0 -93.0 30.0 2
assign (resid 14 and name c and segid c) (resid 15 and name n and segid c)
(resid 15 and name ca and segid c) (resid 15 and name c and segid c) 1.0 -72.0 25.0 2
assign (resid 15 and name c and segid c) (resid 16 and name n and segid c)
(resid 16 and name ca and segid c) (resid 16 and name c and segid c) 1.0 100.0 30.0 2
assign (resid 16 and name c and segid c) (resid 17 and name n and segid c)
(resid 17 and name ca and segid c) (resid 17 and name c and segid c) 1.0 -60.0 25.0 2
assign (resid 17 and name c and segid c) (resid 18 and name n and segid c)
(resid 18 and name ca and segid c) (resid 18 and name c and segid c) 1.0 -58.0 10.0 2
assign (resid 18 and name c and segid c) (resid 19 and name n and segid c)
(resid 19 and name ca and segid c) (resid 19 and name c and segid c) 1.0 -62.0 10.0 2
assign (resid 19 and name c and segid c) (resid 20 and name n and segid c)
(resid 20 and name ca and segid c) (resid 20 and name c and segid c) 1.0 -55.0 10.0 2
assign (resid 20 and name c and segid c) (resid 21 and name n and segid c)
(resid 21 and name ca and segid c) (resid 21 and name c and segid c) 1.0 -50.0 10.0 2
assign (resid 21 and name c and segid c) (resid 22 and name n and segid c)
(resid 22 and name ca and segid c) (resid 22 and name c and segid c) 1.0 -62.0 10.0 2
assign (resid 22 and name c and segid c) (resid 23 and name n and segid c)
(resid 23 and name ca and segid c) (resid 23 and name c and segid c) 1.0 -60.0 10.0 2
assign (resid 23 and name c and segid c) (resid 24 and name n and segid c)
(resid 24 and name ca and segid c) (resid 24 and name c and segid c) 1.0 -48.0 10.0 2
assign (resid 24 and name c and segid c) (resid 25 and name n and segid c)
(resid 25 and name ca and segid c) (resid 25 and name c and segid c) 1.0 -59.0 10.0 2
assign (resid 25 and name c and segid c) (resid 26 and name n and segid c)
(resid 26 and name ca and segid c) (resid 26 and name c and segid c) 1.0 -62.0 10.0 2
assign (resid 26 and name c and segid c) (resid 27 and name n and segid c)
(resid 27 and name ca and segid c) (resid 27 and name c and segid c) 1.0 -58.0 10.0 2
assign (resid 27 and name c and segid c) (resid 28 and name n and segid c)
(resid 28 and name ca and segid c) (resid 28 and name c and segid c) 1.0 -61.0 10.0 2
assign (resid 28 and name c and segid c) (resid 29 and name n and segid c)
(resid 29 and name ca and segid c) (resid 29 and name c and segid c) 1.0 -58.0 10.0 2
assign (resid 29 and name c and segid c) (resid 30 and name n and segid c)
(resid 30 and name ca and segid c) (resid 30 and name c and segid c) 1.0 -61.0 10.0 2
assign (resid 30 and name c and segid c) (resid 31 and name n and segid c)
(resid 31 and name ca and segid c) (resid 31 and name c and segid c) 1.0 -58.0 10.0 2
assign (resid 31 and name c and segid c) (resid 32 and name n and segid c)
(resid 32 and name ca and segid c) (resid 32 and name c and segid c) 1.0 -62.0 10.0 2
assign (resid 32 and name c and segid c) (resid 33 and name n and segid c)
(resid 33 and name ca and segid c) (resid 33 and name c and segid c) 1.0 -60.0 10.0 2
assign (resid 33 and name c and segid c) (resid 34 and name n and segid c)
(resid 34 and name ca and segid c) (resid 34 and name c and segid c) 1.0 -55.0 10.0 2
assign (resid 34 and name c and segid c) (resid 35 and name n and segid c)
(resid 35 and name ca and segid c) (resid 35 and name c and segid c) 1.0 -68.0 10.0 2
assign (resid 35 and name c and segid c) (resid 36 and name n and segid c)
(resid 36 and name ca and segid c) (resid 36 and name c and segid c) 1.0 -80.0 10.0 2
assign (resid 36 and name c and segid c) (resid 37 and name n and segid c)
(resid 37 and name ca and segid c) (resid 37 and name c and segid c) 1.0 -70.0 10.0 2
assign (resid 37 and name c and segid c) (resid 38 and name n and segid c)
(resid 38 and name ca and segid c) (resid 38 and name c and segid c) 1.0 -60.0 25.0 2
assign (resid 38 and name c and segid c) (resid 39 and name n and segid c)
(resid 39 and name ca and segid c) (resid 39 and name c and segid c) 1.0 -85.0 10.0 2
assign (resid 39 and name c and segid c) (resid 40 and name n and segid c)
(resid 40 and name ca and segid c) (resid 40 and name c and segid c) 1.0 -50.0 10.0 2
!chi1
ASSIGN (resid 5 and name n and segid c) (resid 5 and name ca and segid c)
(resid 5 and name cb and segid c) (resid 5 and name cg and segid c) 1.0 -60.0 25.0 2
assign (resid 8 and name n and segid c) (resid 8 and name ca and segid c)
(resid 8 and name cb and segid c) (resid 8 and name cg and segid c) 1.0 -60.0 25.0 2
assign (resid 9 and name n and segid c) (resid 9 and name ca and segid c)
(resid 9 and name cb and segid c) (resid 9 and name cg and segid c) 1.0 -60.0 25.0 2
assign (resid 10 and name n and segid c) (resid 10 and name ca and segid c)
(resid 10 and name cb and segid c) (resid 10 and name cg and segid c) 1.0 -60.0 25.0 2
assign (resid 11 and name n and segid c) (resid 11 and name ca and segid c)
(resid 11 and name cb and segid c)(resid 11 and name og1 and segid c) 1.0 60.0 25.0 2
assign (resid 12 and name n and segid c) (resid 12 and name ca and segid c)
(resid 12 and name cb and segid c) (resid 12 and name cg and segid c) 1.0 180.0 25.0 2
ASSIGN (resid 13 and name n and segid c) (resid 13 and name ca and segid c)
(resid 13 and name cb and segid c) (resid 13 and name cg and segid c) 1.0 180.0 25.0 2
assign (resid 14 and name n and segid c) (resid 14 and name ca and segid c)
(resid 14 and name cb and segid c) (resid 14 and name cg1 and segid c) 1.0 -60.0 25.0 2
assign (resid 15 and name n and segid c) (resid 15 and name ca and segid c)
(resid 15 and name cb and segid c) (resid 15 and name cg and segid c) 1.0 180.0 25.0 2
ASSIGN (resid 17 and name n and segid c) (resid 17 and name ca and segid c)
(resid 17 and name cb and segid c) (resid 17 and name cg and segid c) 1.0 180.0 25.0 2
assign (resid 19 and name n and segid c) (resid 19 and name ca and segid c)
(resid 19 and name cb and segid c) (resid 19 and name cg and segid c) 1.0 -180.0 25.0 2
assign (resid 20 and name n and segid c) (resid 20 and name ca and segid c)
(resid 20 and name cb and segid c) (resid 20 and name cg and segid c) 1.0 180.0 25.0 2
ASSIGN (resid 21 and name n and segid c) (resid 21 and name ca and segid c)
(resid 21 and name cb and segid c) (resid 21 and name cg and segid c) 1.0 -60.0 25.0 2
assign (resid 22 and name n and segid c) (resid 22 and name ca and segid c)
(resid 22 and name cb and segid c) (resid 22 and name cg and segid c) 1.0 180.0 25.0 2
assign (resid 23 and name n and segid c) (resid 23 and name ca and segid c)
(resid 23 and name cb and segid c) (resid 23 and name cg and segid c) 1.0 -60.0 25.0 2
ASSIGN (resid 24 and name n and segid c) (resid 24 and name ca and segid c)
(resid 24 and name cb and segid c) (resid 24 and name cg and segid c) 1.0 180.0 25.0 2
ASSIGN (resid 26 and name n and segid c) (resid 26 and name ca and segid c)
(resid 26 and name cb and segid c) (resid 26 and name cg and segid c) 1.0 -60.0 25.0 2
assign (resid 27 and name n and segid c) (resid 27 and name ca and segid c)
(resid 27 and name cb and segid c) (resid 27 and name cg and segid c) 1.0 180.0 25.0 2
assign (resid 30 and name n and segid c) (resid 30 and name ca and segid c)
(resid 30 and name cb and segid c) (resid 30 and name cg and segid c) 1.0 -60.0 25.0 2
ASSIGN (resid 31 and name n and segid c) (resid 31 and name ca and segid c)
(resid 31 and name cb and segid c) (resid 31 and name cg and segid c) 1.0 -60.0 25.0 2
assign (resid 32 and name n and segid c) (resid 32 and name ca and segid c)
(resid 32 and name cb and segid c) (resid 32 and name cg and segid c) 1.0 180.0 25.0 2
ASSIGN (resid 33 and name n and segid c) (resid 33 and name ca and segid c)
(resid 33 and name cb and segid c) (resid 33 and name cg and segid c) 1.0 180.0 25.0 2
ASSIGN (resid 34 and name n and segid c) (resid 34 and name ca and segid c)
(resid 34 and name cb and segid c) (resid 34 and name cg and segid c) 1.0 -60.0 25.0 2
!chi2
ASSIGN (resid 6 and name n and segid c) (resid 6 and name ca and segid c)
(resid 6 and name cb and segid c) (resid 6 and name cg and segid c) 1.0 -60.0 25.0 2
assign (resid 12 and name ca and segid c) (resid 12 and name cb and segid c)
(resid 12 and name cg and segid c) (resid 12 and name cd1 and segid c) 1.0 60.0 25.0 2
assign (resid 14 and name ca and segid c) (resid 14 and name cb and segid c)
(resid 14 and name cg1 and segid c) (resid 14 and name cd1 and segid c) 1.0 180.0 25.0 2
assign (resid 22 and name ca and segid c) (resid 22 and name cb and segid c)
(resid 22 and name cg and segid c) (resid 22 and name sd and segid c) 1.0 180.0 25.0 2
assign (resid 26 and name ca and segid c) (resid 26 and name cb and segid c)
(resid 26 and name cg and segid c) (resid 26 and name cd1 and segid c) 1.0 180.0 25.0 2
assign (resid 30 and name ca and segid c) (resid 30 and name cb and segid c)
(resid 30 and name cg and segid c) (resid 30 and name cd1 and segid c) 1.0 180.0 25.0 2
!chi2 aromatic
assign (resid 9 and name ca and segid c) (resid 9 and name cb and segid c)
(resid 9 and name cg and segid c) (resid 9 and name cd1 and segid c) 1.0 90.0 50.0 2
assign (resid 10 and name ca and segid c) (resid 10 and name cb and segid c)
(resid 10 and name cg and segid c) (resid 10 and name cd1 and segid c) 1.0 90.0 50.0 2
assign (resid 20 and name ca and segid c) (resid 20 and name cb and segid c)
(resid 20 and name cg and segid c) (resid 20 and name cd1 and segid c) 1.0 90.0 50.0 2
assign (resid 23 and name ca and segid c) (resid 23 and name cb and segid c)
(resid 23 and name cg and segid c) (resid 23 and name cd1 and segid c) 1.0 90.0 50.0 2
!phi
assign (resid 4 and name c and segid d) (resid 5 and name n and segid d)
(resid 5 and name ca and segid d) (resid 5 and name c and segid d) 1.0 -80.0 10.0 2
assign (resid 5 and name c and segid d) (resid 6 and name n and segid d)
(resid 6 and name ca and segid d) (resid 6 and name c and segid d) 1.0 -80.0 10.0 2
assign (resid 6 and name c and segid d) (resid 7 and name n and segid d)
(resid 7 and name ca and segid d) (resid 7 and name c and segid d) 1.0 -70.0 15.0 2
assign (resid 7 and name c and segid d) (resid 8 and name n and segid d)
(resid 8 and name ca and segid d) (resid 8 and name c and segid d) 1.0 -58.0 10.0 2
assign (resid 8 and name c and segid d) (resid 9 and name n and segid d)
(resid 9 and name ca and segid d) (resid 9 and name c and segid d) 1.0 -95.0 15.0 2
assign (resid 9 and name c and segid d) (resid 10 and name n and segid d)
(resid 10 and name ca and segid d) (resid 10 and name c and segid d) 1.0 -135.0 10.0 2
assign (resid 10 and name c and segid d) (resid 11 and name n and segid d)
(resid 11 and name ca and segid d) (resid 11 and name c and segid d) 1.0 -120.0 40.0 2
assign (resid 11 and name c and segid d) (resid 12 and name n and segid d)
(resid 12 and name ca and segid d) (resid 12 and name c and segid d) 1.0 -120.0 40.0 2
assign (resid 12 and name c and segid d) (resid 13 and name n and segid d)
(resid 13 and name ca and segid d) (resid 13 and name c and segid d) 1.0 -82.0 10.0 2
assign (resid 13 and name c and segid d) (resid 14 and name n and segid d)
(resid 14 and name ca and segid d) (resid 14 and name c and segid d) 1.0 -93.0 30.0 2
assign (resid 14 and name c and segid d) (resid 15 and name n and segid d)
(resid 15 and name ca and segid d) (resid 15 and name c and segid d) 1.0 -72.0 25.0 2
assign (resid 15 and name c and segid d) (resid 16 and name n and segid d)
(resid 16 and name ca and segid d) (resid 16 and name c and segid d) 1.0 100.0 30.0 2
assign (resid 16 and name c and segid d) (resid 17 and name n and segid d)
(resid 17 and name ca and segid d) (resid 17 and name c and segid d) 1.0 -60.0 25.0 2
assign (resid 17 and name c and segid d) (resid 18 and name n and segid d)
(resid 18 and name ca and segid d) (resid 18 and name c and segid d) 1.0 -58.0 10.0 2
assign (resid 18 and name c and segid d) (resid 19 and name n and segid d)
(resid 19 and name ca and segid d) (resid 19 and name c and segid d) 1.0 -62.0 10.0 2
assign (resid 19 and name c and segid d) (resid 20 and name n and segid d)
(resid 20 and name ca and segid d) (resid 20 and name c and segid d) 1.0 -55.0 10.0 2
assign (resid 20 and name c and segid d) (resid 21 and name n and segid d)
(resid 21 and name ca and segid d) (resid 21 and name c and segid d) 1.0 -50.0 10.0 2
assign (resid 21 and name c and segid d) (resid 22 and name n and segid d)
(resid 22 and name ca and segid d) (resid 22 and name c and segid d) 1.0 -62.0 10.0 2
assign (resid 22 and name c and segid d) (resid 23 and name n and segid d)
(resid 23 and name ca and segid d) (resid 23 and name c and segid d) 1.0 -60.0 10.0 2
assign (resid 23 and name c and segid d) (resid 24 and name n and segid d)
(resid 24 and name ca and segid d) (resid 24 and name c and segid d) 1.0 -48.0 10.0 2
assign (resid 24 and name c and segid d) (resid 25 and name n and segid d)
(resid 25 and name ca and segid d) (resid 25 and name c and segid d) 1.0 -59.0 10.0 2
assign (resid 25 and name c and segid d) (resid 26 and name n and segid d)
(resid 26 and name ca and segid d) (resid 26 and name c and segid d) 1.0 -62.0 10.0 2
assign (resid 26 and name c and segid d) (resid 27 and name n and segid d)
(resid 27 and name ca and segid d) (resid 27 and name c and segid d) 1.0 -58.0 10.0 2
assign (resid 27 and name c and segid d) (resid 28 and name n and segid d)
(resid 28 and name ca and segid d) (resid 28 and name c and segid d) 1.0 -61.0 10.0 2
assign (resid 28 and name c and segid d) (resid 29 and name n and segid d)
(resid 29 and name ca and segid d) (resid 29 and name c and segid d) 1.0 -58.0 10.0 2
assign (resid 29 and name c and segid d) (resid 30 and name n and segid d)
(resid 30 and name ca and segid d) (resid 30 and name c and segid d) 1.0 -61.0 10.0 2
assign (resid 30 and name c and segid d) (resid 31 and name n and segid d)
(resid 31 and name ca and segid d) (resid 31 and name c and segid d) 1.0 -58.0 10.0 2
assign (resid 31 and name c and segid d) (resid 32 and name n and segid d)
(resid 32 and name ca and segid d) (resid 32 and name c and segid d) 1.0 -62.0 10.0 2
assign (resid 32 and name c and segid d) (resid 33 and name n and segid d)
(resid 33 and name ca and segid d) (resid 33 and name c and segid d) 1.0 -60.0 10.0 2
assign (resid 33 and name c and segid d) (resid 34 and name n and segid d)
(resid 34 and name ca and segid d) (resid 34 and name c and segid d) 1.0 -55.0 10.0 2
assign (resid 34 and name c and segid d) (resid 35 and name n and segid d)
(resid 35 and name ca and segid d) (resid 35 and name c and segid d) 1.0 -68.0 10.0 2
assign (resid 35 and name c and segid d) (resid 36 and name n and segid d)
(resid 36 and name ca and segid d) (resid 36 and name c and segid d) 1.0 -80.0 10.0 2
assign (resid 36 and name c and segid d) (resid 37 and name n and segid d)
(resid 37 and name ca and segid d) (resid 37 and name c and segid d) 1.0 -70.0 10.0 2
assign (resid 37 and name c and segid d) (resid 38 and name n and segid d)
(resid 38 and name ca and segid d) (resid 38 and name c and segid d) 1.0 -60.0 25.0 2
assign (resid 38 and name c and segid d) (resid 39 and name n and segid d)
(resid 39 and name ca and segid d) (resid 39 and name c and segid d) 1.0 -85.0 10.0 2
assign (resid 39 and name c and segid d) (resid 40 and name n and segid d)
(resid 40 and name ca and segid d) (resid 40 and name c and segid d) 1.0 -50.0 10.0 2
!chi1
ASSIGN (resid 5 and name n and segid d) (resid 5 and name ca and segid d)
(resid 5 and name cb and segid d) (resid 5 and name cg and segid d) 1.0 -60.0 25.0 2
assign (resid 8 and name n and segid d) (resid 8 and name ca and segid d)
(resid 8 and name cb and segid d) (resid 8 and name cg and segid d) 1.0 -60.0 25.0 2
assign (resid 9 and name n and segid d) (resid 9 and name ca and segid d)
(resid 9 and name cb and segid d) (resid 9 and name cg and segid d) 1.0 -60.0 25.0 2
assign (resid 10 and name n and segid d) (resid 10 and name ca and segid d)
(resid 10 and name cb and segid d) (resid 10 and name cg and segid d) 1.0 -60.0 25.0 2
assign (resid 11 and name n and segid d) (resid 11 and name ca and segid d)
(resid 11 and name cb and segid d)(resid 11 and name og1 and segid d) 1.0 60.0 25.0 2
assign (resid 12 and name n and segid d) (resid 12 and name ca and segid d)
(resid 12 and name cb and segid d) (resid 12 and name cg and segid d) 1.0 180.0 25.0 2
ASSIGN (resid 13 and name n and segid d) (resid 13 and name ca and segid d)
(resid 13 and name cb and segid d) (resid 13 and name cg and segid d) 1.0 180.0 25.0 2
assign (resid 14 and name n and segid d) (resid 14 and name ca and segid d)
(resid 14 and name cb and segid d) (resid 14 and name cg1 and segid d) 1.0 -60.0 25.0 2
assign (resid 15 and name n and segid d) (resid 15 and name ca and segid d)
(resid 15 and name cb and segid d) (resid 15 and name cg and segid d) 1.0 180.0 25.0 2
ASSIGN (resid 17 and name n and segid d) (resid 17 and name ca and segid d)
(resid 17 and name cb and segid d) (resid 17 and name cg and segid d) 1.0 180.0 25.0 2
assign (resid 19 and name n and segid d) (resid 19 and name ca and segid d)
(resid 19 and name cb and segid d) (resid 19 and name cg and segid d) 1.0 -180.0 25.0 2
assign (resid 20 and name n and segid d) (resid 20 and name ca and segid d)
(resid 20 and name cb and segid d) (resid 20 and name cg and segid d) 1.0 180.0 25.0 2
ASSIGN (resid 21 and name n and segid d) (resid 21 and name ca and segid d)
(resid 21 and name cb and segid d) (resid 21 and name cg and segid d) 1.0 -60.0 25.0 2
assign (resid 22 and name n and segid d) (resid 22 and name ca and segid d)
(resid 22 and name cb and segid d) (resid 22 and name cg and segid d) 1.0 180.0 25.0 2
assign (resid 23 and name n and segid d) (resid 23 and name ca and segid d)
(resid 23 and name cb and segid d) (resid 23 and name cg and segid d) 1.0 -60.0 25.0 2
ASSIGN (resid 24 and name n and segid d) (resid 24 and name ca and segid d)
(resid 24 and name cb and segid d) (resid 24 and name cg and segid d) 1.0 180.0 25.0 2
ASSIGN (resid 26 and name n and segid d) (resid 26 and name ca and segid d)
(resid 26 and name cb and segid d) (resid 26 and name cg and segid d) 1.0 -60.0 25.0 2
assign (resid 27 and name n and segid d) (resid 27 and name ca and segid d)
(resid 27 and name cb and segid d) (resid 27 and name cg and segid d) 1.0 180.0 25.0 2
assign (resid 30 and name n and segid d) (resid 30 and name ca and segid d)
(resid 30 and name cb and segid d) (resid 30 and name cg and segid d) 1.0 -60.0 25.0 2
ASSIGN (resid 31 and name n and segid d) (resid 31 and name ca and segid d)
(resid 31 and name cb and segid d) (resid 31 and name cg and segid d) 1.0 -60.0 25.0 2
assign (resid 32 and name n and segid d) (resid 32 and name ca and segid d)
(resid 32 and name cb and segid d) (resid 32 and name cg and segid d) 1.0 180.0 25.0 2
ASSIGN (resid 33 and name n and segid d) (resid 33 and name ca and segid d)
(resid 33 and name cb and segid d) (resid 33 and name cg and segid d) 1.0 180.0 25.0 2
ASSIGN (resid 34 and name n and segid d) (resid 34 and name ca and segid d)
(resid 34 and name cb and segid d) (resid 34 and name cg and segid d) 1.0 -60.0 25.0 2
!chi2
ASSIGN (resid 6 and name n and segid d) (resid 6 and name ca and segid d)
(resid 6 and name cb and segid d) (resid 6 and name cg and segid d) 1.0 -60.0 25.0 2
assign (resid 12 and name ca and segid d) (resid 12 and name cb and segid d)
(resid 12 and name cg and segid d) (resid 12 and name cd1 and segid d) 1.0 60.0 25.0 2
assign (resid 14 and name ca and segid d) (resid 14 and name cb and segid d)
(resid 14 and name cg1 and segid d) (resid 14 and name cd1 and segid d) 1.0 180.0 25.0 2
assign (resid 22 and name ca and segid d) (resid 22 and name cb and segid d)
(resid 22 and name cg and segid d) (resid 22 and name sd and segid d) 1.0 180.0 25.0 2
assign (resid 26 and name ca and segid d) (resid 26 and name cb and segid d)
(resid 26 and name cg and segid d) (resid 26 and name cd1 and segid d) 1.0 180.0 25.0 2
assign (resid 30 and name ca and segid d) (resid 30 and name cb and segid d)
(resid 30 and name cg and segid d) (resid 30 and name cd1 and segid d) 1.0 180.0 25.0 2
!chi2 aromatic
assign (resid 9 and name ca and segid d) (resid 9 and name cb and segid d)
(resid 9 and name cg and segid d) (resid 9 and name cd1 and segid d) 1.0 90.0 50.0 2
assign (resid 10 and name ca and segid d) (resid 10 and name cb and segid d)
(resid 10 and name cg and segid d) (resid 10 and name cd1 and segid d) 1.0 90.0 50.0 2
assign (resid 20 and name ca and segid d) (resid 20 and name cb and segid d)
(resid 20 and name cg and segid d) (resid 20 and name cd1 and segid d) 1.0 90.0 50.0 2
assign (resid 23 and name ca and segid d) (resid 23 and name cb and segid d)
(resid 23 and name cg and segid d) (resid 23 and name cd1 and segid d) 1.0 90.0 50.0 2
!chi2 and chi3 for met22
assign (resid 22 and name ca and segid a) (resid 22 and name cb and segid a)
(resid 22 and name cg and segid a) (resid 22 and name sd and segid a) 1.0 180.0 30.0 2
assign (resid 22 and name cb and segid a) (resid 22 and name cg and segid a)
(resid 22 and name sd and segid a) (resid 22 and name sd and segid a) 1.0 90.0 30.0 2
assign (resid 22 and name ca and segid b) (resid 22 and name cb and segid b)
(resid 22 and name cg and segid b) (resid 22 and name sd and segid b) 1.0 180.0 30.0 2
assign (resid 22 and name cb and segid b) (resid 22 and name cg and segid b)
(resid 22 and name sd and segid b) (resid 22 and name sd and segid b) 1.0 90.0 30.0 2
assign (resid 22 and name ca and segid c) (resid 22 and name cb and segid c)
(resid 22 and name cg and segid c) (resid 22 and name sd and segid c) 1.0 180.0 30.0 2
assign (resid 22 and name cb and segid c) (resid 22 and name cg and segid c)
(resid 22 and name sd and segid c) (resid 22 and name sd and segid c) 1.0 90.0 30.0 2
assign (resid 22 and name ca and segid d) (resid 22 and name cb and segid d)
(resid 22 and name cg and segid d) (resid 22 and name sd and segid d) 1.0 180.0 30.0 2
assign (resid 22 and name cb and segid d) (resid 22 and name cg and segid d)
(resid 22 and name sd and segid d) (resid 22 and name sd and segid d) 1.0 90.0 30.0 2
end
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