NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
604440 |
2na9   |
25932 | cing | 1-original | 1 | XPLOR/CNS | dihedral angle |
! Talos+, 2 sdtdev
assign (resid 6 and name c) (resid 7 and name n)
(resid 7 and name ca) (resid 7 and name c) 1.0 -58.0 10.0 2
assign (resid 7 and name n) (resid 7 and name ca)
(resid 7 and name c) (resid 8 and name n) 1.0 -37.0 18.0 2
assign (resid 7 and name c) (resid 8 and name n)
(resid 8 and name ca) (resid 8 and name c) 1.0 -61.0 10.0 2
assign (resid 8 and name n) (resid 8 and name ca)
(resid 8 and name c) (resid 9 and name n) 1.0 -43.0 12.0 2
assign (resid 8 and name c) (resid 9 and name n)
(resid 9 and name ca) (resid 9 and name c) 1.0 -62.0 8.0 2
assign (resid 9 and name n) (resid 9 and name ca)
(resid 9 and name c) (resid 10 and name n) 1.0 -42.0 14.0 2
assign (resid 9 and name c) (resid 10 and name n)
(resid 10 and name ca) (resid 10 and name c) 1.0 -65.7 9.5 2
assign (resid 10 and name n) (resid 10 and name ca)
(resid 10 and name c) (resid 11 and name n) 1.0 -42.8 9.3 2
assign (resid 10 and name c) (resid 11 and name n)
(resid 11 and name ca) (resid 11 and name c) 1.0 -64.0 8.0 2
assign (resid 11 and name n) (resid 11 and name ca)
(resid 11 and name c) (resid 12 and name n) 1.0 -43.0 10.0 2
assign (resid 11 and name c) (resid 12 and name n)
(resid 12 and name ca) (resid 12 and name c) 1.0 -60.0 10.0 2
assign (resid 12 and name n) (resid 12 and name ca)
(resid 12 and name c) (resid 13 and name n) 1.0 -43.0 12.0 2
assign (resid 12 and name c) (resid 13 and name n)
(resid 13 and name ca) (resid 13 and name c) 1.0 -63.3 9.4 2
assign (resid 13 and name n) (resid 13 and name ca)
(resid 13 and name c) (resid 14 and name n) 1.0 -43.1 12.3 2
assign (resid 13 and name c) (resid 14 and name n)
(resid 14 and name ca) (resid 14 and name c) 1.0 -63.7 8.0 2
assign (resid 14 and name n) (resid 14 and name ca)
(resid 14 and name c) (resid 15 and name n) 1.0 -43.4 14.1 2
assign (resid 14 and name c) (resid 15 and name n)
(resid 15 and name ca) (resid 15 and name c) 1.0 -65.4 7.2 2
assign (resid 15 and name n) (resid 15 and name ca)
(resid 15 and name c) (resid 16 and name n) 1.0 -39.9 8.9 2
assign (resid 15 and name c) (resid 16 and name n)
(resid 16 and name ca) (resid 16 and name c) 1.0 -58.9 12.8 2
assign (resid 16 and name n) (resid 16 and name ca)
(resid 16 and name c) (resid 17 and name n) 1.0 -46.1 5.8 2
assign (resid 16 and name c) (resid 17 and name n)
(resid 17 and name ca) (resid 17 and name c) 1.0 -61.6 11.1 2
assign (resid 17 and name n) (resid 17 and name ca)
(resid 17 and name c) (resid 18 and name n) 1.0 -44.4 12.7 2
assign (resid 17 and name c) (resid 18 and name n)
(resid 18 and name ca) (resid 18 and name c) 1.0 -63.3 8.6 2
assign (resid 18 and name n) (resid 18 and name ca)
(resid 18 and name c) (resid 19 and name n) 1.0 -43.0 13.5 2
assign (resid 18 and name c) (resid 19 and name n)
(resid 19 and name ca) (resid 19 and name c) 1.0 -64.5 10.5 2
assign (resid 19 and name n) (resid 19 and name ca)
(resid 19 and name c) (resid 20 and name n) 1.0 -41.4 5.7 2
assign (resid 19 and name c) (resid 20 and name n)
(resid 20 and name ca) (resid 20 and name c) 1.0 -63.1 8.7 2
assign (resid 20 and name n) (resid 20 and name ca)
(resid 20 and name c) (resid 21 and name n) 1.0 -39.2 14.0 2
assign (resid 20 and name c) (resid 21 and name n)
(resid 21 and name ca) (resid 21 and name c) 1.0 -64.9 10.5 2
assign (resid 21 and name n) (resid 21 and name ca)
(resid 21 and name c) (resid 22 and name n) 1.0 -42.4 7.7 2
assign (resid 21 and name c) (resid 22 and name n)
(resid 22 and name ca) (resid 22 and name c) 1.0 -60.3 11.1 2
assign (resid 22 and name n) (resid 22 and name ca)
(resid 22 and name c) (resid 23 and name n) 1.0 -42.8 4.9 2
assign (resid 22 and name c) (resid 23 and name n)
(resid 23 and name ca) (resid 23 and name c) 1.0 -60.8 8.4 2
assign (resid 23 and name n) (resid 23 and name ca)
(resid 23 and name c) (resid 24 and name n) 1.0 -41.2 13.1 2
assign (resid 23 and name c) (resid 24 and name n)
(resid 24 and name ca) (resid 24 and name c) 1.0 -64.2 12.7 2
assign (resid 24 and name n) (resid 24 and name ca)
(resid 24 and name c) (resid 25 and name n) 1.0 -45.0 8.6 2
assign (resid 24 and name c) (resid 25 and name n)
(resid 25 and name ca) (resid 25 and name c) 1.0 -64.6 7.6 2
assign (resid 25 and name n) (resid 25 and name ca)
(resid 25 and name c) (resid 26 and name n) 1.0 -41.1 18.5 2
assign (resid 25 and name c) (resid 26 and name n)
(resid 26 and name ca) (resid 26 and name c) 1.0 -59.7 10.2 2
assign (resid 26 and name n) (resid 26 and name ca)
(resid 26 and name c) (resid 27 and name n) 1.0 -42.9 9.8 2
assign (resid 26 and name c) (resid 27 and name n)
(resid 27 and name ca) (resid 27 and name c) 1.0 -64.4 11.1 2
assign (resid 27 and name n) (resid 27 and name ca)
(resid 27 and name c) (resid 28 and name n) 1.0 -42.7 5.8 2
assign (resid 27 and name c) (resid 28 and name n)
(resid 28 and name ca) (resid 28 and name c) 1.0 -59.1 8.4 2
assign (resid 28 and name n) (resid 28 and name ca)
(resid 28 and name c) (resid 29 and name n) 1.0 -43.2 8.4 2
assign (resid 28 and name c) (resid 29 and name n)
(resid 29 and name ca) (resid 29 and name c) 1.0 -63.9 9.8 2
assign (resid 29 and name n) (resid 29 and name ca)
(resid 29 and name c) (resid 30 and name n) 1.0 -37.9 8.5 2
assign (resid 29 and name c) (resid 30 and name n)
(resid 30 and name ca) (resid 30 and name c) 1.0 -63.4 5.9 2
assign (resid 30 and name n) (resid 30 and name ca)
(resid 30 and name c) (resid 31 and name n) 1.0 -43.4 11.4 2
assign (resid 30 and name c) (resid 31 and name n)
(resid 31 and name ca) (resid 31 and name c) 1.0 -61.7 8.2 2
assign (resid 31 and name n) (resid 31 and name ca)
(resid 31 and name c) (resid 32 and name n) 1.0 -43.3 14.1 2
assign (resid 31 and name c) (resid 32 and name n)
(resid 32 and name ca) (resid 32 and name c) 1.0 -64.6 10.2 2
assign (resid 32 and name n) (resid 32 and name ca)
(resid 32 and name c) (resid 33 and name n) 1.0 -39.7 14.0 2
assign (resid 32 and name c) (resid 33 and name n)
(resid 33 and name ca) (resid 33 and name c) 1.0 -63.2 9.4 2
assign (resid 33 and name n) (resid 33 and name ca)
(resid 33 and name c) (resid 34 and name n) 1.0 -42.3 14.7 2
assign (resid 33 and name c) (resid 34 and name n)
(resid 34 and name ca) (resid 34 and name c) 1.0 -66.1 12.2 2
assign (resid 34 and name n) (resid 34 and name ca)
(resid 34 and name c) (resid 35 and name n) 1.0 -30.2 24.0 2
assign (resid 34 and name c) (resid 35 and name n)
(resid 35 and name ca) (resid 35 and name c) 1.0 -72.0 26.1 2
assign (resid 35 and name n) (resid 35 and name ca)
(resid 35 and name c) (resid 36 and name n) 1.0 -23.9 32.7 2
assign (resid 35 and name c) (resid 36 and name n)
(resid 36 and name ca) (resid 36 and name c) 1.0 -70.0 18.0 2
assign (resid 36 and name n) (resid 36 and name ca)
(resid 36 and name c) (resid 37 and name n) 1.0 -31.0 28.0 2
assign (resid 36 and name c) (resid 37 and name n)
(resid 37 and name ca) (resid 37 and name c) 1.0 -90.0 18.0 2
assign (resid 37 and name n) (resid 37 and name ca)
(resid 37 and name c) (resid 38 and name n) 1.0 -1.0 16.0 2
assign (resid 37 and name c) (resid 38 and name n)
(resid 38 and name ca) (resid 38 and name c) 1.0 77.0 32.0 2
assign (resid 38 and name n) (resid 38 and name ca)
(resid 38 and name c) (resid 39 and name n) 1.0 23.0 28.0 2
!---------- chi1 experimental ---------
! aromatic
assign (resid 5 and name N)
(resid 5 and name CA)
(resid 5 and name CB)
(resid 5 and name CG) 1.00 -60.000 30.000 2
assign (resid 7 and name N)
(resid 7 and name CA)
(resid 7 and name CB)
(resid 7 and name CG) 1.00 -60.000 60.000 2
assign (resid 14 and name N)
(resid 14 and name CA)
(resid 14 and name CB)
(resid 14 and name CG) 1.00 60.000 30.000 2
assign (resid 29 and name N)
(resid 29 and name CA)
(resid 29 and name CB)
(resid 29 and name CG) 1.00 -60.000 60.000 2
assign (resid 33 and name N)
(resid 33 and name CA)
(resid 33 and name CB)
(resid 33 and name CG) 1.00 180.000 60.000 2
assign (resid 41 and name N)
(resid 41 and name CA)
(resid 41 and name CB)
(resid 41 and name CG) 1.00 -60.000 60.000 2
! aliphatic
assign (resid 13 and name N)
(resid 13 and name CA)
(resid 13 and name CB)
(resid 13 and name CG) 1.00 -60.000 60.000 2
assign (resid 18 and name N)
(resid 18 and name CA)
(resid 18 and name CB)
(resid 18 and name CG) 1.00 -60.000 60.000 2
assign (resid 23 and name N)
(resid 23 and name CA)
(resid 23 and name CB)
(resid 23 and name CG) 1.00 -60.000 60.000 2
assign (resid 28 and name N)
(resid 28 and name CA)
(resid 28 and name CB)
(resid 28 and name CG) 1.00 -60.000 60.000 2
assign (resid 31 and name N)
(resid 31 and name CA)
(resid 31 and name CB)
(resid 31 and name CG) 1.00 60.000 60.000 2
assign (resid 36 and name N)
(resid 36 and name CA)
(resid 36 and name CB)
(resid 36 and name CG1) 1.00 180.000 60.000 2
!---------- chi1 empirical ---------
!W14 snorkel
assign (resid 14 and name CA)
(resid 14 and name CB)
(resid 14 and name CG)
(resid 14 and name CD1) 1.00 -120.000 30.000 2
!Phe22
assign (resid 22 and name N)
(resid 22 and name CA)
(resid 22 and name CB)
(resid 22 and name CG) 1.00 -60.000 30.000 2
assign (resid 22 and name CA)
(resid 22 and name CB)
(resid 22 and name CG)
(resid 22 and name CD1) 1.00 90.000 30.000 2
!Phe33
assign (resid 33 and name CA)
(resid 33 and name CB)
(resid 33 and name CG)
(resid 33 and name CD1) 1.00 90.000 30.000 2
!Arg 32, snorkel
assign (resid 32 and name N)
(resid 32 and name CA)
(resid 32 and name CB)
(resid 32 and name CG) 1.00 180.000 30.000 2
assign (resid 32 and name CA)
(resid 32 and name CB)
(resid 32 and name CG)
(resid 32 and name CD) 1.00 -60.000 30.000 2 ! Chi2 is adjusted to snorkel
Contact the webmaster for help, if required. Thursday, May 23, 2024 3:22:04 PM GMT (wattos1)