NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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|
604429 |
2na8   |
25931 | cing | 1-original | 1 | XPLOR/CNS | dihedral angle |
! Talos+, 2 stddev
assign (resid 9 and name c) (resid 10 and name n)
(resid 10 and name ca) (resid 10 and name c) 1.0 -78.0 30.0 2
assign (resid 10 and name n) (resid 10 and name ca)
(resid 10 and name c) (resid 11 and name n) 1.0 -25.0 34.0 2
assign (resid 10 and name c) (resid 11 and name n)
(resid 11 and name ca) (resid 11 and name c) 1.0 -85.0 56.0 2
assign (resid 11 and name n) (resid 11 and name ca)
(resid 11 and name c) (resid 12 and name n) 1.0 134.0 68.0 2
assign (resid 14 and name c) (resid 15 and name n)
(resid 15 and name ca) (resid 15 and name c) 1.0 -63.0 6.0 2
assign (resid 15 and name n) (resid 15 and name ca)
(resid 15 and name c) (resid 16 and name n) 1.0 -41.0 8.0 2
assign (resid 15 and name c) (resid 16 and name n)
(resid 16 and name ca) (resid 16 and name c) 1.0 -61.8 11.5 2
assign (resid 16 and name n) (resid 16 and name ca)
(resid 16 and name c) (resid 17 and name n) 1.0 -42.0 11.9 2
assign (resid 16 and name c) (resid 17 and name n)
(resid 17 and name ca) (resid 17 and name c) 1.0 -61.2 14.6 2
assign (resid 17 and name n) (resid 17 and name ca)
(resid 17 and name c) (resid 18 and name n) 1.0 -45.6 10.7 2
assign (resid 17 and name c) (resid 18 and name n)
(resid 18 and name ca) (resid 18 and name c) 1.0 -63.0 9.2 2
assign (resid 18 and name n) (resid 18 and name ca)
(resid 18 and name c) (resid 19 and name n) 1.0 -43.2 14.2 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 -63.5 7.7 2
assign (resid 20 and name n) (resid 20 and name ca)
(resid 20 and name c) (resid 21 and name n) 1.0 -39.8 16.1 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 -60.2 6.9 2
assign (resid 23 and name n) (resid 23 and name ca)
(resid 23 and name c) (resid 24 and name n) 1.0 -41.5 13.0 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 12.8 2
assign (resid 24 and name n) (resid 24 and name ca)
(resid 24 and name c) (resid 25 and name n) 1.0 -44.7 7.9 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 -59.0 7.7 2
assign (resid 26 and name n) (resid 26 and name ca)
(resid 26 and name c) (resid 27 and name n) 1.0 -42.6 9.9 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 -59.5 8.0 2
assign (resid 28 and name n) (resid 28 and name ca)
(resid 28 and name c) (resid 29 and name n) 1.0 -42.6 7.0 2
assign (resid 28 and name c) (resid 29 and name n)
(resid 29 and name ca) (resid 29 and name c) 1.0 -65.4 16.2 2
assign (resid 29 and name n) (resid 29 and name ca)
(resid 29 and name c) (resid 30 and name n) 1.0 -38.4 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 -62.5 6.2 2
assign (resid 30 and name n) (resid 30 and name ca)
(resid 30 and name c) (resid 31 and name n) 1.0 -43.7 10.5 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 -64.0 9.1 2
assign (resid 32 and name n) (resid 32 and name ca)
(resid 32 and name c) (resid 33 and name n) 1.0 -40.7 12.0 2
assign (resid 32 and name c) (resid 33 and name n)
(resid 33 and name ca) (resid 33 and name c) 1.0 -62.4 8.9 2
assign (resid 33 and name n) (resid 33 and name ca)
(resid 33 and name c) (resid 34 and name n) 1.0 -42.7 14.3 2
assign (resid 33 and name c) (resid 34 and name n)
(resid 34 and name ca) (resid 34 and name c) 1.0 -65.3 11.6 2
assign (resid 34 and name n) (resid 34 and name ca)
(resid 34 and name c) (resid 35 and name n) 1.0 -32.6 21.7 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 -69.9 18.5 2
assign (resid 36 and name n) (resid 36 and name ca)
(resid 36 and name c) (resid 37 and name n) 1.0 -31.1 27.7 2
assign (resid 36 and name c) (resid 37 and name n)
(resid 37 and name ca) (resid 37 and name c) 1.0 -88.7 16.3 2
assign (resid 37 and name n) (resid 37 and name ca)
(resid 37 and name c) (resid 38 and name n) 1.0 -2.2 15.3 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
! M13-W14 helical model
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 30.0 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 40.0 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 30.0 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 40.0 2
!---------- chi1 experimental ---------
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 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 28 and name N)
(resid 28 and name CA)
(resid 28 and name CB)
(resid 28 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 30.000 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 37 and name N)
(resid 37 and name CA)
(resid 37 and name CB)
(resid 37 and name CG) 1.00 -60.000 30.000 2
!---------- chi1 empirical ---------
!W14 snorkel
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 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 N)
(resid 33 and name CA)
(resid 33 and name CB)
(resid 33 and name CG) 1.00 180.000 30.000 2
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
!Tyr37
assign (resid 37 and name CA)
(resid 37 and name CB)
(resid 37 and name CG)
(resid 37 and name CD1) 1.00 90.000 30.000 2
!Lys 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
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