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 |
|
|
23224 |
2jub   |
15438 | cing | 1-original | 5 | XPLOR/CNS | dihedral angle |
! Dihedral angles for ip1 obtained from TALOS.
! TALOS angles for ip1 in usr/local/nmrpipe2/talos
! Dihedral and TALOS values agree unless otherwise stated
!L3 phi
assign (segid="ip1" and resid 2 and name c)
(segid="ip1" and resid 3 and name n)
(segid="ip1" and resid 3 and name ca)
(segid="ip1" and resid 3 and name c) 1 -60.2 20.0 2
!L3 psi
assign (segid="ip1" and resid 3 and name n)
(segid="ip1" and resid 3 and name ca)
(segid="ip1" and resid 3 and name c)
(segid="ip1" and resid 4 and name n) 1 -40.0 15.0 2
!T4 phi
assign (segid="ip1" and resid 3 and name c)
(segid="ip1" and resid 4 and name n)
(segid="ip1" and resid 4 and name ca)
(segid="ip1" and resid 4 and name c) 1 -62.09 20.0 2
!T4 psi
assign (segid="ip1" and resid 4 and name n)
(segid="ip1" and resid 4 and name ca)
(segid="ip1" and resid 4 and name c)
(segid="ip1" and resid 5 and name n) 1 -44.7 15.0 2
!S5 phi
assign (segid="ip1" and resid 4 and name c)
(segid="ip1" and resid 5 and name n)
(segid="ip1" and resid 5 and name ca)
(segid="ip1" and resid 5 and name c) 1 -60.81 20.0 2
!S5 psi
assign (segid="ip1" and resid 5 and name n)
(segid="ip1" and resid 5 and name ca)
(segid="ip1" and resid 5 and name c)
(segid="ip1" and resid 6 and name n) 1 -40.0 15.0 2
!E6 phi
assign (segid="ip1" and resid 5 and name c)
(segid="ip1" and resid 6 and name n)
(segid="ip1" and resid 6 and name ca)
(segid="ip1" and resid 6 and name c) 1 -69.36 20.0 2
!E6 psi
assign (segid="ip1" and resid 6 and name n)
(segid="ip1" and resid 6 and name ca)
(segid="ip1" and resid 6 and name c)
(segid="ip1" and resid 7 and name n) 1 -40.0 15.0 2
!V7 phi
assign (segid="ip1" and resid 6 and name c)
(segid="ip1" and resid 7 and name n)
(segid="ip1" and resid 7 and name ca)
(segid="ip1" and resid 7 and name c) 1 -64.13 20.0 2
!V7 psi
assign (segid="ip1" and resid 7 and name n)
(segid="ip1" and resid 7 and name ca)
(segid="ip1" and resid 7 and name c)
(segid="ip1" and resid 8 and name n) 1 -40 15.0 2
!I8 phi
assign (segid="ip1" and resid 7 and name c)
(segid="ip1" and resid 8 and name n)
(segid="ip1" and resid 8 and name ca)
(segid="ip1" and resid 8 and name c) 1 -61.68 20.0 2
!I8 psi
assign (segid="ip1" and resid 8 and name n)
(segid="ip1" and resid 8 and name ca)
(segid="ip1" and resid 8 and name c)
(segid="ip1" and resid 9 and name n) 1 -40 15.0 2
!K9 phi
assign (segid="ip1" and resid 8 and name c)
(segid="ip1" and resid 9 and name n)
(segid="ip1" and resid 9 and name ca)
(segid="ip1" and resid 9 and name c) 1 -61.99 20.0 2
!K9 psi
assign (segid="ip1" and resid 9 and name n)
(segid="ip1" and resid 9 and name ca)
(segid="ip1" and resid 9 and name c)
(segid="ip1" and resid 10 and name n) 1 -40 15.0 2
!A10 phi
assign (segid="ip1" and resid 9 and name c)
(segid="ip1" and resid 10 and name n)
(segid="ip1" and resid 10 and name ca)
(segid="ip1" and resid 10 and name c) 1 -69.01 20.0 2
!A10 psi
assign (segid="ip1" and resid 10 and name n)
(segid="ip1" and resid 10 and name ca)
(segid="ip1" and resid 10 and name c)
(segid="ip1" and resid 11 and name n) 1 -40 20.0 2
!P18 phi
assign (segid="ip1" and resid 17 and name c)
(segid="ip1" and resid 18 and name n)
(segid="ip1" and resid 18 and name ca)
(segid="ip1" and resid 18 and name c) 1 -60.01 40.0 2
!P18 psi
!assign (segid="ip1" and resid 18 and name n)
!(segid="ip1" and resid 18 and name ca)
!(segid="ip1" and resid 18 and name c)
!(segid="ip1" and resid 19 and name n) 1 144.51 15.0 2
!M19 phi
assign (segid="ip1" and resid 18 and name c)
(segid="ip1" and resid 19 and name n)
(segid="ip1" and resid 19 and name ca)
(segid="ip1" and resid 19 and name c) 1 -106.44 40.0 2
!M19 psi
assign (segid="ip1" and resid 19 and name n)
(segid="ip1" and resid 19 and name ca)
(segid="ip1" and resid 19 and name c)
(segid="ip1" and resid 20 and name n) 1 140 40.0 2
!I20 phi
assign (segid="ip1" and resid 19 and name c)
(segid="ip1" and resid 20 and name n)
(segid="ip1" and resid 20 and name ca)
(segid="ip1" and resid 20 and name c) 1 -106.3 40.0 2
!I20 psi
assign (segid="ip1" and resid 20 and name n)
(segid="ip1" and resid 20 and name ca)
(segid="ip1" and resid 20 and name c)
(segid="ip1" and resid 21 and name n) 1 140 40.0 2
!S21 phi
assign (segid="ip1" and resid 20 and name c)
(segid="ip1" and resid 21 and name n)
(segid="ip1" and resid 21 and name ca)
(segid="ip1" and resid 21 and name c) 1 -88 40.0 2
!S21 psi
assign (segid="ip1" and resid 21 and name n)
(segid="ip1" and resid 21 and name ca)
(segid="ip1" and resid 21 and name c)
(segid="ip1" and resid 22 and name n) 1 140 40.0 2
!E26 phi
assign (segid="ip1" and resid 25 and name c)
(segid="ip1" and resid 26 and name n)
(segid="ip1" and resid 26 and name ca)
(segid="ip1" and resid 26 and name c) 1 -113.5 40.0 2
!E26 psi
assign (segid="ip1" and resid 26 and name n)
(segid="ip1" and resid 26 and name ca)
(segid="ip1" and resid 26 and name c)
(segid="ip1" and resid 27 and name n) 1 140 40.0 2
!E27 phi
assign (segid="ip1" and resid 26 and name c)
(segid="ip1" and resid 27 and name n)
(segid="ip1" and resid 27 and name ca)
(segid="ip1" and resid 27 and name c) 1 -88 40.0 2
!E27 psi
assign (segid="ip1" and resid 27 and name n)
(segid="ip1" and resid 27 and name ca)
(segid="ip1" and resid 27 and name c)
(segid="ip1" and resid 28 and name n) 1 140 40.0 2
!I28 phi
assign (segid="ip1" and resid 27 and name c)
(segid="ip1" and resid 28 and name n)
(segid="ip1" and resid 28 and name ca)
(segid="ip1" and resid 28 and name c) 1 -101 40.0 2
!G30 phi
!assign (segid="ip1" and resid 29 and name c)
!(segid="ip1" and resid 30 and name n)
!(segid="ip1" and resid 30 and name ca)
!(segid="ip1" and resid 30 and name c) 1 85.7 20.0 2
!T31 phi
assign (segid="ip1" and resid 30 and name c)
(segid="ip1" and resid 31 and name n)
(segid="ip1" and resid 31 and name ca)
(segid="ip1" and resid 31 and name c) 1 -131.68 20.0 2
!T31 psi
!assign (segid="ip1" and resid 31 and name n)
!(segid="ip1" and resid 31 and name ca)
!(segid="ip1" and resid 31 and name c)
!(segid="ip1" and resid 32 and name n) 1 163.25 15.0 2
!V32 phi
assign (segid="ip1" and resid 31 and name c)
(segid="ip1" and resid 32 and name n)
(segid="ip1" and resid 32 and name ca)
(segid="ip1" and resid 32 and name c) 1 -139.18 20.0 2
!V32 psi
!assign (segid="ip1" and resid 32 and name n)
!(segid="ip1" and resid 32 and name ca)
!(segid="ip1" and resid 32 and name c)
!(segid="ip1" and resid 33 and name n) 1 144.26 15.0 2
!W38 psi
assign (segid="ip1" and resid 38 and name n)
(segid="ip1" and resid 38 and name ca)
(segid="ip1" and resid 38 and name c)
(segid="ip1" and resid 39 and name n) 1 140 40.0 2
!S39 phi
assign (segid="ip1" and resid 38 and name c)
(segid="ip1" and resid 39 and name n)
(segid="ip1" and resid 39 and name ca)
(segid="ip1" and resid 39 and name c) 1 -134.9 40.0 2
!S39 psi
assign (segid="ip1" and resid 39 and name n)
(segid="ip1" and resid 39 and name ca)
(segid="ip1" and resid 39 and name c)
(segid="ip1" and resid 40 and name n) 1 140 40.0 2
!A40 phi
assign (segid="ip1" and resid 39 and name c)
(segid="ip1" and resid 40 and name n)
(segid="ip1" and resid 40 and name ca)
(segid="ip1" and resid 40 and name c) 1 -143.8 40.0 2
!A40 psi
assign (segid="ip1" and resid 40 and name n)
(segid="ip1" and resid 40 and name ca)
(segid="ip1" and resid 40 and name c)
(segid="ip1" and resid 41 and name n) 1 140 40.0 2
!K41 phi
assign (segid="ip1" and resid 40 and name c)
(segid="ip1" and resid 41 and name n)
(segid="ip1" and resid 41 and name ca)
(segid="ip1" and resid 41 and name c) 1 -141.6 40.0 2
!K41 psi
assign (segid="ip1" and resid 41 and name n)
(segid="ip1" and resid 41 and name ca)
(segid="ip1" and resid 41 and name c)
(segid="ip1" and resid 42 and name n) 1 140 40.0 2
!K42 phi
assign (segid="ip1" and resid 41 and name c)
(segid="ip1" and resid 42 and name n)
(segid="ip1" and resid 42 and name ca)
(segid="ip1" and resid 42 and name c) 1 -106.6 40.0 2
!K42 psi
assign (segid="ip1" and resid 42 and name n)
(segid="ip1" and resid 42 and name ca)
(segid="ip1" and resid 42 and name c)
(segid="ip1" and resid 43 and name n) 1 140 40.00 2
!D43 phi
assign (segid="ip1" and resid 42 and name c)
(segid="ip1" and resid 43 and name n)
(segid="ip1" and resid 43 and name ca)
(segid="ip1" and resid 43 and name c) 1 -113.7 20.0 2
!T46 psi may not be part of beta sheet- not hydrogen bonded, but talos values fit
assign (segid="ip1" and resid 46 and name n)
(segid="ip1" and resid 46 and name ca)
(segid="ip1" and resid 46 and name c)
(segid="ip1" and resid 47 and name n) 1 140 40.0 2
!I47 phi
assign (segid="ip1" and resid 46 and name c)
(segid="ip1" and resid 47 and name n)
(segid="ip1" and resid 47 and name ca)
(segid="ip1" and resid 47 and name c) 1 -109.76 40.0 2
!I47 psi
assign (segid="ip1" and resid 47 and name n)
(segid="ip1" and resid 47 and name ca)
(segid="ip1" and resid 47 and name c)
(segid="ip1" and resid 48 and name n) 1 140 40.0 2
!V48 phi
assign (segid="ip1" and resid 47 and name c)
(segid="ip1" and resid 48 and name n)
(segid="ip1" and resid 48 and name ca)
(segid="ip1" and resid 48 and name c) 1 -105.44 40.0 2
!V48 psi
assign (segid="ip1" and resid 48 and name n)
(segid="ip1" and resid 48 and name ca)
(segid="ip1" and resid 48 and name c)
(segid="ip1" and resid 49 and name n) 1 140 40.0 2
!I49 phi
assign (segid="ip1" and resid 48 and name c)
(segid="ip1" and resid 49 and name n)
(segid="ip1" and resid 49 and name ca)
(segid="ip1" and resid 49 and name c) 1 -116.74 40.0 2
!I49 psi
assign (segid="ip1" and resid 49 and name n)
(segid="ip1" and resid 49 and name ca)
(segid="ip1" and resid 49 and name c)
(segid="ip1" and resid 50 and name n) 1 140 40.0 2
!S50 phi
assign (segid="ip1" and resid 49 and name c)
(segid="ip1" and resid 50 and name n)
(segid="ip1" and resid 50 and name ca)
(segid="ip1" and resid 50 and name c) 1 -112.15 40.0 2
!S50 psi
assign (segid="ip1" and resid 50 and name n)
(segid="ip1" and resid 50 and name ca)
(segid="ip1" and resid 50 and name c)
(segid="ip1" and resid 51 and name n) 1 140 40.0 2
!A52 phi
assign (segid="ip1" and resid 51 and name c)
(segid="ip1" and resid 52 and name n)
(segid="ip1" and resid 52 and name ca)
(segid="ip1" and resid 52 and name c) 1 -82.6 25.0 2
!E53 phi
assign (segid="ip1" and resid 52 and name c)
(segid="ip1" and resid 53 and name n)
(segid="ip1" and resid 53 and name ca)
(segid="ip1" and resid 53 and name c) 1 -140.58 40.0 2
!E53 psi
assign (segid="ip1" and resid 53 and name n)
(segid="ip1" and resid 53 and name ca)
(segid="ip1" and resid 53 and name c)
(segid="ip1" and resid 54 and name n) 1 154.55 40.0 2
!T55 phi
assign (segid="ip1" and resid 54 and name c)
(segid="ip1" and resid 55 and name n)
(segid="ip1" and resid 55 and name ca)
(segid="ip1" and resid 55 and name c) 1 -108.42 25.0 2
!L57 phi
assign (segid="ip1" and resid 56 and name c)
(segid="ip1" and resid 57 and name n)
(segid="ip1" and resid 57 and name ca)
(segid="ip1" and resid 57 and name c) 1 -85.56 25.0 2
!F58 phi
assign (segid="ip1" and resid 57 and name c)
(segid="ip1" and resid 58 and name n)
(segid="ip1" and resid 58 and name ca)
(segid="ip1" and resid 58 and name c) 1 -116.64 25.0 2
!K59 phi
assign (segid="ip1" and resid 58 and name c)
(segid="ip1" and resid 59 and name n)
(segid="ip1" and resid 59 and name ca)
(segid="ip1" and resid 59 and name c) 1 -126.24 40.0 2
!K59 psi
assign (segid="ip1" and resid 59 and name n)
(segid="ip1" and resid 59 and name ca)
(segid="ip1" and resid 59 and name c)
(segid="ip1" and resid 60 and name n) 1 136 40.0 2
!A60 phi
assign (segid="ip1" and resid 59 and name c)
(segid="ip1" and resid 60 and name n)
(segid="ip1" and resid 60 and name ca)
(segid="ip1" and resid 60 and name c) 1 -96 40.0 2
!A60 psi
assign (segid="ip1" and resid 60 and name n)
(segid="ip1" and resid 60 and name ca)
(segid="ip1" and resid 60 and name c)
(segid="ip1" and resid 61 and name n) 1 140 40.0 2
!K61 phi
assign (segid="ip1" and resid 60 and name c)
(segid="ip1" and resid 61 and name n)
(segid="ip1" and resid 61 and name ca)
(segid="ip1" and resid 61 and name c) 1 -116.57 40.0 2
!K61 psi
assign (segid="ip1" and resid 61 and name n)
(segid="ip1" and resid 61 and name ca)
(segid="ip1" and resid 61 and name c)
(segid="ip1" and resid 62 and name n) 1 134.1 40.0 2
!H62 phi
assign (segid="ip1" and resid 61 and name c)
(segid="ip1" and resid 62 and name n)
(segid="ip1" and resid 62 and name ca)
(segid="ip1" and resid 62 and name c) 1 -98.26 40.0 2
!H62 psi
assign (segid="ip1" and resid 62 and name n)
(segid="ip1" and resid 62 and name ca)
(segid="ip1" and resid 62 and name c)
(segid="ip1" and resid 63 and name n) 1 140 40.0 2
!I63 phi
assign (segid="ip1" and resid 62 and name c)
(segid="ip1" and resid 63 and name n)
(segid="ip1" and resid 63 and name ca)
(segid="ip1" and resid 63 and name c) 1 -128.99 40.0 2
!A65 phi
assign (segid="ip1" and resid 64 and name c)
(segid="ip1" and resid 65 and name n)
(segid="ip1" and resid 65 and name ca)
(segid="ip1" and resid 65 and name c) 1 -61.35 20.0 2
!A65 psi
assign (segid="ip1" and resid 65 and name n)
(segid="ip1" and resid 65 and name ca)
(segid="ip1" and resid 65 and name c)
(segid="ip1" and resid 66 and name n) 1 -40.0 15.0 2
!A66 phi
assign (segid="ip1" and resid 65 and name c)
(segid="ip1" and resid 66 and name n)
(segid="ip1" and resid 66 and name ca)
(segid="ip1" and resid 66 and name c) 1 -63.61 20.0 2
!A66 psi
assign (segid="ip1" and resid 66 and name n)
(segid="ip1" and resid 66 and name ca)
(segid="ip1" and resid 66 and name c)
(segid="ip1" and resid 67 and name n) 1 -40 15.0 2
!H67 phi
assign (segid="ip1" and resid 66 and name c)
(segid="ip1" and resid 67 and name n)
(segid="ip1" and resid 67 and name ca)
(segid="ip1" and resid 67 and name c) 1 -73.43 20.0 2
!H67 psi
assign (segid="ip1" and resid 67 and name n)
(segid="ip1" and resid 67 and name ca)
(segid="ip1" and resid 67 and name c)
(segid="ip1" and resid 68 and name n) 1 -40 15.0 2
!L68 phi
assign (segid="ip1" and resid 67 and name c)
(segid="ip1" and resid 68 and name n)
(segid="ip1" and resid 68 and name ca)
(segid="ip1" and resid 68 and name c) 1 -65.49 20.0 2
!L68 psi
assign (segid="ip1" and resid 68 and name n)
(segid="ip1" and resid 68 and name ca)
(segid="ip1" and resid 68 and name c)
(segid="ip1" and resid 69 and name n) 1 -40 15.0 2
!K69 phi
assign (segid="ip1" and resid 68 and name c)
(segid="ip1" and resid 69 and name n)
(segid="ip1" and resid 69 and name ca)
(segid="ip1" and resid 69 and name c) 1 -61.57 20.0 2
!K69 psi
assign (segid="ip1" and resid 69 and name n)
(segid="ip1" and resid 69 and name ca)
(segid="ip1" and resid 69 and name c)
(segid="ip1" and resid 70 and name n) 1 -40 15.0 2
!I70 phi
assign (segid="ip1" and resid 69 and name c)
(segid="ip1" and resid 70 and name n)
(segid="ip1" and resid 70 and name ca)
(segid="ip1" and resid 70 and name c) 1 -64.25 20.0 2
!I70 psi
assign (segid="ip1" and resid 70 and name n)
(segid="ip1" and resid 70 and name ca)
(segid="ip1" and resid 70 and name c)
(segid="ip1" and resid 71 and name n) 1 -40 15.0 2
!I71 phi
assign (segid="ip1" and resid 70 and name c)
(segid="ip1" and resid 71 and name n)
(segid="ip1" and resid 71 and name ca)
(segid="ip1" and resid 71 and name c) 1 -64 20.0 2
!I71 psi
assign (segid="ip1" and resid 71 and name n)
(segid="ip1" and resid 71 and name ca)
(segid="ip1" and resid 71 and name c)
(segid="ip1" and resid 72 and name n) 1 -40 15.0 2
!I72 phi
assign (segid="ip1" and resid 71 and name c)
(segid="ip1" and resid 72 and name n)
(segid="ip1" and resid 72 and name ca)
(segid="ip1" and resid 72 and name c) 1 -64 20.0 2
!A72 psi
assign (segid="ip1" and resid 72 and name n)
(segid="ip1" and resid 72 and name ca)
(segid="ip1" and resid 72 and name c)
(segid="ip1" and resid 73 and name n) 1 -40 15.0 2
!A73 phi
assign (segid="ip1" and resid 72 and name c)
(segid="ip1" and resid 73 and name n)
(segid="ip1" and resid 73 and name ca)
(segid="ip1" and resid 73 and name c) 1 -79.69 20.0 2
!K73 psi
assign (segid="ip1" and resid 73 and name n)
(segid="ip1" and resid 73 and name ca)
(segid="ip1" and resid 73 and name c)
(segid="ip1" and resid 74 and name n) 1 -40 15.0 2
!N74 phi bad fit in talos
assign (segid="ip1" and resid 73 and name c)
(segid="ip1" and resid 74 and name n)
(segid="ip1" and resid 74 and name ca)
(segid="ip1" and resid 74 and name c) 1 -60 20.0 2
!L75 phi bad fit in talos
assign (segid="ip1" and resid 74 and name c)
(segid="ip1" and resid 75 and name n)
(segid="ip1" and resid 75 and name ca)
(segid="ip1" and resid 75 and name c) 1 -60 20.0 2
!L75 psi
assign (segid="ip1" and resid 75 and name n)
(segid="ip1" and resid 75 and name ca)
(segid="ip1" and resid 75 and name c)
(segid="ip1" and resid 76 and name n) 1 -40 15.0 2
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