NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
513391 |
2kzy   |
17023 | cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
!! { Dihedral Angle Restraints }
!!phi C(i-1)-N(i)-CA(i)-C(i)
! S2
assign
(resid 1 and name C )
(resid 2 and name N )
(resid 2 and name CA )
(resid 2 and name C ) 1 -77.39 60.00 2
! M3
assign
(resid 2 and name C )
(resid 3 and name N )
(resid 3 and name CA )
(resid 3 and name C ) 1 -95.16 60.00 2
! A4
assign
(resid 3 and name C )
(resid 4 and name N )
(resid 4 and name CA )
(resid 4 and name C ) 1 -87.92 50.00 2
! Q5
assign
(resid 4 and name C )
(resid 5 and name N )
(resid 5 and name CA )
(resid 5 and name C ) 1 -87.35 50.00 2
! E6
assign
(resid 5 and name C )
(resid 6 and name N )
(resid 6 and name CA )
(resid 6 and name C ) 1 -92.50 50.00 2
! T7
assign
(resid 6 and name C )
(resid 7 and name N )
(resid 7 and name CA )
(resid 7 and name C ) 1 -95.60 50.00 2
! N8
assign
(resid 7 and name C )
(resid 8 and name N )
(resid 8 and name CA )
(resid 8 and name C ) 1 -81.33 50.00 2
! Q9
assign
(resid 8 and name C )
(resid 9 and name N )
(resid 9 and name CA )
(resid 9 and name C ) 1 -88.51 50.00 2
! T10
assign
(resid 9 and name C )
(resid 10 and name N )
(resid 10 and name CA )
(resid 10 and name C ) 1 -136.74 50.00 2
! P11
assign
(resid 10 and name C )
(resid 11 and name N )
(resid 11 and name CA )
(resid 11 and name C ) 1 -82.51 50.00 2
! G12
!assign
!(resid 11 and name C )
!(resid 12 and name N )
!(resid 12 and name CA )
!(resid 12 and name C ) 1 89.28 50.00 2
! P13
assign
(resid 12 and name C )
(resid 13 and name N )
(resid 13 and name CA )
(resid 13 and name C ) 1 -81.06 50.00 2
! M14
assign
(resid 13 and name C )
(resid 14 and name N )
(resid 14 and name CA )
(resid 14 and name C ) 1 -50.60 20.00 2
! L15
assign
(resid 14 and name C )
(resid 15 and name N )
(resid 15 and name CA )
(resid 15 and name C ) 1 -83.94 30.00 2
! C16
assign
(resid 15 and name C )
(resid 16 and name N )
(resid 16 and name CA )
(resid 16 and name C ) 1 -59.75 30.00 2
! S17
assign
(resid 16 and name C )
(resid 17 and name N )
(resid 17 and name CA )
(resid 17 and name C ) 1 -65.87 20.00 2
! T18
assign
(resid 17 and name C )
(resid 18 and name N )
(resid 18 and name CA )
(resid 18 and name C ) 1 -84.62 30.00 2
! G19
assign
(resid 18 and name C )
(resid 19 and name N )
(resid 19 and name CA )
(resid 19 and name C ) 1 80.00 20.00 2
! C20
assign
(resid 19 and name C )
(resid 20 and name N )
(resid 20 and name CA )
(resid 20 and name C ) 1 -56.17 30.00 2
! G21
assign
(resid 20 and name C )
(resid 21 and name N )
(resid 21 and name CA )
(resid 21 and name C ) 1 101.11 30.00 2
! F22
assign
(resid 21 and name C )
(resid 22 and name N )
(resid 22 and name CA )
(resid 22 and name C ) 1 -84.04 30.00 2
! Y23
assign
(resid 22 and name C )
(resid 23 and name N )
(resid 23 and name CA )
(resid 23 and name C ) 1 -70.20 25.00 2
! 24
assign
(resid 23 and name C )
(resid 24 and name N )
(resid 24 and name CA )
(resid 24 and name C ) 1 -90.20 40.00 2
! N25
assign
(resid 24 and name C )
(resid 25 and name N )
(resid 25 and name CA )
(resid 25 and name C ) 1 -120.68 20.00 2
! P26
assign
(resid 25 and name C )
(resid 26 and name N )
(resid 26 and name CA )
(resid 26 and name C ) 1 -60.00 15.00 2
! R27
assign
(resid 26 and name C )
(resid 27 and name N )
(resid 27 and name CA )
(resid 27 and name C ) 1 -75.04 15.00 2
! T28
assign
(resid 27 and name C )
(resid 28 and name N )
(resid 28 and name CA )
(resid 28 and name C ) 1 -77.67 20.00 2
! N29
assign
(resid 28 and name C )
(resid 29 and name N )
(resid 29 and name CA )
(resid 29 and name C ) 1 -75.97 13.00 2
! M31
assign
(resid 30 and name C )
(resid 31 and name N )
(resid 31 and name CA )
(resid 31 and name C ) 1 -129.88 30.00 2
! C32
assign
(resid 31 and name C )
(resid 32 and name N )
(resid 32 and name CA )
(resid 32 and name C ) 1 -76.97 30.00 2
! S33
assign
(resid 32 and name C )
(resid 33 and name N )
(resid 33 and name CA )
(resid 33 and name C ) 1 -60.00 15.00 2
! V34
assign
(resid 33 and name C )
(resid 34 and name N )
(resid 34 and name CA )
(resid 34 and name C ) 1 -62.95 10.00 2
! C35
assign
(resid 34 and name C )
(resid 35 and name N )
(resid 35 and name CA )
(resid 35 and name C ) 1 -62.38 10.00 2
! Y36
assign
(resid 35 and name C )
(resid 36 and name N )
(resid 36 and name CA )
(resid 36 and name C ) 1 -59.40 10.00 2
! K37
assign
(resid 36 and name C )
(resid 37 and name N )
(resid 37 and name CA )
(resid 37 and name C ) 1 -65.81 10.00 2
! E38
assign
(resid 37 and name C )
(resid 38 and name N )
(resid 38 and name CA )
(resid 38 and name C ) 1 -65.03 10.00 2
! H39
assign
(resid 38 and name C )
(resid 39 and name N )
(resid 39 and name CA )
(resid 39 and name C ) 1 -72.12 12.00 2
! L40
assign
(resid 39 and name C )
(resid 40 and name N )
(resid 40 and name CA )
(resid 40 and name C ) 1 -62.56 13.00 2
! Q41
assign
(resid 40 and name C )
(resid 41 and name N )
(resid 41 and name CA )
(resid 41 and name C ) 1 -65.37 13.00 2
! R42
assign
(resid 41 and name C )
(resid 42 and name N )
(resid 42 and name CA )
(resid 42 and name C ) 1 -63.37 30.00 2
! Q43
assign
(resid 42 and name C )
(resid 43 and name N )
(resid 43 and name CA )
(resid 43 and name C ) 1 -66.13 15.00 2
! Q44
assign
(resid 43 and name C )
(resid 44 and name N )
(resid 44 and name CA )
(resid 44 and name C ) 1 -60.72 20.00 2
! N45
assign
(resid 44 and name C )
(resid 45 and name N )
(resid 45 and name CA )
(resid 45 and name C ) 1 -60.92 50.00 2
! S46
assign
(resid 45 and name C )
(resid 46 and name N )
(resid 46 and name CA )
(resid 46 and name C ) 1 -90.37 50.00 2
! G47
assign
(resid 46 and name C )
(resid 47 and name N )
(resid 47 and name CA )
(resid 47 and name C ) 1 85.89 60.00 2
! R48
assign
(resid 47 and name C )
(resid 48 and name N )
(resid 48 and name CA )
(resid 48 and name C ) 1 -83.88 60.00 2
! M49
assign
(resid 48 and name C )
(resid 49 and name N )
(resid 49 and name CA )
(resid 49 and name C ) 1 -72.26 50.00 2
! S50
assign
(resid 49 and name C )
(resid 50 and name N )
(resid 50 and name CA )
(resid 50 and name C ) 1 -138.59 50.00 2
! P51
assign
(resid 50 and name C )
(resid 51 and name N )
(resid 51 and name CA )
(resid 51 and name C ) 1 -69.97 50.00 2
! M52
assign
(resid 51 and name C )
(resid 52 and name N )
(resid 52 and name CA )
(resid 52 and name C ) 1 -92.86 50.00 2
! G53
assign
(resid 52 and name C )
(resid 53 and name N )
(resid 53 and name CA )
(resid 53 and name C ) 1 95.15 50.00 2
! T54
assign
(resid 53 and name C )
(resid 54 and name N )
(resid 54 and name CA )
(resid 54 and name C ) 1 -95.04 50.00 2
! A55
assign
(resid 54 and name C )
(resid 55 and name N )
(resid 55 and name CA )
(resid 55 and name C ) 1 -85.21 60.00 2
! S56
assign
(resid 55 and name C )
(resid 56 and name N )
(resid 56 and name CA )
(resid 56 and name C ) 1 -92.13 60.00 2
! G57
assign
(resid 56 and name C )
(resid 57 and name N )
(resid 57 and name CA )
(resid 57 and name C ) 1 65.62 60.00 2
! S58
assign
(resid 57 and name C )
(resid 58 and name N )
(resid 58 and name CA )
(resid 58 and name C ) 1 -94.05 60.00 2
! N59
assign
(resid 58 and name C )
(resid 59 and name N )
(resid 59 and name CA )
(resid 59 and name C ) 1 -90.50 20.00 2
! S60
assign
(resid 59 and name C )
(resid 60 and name N )
(resid 60 and name CA )
(resid 60 and name C ) 1 -122.52 60.00 2
! P61
assign
(resid 60 and name C )
(resid 61 and name N )
(resid 61 and name CA )
(resid 61 and name C ) 1 -71.87 60.00 2
!! { Dihedral Angle Restraints }
!!psi N(i)-CA(i)-C(i)-N(i+1)
! A4
assign
(resid 4 and name N )
(resid 4 and name CA )
(resid 4 and name C )
(resid 5 and name N ) 1 -15.98 52.00 2
! Q5
assign
(resid 5 and name N )
(resid 5 and name CA )
(resid 5 and name C )
(resid 6 and name N ) 1 -8.47 52.00 2
! T7
assign
(resid 7 and name N )
(resid 7 and name CA )
(resid 7 and name C )
(resid 8 and name N ) 1 153.71 52.00 2
! N8
assign
(resid 8 and name N )
(resid 8 and name CA )
(resid 8 and name C )
(resid 9 and name N ) 1 -13.96 52.00 2
! Q9
assign
(resid 9 and name N )
(resid 9 and name CA )
(resid 9 and name C )
(resid 10 and name N ) 1 130.59 52.00 2
! T10
assign
(resid 10 and name N )
(resid 10 and name CA )
(resid 10 and name C )
(resid 11 and name N ) 1 142.87 52.00 2
! P11
assign
(resid 11 and name N )
(resid 11 and name CA )
(resid 11 and name C )
(resid 12 and name N ) 1 143.12 52.00 2
! G12
assign
(resid 12 and name N )
(resid 12 and name CA )
(resid 12 and name C )
(resid 13 and name N ) 1 -10.07 52.00 2
! P13
!assign
!(resid 13 and name N )
!(resid 13 and name CA )
!(resid 13 and name C )
!(resid 14 and name N ) 1 -2.60 52.00 2
! M14
assign
(resid 14 and name N )
(resid 14 and name CA )
(resid 14 and name C )
(resid 15 and name N ) 1 95.50 30.00 2
! L15
assign
(resid 15 and name N )
(resid 15 and name CA )
(resid 15 and name C )
(resid 16 and name N ) 1 120.00 25.00 2
! C16
assign
(resid 15 and name N )
(resid 15 and name CA )
(resid 15 and name C )
(resid 16 and name N ) 1 120.00 30.00 2
! S17
assign
(resid 17 and name N )
(resid 17 and name CA )
(resid 17 and name C )
(resid 18 and name N ) 1 -36.31 21.00 2
! T18
assign
(resid 18 and name N )
(resid 18 and name CA )
(resid 18 and name C )
(resid 19 and name N ) 1 -8.67 50.00 2
! G19
assign
(resid 19 and name N )
(resid 19 and name CA )
(resid 19 and name C )
(resid 20 and name N ) 1 20.17 22.00 2
! C20
assign
(resid 20 and name N )
(resid 20 and name CA )
(resid 20 and name C )
(resid 21 and name N ) 1 -10.68 32.00 2
! G21
assign
(resid 21 and name N )
(resid 21 and name CA )
(resid 21 and name C )
(resid 22 and name N ) 1 -10.77 42.00 2
! Y23
assign
(resid 23 and name N )
(resid 23 and name CA )
(resid 23 and name C )
(resid 24 and name N ) 1 120.0 25.00 2
! N25
assign
(resid 25 and name N )
(resid 25 and name CA )
(resid 25 and name C )
(resid 26 and name N ) 1 130.15 22.00 2
! P26
assign
(resid 26 and name N )
(resid 26 and name CA )
(resid 26 and name C )
(resid 27 and name N ) 1 -26.33 15.00 2
! R27
assign
(resid 27 and name N )
(resid 27 and name CA )
(resid 27 and name C )
(resid 28 and name N ) 1 -34.10 15.00 2
! T28
assign
(resid 28 and name N )
(resid 28 and name CA )
(resid 28 and name C )
(resid 29 and name N ) 1 -175.0 25.00 2
! N29
assign
(resid 29 and name N )
(resid 29 and name CA )
(resid 29 and name C )
(resid 30 and name N ) 1 10.0 15.00 2
! G30
assign
(resid 30 and name N )
(resid 30 and name CA )
(resid 30 and name C )
(resid 31 and name N ) 1 -3.28 20.00 2
! M31
assign
(resid 31 and name N )
(resid 31 and name CA )
(resid 31 and name C )
(resid 32 and name N ) 1 150.49 25.00 2
! C32
assign
(resid 32 and name N )
(resid 32 and name CA )
(resid 32 and name C )
(resid 33 and name N ) 1 -180.00 25.00 2
! S33
assign
(resid 33 and name N )
(resid 33 and name CA )
(resid 33 and name C )
(resid 34 and name N ) 1 -40.00 11.00 2
! V34
assign
(resid 34 and name N )
(resid 34 and name CA )
(resid 34 and name C )
(resid 35 and name N ) 1 -50.00 13.00 2
! C35
assign
(resid 35 and name N )
(resid 35 and name CA )
(resid 35 and name C )
(resid 36 and name N ) 1 -47.00 11.00 2
! Y36
assign
(resid 36 and name N )
(resid 36 and name CA )
(resid 36 and name C )
(resid 37 and name N ) 1 -40.01 11.00 2
! K37
assign
(resid 37 and name N )
(resid 37 and name CA )
(resid 37 and name C )
(resid 38 and name N ) 1 -43.15 11.00 2
! E38
assign
(resid 38 and name N )
(resid 38 and name CA )
(resid 38 and name C )
(resid 39 and name N ) 1 -40.11 11.00 2
! H39
assign
(resid 39 and name N )
(resid 39 and name CA )
(resid 39 and name C )
(resid 40 and name N ) 1 -45.08 11.00 2
! L40
assign
(resid 40 and name N )
(resid 40 and name CA )
(resid 40 and name C )
(resid 41 and name N ) 1 -36.78 10.00 2
! Q41
assign
(resid 41 and name N )
(resid 41 and name CA )
(resid 41 and name C )
(resid 42 and name N ) 1 -39.12 11.00 2
! R42
assign
(resid 42 and name N )
(resid 42 and name CA )
(resid 42 and name C )
(resid 43 and name N ) 1 -42.10 11.00 2
! Q43
assign
(resid 43 and name N )
(resid 43 and name CA )
(resid 43 and name C )
(resid 44 and name N ) 1 -42.32 16.00 2
! Q44
assign
(resid 44 and name N )
(resid 44 and name CA )
(resid 44 and name C )
(resid 45 and name N ) 1 -24.17 42.00 2
! N45
assign
(resid 45 and name N )
(resid 45 and name CA )
(resid 45 and name C )
(resid 46 and name N ) 1 -30.91 25.00 2
! S46
assign
(resid 46 and name N )
(resid 46 and name CA )
(resid 46 and name C )
(resid 47 and name N ) 1 -20.26 52.00 2
! G47
assign
(resid 47 and name N )
(resid 47 and name CA )
(resid 47 and name C )
(resid 48 and name N ) 1 6.25 62.00 2
! S50
assign
(resid 50 and name N )
(resid 50 and name CA )
(resid 50 and name C )
(resid 51 and name N ) 1 146.44 52.00 2
! G53
assign
(resid 53 and name N )
(resid 53 and name CA )
(resid 53 and name C )
(resid 54 and name N ) 1 -15.61 52.00 2
! T54
assign
(resid 54 and name N )
(resid 54 and name CA )
(resid 54 and name C )
(resid 55 and name N ) 1 158.33 52.00 2
! G57
assign
(resid 57 and name N )
(resid 57 and name CA )
(resid 57 and name C )
(resid 58 and name N ) 1 18.00 62.00 2
! S58
assign
(resid 58 and name N )
(resid 58 and name CA )
(resid 58 and name C )
(resid 59 and name N ) 1 -7.12 62.00 2
! N59
assign
(resid 59 and name N )
(resid 59 and name CA )
(resid 59 and name C )
(resid 60 and name N ) 1 130.94 22.00 2
! S60
assign
(resid 60 and name N )
(resid 60 and name CA )
(resid 60 and name C )
(resid 61 and name N ) 1 143.21 62.00 2
! P61
assign
(resid 61 and name N )
(resid 61 and name CA )
(resid 61 and name C )
(resid 62 and name N ) 1 139.31 62.00 2
!! { Dihedral Angle Restraints }
!! chi1 N(i)-CA(i)-CB(i)-CG(i)
! M14
assign
(resid 14 and name N )
(resid 14 and name CA )
(resid 14 and name CB )
(resid 14 and name CG ) 1 -60.00 60.00 2
! L15
!assign
!(resid 15 and name N )
!(resid 15 and name CA )
!(resid 15 and name CB )
!(resid 15 and name CG ) 1 -60.00 30.00 2
! S17
assign
(resid 17 and name N )
(resid 17 and name CA )
(resid 17 and name CB )
(resid 17 and name OG ) 1 -60.00 60.00 2
! T18
assign
(resid 18 and name N )
(resid 18 and name CA )
(resid 18 and name CB )
(resid 18 and name OG1 ) 1 60.00 30.00 2
! F22
assign
(resid 22 and name N )
(resid 22 and name CA )
(resid 22 and name CB )
(resid 22 and name CG ) 1 -60.00 30.00 2
! Y23
assign
(resid 23 and name N )
(resid 23 and name CA )
(resid 23 and name CB )
(resid 23 and name CG ) 1 180.00 25.00 2
! N25
assign
(resid 25 and name N )
(resid 25 and name CA )
(resid 25 and name CB )
(resid 25 and name CG ) 1 180.00 30.00 2
! R27
assign
(resid 27 and name N )
(resid 27 and name CA )
(resid 27 and name CB )
(resid 27 and name CG ) 1 -60.00 30.00 2
! T28
assign
(resid 28 and name N )
(resid 28 and name CA )
(resid 28 and name CB )
(resid 28 and name OG1 ) 1 60.00 30.00 2
! N29
assign
(resid 29 and name N )
(resid 29 and name CA )
(resid 29 and name CB )
(resid 29 and name CG ) 1 -60.00 80.00 2
! S33
assign
(resid 33 and name N )
(resid 33 and name CA )
(resid 33 and name CB )
(resid 33 and name OG ) 1 -60.00 80.00 2
! E38
assign
(resid 38 and name N )
(resid 38 and name CA )
(resid 38 and name CB )
(resid 38 and name CG ) 1 -60.00 30.00 2
!! { Dihedral Angle Restraints }
!!omega CA(i)-C(i)-N(i+1)-CA(i+1)
! S2
assign
(resid 2 and name CA )
(resid 2 and name C )
(resid 3 and name N )
(resid 3 and name CA ) 1 180.00 4.00 2
! M3
assign
(resid 3 and name CA )
(resid 3 and name C )
(resid 4 and name N )
(resid 4 and name CA ) 1 180.00 4.00 2
! A4
assign
(resid 4 and name CA )
(resid 4 and name C )
(resid 5 and name N )
(resid 5 and name CA ) 1 180.00 4.00 2
! Q5
assign
(resid 5 and name CA )
(resid 5 and name C )
(resid 6 and name N )
(resid 6 and name CA ) 1 180.00 4.00 2
! E6
assign
(resid 6 and name CA )
(resid 6 and name C )
(resid 7 and name N )
(resid 7 and name CA ) 1 180.00 4.00 2
! T7
assign
(resid 7 and name CA )
(resid 7 and name C )
(resid 8 and name N )
(resid 8 and name CA ) 1 180.00 4.00 2
! N8
assign
(resid 8 and name CA )
(resid 8 and name C )
(resid 9 and name N )
(resid 9 and name CA ) 1 180.00 4.00 2
! Q9
assign
(resid 9 and name CA )
(resid 9 and name C )
(resid 10 and name N )
(resid 10 and name CA ) 1 180.00 4.00 2
! T10
assign
(resid 10 and name CA )
(resid 10 and name C )
(resid 11 and name N )
(resid 11 and name CA ) 1 180.00 4.00 2
! P11
assign
(resid 11 and name CA )
(resid 11 and name C )
(resid 12 and name N )
(resid 12 and name CA ) 1 180.00 4.00 2
! G12
assign
(resid 12 and name CA )
(resid 12 and name C )
(resid 13 and name N )
(resid 13 and name CA ) 1 180.00 4.00 2
! P13
assign
(resid 13 and name CA )
(resid 13 and name C )
(resid 14 and name N )
(resid 14 and name CA ) 1 180.00 4.00 2
! M14
assign
(resid 14 and name CA )
(resid 14 and name C )
(resid 15 and name N )
(resid 15 and name CA ) 1 180.00 4.00 2
! L15
assign
(resid 15 and name CA )
(resid 15 and name C )
(resid 16 and name N )
(resid 16 and name CA ) 1 180.00 4.00 2
! C16
assign
(resid 16 and name CA )
(resid 16 and name C )
(resid 17 and name N )
(resid 17 and name CA ) 1 180.00 4.00 2
! S17
assign
(resid 17 and name CA )
(resid 17 and name C )
(resid 18 and name N )
(resid 18 and name CA ) 1 180.00 4.00 2
! T18
assign
(resid 18 and name CA )
(resid 18 and name C )
(resid 19 and name N )
(resid 19 and name CA ) 1 180.00 4.00 2
! G19
assign
(resid 19 and name CA )
(resid 19 and name C )
(resid 20 and name N )
(resid 20 and name CA ) 1 180.00 4.00 2
! C20
assign
(resid 20 and name CA )
(resid 20 and name C )
(resid 21 and name N )
(resid 21 and name CA ) 1 180.00 4.00 2
! G21
assign
(resid 21 and name CA )
(resid 21 and name C )
(resid 22 and name N )
(resid 22 and name CA ) 1 180.00 4.00 2
! F22
assign
(resid 22 and name CA )
(resid 22 and name C )
(resid 23 and name N )
(resid 23 and name CA ) 1 180.00 4.00 2
! Y23
assign
(resid 23 and name CA )
(resid 23 and name C )
(resid 24 and name N )
(resid 24 and name CA ) 1 180.00 4.00 2
! G24
assign
(resid 24 and name CA )
(resid 24 and name C )
(resid 25 and name N )
(resid 25 and name CA ) 1 180.00 4.00 2
! N25
assign
(resid 25 and name CA )
(resid 25 and name C )
(resid 26 and name N )
(resid 26 and name CA ) 1 180.00 4.00 2
! P26
assign
(resid 26 and name CA )
(resid 26 and name C )
(resid 27 and name N )
(resid 27 and name CA ) 1 180.00 4.00 2
! R27
assign
(resid 27 and name CA )
(resid 27 and name C )
(resid 28 and name N )
(resid 28 and name CA ) 1 180.00 4.00 2
! T28
assign
(resid 28 and name CA )
(resid 28 and name C )
(resid 29 and name N )
(resid 29 and name CA ) 1 180.00 4.00 2
! N29
assign
(resid 29 and name CA )
(resid 29 and name C )
(resid 30 and name N )
(resid 30 and name CA ) 1 180.00 4.00 2
! G30
assign
(resid 30 and name CA )
(resid 30 and name C )
(resid 31 and name N )
(resid 31 and name CA ) 1 180.00 4.00 2
! M31
assign
(resid 31 and name CA )
(resid 31 and name C )
(resid 32 and name N )
(resid 32 and name CA ) 1 180.00 4.00 2
! C32
assign
(resid 32 and name CA )
(resid 32 and name C )
(resid 33 and name N )
(resid 33 and name CA ) 1 180.00 4.00 2
! S33
assign
(resid 33 and name CA )
(resid 33 and name C )
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! V34
assign
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! C35
assign
(resid 35 and name CA )
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! Y36
assign
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! K37
assign
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! E38
assign
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! H39
assign
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! L40
assign
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! Q41
assign
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! R42
assign
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! Q43
assign
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! Q44
assign
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! N45
assign
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! S46
assign
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! G47
assign
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! R48
assign
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! M49
assign
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! S50
assign
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! P51
assign
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! M52
assign
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! G53
assign
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! T54
assign
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! A55
assign
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! S56
assign
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! G57
assign
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! S58
assign
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! N59
assign
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! S60
assign
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! P61
assign
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!! { Dihedral Angle Restraints }
!!phi C(i-1)-N(i)-CA(i)-C(i)
! S2
assign
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! M3
assign
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! A4
assign
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! Q5
assign
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! E6
assign
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! T7
assign
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! N8
assign
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! Q9
assign
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! T10
assign
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! P11
assign
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! G12
!assign
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! P13
assign
(resid 12 and name C )
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! M14
assign
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! L15
assign
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! C16
assign
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! S17
assign
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! T18
assign
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! G19
assign
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! C20
assign
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! G21
assign
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! F22
assign
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! Y23
assign
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! 24
assign
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! N25
assign
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! P26
assign
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! R27
assign
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! T28
assign
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! N29
assign
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! M31
assign
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! C32
assign
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! S33
assign
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! V34
assign
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! C35
assign
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! Y36
assign
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! K37
assign
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! E38
assign
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! H39
assign
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! L40
assign
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! Q41
assign
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! R42
assign
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! Q43
assign
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! Q44
assign
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! N45
assign
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! S46
assign
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! G47
assign
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! R48
assign
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! M49
assign
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! S50
assign
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! P51
assign
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! M52
assign
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! G53
assign
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! T54
assign
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! A55
assign
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! S56
assign
(resid 55 and name C )
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! G57
assign
(resid 56 and name C )
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! S58
assign
(resid 57 and name C )
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! N59
assign
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! S60
assign
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! P61
assign
(resid 60 and name C )
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!! { Dihedral Angle Restraints }
!!psi N(i)-CA(i)-C(i)-N(i+1)
! A4
assign
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! Q5
assign
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! T7
assign
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! N8
assign
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! Q9
assign
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! T10
assign
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! P11
assign
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! G12
assign
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! P13
!assign
!(resid 13 and name N )
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! M14
assign
(resid 14 and name N )
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! L15
assign
(resid 15 and name N )
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! C16
assign
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(resid 15 and name CA )
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! S17
assign
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! T18
assign
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! G19
assign
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! C20
assign
(resid 20 and name N )
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! G21
assign
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! Y23
assign
(resid 23 and name N )
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! N25
assign
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! P26
assign
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! R27
assign
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! T28
assign
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! N29
assign
(resid 29 and name N )
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! G30
assign
(resid 30 and name N )
(resid 30 and name CA )
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! M31
assign
(resid 31 and name N )
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! C32
assign
(resid 32 and name N )
(resid 32 and name CA )
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! S33
assign
(resid 33 and name N )
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! V34
assign
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! C35
assign
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! Y36
assign
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! K37
assign
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! E38
assign
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! H39
assign
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! L40
assign
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! Q41
assign
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! R42
assign
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! Q43
assign
(resid 43 and name N )
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! Q44
assign
(resid 44 and name N )
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! N45
assign
(resid 45 and name N )
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! S46
assign
(resid 46 and name N )
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! G47
assign
(resid 47 and name N )
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! S50
assign
(resid 50 and name N )
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! G53
assign
(resid 53 and name N )
(resid 53 and name CA )
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! T54
assign
(resid 54 and name N )
(resid 54 and name CA )
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! G57
assign
(resid 57 and name N )
(resid 57 and name CA )
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! S58
assign
(resid 58 and name N )
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! N59
assign
(resid 59 and name N )
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! S60
assign
(resid 60 and name N )
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! P61
assign
(resid 61 and name N )
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(resid 61 and name C )
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!! { Dihedral Angle Restraints }
!! chi1 N(i)-CA(i)-CB(i)-CG(i)
! M14
assign
(resid 14 and name N )
(resid 14 and name CA )
(resid 14 and name CB )
(resid 14 and name CG ) 1 -60.00 60.00 2
! L15
!assign
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!(resid 15 and name CA )
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! S17
assign
(resid 17 and name N )
(resid 17 and name CA )
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! T18
assign
(resid 18 and name N )
(resid 18 and name CA )
(resid 18 and name CB )
(resid 18 and name OG1 ) 1 60.00 30.00 2
! F22
assign
(resid 22 and name N )
(resid 22 and name CA )
(resid 22 and name CB )
(resid 22 and name CG ) 1 -60.00 30.00 2
! Y23
assign
(resid 23 and name N )
(resid 23 and name CA )
(resid 23 and name CB )
(resid 23 and name CG ) 1 180.00 25.00 2
! N25
assign
(resid 25 and name N )
(resid 25 and name CA )
(resid 25 and name CB )
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! R27
assign
(resid 27 and name N )
(resid 27 and name CA )
(resid 27 and name CB )
(resid 27 and name CG ) 1 -60.00 30.00 2
! T28
assign
(resid 28 and name N )
(resid 28 and name CA )
(resid 28 and name CB )
(resid 28 and name OG1 ) 1 60.00 30.00 2
! N29
assign
(resid 29 and name N )
(resid 29 and name CA )
(resid 29 and name CB )
(resid 29 and name CG ) 1 -60.00 80.00 2
! S33
assign
(resid 33 and name N )
(resid 33 and name CA )
(resid 33 and name CB )
(resid 33 and name OG ) 1 -60.00 80.00 2
! E38
assign
(resid 38 and name N )
(resid 38 and name CA )
(resid 38 and name CB )
(resid 38 and name CG ) 1 -60.00 30.00 2
!! { Dihedral Angle Restraints }
!!omega CA(i)-C(i)-N(i+1)-CA(i+1)
! S2
assign
(resid 2 and name CA )
(resid 2 and name C )
(resid 3 and name N )
(resid 3 and name CA ) 1 180.00 4.00 2
! M3
assign
(resid 3 and name CA )
(resid 3 and name C )
(resid 4 and name N )
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! A4
assign
(resid 4 and name CA )
(resid 4 and name C )
(resid 5 and name N )
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! Q5
assign
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! E6
assign
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! T7
assign
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! N8
assign
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! Q9
assign
(resid 9 and name CA )
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! T10
assign
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! P11
assign
(resid 11 and name CA )
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! G12
assign
(resid 12 and name CA )
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! P13
assign
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! M14
assign
(resid 14 and name CA )
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! L15
assign
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! C16
assign
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! S17
assign
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! T18
assign
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! G19
assign
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! C20
assign
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! G21
assign
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! F22
assign
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! Y23
assign
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! G24
assign
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! N25
assign
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! P26
assign
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! R27
assign
(resid 27 and name CA )
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! T28
assign
(resid 28 and name CA )
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! N29
assign
(resid 29 and name CA )
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! G30
assign
(resid 30 and name CA )
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! M31
assign
(resid 31 and name CA )
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! C32
assign
(resid 32 and name CA )
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! S33
assign
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! V34
assign
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! C35
assign
(resid 35 and name CA )
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! Y36
assign
(resid 36 and name CA )
(resid 36 and name C )
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! K37
assign
(resid 37 and name CA )
(resid 37 and name C )
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! E38
assign
(resid 38 and name CA )
(resid 38 and name C )
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(resid 39 and name CA ) 1 180.00 4.00 2
! H39
assign
(resid 39 and name CA )
(resid 39 and name C )
(resid 40 and name N )
(resid 40 and name CA ) 1 180.00 4.00 2
! L40
assign
(resid 40 and name CA )
(resid 40 and name C )
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(resid 41 and name CA ) 1 180.00 4.00 2
! Q41
assign
(resid 41 and name CA )
(resid 41 and name C )
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(resid 42 and name CA ) 1 180.00 4.00 2
! R42
assign
(resid 42 and name CA )
(resid 42 and name C )
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(resid 43 and name CA ) 1 180.00 4.00 2
! Q43
assign
(resid 43 and name CA )
(resid 43 and name C )
(resid 44 and name N )
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! Q44
assign
(resid 44 and name CA )
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! N45
assign
(resid 45 and name CA )
(resid 45 and name C )
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! S46
assign
(resid 46 and name CA )
(resid 46 and name C )
(resid 47 and name N )
(resid 47 and name CA ) 1 180.00 4.00 2
! G47
assign
(resid 47 and name CA )
(resid 47 and name C )
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(resid 48 and name CA ) 1 180.00 4.00 2
! R48
assign
(resid 48 and name CA )
(resid 48 and name C )
(resid 49 and name N )
(resid 49 and name CA ) 1 180.00 4.00 2
! M49
assign
(resid 49 and name CA )
(resid 49 and name C )
(resid 50 and name N )
(resid 50 and name CA ) 1 180.00 4.00 2
! S50
assign
(resid 50 and name CA )
(resid 50 and name C )
(resid 51 and name N )
(resid 51 and name CA ) 1 180.00 4.00 2
! P51
assign
(resid 51 and name CA )
(resid 51 and name C )
(resid 52 and name N )
(resid 52 and name CA ) 1 180.00 4.00 2
! M52
assign
(resid 52 and name CA )
(resid 52 and name C )
(resid 53 and name N )
(resid 53 and name CA ) 1 180.00 4.00 2
! G53
assign
(resid 53 and name CA )
(resid 53 and name C )
(resid 54 and name N )
(resid 54 and name CA ) 1 180.00 4.00 2
! T54
assign
(resid 54 and name CA )
(resid 54 and name C )
(resid 55 and name N )
(resid 55 and name CA ) 1 180.00 4.00 2
! A55
assign
(resid 55 and name CA )
(resid 55 and name C )
(resid 56 and name N )
(resid 56 and name CA ) 1 180.00 4.00 2
! S56
assign
(resid 56 and name CA )
(resid 56 and name C )
(resid 57 and name N )
(resid 57 and name CA ) 1 180.00 4.00 2
! G57
assign
(resid 57 and name CA )
(resid 57 and name C )
(resid 58 and name N )
(resid 58 and name CA ) 1 180.00 4.00 2
! S58
assign
(resid 58 and name CA )
(resid 58 and name C )
(resid 59 and name N )
(resid 59 and name CA ) 1 180.00 4.00 2
! N59
assign
(resid 59 and name CA )
(resid 59 and name C )
(resid 60 and name N )
(resid 60 and name CA ) 1 180.00 4.00 2
! S60
assign
(resid 60 and name CA )
(resid 60 and name C )
(resid 61 and name N )
(resid 61 and name CA ) 1 180.00 4.00 2
! P61
assign
(resid 61 and name CA )
(resid 61 and name C )
(resid 62 and name N )
(resid 62 and name CA ) 1 180.00 4.00 2
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