NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type
551398 2ln7 18152 cing 1-original 2 XPLOR/CNS dihedral angle


! Phi and Psi constraints are based on the results of TALOS 
! only for residues with 'Good' status.                            
!                                                                  
!  The center value is the avergae of TALOS predictions.           
!                                                                  
!  The range of constrains are three times of standard deviation   
! of TALOS predictions. But if such a value is smaller than 20     
! degree, the range is set to 20 degree.                           
!                                                  J.I.            
!                                                                  
!E9 (TALOS: Phi -92.0 +/- 26.0  , TALOS: Psi 139.0 +/- 12.0 )
!assign (resid   8 and name C)    (resid   9 and name  N)
!       (resid   9 and name CA)   (resid   9 and name  C) 1.0  -92.0 78.0  2
!assign (resid   9 and name  N)   (resid   9 and name CA)
!       (resid   9 and name  C)   (resid  10 and name  N) 1.0  139.0 36.0  2
!H10 (TALOS: Phi -93.0 +/- 16.0  , TALOS: Psi 141.0 +/- 16.0 )
!assign (resid   9 and name C)    (resid  10 and name  N)
!       (resid  10 and name CA)   (resid  10 and name  C) 1.0  -93.0 48.0  2
!assign (resid  10 and name  N)   (resid  10 and name CA)
!       (resid  10 and name  C)   (resid  11 and name  N) 1.0  141.0 48.0  2
!K11 (TALOS: Phi -90.0 +/- 30.0  , TALOS: Psi 145.0 +/- 20.0 )
!assign (resid  10 and name C)    (resid  11 and name  N)
!       (resid  11 and name CA)   (resid  11 and name  C) 1.0  -90.0 90.0  2
!assign (resid  11 and name  N)   (resid  11 and name CA)
!       (resid  11 and name  C)   (resid  12 and name  N) 1.0  145.0 60.0  2
!K12 keeping phi of 12 into better rama space
assign (resid  11 and name C)    (resid  12 and name  N) 
       (resid  12 and name CA)   (resid  12 and name  C) 1.0  -90.0 30.0  2
!G13 (TALOS: Phi  85.0 +/- 23.0  , TALOS: Psi   1.0 +/- 30.0 )
assign (resid  12 and name C)    (resid  13 and name  N)
       (resid  13 and name CA)   (resid  13 and name  C) 1.0   85.0 69.0  2
assign (resid  13 and name  N)   (resid  13 and name CA)
       (resid  13 and name  C)   (resid  14 and name  N) 1.0    1.0 90.0  2
!V16 (TALOS: Phi -143.0 +/- 14.0  , TALOS: Psi 152.0 +/- 13.0 )
assign (resid  15 and name C)    (resid  16 and name  N)
       (resid  16 and name CA)   (resid  16 and name  C) 1.0  -143.0 42.0  2
!assign (resid  16 and name  N)   (resid  16 and name CA)
!       (resid  16 and name  C)   (resid  17 and name  N) 1.0  152.0 39.0  2
!A17 (TALOS: Phi -150.0 +/- 10.0  , TALOS: Psi 153.0 +/- 5.0  )
!assign (resid  16 and name C)    (resid  17 and name  N)
!       (resid  17 and name CA)   (resid  17 and name  C) 1.0  -150.0 30.0  2
assign (resid  17 and name  N)   (resid  17 and name CA)
       (resid  17 and name  C)   (resid  18 and name  N) 1.0  153.0 20.0  2
!M18 (TALOS: Phi -146.0 +/- 11.0  , TALOS: Psi 139.0 +/- 13.0 )
assign (resid  17 and name C)    (resid  18 and name  N)
       (resid  18 and name CA)   (resid  18 and name  C) 1.0  -146.0 33.0  2
assign (resid  18 and name  N)   (resid  18 and name CA)
       (resid  18 and name  C)   (resid  19 and name  N) 1.0  139.0 39.0  2
!L19 (TALOS: Phi -136.0 +/- 14.0  , TALOS: Psi 134.0 +/- 8.0  )
assign (resid  18 and name C)    (resid  19 and name  N)
       (resid  19 and name CA)   (resid  19 and name  C) 1.0  -136.0 42.0  2
assign (resid  19 and name  N)   (resid  19 and name CA)
       (resid  19 and name  C)   (resid  20 and name  N) 1.0  134.0 24.0  2
!N20 (TALOS: Phi -115.0 +/- 10.0  , TALOS: Psi 130.0 +/- 11.0 )
assign (resid  19 and name C)    (resid  20 and name  N)
       (resid  20 and name CA)   (resid  20 and name  C) 1.0  -115.0 30.0  2
assign (resid  20 and name  N)   (resid  20 and name CA)
       (resid  20 and name  C)   (resid  21 and name  N) 1.0  130.0 33.0  2
!I21 (TALOS: Phi -116.8 +/- 21.2  , TALOS: Psi 126.2 +/- 13.5 )
assign (resid  20 and name C)    (resid  21 and name  N)
       (resid  21 and name CA)   (resid  21 and name  C) 1.0  -116.8 63.6  2
assign (resid  21 and name  N)   (resid  21 and name CA)
       (resid  21 and name  C)   (resid  22 and name  N) 1.0  126.2 40.5  2
!K23 (TALOS: Phi -90.0 +/- 20.0  , TALOS: Psi -38.0 +/- 12.0 )
assign (resid  22 and name C)    (resid  23 and name  N)
       (resid  23 and name CA)   (resid  23 and name  C) 1.0  -90.0 60.0  2
assign (resid  23 and name  N)   (resid  23 and name CA)
       (resid  23 and name  C)   (resid  24 and name  N) 1.0  -38.0 36.0  2
!L24 (TALOS: Phi -104.0 +/- 23.0  , TALOS: Psi -15.0 +/- 25.0 )
assign (resid  23 and name C)    (resid  24 and name  N)
       (resid  24 and name CA)   (resid  24 and name  C) 1.0  -104.0 69.0  2
assign (resid  24 and name  N)   (resid  24 and name CA)
       (resid  24 and name  C)   (resid  25 and name  N) 1.0  -15.0 75.0  2
!K25 (TALOS: Phi  57.0 +/- 4.0   , TALOS: Psi  47.0 +/- 12.0 )
assign (resid  24 and name C)    (resid  25 and name  N)
       (resid  25 and name CA)   (resid  25 and name  C) 1.0   57.0 20.0  2
assign (resid  25 and name  N)   (resid  25 and name CA)
       (resid  25 and name  C)   (resid  26 and name  N) 1.0   47.0 36.0  2
!K26 (TALOS: Phi -113.0 +/- 24.0  , TALOS: Psi 149.0 +/- 11.0 )
assign (resid  25 and name C)    (resid  26 and name  N)
       (resid  26 and name CA)   (resid  26 and name  C) 1.0  -113.0 72.0  2
assign (resid  26 and name  N)   (resid  26 and name CA)
       (resid  26 and name  C)   (resid  27 and name  N) 1.0  149.0 33.0  2
!K27 (TALOS: Phi -143.9 +/- 21.8  , TALOS: Psi 152.0 +/- 10.2 )
assign (resid  26 and name C)    (resid  27 and name  N)
       (resid  27 and name CA)   (resid  27 and name  C) 1.0  -143.9 65.5  2
assign (resid  27 and name  N)   (resid  27 and name CA)
       (resid  27 and name  C)   (resid  28 and name  N) 1.0  152.0 30.7  2
!F28 (TALOS: Phi -140.5 +/- 14.5  , TALOS: Psi 134.3 +/- 11.4 )
assign (resid  27 and name C)    (resid  28 and name  N)
       (resid  28 and name CA)   (resid  28 and name  C) 1.0  -140.5 43.6  2
assign (resid  28 and name  N)   (resid  28 and name CA)
       (resid  28 and name  C)   (resid  29 and name  N) 1.0  134.3 34.2  2
!S29 (TALOS: Phi -96.0 +/- 32.0  , TALOS: Psi 135.0 +/- 7.0  )
assign (resid  28 and name C)    (resid  29 and name  N)
       (resid  29 and name CA)   (resid  29 and name  C) 1.0  -96.0 96.0  2
assign (resid  29 and name  N)   (resid  29 and name CA)
       (resid  29 and name  C)   (resid  30 and name  N) 1.0  135.0 21.0  2
!I30 (TALOS: Phi -123.7 +/- 17.6  , TALOS: Psi 137.9 +/- 16.8 )
assign (resid  29 and name C)    (resid  30 and name  N)
       (resid  30 and name CA)   (resid  30 and name  C) 1.0  -123.7 52.7  2
assign (resid  30 and name  N)   (resid  30 and name CA)
       (resid  30 and name  C)   (resid  31 and name  N) 1.0  137.9 50.3  2
!Y31 (TALOS: Phi -134.0 +/- 18.1  , TALOS: Psi 145.7 +/- 16.0 )
assign (resid  30 and name C)    (resid  31 and name  N)
       (resid  31 and name CA)   (resid  31 and name  C) 1.0  -134.0 54.3  2
assign (resid  31 and name  N)   (resid  31 and name CA)
       (resid  31 and name  C)   (resid  32 and name  N) 1.0  145.7 48.0  2
!W32 (TALOS: Phi -136.4 +/- 24.9  , TALOS: Psi 137.4 +/- 16.6 )
assign (resid  31 and name C)    (resid  32 and name  N)
       (resid  32 and name CA)   (resid  32 and name  C) 1.0  -136.4 74.8  2
assign (resid  32 and name  N)   (resid  32 and name CA)
       (resid  32 and name  C)   (resid  33 and name  N) 1.0  137.4 49.8  2
!A34 (TALOS: Phi -130.0 +/- 30.0  , TALOS: Psi 154.0 +/- 17.0 )
assign (resid  33 and name C)    (resid  34 and name  N)
       (resid  34 and name CA)   (resid  34 and name  C) 1.0  -130.0 90.0  2
assign (resid  34 and name  N)   (resid  34 and name CA)
       (resid  34 and name  C)   (resid  35 and name  N) 1.0  154.0 75.0  2 ! widened to avoid violaton
!D35 (TALOS: Phi -73.0 +/- 10.0  , TALOS: Psi 133.0 +/- 35.0 )
assign (resid  34 and name C)    (resid  35 and name  N)
       (resid  35 and name CA)   (resid  35 and name  C) 1.0  -73.0 30.0  2
assign (resid  35 and name  N)   (resid  35 and name CA)
       (resid  35 and name  C)   (resid  36 and name  N) 1.0  133.0 105.0  2
!D36 (TALOS: Phi -61.9 +/- 9.2   , TALOS: Psi -40.4 +/- 8.5  )
assign (resid  35 and name C)    (resid  36 and name  N)
       (resid  36 and name CA)   (resid  36 and name  C) 1.0  -61.9 27.5  2
assign (resid  36 and name  N)   (resid  36 and name CA)
       (resid  36 and name  C)   (resid  37 and name  N) 1.0  -40.4 45.0  2 ! widened to avoid violation
!A37 (TALOS: Phi -64.4 +/- 5.4   , TALOS: Psi -38.6 +/- 6.6  )
assign (resid  36 and name C)    (resid  37 and name  N)
       (resid  37 and name CA)   (resid  37 and name  C) 1.0  -64.4 20.0  2
assign (resid  37 and name  N)   (resid  37 and name CA)
       (resid  37 and name  C)   (resid  38 and name  N) 1.0  -38.6 30.0  2 ! widened to avoid violation
!T38 (TALOS: Phi -71.7 +/- 12.5  , TALOS: Psi -45.6 +/- 3.6  )
assign (resid  37 and name C)    (resid  38 and name  N)
       (resid  38 and name CA)   (resid  38 and name  C) 1.0  -71.7 37.6  2
!G42 (TALOS: Phi  81.9 +/- 11.3  , TALOS: Psi   5.3 +/- 19.9 )
!assign (resid  41 and name C)    (resid  42 and name  N)
!       (resid  42 and name CA)   (resid  42 and name  C) 1.0   81.9 34.0  2 ! not to be trusted
assign (resid  42 and name  N)   (resid  42 and name CA)
       (resid  42 and name  C)   (resid  43 and name  N) 1.0    5.3 59.6  2
!V43 (TALOS: Phi -129.0 +/- 18.0  , TALOS: Psi 129.0 +/- 12.0 )
assign (resid  42 and name C)    (resid  43 and name  N)
       (resid  43 and name CA)   (resid  43 and name  C) 1.0  -129.0 54.0  2
assign (resid  43 and name  N)   (resid  43 and name CA)
       (resid  43 and name  C)   (resid  44 and name  N) 1.0  129.0 36.0  2
!G44 (TALOS: Phi -129.0 +/- 33.0  , TALOS: Psi 136.0 +/- 17.0 )
assign (resid  43 and name C)    (resid  44 and name  N)
       (resid  44 and name CA)   (resid  44 and name  C) 1.0  -129.0 99.0  2
assign (resid  44 and name  N)   (resid  44 and name CA)
       (resid  44 and name  C)   (resid  45 and name  N) 1.0  136.0 51.0  2
!M45 (TALOS: Phi -97.0 +/- 31.0  , TALOS: Psi 129.0 +/- 16.0 )
assign (resid  44 and name C)    (resid  45 and name  N)
       (resid  45 and name CA)   (resid  45 and name  C) 1.0  -97.0 93.0  2
assign (resid  45 and name  N)   (resid  45 and name CA)
       (resid  45 and name  C)   (resid  46 and name  N) 1.0  129.0 48.0  2
!F46 (TALOS: Phi -85.0 +/- 24.0  , TALOS: Psi 129.0 +/- 10.0 )
assign (resid  45 and name C)    (resid  46 and name  N)
       (resid  46 and name CA)   (resid  46 and name  C) 1.0  -85.0 72.0  2
assign (resid  46 and name  N)   (resid  46 and name CA)
       (resid  46 and name  C)   (resid  47 and name  N) 1.0  129.0 30.0  2
!S48 (TALOS: Phi -115.0 +/- 38.0  , TALOS: Psi 168.0 +/- 19.0 )
assign (resid  47 and name C)    (resid  48 and name  N)
       (resid  48 and name CA)   (resid  48 and name  C) 1.0  -115.0 114.0  2
assign (resid  48 and name  N)   (resid  48 and name CA)
       (resid  48 and name  C)   (resid  49 and name  N) 1.0  168.0 20.0  2 ! manually reduced to +/- 20
!D49 (TALOS: Phi -78.7 +/- 18.0  , TALOS: Psi -24.4 +/- 13.3 )
assign (resid  48 and name C)    (resid  49 and name  N)
       (resid  49 and name CA)   (resid  49 and name  C) 1.0  -78.7 54.1  2
assign (resid  49 and name  N)   (resid  49 and name CA)
       (resid  49 and name  C)   (resid  50 and name  N) 1.0  -24.4 39.9  2
!V50 (TALOS: Phi -117.1 +/- 10.7  , TALOS: Psi   2.3 +/- 14.3 )
assign (resid  49 and name C)    (resid  50 and name  N)
       (resid  50 and name CA)   (resid  50 and name  C) 1.0  -117.1 32.2  2
assign (resid  50 and name  N)   (resid  50 and name CA)
       (resid  50 and name  C)   (resid  51 and name  N) 1.0    2.3 43.0  2
!T51 (TALOS: Phi -140.5 +/- 20.9  , TALOS: Psi 151.1 +/- 11.4 )
assign (resid  50 and name C)    (resid  51 and name  N)
       (resid  51 and name CA)   (resid  51 and name  C) 1.0  -140.5 62.8  2
assign (resid  51 and name  N)   (resid  51 and name CA)
       (resid  51 and name  C)   (resid  52 and name  N) 1.0  151.1 34.2  2
!T52 (TALOS: Phi -113.0 +/- 34.4  , TALOS: Psi 160.4 +/- 14.5 )
assign (resid  51 and name C)    (resid  52 and name  N)
       (resid  52 and name CA)   (resid  52 and name  C) 1.0  -113.0 103.2  2
assign (resid  52 and name  N)   (resid  52 and name CA)
       (resid  52 and name  C)   (resid  53 and name  N) 1.0  160.4 26  2 ! manually reduced to +/- 26
!T53 (TALOS: Phi -87.0 +/- 22.0  , TALOS: Psi 154.0 +/- 30.0 )
assign (resid  52 and name C)    (resid  53 and name  N)
       (resid  53 and name CA)   (resid  53 and name  C) 1.0  -87.0 66.0  2
assign (resid  53 and name  N)   (resid  53 and name CA)
       (resid  53 and name  C)   (resid  54 and name  N) 1.0  154.0 90.0  2
!S55 (TALOS: Phi -86.8 +/- 21.8  , TALOS: Psi -23.3 +/- 22.8 )
assign (resid  54 and name C)    (resid  55 and name  N)
       (resid  55 and name CA)   (resid  55 and name  C) 1.0  -86.8 65.5  2
assign (resid  55 and name  N)   (resid  55 and name CA)
       (resid  55 and name  C)   (resid  56 and name  N) 1.0  -23.3 68.4  2
!H59 (TALOS: Phi -103.5 +/- 14.9  , TALOS: Psi 129.4 +/- 13.3 )
assign (resid  58 and name C)    (resid  59 and name  N)
       (resid  59 and name CA)   (resid  59 and name  C) 1.0  -103.5 44.7  2
assign (resid  59 and name  N)   (resid  59 and name CA)
       (resid  59 and name  C)   (resid  60 and name  N) 1.0  129.4 39.9  2
!T60 (TALOS: Phi -116.3 +/- 23.1  , TALOS: Psi 133.3 +/- 11.3 )
assign (resid  59 and name C)    (resid  60 and name  N)
       (resid  60 and name CA)   (resid  60 and name  C) 1.0  -116.3 69.4  2
assign (resid  60 and name  N)   (resid  60 and name CA)
       (resid  60 and name  C)   (resid  61 and name  N) 1.0  133.3 34.0  2
!V61 (TALOS: Phi -121.9 +/- 12.7  , TALOS: Psi 135.8 +/- 15.1 )
assign (resid  60 and name C)    (resid  61 and name  N)
       (resid  61 and name CA)   (resid  61 and name  C) 1.0  -121.9 38.2  2
assign (resid  61 and name  N)   (resid  61 and name CA)
       (resid  61 and name  C)   (resid  62 and name  N) 1.0  135.8 45.4  2
!L62 (TALOS: Phi -120.4 +/- 13.0  , TALOS: Psi 138.7 +/- 13.2 )
assign (resid  61 and name C)    (resid  62 and name  N)
       (resid  62 and name CA)   (resid  62 and name  C) 1.0  -120.4 38.9  2
assign (resid  62 and name  N)   (resid  62 and name CA)
       (resid  62 and name  C)   (resid  63 and name  N) 1.0  138.7 39.5  2
!S63 (TALOS: Phi -130.2 +/- 15.6  , TALOS: Psi 145.7 +/- 12.4 )
assign (resid  62 and name C)    (resid  63 and name  N)
       (resid  63 and name CA)   (resid  63 and name  C) 1.0  -130.2 46.8  2
assign (resid  63 and name  N)   (resid  63 and name CA)
       (resid  63 and name  C)   (resid  64 and name  N) 1.0  145.7 37.3  2
!D72 (TALOS: Phi -61.7 +/- 6.3   , TALOS: Psi -43.3 +/- 6.5  )
assign (resid  71 and name C)    (resid  72 and name  N)
       (resid  72 and name CA)   (resid  72 and name  C) 1.0  -61.7 20.0  2
assign (resid  72 and name  N)   (resid  72 and name CA)
       (resid  72 and name  C)   (resid  73 and name  N) 1.0  -43.3 20.0  2
!L73 (TALOS: Phi -63.5 +/- 3.6   , TALOS: Psi -43.3 +/- 6.5  )
assign (resid  72 and name C)    (resid  73 and name  N)
       (resid  73 and name CA)   (resid  73 and name  C) 1.0  -63.5 20.0  2
assign (resid  73 and name  N)   (resid  73 and name CA)
       (resid  73 and name  C)   (resid  74 and name  N) 1.0  -43.3 30.0  2 ! manually widened to +/- 30
!G74 (TALOS: Phi -64.9 +/- 9.3   , TALOS: Psi -37.5 +/- 9.0  )
assign (resid  73 and name C)    (resid  74 and name  N)
       (resid  74 and name CA)   (resid  74 and name  C) 1.0  -64.9 28.0  2
assign (resid  74 and name  N)   (resid  74 and name CA)
       (resid  74 and name  C)   (resid  75 and name  N) 1.0  -37.5 27.0  2
!Q75 (TALOS: Phi -83.8 +/- 19.9  , TALOS: Psi -29.6 +/- 12.8 )
assign (resid  74 and name C)    (resid  75 and name  N)
       (resid  75 and name CA)   (resid  75 and name  C) 1.0  -83.8 59.7  2
assign (resid  75 and name  N)   (resid  75 and name CA)
       (resid  75 and name  C)   (resid  76 and name  N) 1.0  -29.6 38.5  2
!76 (this is artificial - trying to put phi of 76 into good space
assign (resid  75 and name C)    (resid  76 and name  N)
       (resid  76 and name CA)   (resid  76 and name  C) 1.0  -120.0 30.0  2
assign (resid  76 and name  N)   (resid  76 and name CA)
       (resid  76 and name  C)   (resid  77 and name  N) 1.0  80.0 40.0  2
!K77 (TALOS: Phi -112.4 +/- 25.0  , TALOS: Psi 156.4 +/- 11.5 )
assign (resid  76 and name C)    (resid  77 and name  N)
       (resid  77 and name CA)   (resid  77 and name  C) 1.0  -112.4 75.1  2
assign (resid  77 and name  N)   (resid  77 and name CA)
       (resid  77 and name  C)   (resid  78 and name  N) 1.0  156.4 34.4  2
!E78 (TALOS: Phi -58.3 +/- 4.0   , TALOS: Psi -41.1 +/- 10.1 )
assign (resid  77 and name C)    (resid  78 and name  N)
       (resid  78 and name CA)   (resid  78 and name  C) 1.0  -58.3 20.0  2
assign (resid  78 and name  N)   (resid  78 and name CA)
       (resid  78 and name  C)   (resid  79 and name  N) 1.0  -41.1 30.4  2
!K79 (TALOS: Phi -63.0 +/- 8.0   , TALOS: Psi -38.0 +/- 6.0  )
assign (resid  78 and name C)    (resid  79 and name  N)
       (resid  79 and name CA)   (resid  79 and name  C) 1.0  -63.0 24.0  2
assign (resid  79 and name  N)   (resid  79 and name CA)
       (resid  79 and name  C)   (resid  80 and name  N) 1.0  -38.0 20.0  2
!T81 (TALOS: Phi -145.4 +/- 21.9  , TALOS: Psi 151.3 +/- 14.6 )
assign (resid  80 and name C)    (resid  81 and name  N)
       (resid  81 and name CA)   (resid  81 and name  C) 1.0  -145.4 65.7  2
assign (resid  81 and name  N)   (resid  81 and name CA)
       (resid  81 and name  C)   (resid  82 and name  N) 1.0  151.3 43.9  2
!L82 (TALOS: Phi -145.6 +/- 19.2  , TALOS: Psi 140.3 +/- 11.4 )
assign (resid  81 and name C)    (resid  82 and name  N)
       (resid  82 and name CA)   (resid  82 and name  C) 1.0  -145.6 57.6  2
assign (resid  82 and name  N)   (resid  82 and name CA)
       (resid  82 and name  C)   (resid  83 and name  N) 1.0  140.3 34.3  2
!V83 (TALOS: Phi -137.9 +/- 14.9  , TALOS: Psi 135.7 +/- 11.4 )
assign (resid  82 and name C)    (resid  83 and name  N)
       (resid  83 and name CA)   (resid  83 and name  C) 1.0  -137.9 44.6  2
assign (resid  83 and name  N)   (resid  83 and name CA)
       (resid  83 and name  C)   (resid  84 and name  N) 1.0  135.7 34.3  2
!L84 (TALOS: Phi -130.4 +/- 19.6  , TALOS: Psi 134.8 +/- 13.7 )
assign (resid  83 and name C)    (resid  84 and name  N)
       (resid  84 and name CA)   (resid  84 and name  C) 1.0  -130.4 58.7  2
assign (resid  84 and name  N)   (resid  84 and name CA)
       (resid  84 and name  C)   (resid  85 and name  N) 1.0  134.8 41.1  2
!E85 (TALOS: Phi -116.3 +/- 16.9  , TALOS: Psi 132.2 +/- 11.9 )
assign (resid  84 and name C)    (resid  85 and name  N)
       (resid  85 and name CA)   (resid  85 and name  C) 1.0  -116.3 50.6  2
assign (resid  85 and name  N)   (resid  85 and name CA)
       (resid  85 and name  C)   (resid  86 and name  N) 1.0  132.2 35.8  2
!Y86 (TALOS: Phi -134.3 +/- 9.9   , TALOS: Psi 124.5 +/- 8.9  )
assign (resid  85 and name C)    (resid  86 and name  N)
       (resid  86 and name CA)   (resid  86 and name  C) 1.0  -134.3 29.7  2
assign (resid  86 and name  N)   (resid  86 and name CA)
       (resid  86 and name  C)   (resid  87 and name  N) 1.0  124.5 26.8  2
!Y87 - this one is manual and forces 87 to be in left hand helical space
assign (resid  87 and name  N)   (resid  87 and name CA)
       (resid  87 and name  C)   (resid  88 and name CA) 1.0  40.0  20  2
!K89 (TALOS: Phi -128.0 +/- 26.0  , TALOS: Psi 148.0 +/- 13.0 )
assign (resid  88 and name C)    (resid  89 and name  N)
       (resid  89 and name CA)   (resid  89 and name  C) 1.0  -128.0 78.0  2
assign (resid  89 and name  N)   (resid  89 and name CA)
       (resid  89 and name  C)   (resid  90 and name  N) 1.0  148.0 39.0  2
!T90 (TALOS: Phi -120.4 +/- 18.6  , TALOS: Psi 127.5 +/- 12.8 )
assign (resid  89 and name C)    (resid  90 and name  N)
       (resid  90 and name CA)   (resid  90 and name  C) 1.0  -120.4 55.9  2
assign (resid  90 and name  N)   (resid  90 and name CA)
       (resid  90 and name  C)   (resid  91 and name  N) 1.0  127.5 38.4  2
!Y91 (TALOS: Phi -123.5 +/- 17.9  , TALOS: Psi 136.4 +/- 13.8 )
assign (resid  90 and name C)    (resid  91 and name  N)
       (resid  91 and name CA)   (resid  91 and name  C) 1.0  -123.5 53.6  2
assign (resid  91 and name  N)   (resid  91 and name CA)
       (resid  91 and name  C)   (resid  92 and name  N) 1.0  136.4 41.4  2
!T92 (TALOS: Phi -116.9 +/- 22.3  , TALOS: Psi 139.3 +/- 11.1 )
assign (resid  91 and name C)    (resid  92 and name  N)
       (resid  92 and name CA)   (resid  92 and name  C) 1.0  -116.9 66.9  2
assign (resid  92 and name  N)   (resid  92 and name CA)
       (resid  92 and name  C)   (resid  93 and name  N) 1.0  139.3 33.2  2
!Y93 (TALOS: Phi -138.3 +/- 22.0  , TALOS: Psi 149.6 +/- 16.5 )
assign (resid  92 and name C)    (resid  93 and name  N)
       (resid  93 and name CA)   (resid  93 and name  C) 1.0  -138.3 66.1  2
assign (resid  93 and name  N)   (resid  93 and name CA)
       (resid  93 and name  C)   (resid  94 and name  N) 1.0  149.6 49.6  2
!E94 (TALOS: Phi -134.4 +/- 10.4  , TALOS: Psi 132.6 +/- 18.9 )
assign (resid  93 and name C)    (resid  94 and name  N)
       (resid  94 and name CA)   (resid  94 and name  C) 1.0  -134.4 31.2  2
assign (resid  94 and name  N)   (resid  94 and name CA)
       (resid  94 and name  C)   (resid  95 and name  N) 1.0  132.6 56.6  2
!I95 (TALOS: Phi -70.0 +/- 16.9  , TALOS: Psi 131.8 +/- 8.7  )
assign (resid  94 and name C)    (resid  95 and name  N)
       (resid  95 and name CA)   (resid  95 and name  C) 1.0  -70.0 50.6  2
assign (resid  95 and name  N)   (resid  95 and name CA)
       (resid  95 and name  C)   (resid  96 and name  N) 1.0  131.8 26.2  2
!K97 (TALOS: Phi -147.0 +/- 9.0   , TALOS: Psi 141.0 +/- 6.0  )
assign (resid  96 and name C)    (resid  97 and name  N)
       (resid  97 and name CA)   (resid  97 and name  C) 1.0  -147.0 27.0  2
assign (resid  97 and name  N)   (resid  97 and name CA)
       (resid  97 and name  C)   (resid  98 and name  N) 1.0  141.0 20.0  2
!I98 (TALOS: Phi -119.1 +/- 18.3  , TALOS: Psi 139.7 +/- 13.0 )
assign (resid  97 and name C)    (resid  98 and name  N)
       (resid  98 and name CA)   (resid  98 and name  C) 1.0  -119.1 55.0  2
assign (resid  98 and name  N)   (resid  98 and name CA)
       (resid  98 and name  C)   (resid  99 and name  N) 1.0  139.7 38.9  2
!W99 (TALOS: Phi -136.1 +/- 17.1  , TALOS: Psi 151.7 +/- 19.9 )
assign (resid  98 and name C)    (resid  99 and name  N)
       (resid  99 and name CA)   (resid  99 and name  C) 1.0  -136.1 51.2  2
assign (resid  99 and name  N)   (resid  99 and name CA)
       (resid  99 and name  C)   (resid 100 and name  N) 1.0  151.7 59.7  2
!I100 (TALOS: Phi -107.0 +/- 32.0  , TALOS: Psi 131.0 +/- 14.0 )
assign (resid  99 and name C)    (resid 100 and name  N)
       (resid 100 and name CA)   (resid 100 and name  C) 1.0  -107.0 96.0  2
assign (resid 100 and name  N)   (resid 100 and name CA)
       (resid 100 and name  C)   (resid 101 and name  N) 1.0  131.0 42.0  2
!T101 (TALOS: Phi -125.9 +/- 23.8  , TALOS: Psi 151.3 +/- 15.4 )
assign (resid 100 and name C)    (resid 101 and name  N)
       (resid 101 and name CA)   (resid 101 and name  C) 1.0  -125.9 71.4  2
assign (resid 101 and name  N)   (resid 101 and name CA)
       (resid 101 and name  C)   (resid 102 and name  N) 1.0  151.3 46.2  2
!H102 (TALOS: Phi -84.9 +/- 19.9  , TALOS: Psi 150.1 +/- 18.8 )
assign (resid 101 and name C)    (resid 102 and name  N)
       (resid 102 and name CA)   (resid 102 and name  C) 1.0  -84.9 59.7  2
assign (resid 102 and name  N)   (resid 102 and name CA)
       (resid 102 and name  C)   (resid 103 and name  N) 1.0  150.1 56.5  2
!A103 (TALOS: Phi -63.5 +/- 8.2   , TALOS: Psi -25.6 +/- 11.2 )
assign (resid 102 and name C)    (resid 103 and name  N)
       (resid 103 and name CA)   (resid 103 and name  C) 1.0  -63.5 24.6  2
assign (resid 103 and name  N)   (resid 103 and name CA)
       (resid 103 and name  C)   (resid 104 and name  N) 1.0  -25.6 33.7  2
!D104 (TALOS: Phi -80.2 +/- 18.8  , TALOS: Psi -30.4 +/- 22.9 )
assign (resid 103 and name C)    (resid 104 and name  N)
       (resid 104 and name CA)   (resid 104 and name  C) 1.0  -80.2 56.4  2
assign (resid 104 and name  N)   (resid 104 and name CA)
       (resid 104 and name  C)   (resid 105 and name  N) 1.0  -30.4 68.6  2
!D105 (TALOS: Phi -73.0 +/- 12.1  , TALOS: Psi 122.3 +/- 28.5 )
assign (resid 104 and name C)    (resid 105 and name  N)
       (resid 105 and name CA)   (resid 105 and name  C) 1.0  -73.0 36.4  2
assign (resid 105 and name  N)   (resid 105 and name CA)
       (resid 105 and name  C)   (resid 106 and name  N) 1.0  122.3 85.5  2
!R106 (TALOS: Phi -74.0 +/- 14.0  , TALOS: Psi -36.0 +/- 18.0 )
assign (resid 105 and name C)    (resid 106 and name  N)
       (resid 106 and name CA)   (resid 106 and name  C) 1.0  -74.0 42.0  2
assign (resid 106 and name  N)   (resid 106 and name CA)
       (resid 106 and name  C)   (resid 107 and name  N) 1.0  -36.0 54.0  2
!V108 (TALOS: Phi -69.5 +/- 12.8  , TALOS: Psi -41.2 +/- 13.1 )
assign (resid 107 and name C)    (resid 108 and name  N)
       (resid 108 and name CA)   (resid 108 and name  C) 1.0  -69.5 60.0  2 ! widened to avoid violaton
assign (resid 108 and name  N)   (resid 108 and name CA)
       (resid 108 and name  C)   (resid 109 and name  N) 1.0  -41.2 39.2  2
!110 (this is artificial - trying to put phi of 110 into good space
assign (resid 109 and name C)    (resid 110 and name  N) 
       (resid 110 and name CA)   (resid 110 and name  C) 1.0  -120.0 40.0  2
!K111 (TALOS: Phi -97.0 +/- 30.0  , TALOS: Psi 137.0 +/- 13.0 )
assign (resid 110 and name C)    (resid 111 and name  N)
       (resid 111 and name CA)   (resid 111 and name  C) 1.0  -97.0 90.0  2
assign (resid 111 and name  N)   (resid 111 and name CA)
       (resid 111 and name  C)   (resid 112 and name  N) 1.0  137.0 39.0  2
!K112 (TALOS: Phi -137.5 +/- 19.9  , TALOS: Psi 152.1 +/- 13.8 )
assign (resid 111 and name C)    (resid 112 and name  N)
       (resid 112 and name CA)   (resid 112 and name  C) 1.0  -137.5 59.7  2
assign (resid 112 and name  N)   (resid 112 and name CA)
       (resid 112 and name  C)   (resid 113 and name  N) 1.0  152.1 41.3  2
!E114 (TALOS: Phi -134.1 +/- 15.6  , TALOS: Psi 125.5 +/- 27.2 )
assign (resid 113 and name C)    (resid 114 and name  N)
       (resid 114 and name CA)   (resid 114 and name  C) 1.0  -134.1 46.8  2
assign (resid 114 and name  N)   (resid 114 and name CA)
       (resid 114 and name  C)   (resid 115 and name  N) 1.0  125.5 81.7  2
!I116 (TALOS: Phi -122.1 +/- 9.7   , TALOS: Psi 138.5 +/- 17.0 )
assign (resid 115 and name C)    (resid 116 and name  N)
       (resid 116 and name CA)   (resid 116 and name  C) 1.0  -122.1 29.1  2
assign (resid 116 and name  N)   (resid 116 and name CA)
       (resid 116 and name  C)   (resid 117 and name  N) 1.0  138.5 51.1  2
!L117 (TALOS: Phi -119.9 +/- 17.7  , TALOS: Psi 127.0 +/- 6.5  )
assign (resid 116 and name C)    (resid 117 and name  N)
       (resid 117 and name CA)   (resid 117 and name  C) 1.0  -119.9 53.2  2
assign (resid 117 and name  N)   (resid 117 and name CA)
       (resid 117 and name  C)   (resid 118 and name  N) 1.0  127.0 20.0  2
!T118 (TALOS: Phi -114.8 +/- 10.6  , TALOS: Psi 126.1 +/- 9.4  )
assign (resid 117 and name C)    (resid 118 and name  N)
       (resid 118 and name CA)   (resid 118 and name  C) 1.0  -114.8 31.9  2
assign (resid 118 and name  N)   (resid 118 and name CA)
       (resid 118 and name  C)   (resid 119 and name  N) 1.0  126.1 28.3  2
!L119 (TALOS: Phi -121.9 +/- 14.6  , TALOS: Psi 133.2 +/- 8.3  )
assign (resid 118 and name C)    (resid 119 and name  N)
       (resid 119 and name CA)   (resid 119 and name  C) 1.0  -121.9 43.8  2
assign (resid 119 and name  N)   (resid 119 and name CA)
       (resid 119 and name  C)   (resid 120 and name  N) 1.0  133.2 24.8  2
!T120 (TALOS: Phi -121.6 +/- 17.6  , TALOS: Psi 143.3 +/- 11.3 )
assign (resid 119 and name C)    (resid 120 and name  N)
       (resid 120 and name CA)   (resid 120 and name  C) 1.0  -121.6 52.8  2
assign (resid 120 and name  N)   (resid 120 and name CA)
       (resid 120 and name  C)   (resid 121 and name  N) 1.0  143.3 34.0  2
!T121 (TALOS: Phi -134.9 +/- 15.9  , TALOS: Psi 140.5 +/- 18.6 )
assign (resid 120 and name C)    (resid 121 and name  N)
       (resid 121 and name CA)   (resid 121 and name  C) 1.0  -134.9 47.7  2
assign (resid 121 and name  N)   (resid 121 and name CA)
       (resid 121 and name  C)   (resid 122 and name  N) 1.0  140.5 55.7  2
!make C122 beta sheet
!assign (resid 121 and name C)    (resid 122 and name  N)
!       (resid 122 and name CA)   (resid 122 and name  C) 1.0  -110.0 70.0  2 ! make C122 beta sheet
!assign (resid 122 and name  N)   (resid 122 and name CA)
!       (resid 122 and name  C)   (resid 123 and name  N) 1.0  120.0 60.0  2 ! make C122 beta sheet
!F125 (TALOS: Phi -69.0 +/- 18.0  , TALOS: Psi -32.0 +/- 17.0 )
assign (resid 124 and name C)    (resid 125 and name  N)
       (resid 125 and name CA)   (resid 125 and name  C) 1.0  -69.0 54.0  2
assign (resid 125 and name  N)   (resid 125 and name CA)
       (resid 125 and name  C)   (resid 126 and name  N) 1.0  -32.0 51.0  2
!D126 (TALOS: Phi -89.0 +/- 18.0  , TALOS: Psi -14.0 +/- 21.0 )
assign (resid 125 and name C)    (resid 126 and name  N)
       (resid 126 and name CA)   (resid 126 and name  C) 1.0  -89.0 54.0  2
assign (resid 126 and name  N)   (resid 126 and name CA)
       (resid 126 and name  C)   (resid 127 and name  N) 1.0  -14.0 63.0  2
!Y127 (TALOS: Phi -80.0 +/- 14.0  , TALOS: Psi 134.0 +/- 12.0 )
assign (resid 126 and name C)    (resid 127 and name  N)
       (resid 127 and name CA)   (resid 127 and name  C) 1.0  -80.0 42.0  2
!assign (resid 127 and name  N)   (resid 127 and name CA)
!       (resid 127 and name  C)   (resid 128 and name  N) 1.0  134.0 36.0  2
!I128 (TALOS: Phi -107.0 +/- 25.0  , TALOS: Psi 128.0 +/- 16.0 )
!assign (resid 127 and name C)    (resid 128 and name  N)
!       (resid 128 and name CA)   (resid 128 and name  C) 1.0  -107.0 75.0  2
assign (resid 128 and name  N)   (resid 128 and name CA)
       (resid 128 and name  C)   (resid 129 and name  N) 1.0  128.0 48.0  2
!D130 (TALOS: Phi -81.3 +/- 21.7  , TALOS: Psi 132.5 +/- 11.6 )
assign (resid 129 and name C)    (resid 130 and name  N)
       (resid 130 and name CA)   (resid 130 and name  C) 1.0  -81.3 65.0  2
assign (resid 130 and name  N)   (resid 130 and name CA)
       (resid 130 and name  C)   (resid 131 and name  N) 1.0  132.5 34.8  2
!D133 (TALOS: Phi -136.0 +/- 27.0  , TALOS: Psi 148.0 +/- 11.0 )
assign (resid 132 and name C)    (resid 133 and name  N)
       (resid 133 and name CA)   (resid 133 and name  C) 1.0  -136.0 81.0  2
assign (resid 133 and name  N)   (resid 133 and name CA)
       (resid 133 and name  C)   (resid 134 and name  N) 1.0  148.0 33.0  2
!R134 (TALOS: Phi -141.0 +/- 14.0  , TALOS: Psi 137.0 +/- 11.0 )
assign (resid 133 and name C)    (resid 134 and name  N)
       (resid 134 and name CA)   (resid 134 and name  C) 1.0  -141.0 42.0  2
assign (resid 134 and name  N)   (resid 134 and name CA)
       (resid 134 and name  C)   (resid 135 and name  N) 1.0  137.0 33.0  2
!Y135 (TALOS: Phi -110.5 +/- 26.4  , TALOS: Psi 123.3 +/- 11.8 )
assign (resid 134 and name C)    (resid 135 and name  N)
       (resid 135 and name CA)   (resid 135 and name  C) 1.0  -110.5 79.3  2
assign (resid 135 and name  N)   (resid 135 and name CA)
       (resid 135 and name  C)   (resid 136 and name  N) 1.0  123.3 35.4  2
!I136 (TALOS: Phi -92.9 +/- 19.6  , TALOS: Psi 126.3 +/- 7.5  )
assign (resid 135 and name C)    (resid 136 and name  N)
       (resid 136 and name CA)   (resid 136 and name  C) 1.0  -92.9 58.9  2
assign (resid 136 and name  N)   (resid 136 and name CA)
       (resid 136 and name  C)   (resid 137 and name  N) 1.0  126.3 22.6  2
!I137 (TALOS: Phi -128.2 +/- 23.1  , TALOS: Psi 139.1 +/- 10.5 )
assign (resid 136 and name C)    (resid 137 and name  N)
       (resid 137 and name CA)   (resid 137 and name  C) 1.0  -128.2 69.2  2
assign (resid 137 and name  N)   (resid 137 and name CA)
       (resid 137 and name  C)   (resid 138 and name  N) 1.0  139.1 31.6  2
!E138 (TALOS: Phi -127.5 +/- 18.5  , TALOS: Psi 134.9 +/- 15.1 )
assign (resid 137 and name C)    (resid 138 and name  N)
       (resid 138 and name CA)   (resid 138 and name  C) 1.0  -127.5 55.4  2
assign (resid 138 and name  N)   (resid 138 and name CA)
       (resid 138 and name  C)   (resid 139 and name  N) 1.0  134.9 45.2  2
!A139 (TALOS: Phi -136.5 +/- 16.2  , TALOS: Psi 146.0 +/- 17.7 )
assign (resid 138 and name C)    (resid 139 and name  N)
       (resid 139 and name CA)   (resid 139 and name  C) 1.0  -136.5 48.7  2
assign (resid 139 and name  N)   (resid 139 and name CA)
       (resid 139 and name  C)   (resid 140 and name  N) 1.0  146.0 53.2  2
!K140 (TALOS: Phi -128.4 +/- 19.4  , TALOS: Psi 138.0 +/- 12.1 )
assign (resid 139 and name C)    (resid 140 and name  N)
       (resid 140 and name CA)   (resid 140 and name  C) 1.0  -128.4 58.2  2
assign (resid 140 and name  N)   (resid 140 and name CA)
       (resid 140 and name  C)   (resid 141 and name  N) 1.0  138.0 36.4  2
!L141 (TALOS: Phi -74.0 +/- 11.0  , TALOS: Psi 136.0 +/- 5.0  )
assign (resid 140 and name C)    (resid 141 and name  N)
       (resid 141 and name CA)   (resid 141 and name  C) 1.0  -74.0 33.0  2
assign (resid 141 and name  N)   (resid 141 and name CA)
       (resid 141 and name  C)   (resid 142 and name  N) 1.0  136.0 20.0  2
!S144 (TALOS: Phi -131.0 +/- 17.0  , TALOS: Psi 144.0 +/- 16.0 )
assign (resid 143 and name C)    (resid 144 and name  N)
       (resid 144 and name CA)   (resid 144 and name  C) 1.0  -131.0 51.0  2
assign (resid 144 and name  N)   (resid 144 and name CA)
       (resid 144 and name  C)   (resid 145 and name  N) 1.0  144.0 48.0  2
!Y145 (TALOS: Phi -131.8 +/- 22.6  , TALOS: Psi 125.4 +/- 17.1 )
assign (resid 144 and name C)    (resid 145 and name  N)
       (resid 145 and name CA)   (resid 145 and name  C) 1.0  -131.8 67.8  2
assign (resid 145 and name  N)   (resid 145 and name CA)
       (resid 145 and name  C)   (resid 146 and name  N) 1.0  125.4 51.2  2



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