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
21627 2htf 7259 cing 1-original 2 XPLOR/CNS dihedral angle


! Talos Database predictions rerun by GM 030399
! Chemical shifts corrected for deuteration HVIL labeling
! Talos recompiled without mbp in database.

! PHI restraints from Luginbuehl et al., JMR B 109(1995):229-233 
! Helix: -120...-20 = -70.0 50.0 2 
! Sheet: 160...180...-80 = -140.0 60.0 2 
! PSI restraints --- see note above 
! Helix: -100...0 = -50.0 50.0 2 
! Sheet: 40.0...180.0...-140.0 = 130.0 90.0 2 

!Talos predictions take precedance.

! Resdiue T 2 DATABASE
assign (resid 1 and name C  )(resid 2 and name N  )
       (resid 2 and name CA )(resid 2 and name C  ) 1.0 -101.57 36.68 2
assign (resid 2 and name N  )(resid 2 and name CA )
       (resid 2 and name C  )(resid 3 and name N  ) 1.0 131.99 35.48 2

! Resdiue P 3 DATABASE
assign (resid 2 and name C  )(resid 3 and name N  )
       (resid 3 and name CA )(resid 3 and name C  ) 1.0 -67.65 33.76 2
assign (resid 3 and name N  )(resid 3 and name CA )
       (resid 3 and name C  )(resid 4 and name N  ) 1.0 140.73 29.58 2

! Resdiue V 11 DATABASE
assign (resid 10 and name C  )(resid 11 and name N  )
       (resid 11 and name CA )(resid 11 and name C  ) 1.0 -97.60 28.14 2
assign (resid 11 and name N  )(resid 11 and name CA )
       (resid 11 and name C  )(resid 12 and name N  ) 1.0 133.86 25.74 2

! Resid A 12 --- strand CSI
assign (resid 11 and name C  )(resid 12 and name N )
       (resid 12 and name CA )(resid 12 and name C ) 1.0 -140.0 60.0 2
assign (resid 12 and name N  )(resid 12 and name CA )
       (resid 12 and name C  )(resid 13 and name N ) 1.0 130.0 90.0 2

! Resdiue I 13 DATABASE
assign (resid 12 and name C  )(resid 13 and name N  )
       (resid 13 and name CA )(resid 13 and name C  ) 1.0 -118.89 22.00 2
assign (resid 13 and name N  )(resid 13 and name CA )
       (resid 13 and name C  )(resid 14 and name N  ) 1.0 137.68 24.86 2

! Resdiue Y 14 DATABASE
assign (resid 13 and name C  )(resid 14 and name N  )
       (resid 14 and name CA )(resid 14 and name C  ) 1.0 -129.74 20.00 2
assign (resid 14 and name N  )(resid 14 and name CA )
       (resid 14 and name C  )(resid 15 and name N  ) 1.0 129.31 30.04 2

! Resdiue L 15 DATABASE
assign (resid 14 and name C  )(resid 15 and name N  )
       (resid 15 and name CA )(resid 15 and name C  ) 1.0 -104.59 47.14 2
assign (resid 15 and name N  )(resid 15 and name CA )
       (resid 15 and name C  )(resid 16 and name N  ) 1.0 122.46 31.88 2

! Resdiue E 17 DATABASE
assign (resid 16 and name C  )(resid 17 and name N  )
       (resid 17 and name CA )(resid 17 and name C  ) 1.0 -64.06 22.72 2
assign (resid 17 and name N  )(resid 17 and name CA )
       (resid 17 and name C  )(resid 18 and name N  ) 1.0 -33.95 21.34 2

! Resdiue R 22 DATABASE
assign (resid 21 and name C  )(resid 22 and name N  )
       (resid 22 and name CA )(resid 22 and name C  ) 1.0 -57.97 20.00 2
assign (resid 22 and name N  )(resid 22 and name CA )
       (resid 22 and name C  )(resid 23 and name N  ) 1.0 -37.30 21.74 2

! Resdiue S 23 DATABASE
assign (resid 22 and name C  )(resid 23 and name N  )
       (resid 23 and name CA )(resid 23 and name C  ) 1.0 -66.13 20.00 2
assign (resid 23 and name N  )(resid 23 and name CA )
       (resid 23 and name C  )(resid 24 and name N  ) 1.0 -35.85 20.00 2

! Resdiue R 24 DATABASE
assign (resid 23 and name C  )(resid 24 and name N  )
       (resid 24 and name CA )(resid 24 and name C  ) 1.0 -66.73 20.00 2
assign (resid 24 and name N  )(resid 24 and name CA )
       (resid 24 and name C  )(resid 25 and name N  ) 1.0 -41.87 20.00 2

! Resdiue R 25 DATABASE
assign (resid 24 and name C  )(resid 25 and name N  )
       (resid 25 and name CA )(resid 25 and name C  ) 1.0 -63.38 20.00 2
assign (resid 25 and name N  )(resid 25 and name CA )
       (resid 25 and name C  )(resid 26 and name N  ) 1.0 -38.94 20.00 2

! Resdiue A 26 DATABASE
assign (resid 25 and name C  )(resid 26 and name N  )
       (resid 26 and name CA )(resid 26 and name C  ) 1.0 -65.06 20.00 2
assign (resid 26 and name N  )(resid 26 and name CA )
       (resid 26 and name C  )(resid 27 and name N  ) 1.0 -40.27 20.00 2

! Resdiue F 27 DATABASE
assign (resid 26 and name C  )(resid 27 and name N  )
       (resid 27 and name CA )(resid 27 and name C  ) 1.0 -69.06 20.00 2
assign (resid 27 and name N  )(resid 27 and name CA )
       (resid 27 and name C  )(resid 28 and name N  ) 1.0 -38.88 20.00 2

! Resdiue L 28 DATABASE
assign (resid 27 and name C  )(resid 28 and name N  )
       (resid 28 and name CA )(resid 28 and name C  ) 1.0 -63.96 20.00 2
assign (resid 28 and name N  )(resid 28 and name CA )
       (resid 28 and name C  )(resid 29 and name N  ) 1.0 -41.76 20.00 2

! Resdiue T 29 DATABASE
assign (resid 28 and name C  )(resid 29 and name N  )
       (resid 29 and name CA )(resid 29 and name C  ) 1.0 -62.87 20.00 2
assign (resid 29 and name N  )(resid 29 and name CA )
       (resid 29 and name C  )(resid 30 and name N  ) 1.0 -43.16 20.00 2

! Resdiue G 30 DATABASE
assign (resid 29 and name C  )(resid 30 and name N  )
       (resid 30 and name CA )(resid 30 and name C  ) 1.0 -64.25 20.00 2
assign (resid 30 and name N  )(resid 30 and name CA )
       (resid 30 and name C  )(resid 31 and name N  ) 1.0 -38.73 20.00 2

! Resdiue L 31 DATABASE
assign (resid 30 and name C  )(resid 31 and name N  )
       (resid 31 and name CA )(resid 31 and name C  ) 1.0 -66.60 20.00 2
assign (resid 31 and name N  )(resid 31 and name CA )
       (resid 31 and name C  )(resid 32 and name N  ) 1.0 -37.65 20.00 2

! Resdiue A 32 DATABASE
assign (resid 31 and name C  )(resid 32 and name N  )
       (resid 32 and name CA )(resid 32 and name C  ) 1.0 -64.09 20.00 2
assign (resid 32 and name N  )(resid 32 and name CA )
       (resid 32 and name C  )(resid 33 and name N  ) 1.0 -40.26 20.00 2

! Resdiue R 33 DATABASE
assign (resid 32 and name C  )(resid 33 and name N  )
       (resid 33 and name CA )(resid 33 and name C  ) 1.0 -62.98 20.00 2
assign (resid 33 and name N  )(resid 33 and name CA )
       (resid 33 and name C  )(resid 34 and name N  ) 1.0 -37.01 20.00 2

! Resdiue S 34 DATABASE
assign (resid 33 and name C  )(resid 34 and name N  )
       (resid 34 and name CA )(resid 34 and name C  ) 1.0 -64.95 20.00 2
assign (resid 34 and name N  )(resid 34 and name CA )
       (resid 34 and name C  )(resid 35 and name N  ) 1.0 -26.58 29.48 2

! Resid G 36 --- strand CSI
assign (resid 35 and name C  )(resid 36 and name N )
       (resid 36 and name CA )(resid 36 and name C ) 1.0 -140.0 60.0 2
assign (resid 36 and name N  )(resid 36 and name CA )
       (resid 36 and name C  )(resid 37 and name N ) 1.0 130.0 90.0 2

! Resid F 37 --- strand CSI
assign (resid 36 and name C  )(resid 37 and name N )
       (resid 37 and name CA )(resid 37 and name C ) 1.0 -140.0 60.0 2
assign (resid 37 and name N  )(resid 37 and name CA )
       (resid 37 and name C  )(resid 38 and name N ) 1.0 130.0 90.0 2

! Resid R 38 --- strand CSI
assign (resid 37 and name C  )(resid 38 and name N )
       (resid 38 and name CA )(resid 38 and name C ) 1.0 -140.0 60.0 2
assign (resid 38 and name N  )(resid 38 and name CA )
       (resid 38 and name C  )(resid 39 and name N ) 1.0 130.0 90.0 2

! Resdiue V 39 DATABASE
assign (resid 38 and name C  )(resid 39 and name N  )
       (resid 39 and name CA )(resid 39 and name C  ) 1.0 -112.62 34.02 2
assign (resid 39 and name N  )(resid 39 and name CA )
       (resid 39 and name C  )(resid 40 and name N  ) 1.0 124.19 20.00 2

! Resdiue L 40 DATABASE
assign (resid 39 and name C  )(resid 40 and name N  )
       (resid 40 and name CA )(resid 40 and name C  ) 1.0 -99.51 35.10 2
assign (resid 40 and name N  )(resid 40 and name CA )
       (resid 40 and name C  )(resid 41 and name N  ) 1.0 126.82 29.46 2

! Resid D 41 --- strand CSI
assign (resid 40 and name C  )(resid 41 and name N )
       (resid 41 and name CA )(resid 41 and name C ) 1.0 -140.0 60.0 2
assign (resid 41 and name N  )(resid 41 and name CA )
       (resid 41 and name C  )(resid 42 and name N ) 1.0 130.0 90.0 2

! Resdiue A 42 DATABASE
assign (resid 41 and name C  )(resid 42 and name N  )
       (resid 42 and name CA )(resid 42 and name C  ) 1.0 -120.36 41.28 2
assign (resid 42 and name N  )(resid 42 and name CA )
       (resid 42 and name C  )(resid 43 and name N  ) 1.0 151.90 36.88 2

! Resdiue S 45 DATABASE
assign (resid 44 and name C  )(resid 45 and name N  )
       (resid 45 and name CA )(resid 45 and name C  ) 1.0 -73.17 29.16 2
assign (resid 45 and name N  )(resid 45 and name CA )
       (resid 45 and name C  )(resid 46 and name N  ) 1.0 -20.56 25.98 2

! Resdiue E 46 DATABASE
assign (resid 45 and name C  )(resid 46 and name N  )
       (resid 46 and name CA )(resid 46 and name C  ) 1.0 -85.57 38.42 2
assign (resid 46 and name N  )(resid 46 and name CA )
       (resid 46 and name C  )(resid 47 and name N  ) 1.0 -17.61 44.24 2

! Resid T 48 --- strand CSI
assign (resid 47 and name C  )(resid 48 and name N )
       (resid 48 and name CA )(resid 48 and name C ) 1.0 -140.0 60.0 2
assign (resid 48 and name N  )(resid 48 and name CA )
       (resid 48 and name C  )(resid 49 and name N ) 1.0 130.0 90.0 2

! Resid H 49 --- strand CSI
assign (resid 48 and name C  )(resid 49 and name N )
       (resid 49 and name CA )(resid 49 and name C ) 1.0 -140.0 60.0 2
assign (resid 49 and name N  )(resid 49 and name CA )
       (resid 49 and name C  )(resid 50 and name N ) 1.0 130.0 90.0 2

! Resdiue V 50 DATABASE
assign (resid 49 and name C  )(resid 50 and name N  )
       (resid 50 and name CA )(resid 50 and name C  ) 1.0 -115.28 23.12 2
assign (resid 50 and name N  )(resid 50 and name CA )
       (resid 50 and name C  )(resid 51 and name N  ) 1.0 126.55 27.84 2

! Resdiue V 51 DATABASE
assign (resid 50 and name C  )(resid 51 and name N  )
       (resid 51 and name CA )(resid 51 and name C  ) 1.0 -117.84 21.24 2
assign (resid 51 and name N  )(resid 51 and name CA )
       (resid 51 and name C  )(resid 52 and name N  ) 1.0 131.27 29.06 2

! Resdiue M 52 DATABASE
assign (resid 51 and name C  )(resid 52 and name N  )
       (resid 52 and name CA )(resid 52 and name C  ) 1.0 -125.74 26.14 2
assign (resid 52 and name N  )(resid 52 and name CA )
       (resid 52 and name C  )(resid 53 and name N  ) 1.0 136.38 30.32 2

! Resdiue E 53 DATABASE
assign (resid 52 and name C  )(resid 53 and name N  )
       (resid 53 and name CA )(resid 53 and name C  ) 1.0 -124.26 57.50 2
assign (resid 53 and name N  )(resid 53 and name CA )
       (resid 53 and name C  )(resid 54 and name N  ) 1.0 147.52 30.94 2

! Resdiue T 55 DATABASE
assign (resid 54 and name C  )(resid 55 and name N  )
       (resid 55 and name CA )(resid 55 and name C  ) 1.0 -115.94 47.20 2
assign (resid 55 and name N  )(resid 55 and name CA )
       (resid 55 and name C  )(resid 56 and name N  ) 1.0 138.38 47.10 2

! Resdiue S 56 DATABASE
assign (resid 55 and name C  )(resid 56 and name N  )
       (resid 56 and name CA )(resid 56 and name C  ) 1.0 -92.50 51.96 2
assign (resid 56 and name N  )(resid 56 and name CA )
       (resid 56 and name C  )(resid 57 and name N  ) 1.0 154.63 46.46 2

! Resdiue A 57 DATABASE
assign (resid 56 and name C  )(resid 57 and name N  )
       (resid 57 and name CA )(resid 57 and name C  ) 1.0 -60.66 20.00 2
assign (resid 57 and name N  )(resid 57 and name CA )
       (resid 57 and name C  )(resid 58 and name N  ) 1.0 -39.54 21.24 2

! Resdiue E 58 DATABASE
assign (resid 57 and name C  )(resid 58 and name N  )
       (resid 58 and name CA )(resid 58 and name C  ) 1.0 -63.27 20.00 2
assign (resid 58 and name N  )(resid 58 and name CA )
       (resid 58 and name C  )(resid 59 and name N  ) 1.0 -43.24 20.00 2

! Resdiue E 59 DATABASE
assign (resid 58 and name C  )(resid 59 and name N  )
       (resid 59 and name CA )(resid 59 and name C  ) 1.0 -65.42 20.00 2
assign (resid 59 and name N  )(resid 59 and name CA )
       (resid 59 and name C  )(resid 60 and name N  ) 1.0 -40.17 20.00 2

! Resdiue A 60 DATABASE
assign (resid 59 and name C  )(resid 60 and name N  )
       (resid 60 and name CA )(resid 60 and name C  ) 1.0 -66.16 20.00 2
assign (resid 60 and name N  )(resid 60 and name CA )
       (resid 60 and name C  )(resid 61 and name N  ) 1.0 -42.14 20.00 2

! Resdiue V 61 DATABASE
assign (resid 60 and name C  )(resid 61 and name N  )
       (resid 61 and name CA )(resid 61 and name C  ) 1.0 -62.70 20.00 2
assign (resid 61 and name N  )(resid 61 and name CA )
       (resid 61 and name C  )(resid 62 and name N  ) 1.0 -45.59 22.36 2

! Resdiue S 62 DATABASE
assign (resid 61 and name C  )(resid 62 and name N  )
       (resid 62 and name CA )(resid 62 and name C  ) 1.0 -63.52 20.00 2
assign (resid 62 and name N  )(resid 62 and name CA )
       (resid 62 and name C  )(resid 63 and name N  ) 1.0 -38.65 20.00 2

! Resdiue W 63 DATABASE
assign (resid 62 and name C  )(resid 63 and name N  )
       (resid 63 and name CA )(resid 63 and name C  ) 1.0 -67.42 20.00 2
assign (resid 63 and name N  )(resid 63 and name CA )
       (resid 63 and name C  )(resid 64 and name N  ) 1.0 -43.52 20.00 2

! Resdiue Q 64 DATABASE
assign (resid 63 and name C  )(resid 64 and name N  )
       (resid 64 and name CA )(resid 64 and name C  ) 1.0 -64.27 20.00 2
assign (resid 64 and name N  )(resid 64 and name CA )
       (resid 64 and name C  )(resid 65 and name N  ) 1.0 -39.97 20.00 2

! Resdiue E 65 DATABASE
assign (resid 64 and name C  )(resid 65 and name N  )
       (resid 65 and name CA )(resid 65 and name C  ) 1.0 -67.98 20.00 2
assign (resid 65 and name N  )(resid 65 and name CA )
       (resid 65 and name C  )(resid 66 and name N  ) 1.0 -39.39 20.00 2

! Resdiue R 66 DATABASE
assign (resid 65 and name C  )(resid 66 and name N  )
       (resid 66 and name CA )(resid 66 and name C  ) 1.0 -64.38 20.00 2
assign (resid 66 and name N  )(resid 66 and name CA )
       (resid 66 and name C  )(resid 67 and name N  ) 1.0 -41.53 20.00 2

! Resdiue R 67 DATABASE
assign (resid 66 and name C  )(resid 67 and name N  )
       (resid 67 and name CA )(resid 67 and name C  ) 1.0 -64.52 20.00 2
assign (resid 67 and name N  )(resid 67 and name CA )
       (resid 67 and name C  )(resid 68 and name N  ) 1.0 -38.61 20.00 2

! Resdiue M 68 DATABASE
assign (resid 67 and name C  )(resid 68 and name N  )
       (resid 68 and name CA )(resid 68 and name C  ) 1.0 -65.56 20.00 2
assign (resid 68 and name N  )(resid 68 and name CA )
       (resid 68 and name C  )(resid 69 and name N  ) 1.0 -38.43 20.00 2

! Resdiue A 69 DATABASE
assign (resid 68 and name C  )(resid 69 and name N  )
       (resid 69 and name CA )(resid 69 and name C  ) 1.0 -72.98 20.00 2
assign (resid 69 and name N  )(resid 69 and name CA )
       (resid 69 and name C  )(resid 70 and name N  ) 1.0 -31.25 22.24 2

! Resdiue A 71 DATABASE
assign (resid 70 and name C  )(resid 71 and name N  )
       (resid 71 and name CA )(resid 71 and name C  ) 1.0 -76.63 23.20 2
assign (resid 71 and name N  )(resid 71 and name CA )
       (resid 71 and name C  )(resid 72 and name N  ) 1.0 142.38 29.04 2

! Resdiue C 75 DATABASE
assign (resid 74 and name C  )(resid 75 and name N  )
       (resid 75 and name CA )(resid 75 and name C  ) 1.0 -85.27 48.34 2
assign (resid 75 and name N  )(resid 75 and name CA )
       (resid 75 and name C  )(resid 76 and name N  ) 1.0 136.20 35.44 2

! Resdiue T 76 DATABASE
assign (resid 75 and name C  )(resid 76 and name N  )
       (resid 76 and name CA )(resid 76 and name C  ) 1.0 -93.04 61.98 2
assign (resid 76 and name N  )(resid 76 and name CA )
       (resid 76 and name C  )(resid 77 and name N  ) 1.0 132.85 36.78 2

! Resdiue L 80 DATABASE
assign (resid 79 and name C  )(resid 80 and name N  )
       (resid 80 and name CA )(resid 80 and name C  ) 1.0 -95.53 25.50 2
assign (resid 80 and name N  )(resid 80 and name CA )
       (resid 80 and name C  )(resid 81 and name N  ) 1.0 120.30 25.54 2

! Resdiue L 81 DATABASE
assign (resid 80 and name C  )(resid 81 and name N  )
       (resid 81 and name CA )(resid 81 and name C  ) 1.0 -131.19 49.56 2
assign (resid 81 and name N  )(resid 81 and name CA )
       (resid 81 and name C  )(resid 82 and name N  ) 1.0 151.20 40.50 2

! Resdiue D 82 DATABASE
assign (resid 81 and name C  )(resid 82 and name N  )
       (resid 82 and name CA )(resid 82 and name C  ) 1.0 -136.18 31.88 2
assign (resid 82 and name N  )(resid 82 and name CA )
       (resid 82 and name C  )(resid 83 and name N  ) 1.0 149.10 37.24 2

! Resdiue I 83 DATABASE
assign (resid 82 and name C  )(resid 83 and name N  )
       (resid 83 and name CA )(resid 83 and name C  ) 1.0 -92.69 38.66 2

! Resdiue S 84 DATABASE
assign (resid 84 and name N  )(resid 84 and name CA )
       (resid 84 and name C  )(resid 85 and name N  ) 1.0 -35.21 20.00 2

! Resdiue W 85 DATABASE
assign (resid 84 and name C  )(resid 85 and name N  )
       (resid 85 and name CA )(resid 85 and name C  ) 1.0 -64.73 20.00 2
assign (resid 85 and name N  )(resid 85 and name CA )
       (resid 85 and name C  )(resid 86 and name N  ) 1.0 -47.07 20.00 2

! Resdiue L 86 DATABASE
assign (resid 85 and name C  )(resid 86 and name N  )
       (resid 86 and name CA )(resid 86 and name C  ) 1.0 -61.28 20.00 2
assign (resid 86 and name N  )(resid 86 and name CA )
       (resid 86 and name C  )(resid 87 and name N  ) 1.0 -44.86 20.00 2

! Resdiue T 87 DATABASE
assign (resid 86 and name C  )(resid 87 and name N  )
       (resid 87 and name CA )(resid 87 and name C  ) 1.0 -63.57 20.00 2
assign (resid 87 and name N  )(resid 87 and name CA )
       (resid 87 and name C  )(resid 88 and name N  ) 1.0 -39.23 20.00 2

! Resdiue E 88 DATABASE
assign (resid 87 and name C  )(resid 88 and name N  )
       (resid 88 and name CA )(resid 88 and name C  ) 1.0 -63.40 20.00 2
assign (resid 88 and name N  )(resid 88 and name CA )
       (resid 88 and name C  )(resid 89 and name N  ) 1.0 -40.99 20.00 2

! Resdiue S 89 DATABASE
assign (resid 88 and name C  )(resid 89 and name N  )
       (resid 89 and name CA )(resid 89 and name C  ) 1.0 -63.71 20.00 2
assign (resid 89 and name N  )(resid 89 and name CA )
       (resid 89 and name C  )(resid 90 and name N  ) 1.0 -43.00 20.00 2

! Resdiue L 90 DATABASE
assign (resid 89 and name C  )(resid 90 and name N  )
       (resid 90 and name CA )(resid 90 and name C  ) 1.0 -62.96 20.00 2
assign (resid 90 and name N  )(resid 90 and name CA )
       (resid 90 and name C  )(resid 91 and name N  ) 1.0 -39.18 20.00 2

! Resdiue G 91 DATABASE
assign (resid 90 and name C  )(resid 91 and name N  )
       (resid 91 and name CA )(resid 91 and name C  ) 1.0 -65.30 23.32 2
assign (resid 91 and name N  )(resid 91 and name CA )
       (resid 91 and name C  )(resid 92 and name N  ) 1.0 -32.02 20.00 2

! Resdiue A 92 DATABASE
assign (resid 91 and name C  )(resid 92 and name N  )
       (resid 92 and name CA )(resid 92 and name C  ) 1.0 -90.34 32.40 2
assign (resid 92 and name N  )(resid 92 and name CA )
       (resid 92 and name C  )(resid 93 and name N  ) 1.0 -2.85 30.10 2

! Resdiue Q 94 DATABASE
assign (resid 93 and name C  )(resid 94 and name N  )
       (resid 94 and name CA )(resid 94 and name C  ) 1.0 -104.93 60.54 2
assign (resid 94 and name N  )(resid 94 and name CA )
       (resid 94 and name C  )(resid 95 and name N  ) 1.0 148.01 27.56 2

! Resdiue V 96 DATABASE
assign (resid 95 and name C  )(resid 96 and name N  )
       (resid 96 and name CA )(resid 96 and name C  ) 1.0 -86.98 40.72 2
assign (resid 96 and name N  )(resid 96 and name CA )
       (resid 96 and name C  )(resid 97 and name N  ) 1.0 141.81 41.02 2

! Resdiue E 99 DATABASE
assign (resid 98 and name C  )(resid 99 and name N  )
       (resid 99 and name CA )(resid 99 and name C  ) 1.0 -108.24 48.90 2
assign (resid 99 and name N  )(resid 99 and name CA )
       (resid 99 and name C  )(resid 100 and name N  ) 1.0 161.69 20.14 2

! Resdiue C 100 DATABASE
assign (resid 99 and name C  )(resid 100 and name N  )
       (resid 100 and name CA )(resid 100 and name C  ) 1.0 -58.58 20.00 2
assign (resid 100 and name N  )(resid 100 and name CA )
       (resid 100 and name C  )(resid 101 and name N  ) 1.0 -42.14 20.00 2

! Resdiue R 101 DATABASE
assign (resid 100 and name C  )(resid 101 and name N  )
       (resid 101 and name CA )(resid 101 and name C  ) 1.0 -69.56 26.94 2
assign (resid 101 and name N  )(resid 101 and name CA )
       (resid 101 and name C  )(resid 102 and name N  ) 1.0 -26.60 33.58 2

! Resdiue H 102 DATABASE
assign (resid 101 and name C  )(resid 102 and name N  )
       (resid 102 and name CA )(resid 102 and name C  ) 1.0 -83.44 50.42 2
assign (resid 102 and name N  )(resid 102 and name CA )
       (resid 102 and name C  )(resid 103 and name N  ) 1.0 -31.51 39.62 2

! Resdiue R 103 DATABASE
assign (resid 102 and name C  )(resid 103 and name N  )
       (resid 103 and name CA )(resid 103 and name C  ) 1.0 -94.46 35.38 2
assign (resid 103 and name N  )(resid 103 and name CA )
       (resid 103 and name C  )(resid 104 and name N  ) 1.0 -12.87 36.90 2


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