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
648198 6rc7 34392 cing 1-original 2 DYANA/DIANA dihedral angle


# Restraints file 2: ct3nk_talos_161215.aco
# REMARK  error margins are set to conservative default values of double the standard deviation 
#         observed in TALOS-N capped at a minimum of +/-20 degree.

# Phi/Psi Angles From 'Strong' Predictions 
   1   LEU  CHI1    150.0   210.0
   2   LYS+ PHI    -130.5   -90.5
   2   LYS+ PSI     118.6   160.8
   2   LYS+ CHI1    -90.0   -30.0
   3   CYSQ PHI    -130.1   -90.1
   3   CYSQ PSI     109.1   149.1
   3   CYSQ CHI1    -90.0   -30.0
   4   ASN  CHI1    150.0   210.0
   5   LYS+ PHI    -147.5   -66.9
#   5   LYS+ PSI     108.2   167.7
   5   LYS+ CHI1    -90.0   -30.0
   6   LEU  CHI1    150.0   210.0
   7   ILE  PHI    -128.4   -75.6
   7   ILE  PSI     104.8   144.8
   7   ILE  CHI1    -90.0   -30.0
   8   PROX OMEGA   160.0   200.0
#   8   PROX CHI1     30.0    90.0
   9   LEU  CHI1     30.0    90.0
  10   ALA  PHI    -157.8   -80.3
  10   ALA  PSI     104.2   165.5
  11   TYR  PHI    -147.6   -88.1
  11   TYR  PSI     115.9   166.6
  11   TYR  CHI1     30.0    90.0
  12   LYS+ PHI    -152.1  -112.1
  12   LYS+ PSI     127.1   167.1
  13   THR  PHI    -128.1   -68.3
  13   THR  PSI     108.0   148.0
  13   THR  CHI1    -90.0   -30.0
  14   CYSQ PHI    -168.9   -77.2
  14   CYSQ CHI1    -90.0   -30.0
#  14   CYSQ PSI      99.8   186.4
  15   PROX PHI     -87.4   -47.4
#  15   PROX CHI1    -90.0   -30.0
#  15   PROX PSI     128.1   178.1  #widened up
  16   ALA  PHI     -75.8   -35.8
  16   ALA  PSI     114.3   154.3
  17   GLY  PHI      73.9   113.9
  17   GLY  PSI     -28.9    11.1
  18   LYS+ PHI    -109.2   -50.7
  18   LYS+ PSI     102.8   169.2
  18   LYS+ CHI1    -90.0   -30.0
  19   ASN  CHI1     30.0    90.0
  20   LEU  PHI    -149.2   -98.7
  20   LEU  PSI     121.1   161.1
  20   LEU  CHI1    -90.0   -30.0
  21   CYSQ PHI    -145.4  -105.4
  21   CYSQ PSI     128.6   168.6
  21   CYSQ CHI1    -90.0   -30.0
  22   TYR  PHI    -147.9  -107.9
  22   TYR  PSI     125.0   165.0
  22   TYR  CHI1     30.0    90.0
  23   LYS+ PHI    -147.5   -94.9
  23   LYS+ PSI     115.2   155.2
  23   LYS+ CHI1     30.0    90.0
  24   MET  PHI    -147.2  -104.2
  24   MET  PSI     110.0   169.7
#  24   MET  CHI1    -90.0   -30.0
  25   PHE  PHI    -130.2   -90.2
  25   PHE  PSI     105.7   145.7
  25   PHE  CHI1    -90.0   -30.0
  26   MET  PHI    -121.9   -81.9
  26   MET  PSI     102.7   142.7
  26   MET  CHI1    -90.0   -30.0
  27   VAL  CHI1     30.0    90.0
#  30   LYS+ CHI1     30.0    90.0
  31   THR  CHI1    -90.0   -30.0
  32   VAL  PHI    -140.1   -86.3
  32   VAL  PSI     103.5   153.5
  32   VAL  CHI1    150.0   210.0
  33   PROX PHI     -87.3   -47.3
  33   PROX CHI1     30.0    90.0
#  33   PROX PSI     121.2   161.2
  35   LYS+ PHI    -158.5  -102.0
  35   LYS+ PSI     126.0   166.0
  36   ARG+ PHI    -157.8  -115.7
  36   ARG+ PSI     125.7   165.7
  37   GLY  PHI    -196.6  -121.5
  37   GLY  PSI     138.7   211.8
  38   CYSQ PHI    -156.1  -105.2
  38   CYSQ PSI     125.5   165.5
  38   CYSQ CHI1    -90.0   -30.0
  39   ILE  PHI    -146.8   -94.1
  39   ILE  PSI     103.5   157.4
  39   ILE  CHI1    150.0   210.0
  42   CYSQ PHI     -95.8   -47.3
  42   CYSQ PSI     111.9   172.5
  43   PROX PHI     -87.3   -47.3
  43   PROX OMEGA   160.0   200.0
#  43   PROX PSI     129.8   169.8
  44   LYS+ PHI    -120.3   -51.3
  44   LYS+ PSI     108.7   155.4
  45   ASN  PHI    -124.5   -52.7
  45   ASN  PSI     105.4   151.3
  46   SER  PHI    -160.1  -108.8
  46   SER  PSI     130.9   174.7
  49   VAL  PHI    -139.6   -89.7
  49   VAL  PSI     112.4   152.4
  50   LYS+ PHI    -142.8   -93.9
  50   LYS+ PSI     119.4   159.4
  50   LYS+ CHI1    150.0   210.0
  51   TYR  PHI    -147.8   -94.7
  51   TYR  PSI     113.8   156.6
  51   TYR  CHI1    -90.0   -30.0
  52   VAL  PHI    -132.1   -92.1
  52   VAL  PSI     110.1   150.1
  52   VAL  CHI1    150.0   210.0
  53   CYSQ PHI    -147.8  -107.8
  53   CYSQ PSI     120.7   169.1
  54   CYSQ PHI    -162.1   -97.4
  54   CYSQ PSI     118.4   168.2
  54   CYSQ CHI1     30.0    90.0
  56   THR  PHI    -152.9  -112.9
  56   THR  PSI     134.0   174.0
  56   THR  CHI1     30.0    90.0
#  58   ARG+ CHI1    -90.0   -30.0
  59   CYSQ CHI1     30.0    90.0
  60   ASN  CHI1     30.0    90.0

# Phi/Psi Angles From 'Generous' Predictions 
   4   ASN  PHI    -153.7   -71.6
   4   ASN  PSI      98.2   178.4
  57   ASP  PHI     -88.5   -48.5
  57   ASP  PSI     117.0   157.9


Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Friday, May 17, 2024 12:32:37 PM GMT (wattos1)