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


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