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 subtype subsubtype
2050 1bc6 4268 cing 1-original 1 DYANA/DIANA distance NOE simple


  1 ALA 
         HA     36 PRO  HB3     6.00   
         HA     41 ASP- HN      4.40   
         QB     36 PRO  HA      3.40   
         QB     36 PRO  HB2     5.30   
         QB     36 PRO  HB3     3.70   
         QB     36 PRO  QG      7.88   
         QB     39 CYS  HB2     4.00   
  2 TYR 
         HN     39 CYS  HB2     4.10   
         HA      3 VAL  HN      2.70   
         HA      3 VAL  QQG     7.70   
         HA     56 HIS  HA      2.40   
         HA     56 HIS  QB      6.58   
         HA     56 HIS  HD2     6.00   
         HA     57 GLU- HN      4.70   
         QB     34 ILE  HB      6.88   
         QR     41 ASP- HN      6.50   
         QR     41 ASP- QB      9.28   
  3 VAL 
         N      55 TYR  O       3.30   
         HN      3 VAL  HB      3.00   
         HN      4 ILE  HN      6.00   
         HN     55 TYR  HN      3.60   
         HN     55 TYR  HA      4.60   
         HN     55 TYR  HB2     6.00   
         HN     55 TYR  QD      8.00   
         HN     55 TYR  O       2.40   
         HN     56 HIS  HA      2.90   
         HN     60 VAL  QG2     6.80   
         HA      4 ILE  HN      3.10   
         HA      4 ILE  QG2     5.30   
         HA     34 ILE  HN      4.70   
         HA     34 ILE  HB      6.00   
         HA     71 ASN  QD2     7.00   
         HB      4 ILE  HN      5.10   
         HB     55 TYR  HN      6.00   
         HB     57 GLU- HA      4.90   
         HB     60 VAL  QG2     4.10   
         QQG     4 ILE  HN      5.80   
         QQG     5 THR  HN      8.40   
         QQG    55 TYR  HN      8.40   
         QQG    55 TYR  QD      10.40  
         QQG    57 GLU- HN      7.30   
         QQG    57 GLU- QB      6.08   
         QQG    60 VAL  QG1     6.70   
         QQG    60 VAL  QG2     6.20   
         QQG    67 TYR  HN      8.40   
         QQG    67 TYR  HB2     6.40   
         QQG    67 TYR  HB3     8.30   
         QQG    68 ILE  HN      7.00   
         QQG    68 ILE  HA      4.80   
         QQG    68 ILE  HB      7.90   
         QQG    68 ILE  QG2     5.90   
         QQG    68 ILE  QG1     6.58   
         QQG    68 ILE  QD1     5.80   
         QQG    71 ASN  HN      6.00   
         QQG    71 ASN  HB2     7.60   
         QQG    71 ASN  QD2     7.30   
  4 ILE 
         HN      4 ILE  HA      2.90   
         HN      4 ILE  HB      2.90   
         HN      4 ILE  QG2     3.40   
         HN     33 TYR  QE      8.00   
         HN     34 ILE  HN      4.10   
         HN     71 ASN  QD2     5.30   
         HA      5 THR  HN      2.50   
         HA     54 ILE  HA      3.90   
         HA     55 TYR  HN      3.60   
         HB     31 GLN  QE2     6.87   
         HB     33 TYR  HA      4.40   
         HB     71 ASN  HN      6.00   
         HB     71 ASN  QD2     6.70   
         QG2    33 TYR  HA      3.80   
         QG2    33 TYR  HB2     6.30   
         QG2    33 TYR  QE      6.80   
         QG2    71 ASN  HB2     5.80   
         QG1     5 THR  HN      6.90   
         QG1     5 THR  HA      7.00   
         QG1     9 ILE  QD1     6.80   
         QG1    33 TYR  HA      6.00   
         QG1    33 TYR  QD      9.00   
         QG1    55 TYR  HN      6.80   
         QG1    67 TYR  QD      9.00   
  5 THR 
         HN      5 THR  HB      3.90   
         HN      5 THR  QG2     4.00   
         HA      5 THR  HB      2.80   
         HA      5 THR  QG2     3.40   
         HA     67 TYR  HB2     4.50   
         HA     67 TYR  HB3     3.80   
         HA     67 TYR  QD      5.70   
         HA     67 TYR  QE      7.40   
         HB      7 PRO  HD2     3.60   
         HB      7 PRO  HD3     6.00   
         HB     55 TYR  QD      8.00   
         HB     64 TRP  QB      6.38   
         HB     64 TRP  HD1     5.80   
         HB     64 TRP  HE3     4.90   
         HB     67 TYR  QD      6.20   
         HB     67 TYR  QE      7.20   
         QG2     7 PRO  HD2     4.70   
         QG2    55 TYR  HN      5.00   
         QG2    55 TYR  HB2     7.00   
         QG2    55 TYR  QD      6.90   
         QG2    55 TYR  QE      7.10   
         QG2    60 VAL  HA      3.70   
         QG2    60 VAL  QG2     4.40   
         QG2    61 PRO  HD2     7.00   
         QG2    64 TRP  QB      5.28   
         QG2    64 TRP  HE3     4.10   
         QG2    67 TYR  QD      6.80   
         QG2    67 TYR  QE      9.00   
  6 GLU-
         HA      6 GLU- HB2     2.90   
         HA      6 GLU- HB3     2.80   
         HA      6 GLU- HG2     4.10   
         HA      6 GLU- HG3     3.30   
         HA      9 ILE  HN      4.00   
         HA      9 ILE  HB      6.00   
         HA      9 ILE  HG12    4.70   
         HA      9 ILE  HG13    4.70   
         HA      9 ILE  QG1     3.97   
         HA      9 ILE  QD1     3.50   
         HA     67 TYR  QD      8.00   
         HA     67 TYR  QE      5.80   
         HB2     7 PRO  HD2     4.80   
         HB2     7 PRO  HD3     4.50   
         HB2    64 TRP  HD1     6.00   
         HB2    64 TRP  HE1     4.60   
         HB2    64 TRP  HZ2     4.80   
         HB2    64 TRP  HH2     6.00   
         HB2    67 TYR  QE      7.10   
         HB3     7 PRO  QG      6.48   
         HB3     7 PRO  HD2     3.20   
         HB3     7 PRO  HD3     5.20   
         HB3    64 TRP  HE1     5.60   
         HB3    64 TRP  HZ2     6.00   
         HB3    64 TRP  HH2     5.50   
         HG2     7 PRO  HD3     4.90   
         HG2    64 TRP  HZ3     4.60   
         HG2    64 TRP  HZ2     3.70   
         HG2    64 TRP  HH2     3.10   
         HG3     7 PRO  HD3     3.70   
         HG3    64 TRP  HZ3     6.00   
         HG3    64 TRP  HZ2     5.10   
         HG3    64 TRP  HH2     6.00   
         HG3    67 TYR  QE      8.00   
         O       9 ILE  N       3.30   
         O       9 ILE  HN      2.40   
  7 PRO 
         HA      9 ILE  HN      4.10   
         QG     55 TYR  QE      8.88   
         QG     64 TRP  HZ3     6.28   
         HD2    64 TRP  HE3     6.00   
         HD2    64 TRP  HZ3     6.00   
         HD3    64 TRP  HZ3     6.00   
         HD3    64 TRP  HH2     6.00   
  8 CYS 
         SG     16 CYS  SG      6.38   
         SG     49 CYS  SG      6.38   
         FE     16 CYS  FE      2.66   
         FE     16 CYS  SA      2.32   
         FE     16 CYS  SB      2.32   
         FE     49 CYS  FE      2.66   
         SE     16 CYS  SA      3.51   
         SE     16 CYS  SB      3.51   
         SE     49 CYS  FE      2.32   
         SE     49 CYS  SE      3.51   
  9 ILE 
         HN      9 ILE  HA      2.70   
         HN      9 ILE  HB      2.40   
         HN      9 ILE  QG2     4.90   
         HN      9 ILE  HG12    3.70   
         HN      9 ILE  HG13    3.70   
         HN      9 ILE  QG1     3.12   
         HN      9 ILE  QD1     4.10   
         HA      9 ILE  QG2     3.40   
         HA      9 ILE  QD1     4.40   
         HA     31 GLN  QB      6.88   
         HB      9 ILE  HG12    3.00   
         HB      9 ILE  HG13    3.00   
         HB     10 GLY  HA2     5.30   
         HB     11 THR  HN      5.50   
         QG2     9 ILE  QD1     4.40   
         QG2    10 GLY  HN      3.50   
         QG2    10 GLY  HA1     7.00   
         QG2    10 GLY  HA2     6.10   
         QG2    30 ASP- HB2     7.00   
         QG2    30 ASP- HB3     3.80   
         QG2    31 GLN  HG2     7.00   
         QG1    67 TYR  QE      6.58   
         QD1    31 GLN  HG2     5.50   
         QD1    67 TYR  QE      7.80   
 10 GLY 
         HN     10 GLY  HA2     2.90   
         HN     11 THR  HN      4.30   
         HN     30 ASP- HB3     4.80   
         HN     31 GLN  QB      6.78   
         HN     31 GLN  HG3     5.20   
 11 THR 
         HA     11 THR  QG2     3.40   
 16 CYS 
         HA     16 CYS  HB2     2.80   
         HA     45 CYS  HB2     4.50   
         HB2    19 VAL  QG2     4.60   
         HB2    25 ILE  HB      5.50   
         HB2    25 ILE  QG1     3.70   
         HB2    45 CYS  HA      4.50   
         HB2    45 CYS  HB2     3.20   
         HB2    48 VAL  QQG     5.96   
         HB2    54 ILE  QD1     4.10   
         SG     49 CYS  SG      6.38   
         FE     49 CYS  FE      2.66   
         FE     49 CYS  SE      2.32   
         SA     49 CYS  SE      3.51   
         SB     49 CYS  FE      2.32   
         SB     49 CYS  SE      3.51   
 17 VAL 
         HA     17 VAL  HB      2.50   
         QQG    18 GLU- QB      8.54   
         QQG    18 GLU- HG2     6.86   
         QQG    19 VAL  QG1     7.56   
 18 GLU-
         HN     18 GLU- QB      3.59   
         HN     18 GLU- HG2     4.50   
         HN     18 GLU- HG3     5.00   
         HN     19 VAL  HN      3.20   
         QB     18 GLU- HG2     2.65   
         QB     18 GLU- HG3     2.75   
 19 VAL 
         HN     19 VAL  QG1     4.10   
         HN     19 VAL  QG2     3.90   
         HN     20 CYS  HN      3.70   
         HN     20 CYS  HB3     6.00   
         HA     19 VAL  HB      2.40   
         HA     19 VAL  QG1     3.40   
         QG2    45 CYS  HA      3.80   
         QG2    45 CYS  HB2     4.50   
         QG2    48 VAL  QG1     8.00   
         QG2    48 VAL  QG2     8.00   
         QG2    48 VAL  QQG     6.60   
 20 CYS 
         HN     20 CYS  HB3     3.10   
         HB3    21 PRO  QD      5.00   
         HB3    23 ASP- HN      4.50   
         HB3    23 ASP- HA      3.20   
         HB3    25 ILE  QG1     4.90   
         HB3    25 ILE  QD1     5.30   
         SG     39 CYS  SG      6.38   
         SG     42 CYS  SG      6.38   
         SG     45 CYS  SG      6.38   
         FE     39 CYS  FE      2.66   
         FE     39 CYS  SE      2.32   
         FE     42 CYS  FE      2.66   
         FE     45 CYS  FE      2.66   
         FE     45 CYS  SE      2.32   
         SE     39 CYS  SE      3.51   
         SE     42 CYS  FE      2.32   
         SE     42 CYS  SE      3.51   
         SE     45 CYS  FE      2.32   
         SE     45 CYS  SE      3.51   
 21 PRO 
         HB3    40 ILE  QG1     5.80   
 22 VAL 
         QQG    39 CYS  HB2     5.40   
 23 ASP-
         HN     23 ASP- HB2     3.70   
         HA     23 ASP- HB3     2.60   
         HB3    24 CYSN QB      6.88   
 24 CYSN
         HA     24 CYSN HB2     3.00   
         HA     24 CYSN HB3     3.00   
         HA     25 ILE  QG1     6.70   
         HA     26 HIS  HD2     6.00   
         HA     35 ASP- QB      6.88   
         HA     38 VAL  HB      6.00   
         HA     38 VAL  QG1     7.00   
         HA     38 VAL  QG2     7.00   
         HB2    35 ASP- HB2     5.15   
         HB2    35 ASP- HB3     5.15   
         HB2    38 VAL  HB      3.60   
         HB2    38 VAL  QG1     6.80   
         HB3    35 ASP- HB2     5.15   
         HB3    35 ASP- HB3     5.15   
         HB3    38 VAL  HB      3.60   
         HB3    38 VAL  QG1     6.80   
         QB     25 ILE  HA      6.68   
         QB     25 ILE  QG1     7.88   
         QB     35 ASP- HN      6.58   
         QB     35 ASP- QB      4.52   
         QB     38 VAL  HB      3.20   
         QB     38 VAL  QG1     5.99   
         QB     38 VAL  QG2     5.38   
 25 ILE 
         HN     26 HIS  HN      5.10   
         HA     26 HIS  HN      2.40   
         HA     26 HIS  HD2     4.50   
         HA     34 ILE  HA      2.40   
         QG1    26 HIS  HN      5.00   
         QG1    34 ILE  HB      5.50   
         QG1    34 ILE  QG2     8.00   
         QG1    35 ASP- HN      7.00   
 26 HIS 
         N      33 TYR  O       3.30   
         HN     26 HIS  HB2     3.50   
         HN     26 HIS  HB3     3.50   
         HN     26 HIS  QB      3.00   
         HN     26 HIS  HD2     4.40   
         HN     33 TYR  HN      3.20   
         HN     33 TYR  HB3     6.00   
         HN     33 TYR  O       2.40   
         HN     34 ILE  HA      3.10   
         HN     75 PHE  QE      8.00   
         HN     75 PHE  HZ      5.50   
         HA     26 HIS  HB2     3.00   
         HA     26 HIS  HB3     3.00   
         HA     26 HIS  QB      2.72   
         HA     26 HIS  HD2     6.00   
         HA     27 GLU- QG      6.88   
         HB2    27 GLU- HN      3.90   
         HB2    75 PHE  QE      7.50   
         HB2    75 PHE  HZ      4.30   
         HB3    27 GLU- HN      3.90   
         HB3    75 PHE  QE      7.50   
         HB3    75 PHE  HZ      4.30   
         QB     27 GLU- QG      7.75   
         QB     33 TYR  HB2     6.88   
         QB     74 PHE  QE      8.68   
         QB     75 PHE  QE      7.15   
         HD2    35 ASP- HB2     5.70   
         HD2    35 ASP- HB3     5.70   
         HD2    35 ASP- QB      5.34   
         HD2    75 PHE  HZ      3.20   
         O      33 TYR  N       3.30   
         O      33 TYR  HN      2.40   
 27 GLU-
         HN     27 GLU- HB2     2.80   
         HN     27 GLU- QG      4.68   
         HN     33 TYR  QE      8.00   
         HA     27 GLU- HB3     2.60   
         HA     27 GLU- HG2     3.90   
         HA     27 GLU- HG3     3.90   
         HA     27 GLU- QG      3.70   
         HA     28 GLY  HN      3.10   
         HA     32 TYR  HN      5.50   
         HA     32 TYR  HA      2.40   
         HA     32 TYR  HB3     6.00   
         HA     33 TYR  HN      3.10   
         HA     33 TYR  QE      8.00   
         HB2    27 GLU- QG      2.65   
         HB2    28 GLY  HN      6.00   
         HB2    28 GLY  QA      5.28   
         HB2    33 TYR  QE      8.00   
         HB3    27 GLU- QG      2.75   
         HB3    28 GLY  HN      4.70   
         HB3    32 TYR  HB3     5.60   
         HB3    32 TYR  QR      8.40   
         HG2    28 GLY  HN      6.00   
         HG2    32 TYR  QR      8.40   
         HG3    28 GLY  HN      6.00   
         HG3    32 TYR  QR      8.40   
 28 GLY 
         N      31 GLN  O       3.30   
         HN     31 GLN  O       2.40   
         HN     32 TYR  HA      2.40   
         HN     33 TYR  HN      6.00   
         HN     33 TYR  QD      8.00   
         HA1    29 GLU- HN      3.20   
         HA1    74 PHE  QE      6.50   
         HA2    29 GLU- HN      3.20   
         HA2    74 PHE  QE      6.50   
         QA     29 GLU- HN      2.69   
         QA     33 TYR  QD      6.08   
         QA     33 TYR  QE      8.88   
         QA     70 LYS+ QD      7.88   
         QA     74 PHE  QE      6.34   
         QA     74 PHE  HZ      3.48   
 29 GLU-
         HN     29 GLU- HA      2.90   
         HN     29 GLU- HB2     3.20   
         HN     29 GLU- HB3     3.40   
         HN     29 GLU- HG2     5.90   
         HN     29 GLU- HG3     5.90   
         HN     29 GLU- QG      5.26   
         HN     30 ASP- HN      3.10   
         HN     33 TYR  QD      8.00   
         HN     74 PHE  QE      8.00   
         HN     74 PHE  HZ      6.00   
         HA     29 GLU- HB3     2.80   
         HA     29 GLU- HG2     3.70   
         HA     29 GLU- HG3     3.70   
         HA     29 GLU- QG      3.49   
         HA     30 ASP- HA      5.30   
         HB2    30 ASP- HN      3.10   
         HB2    30 ASP- HA      5.70   
         HB2    74 PHE  HZ      6.00   
         HB3    30 ASP- HN      3.10   
         HB3    30 ASP- HA      5.50   
         QG     30 ASP- HN      6.28   
 30 ASP-
         HN     30 ASP- HB2     3.00   
         HN     30 ASP- HB3     3.40   
         HN     31 GLN  HN      2.40   
         HN     33 TYR  QD      8.00   
         HB3    31 GLN  HN      4.80   
 31 GLN 
         HN     31 GLN  HG2     4.50   
         HN     31 GLN  HG3     4.30   
         HN     31 GLN  QE2     6.87   
         HA     31 GLN  HB2     3.00   
         HA     31 GLN  HB3     3.00   
         HA     31 GLN  QB      2.72   
         HA     32 TYR  HN      3.20   
         HA     32 TYR  HB3     6.00   
         HG2    33 TYR  QD      7.80   
         HG3    32 TYR  HN      6.00   
         HG3    32 TYR  HA      6.00   
         HG3    33 TYR  HA      5.30   
         HG3    33 TYR  QD      8.00   
         HG3    33 TYR  QE      8.00   
         QE2    32 TYR  HN      6.87   
 32 TYR 
         HN     33 TYR  HN      4.80   
         HN     33 TYR  QE      8.00   
         HA     32 TYR  HB3     2.80   
         HA     33 TYR  HN      2.40   
         HA     33 TYR  QD      8.00   
         HB3    33 TYR  HN      3.10   
         HB3    33 TYR  QE      7.20   
 33 TYR 
         HN     33 TYR  HB2     3.50   
         HN     33 TYR  HB3     3.80   
         HN     34 ILE  HN      4.70   
         HN     75 PHE  HZ      6.00   
         HA     34 ILE  HN      2.60   
         HB2    34 ILE  HN      3.20   
         HB2    75 PHE  QE      5.40   
         HB2    75 PHE  HZ      4.30   
         HB3    34 ILE  HN      4.00   
         HB3    75 PHE  QE      6.10   
         HB3    75 PHE  HZ      5.40   
         QD     70 LYS+ HB3     8.00   
         QD     70 LYS+ HG2     7.30   
         QD     70 LYS+ HG3     7.90   
         QD     70 LYS+ QE      8.20   
         QD     71 ASN  HN      8.00   
         QD     71 ASN  HA      7.20   
         QD     74 PHE  HN      8.00   
         QD     74 PHE  QB      8.88   
         QD     74 PHE  QD      10.00  
         QD     74 PHE  QE      9.90   
         QD     74 PHE  HZ      8.00   
         QD     75 PHE  QE      10.00  
         QE     71 ASN  HA      8.00   
         QE     74 PHE  QB      7.88   
         QE     75 PHE  QE      10.00  
         HH     67 TYR  QD      6.90   
         HH     67 TYR  QE      7.40   
         HH     71 ASN  QD2     7.00   
 34 ILE 
         HN     34 ILE  HB      2.70   
         HN     75 PHE  QE      7.90   
         HA     35 ASP- HN      2.40   
         HA     75 PHE  QE      8.00   
         HB     35 ASP- HN      5.20   
         QG2    39 CYS  HB2     3.00   
 35 ASP-
         HN     35 ASP- HA      2.80   
         HN     35 ASP- HB2     3.60   
         HN     35 ASP- HB3     3.60   
         HN     35 ASP- QB      3.06   
         HN     75 PHE  QE      7.90   
         HN     75 PHE  HZ      5.70   
         HA     36 PRO  HG2     6.00   
         HA     36 PRO  HG3     6.00   
         HA     36 PRO  QD      3.25   
         HA     37 ASP- HN      3.80   
         HA     75 PHE  QD      5.50   
         HA     75 PHE  QE      5.70   
         HA     75 PHE  HZ      6.00   
         HB2    36 PRO  HD2     7.75   
         HB2    36 PRO  HD3     7.75   
         HB2    38 VAL  QG2     4.80   
         HB2    75 PHE  QE      8.00   
         HB3    36 PRO  HD2     7.75   
         HB3    36 PRO  HD3     7.75   
         HB3    38 VAL  QG2     4.80   
         HB3    75 PHE  QE      8.00   
         QB     36 PRO  QD      6.29   
         QB     37 ASP- HB2     6.88   
         QB     38 VAL  HB      5.18   
         QB     38 VAL  QG2     4.57   
         QB     75 PHE  QB      6.85   
         QB     75 PHE  QD      8.48   
         O      39 CYS  N       3.30   
         O      39 CYS  HN      2.40   
 36 PRO 
         HA     38 VAL  HN      5.30   
         HA     39 CYS  HN      3.40   
         HA     39 CYS  HB2     3.00   
         HB2    72 ARG+ QD      6.88   
         HB2    72 ARG+ HE      6.00   
         HG2    72 ARG+ HA      4.70   
         HG2    72 ARG+ HG3     6.00   
         HG3    72 ARG+ HA      4.70   
         HG3    72 ARG+ HG3     6.00   
         QG     37 ASP- HN      5.06   
         QG     37 ASP- HB2     6.18   
         QG     72 ARG+ HG3     5.50   
         HD2    75 PHE  QD      8.00   
         HD2    75 PHE  QE      8.00   
         HD3    75 PHE  QD      8.00   
         HD3    75 PHE  QE      8.00   
         QD     72 ARG+ HA      4.48   
         QD     72 ARG+ HG3     5.08   
         QD     75 PHE  QD      7.80   
         QD     76 LYS+ QD      7.88   
 37 ASP-
         HN     37 ASP- HB2     3.00   
         HN     37 ASP- HB3     3.10   
         HN     38 VAL  HN      3.60   
         HN     38 VAL  QG2     7.00   
         HA     37 ASP- HB2     2.70   
         HB2    38 VAL  HN      3.90   
         HB2    38 VAL  QG2     7.00   
         HB3    38 VAL  HN      4.00   
         HB3    38 VAL  QG2     5.50   
 38 VAL 
         HN     38 VAL  HB      2.80   
         HN     38 VAL  QG2     3.80   
         HN     39 CYS  HN      2.50   
         HA     38 VAL  QG1     3.40   
         HA     38 VAL  QG2     3.40   
         HB     39 CYS  HN      3.20   
         QG1    39 CYS  HB2     5.10   
         QG2    39 CYS  HN      7.00   
 39 CYS 
         HN     39 CYS  HB2     2.40   
         SG     41 ASP- HN      2.70   
         SG     42 CYS  SG      6.38   
         SG     45 CYS  SG      6.38   
         FE     42 CYS  FE      2.66   
         FE     42 CYS  SE      2.32   
         FE     45 CYS  FE      2.66   
         FE     45 CYS  SE      2.32   
         SE     42 CYS  FE      2.32   
         SE     42 CYS  SE      3.51   
         SE     45 CYS  SE      3.51   
 40 ILE 
         HA     40 ILE  HB      2.40   
         HA     41 ASP- HN      3.40   
         HB     41 ASP- HN      4.80   
         HB     41 ASP- QB      6.88   
         HB     42 CYS  HB3     4.50   
         QG1    41 ASP- HN      4.90   
         QG1    42 CYS  HB3     3.10   
         QD1    41 ASP- HN      5.10   
 41 ASP-
         HN     41 ASP- HB2     4.10   
         HN     41 ASP- HB3     4.10   
         HN     41 ASP- QB      3.81   
 42 CYS 
         HA     42 CYS  HB3     2.90   
         SG     45 CYS  SG      6.38   
         FE     45 CYS  FE      2.66   
         SE     45 CYS  FE      2.32   
         SE     45 CYS  SE      3.51   
 43 GLY 
         HA1    46 GLU- HN      5.60   
         HA2    46 GLU- HN      5.60   
         QA     46 GLU- HN      5.09   
 45 CYS 
         HA     48 VAL  QQG     5.56   
         HB2    48 VAL  QQG     6.06   
         HB2    54 ILE  QD1     4.50   
         O      49 CYS  N       3.30   
         O      49 CYS  HN      2.40   
 46 GLU-
         HN     54 ILE  HB      6.00   
         HN     54 ILE  QG2     7.00   
         QB     47 ALA  HA      4.80   
         QB     54 ILE  QG2     6.90   
 47 ALA 
         HN     47 ALA  QB      3.40   
         HN     48 VAL  HN      3.00   
         QB     48 VAL  HN      3.60   
         QB     48 VAL  HA      4.90   
         QB     48 VAL  QQG     8.06   
 48 VAL 
         HN     48 VAL  QG1     4.10   
         HN     48 VAL  QG2     4.10   
         HN     48 VAL  QQG     3.63   
         HN     49 CYS  HN      5.30   
         HA     48 VAL  HB      2.60   
         QQG    49 CYS  HB2     6.96   
 49 CYS 
         HN     49 CYS  HB2     3.50   
         HN     49 CYS  HB3     3.30   
         HB2    52 SER  HA      3.80   
         HB2    53 ALA  HN      4.40   
         HB2    54 ILE  HN      4.40   
         HB2    54 ILE  HB      3.80   
         HB2    54 ILE  QG2     5.40   
         HB2    54 ILE  QG1     4.90   
         HB2    54 ILE  QD1     4.60   
         HB3    52 SER  HN      4.40   
         HB3    52 SER  HA      2.90   
         HB3    52 SER  QB      5.18   
         HB3    53 ALA  HN      4.10   
         HB3    54 ILE  HN      4.10   
         HB3    54 ILE  HB      4.10   
         SG     54 ILE  HN      2.70   
 50 PRO 
         HB2    51 VAL  QG2     3.90   
 51 VAL 
         HA     51 VAL  QG1     3.40   
         HA     51 VAL  QG2     3.40   
         QG1    52 SER  HN      6.20   
 52 SER 
         HA     52 SER  HB2     3.00   
         HA     52 SER  HB3     3.00   
         HA     52 SER  QB      2.57   
         HA     54 ILE  HN      3.90   
 54 ILE 
         HN     54 ILE  HB      3.50   
         HA     54 ILE  QG2     3.40   
         HA     55 TYR  HN      2.40   
         HA     55 TYR  HB2     4.50   
         HA     55 TYR  QD      7.70   
 55 TYR 
         HN     55 TYR  HA      2.90   
         HN     55 TYR  HB2     2.50   
         HN     55 TYR  HB3     3.70   
         HN     55 TYR  QE      6.90   
         HN     60 VAL  QG2     5.10   
         HA     55 TYR  HB2     2.90   
         HA     55 TYR  HB3     2.60   
         HA     56 HIS  HN      2.50   
         HA     56 HIS  HB2     5.10   
         HA     56 HIS  HB3     5.10   
         HA     56 HIS  QB      4.41   
         HA     60 VAL  QG2     6.10   
         HB2    60 VAL  HA      3.90   
         HB2    60 VAL  QG2     3.40   
         HB3    56 HIS  HN      3.40   
         HB3    56 HIS  HA      5.10   
         HB3    59 PHE  HB2     4.90   
         HB3    60 VAL  HA      3.80   
         HB3    60 VAL  HB      6.00   
         HB3    60 VAL  QG2     4.90   
         QD     56 HIS  HN      8.00   
         QD     59 PHE  HB2     7.00   
         QD     59 PHE  HB3     6.70   
         QD     60 VAL  HA      6.60   
         QD     60 VAL  QG2     6.30   
         QD     61 PRO  HD2     6.90   
         QD     61 PRO  HD3     7.10   
         QE     60 VAL  HA      8.00   
         QE     61 PRO  HG2     8.00   
         QE     61 PRO  HG3     8.00   
         QE     61 PRO  HD2     7.50   
         QE     61 PRO  HD3     8.00   
         QE     64 TRP  HE3     7.20   
         QE     64 TRP  HZ3     5.40   
 56 HIS 
         HN     56 HIS  QB      3.38   
         HN     59 PHE  HB2     2.80   
         HN     59 PHE  QD      8.00   
         HA     56 HIS  HD2     5.10   
         HA     56 HIS  HE1     5.70   
         HA     57 GLU- HN      2.50   
         HB2    59 PHE  HN      4.70   
         HB2    59 PHE  HB3     6.00   
         HB2    59 PHE  QD      7.60   
         HB3    59 PHE  HN      4.70   
         HB3    59 PHE  HB3     6.00   
         HB3    59 PHE  QD      7.60   
         QB     58 ASP- HN      4.68   
         QB     59 PHE  HN      4.05   
         QB     59 PHE  HB2     6.88   
         QB     59 PHE  QD      6.75   
         HD2    57 GLU- HN      6.00   
         HE1    57 GLU- QB      5.38   
         HE1    57 GLU- QG      6.38   
         HE1    58 ASP- HN      4.90   
         HE1    58 ASP- HB2     3.60   
         HE1    58 ASP- HB3     6.00   
         O      60 VAL  N       3.30   
         O      60 VAL  HN      2.40   
 57 GLU-
         HN     57 GLU- HB2     3.40   
         HN     57 GLU- HB3     3.40   
         HN     57 GLU- QB      3.08   
         HN     57 GLU- QG      4.68   
         HN     58 ASP- HN      3.60   
         HA     57 GLU- HB2     3.00   
         HA     57 GLU- HB3     3.00   
         HA     57 GLU- QB      2.72   
         HA     57 GLU- QG      4.00   
         HA     60 VAL  HN      4.30   
         HA     60 VAL  HB      2.40   
         HA     65 LYS+ QD      7.00   
         HA     68 ILE  QG1     6.68   
         HA     68 ILE  QD1     6.30   
         HB2    58 ASP- HN      4.80   
         HB2    68 ILE  QG2     5.20   
         HB3    58 ASP- HN      4.80   
         HB3    68 ILE  QG2     5.20   
         QB     57 GLU- QG      2.48   
         QB     58 ASP- HN      4.19   
         QB     60 VAL  QG1     7.18   
         QB     68 ILE  QG2     4.56   
         QB     68 ILE  QG1     5.25   
         QG     58 ASP- HN      4.68   
         QG     68 ILE  QG2     6.98   
 58 ASP-
         HN     58 ASP- HA      2.90   
         HN     58 ASP- HB2     2.60   
         HN     58 ASP- HB3     3.10   
         HN     59 PHE  HN      3.00   
         HN     59 PHE  QD      8.00   
         HN     60 VAL  HN      3.60   
         HA     58 ASP- HB2     3.00   
         HB2    59 PHE  HN      4.30   
         HB2    59 PHE  QD      8.00   
         HB3    59 PHE  HN      4.80   
         HB3    59 PHE  QD      8.00   
 59 PHE 
         HN     59 PHE  HB2     3.20   
         HN     59 PHE  HB3     3.20   
         HN     60 VAL  HN      2.40   
         HN     60 VAL  HB      4.50   
         HN     60 VAL  QG2     6.00   
         HA     59 PHE  HB2     3.00   
         HB3    60 VAL  HN      6.00   
         HB3    60 VAL  HA      4.90   
         HB3    60 VAL  QG2     5.40   
 60 VAL 
         HN     60 VAL  HB      2.40   
         HN     60 VAL  QG2     3.40   
         HN     61 PRO  HD3     6.00   
         HA     60 VAL  QG1     3.40   
         HA     60 VAL  QG2     3.40   
         HA     61 PRO  HD2     2.80   
         HA     61 PRO  HD3     2.40   
         HA     64 TRP  QB      4.78   
         HB     61 PRO  HD2     6.00   
         HB     65 LYS+ HA      6.00   
         HB     68 ILE  QG1     4.78   
         QG1    61 PRO  HD2     7.00   
         QG1    61 PRO  HD3     5.20   
         QG1    64 TRP  HB2     6.40   
         QG1    64 TRP  HB3     6.40   
         QG1    64 TRP  QB      6.19   
         QG1    65 LYS+ QG      8.00   
         QG1    65 LYS+ QE      6.80   
         QG1    67 TYR  HN      7.00   
         QG1    68 ILE  QD1     8.00   
         QG2    61 PRO  HD2     3.40   
         QG2    61 PRO  HD3     4.40   
         QG2    64 TRP  HN      6.70   
         QG2    64 TRP  HA      6.70   
         QG2    64 TRP  QB      4.48   
         QG2    64 TRP  HE3     5.40   
         QG2    65 LYS+ HA      6.50   
         QG2    67 TYR  QD      9.00   
         QG2    68 ILE  QG1     5.08   
 61 PRO 
         HA     62 GLU- HN      2.80   
         HB2    62 GLU- HN      3.90   
         HB2    63 GLU- HN      4.30   
         HB2    64 TRP  HB2     7.75   
         HB2    64 TRP  HB3     7.75   
         HB3    62 GLU- HN      3.90   
         HB3    63 GLU- HN      4.30   
         HB3    64 TRP  HB2     7.75   
         HB3    64 TRP  HB3     7.75   
         QB     62 GLU- HN      3.70   
         QB     63 GLU- HN      3.73   
         QB     63 GLU- QB      5.95   
         QB     64 TRP  QB      6.82   
         QB     64 TRP  HE3     5.68   
         HG2    64 TRP  HE3     6.00   
         HG3    64 TRP  HE3     6.00   
         QG     64 TRP  HN      6.88   
         QG     64 TRP  QB      7.75   
         QG     64 TRP  HE3     5.74   
         QG     64 TRP  HZ3     4.78   
         HD2    64 TRP  QB      6.68   
         HD2    64 TRP  HD1     6.00   
         HD2    64 TRP  HE3     3.10   
         HD3    64 TRP  QB      5.38   
         HD3    64 TRP  HE3     5.00   
         O      64 TRP  N       3.30   
         O      64 TRP  HN      2.40   
 62 GLU-
         HN     62 GLU- HA      2.70   
         HN     62 GLU- HB2     3.00   
         HN     62 GLU- HB3     3.00   
         HN     62 GLU- HG2     5.10   
         HN     62 GLU- HG3     5.10   
         HN     62 GLU- QG      4.87   
         HN     63 GLU- HN      3.10   
         HN     65 LYS+ QG      7.00   
         HA     65 LYS+ HN      3.30   
         HA     65 LYS+ QG      7.00   
         HA     65 LYS+ QD      5.50   
         HA     65 LYS+ QE      5.30   
         HB2    62 GLU- QG      2.65   
         HB2    63 GLU- HN      4.10   
         HB2    65 LYS+ QD      7.00   
         HB3    63 GLU- HN      3.10   
         HB3    65 LYS+ QG      7.00   
         HG2    65 LYS+ QD      7.00   
         HG3    65 LYS+ QD      7.00   
         QG     63 GLU- HN      6.88   
         QG     65 LYS+ HB2     4.58   
         QG     65 LYS+ HB3     6.88   
 63 GLU-
         HN     63 GLU- HA      2.80   
         HN     63 GLU- HB2     3.00   
         HN     63 GLU- HB3     3.00   
         HN     63 GLU- QB      2.62   
         HN     63 GLU- QG      5.50   
         HN     64 TRP  HN      3.00   
         HA     63 GLU- QB      2.60   
         HB2    64 TRP  HN      5.40   
         HB3    64 TRP  HN      5.40   
         QB     64 TRP  HN      4.55   
         QB     64 TRP  HE3     6.88   
         QG     64 TRP  HD1     7.00   
         QG     64 TRP  HE1     7.00   
         QG     64 TRP  HH2     7.00   
 64 TRP 
         HN     64 TRP  HB2     3.70   
         HN     64 TRP  HB3     3.70   
         HN     64 TRP  QB      3.44   
         HN     65 LYS+ HN      2.70   
         HA     64 TRP  HD1     2.90   
         HA     64 TRP  HE3     6.00   
         HA     64 TRP  HE1     6.00   
         HA     65 LYS+ HN      3.30   
         HA     66 SER  HN      3.70   
         HA     67 TYR  HN      4.00   
         HA     67 TYR  QD      5.40   
         HA     67 TYR  QE      7.10   
         HB2    67 TYR  QD      6.70   
         HB2    67 TYR  QE      8.00   
         HB3    67 TYR  QD      6.70   
         HB3    67 TYR  QE      8.00   
         QB     65 LYS+ HN      5.18   
         QB     67 TYR  HN      5.68   
         QB     67 TYR  QD      5.98   
         HD1    67 TYR  QD      6.90   
         HD1    67 TYR  QE      5.70   
         HE1    67 TYR  QD      8.00   
         HE1    67 TYR  QE      8.00   
 65 LYS+
         HN     65 LYS+ HB2     2.70   
         HN     65 LYS+ HB3     4.20   
         HN     65 LYS+ QG      5.00   
         HN     65 LYS+ QD      6.80   
         HN     66 SER  HN      3.50   
         HA     65 LYS+ QD      5.00   
         HA     65 LYS+ QE      4.30   
         HA     68 ILE  HN      3.60   
         HA     68 ILE  HB      3.70   
         HA     68 ILE  QG1     4.88   
         HA     68 ILE  QD1     7.00   
         HB2    65 LYS+ QD      3.80   
         HB2    65 LYS+ QE      6.30   
         HB2    66 SER  HN      4.20   
         HB3    65 LYS+ QD      3.70   
         HB3    65 LYS+ QE      5.70   
         HB3    68 ILE  QG1     6.28   
         QG     68 ILE  HB      7.00   
         QG     68 ILE  QG1     7.88   
         QG     68 ILE  QD1     7.30   
         QD     68 ILE  QG2     7.60   
         QE     68 ILE  QG2     6.70   
         QE     68 ILE  QG1     7.68   
         QE     68 ILE  QD1     8.00   
 66 SER 
         HN     66 SER  HA      2.80   
         HN     66 SER  QB      3.72   
         HN     67 TYR  HN      3.40   
         HA     69 GLN  QB      4.48   
         O      70 LYS+ N       3.30   
         O      70 LYS+ HN      2.40   
 67 TYR 
         HN     67 TYR  HB2     2.60   
         HN     67 TYR  QE      6.80   
         HN     68 ILE  HN      2.90   
         HA     67 TYR  HB3     2.70   
         HA     70 LYS+ HN      4.00   
         HA     70 LYS+ HB2     2.40   
         HA     70 LYS+ HB3     2.40   
         HA     70 LYS+ HG2     6.00   
         HA     70 LYS+ HG3     6.00   
         HA     70 LYS+ QD      7.00   
         HA     71 ASN  HN      3.80   
         HB2    68 ILE  HN      4.50   
         HB3    68 ILE  HA      3.80   
         HB3    71 ASN  HN      4.30   
         HB3    71 ASN  QD2     6.30   
         QD     70 LYS+ HB2     8.00   
         QD     70 LYS+ HB3     8.00   
         QD     70 LYS+ HG2     8.00   
         QD     70 LYS+ HG3     6.20   
         QD     71 ASN  HN      7.30   
         QD     71 ASN  QD2     8.20   
         QE     70 LYS+ HG3     8.00   
         QE     70 LYS+ QD      9.00   
         O      71 ASN  N       3.30   
         O      71 ASN  HN      2.40   
 68 ILE 
         HN     68 ILE  HA      2.90   
         HN     68 ILE  HB      2.50   
         HN     68 ILE  QG2     4.30   
         HN     68 ILE  HG12    4.00   
         HN     68 ILE  HG13    4.00   
         HN     68 ILE  QG1     3.51   
         HN     68 ILE  QD1     3.90   
         HN     69 GLN  HN      3.00   
         HN     70 LYS+ HN      4.70   
         HA     68 ILE  QG2     3.40   
         HA     68 ILE  HG12    4.10   
         HA     68 ILE  HG13    4.10   
         HA     68 ILE  QG1     3.62   
         HA     68 ILE  QD1     3.40   
         HA     69 GLN  HN      3.60   
         HA     71 ASN  HN      4.50   
         HB     68 ILE  QD1     3.40   
         HB     69 GLN  HN      3.70   
         QG2    68 ILE  HG12    3.40   
         QG2    68 ILE  HG13    3.40   
         QG2    69 GLN  HN      4.80   
         QG2    72 ARG+ QD      6.28   
         QG1    69 GLN  HN      6.78   
         O      72 ARG+ N       3.30   
         O      72 ARG+ HN      2.40   
 69 GLN 
         HN     69 GLN  HB2     3.40   
         HN     69 GLN  HB3     3.40   
         HN     69 GLN  QB      2.90   
         HN     69 GLN  HG2     6.00   
         HN     69 GLN  HG3     4.80   
         HN     69 GLN  QE2     4.57   
         HN     70 LYS+ HN      4.70   
         HA     69 GLN  HG2     3.80   
         HA     69 GLN  HG3     4.10   
         HA     69 GLN  QE2     4.97   
         HA     72 ARG+ HN      4.00   
         HA     72 ARG+ HB2     2.40   
         HA     72 ARG+ HB3     3.70   
         HA     72 ARG+ HD2     6.00   
         HA     72 ARG+ HD3     6.00   
         HA     72 ARG+ QD      5.69   
         HA     76 LYS+ QE      7.00   
         HB2    69 GLN  HG2     3.00   
         HB2    69 GLN  HE21    5.25   
         HB2    69 GLN  HE22    5.25   
         HB2    70 LYS+ HN      3.70   
         HB3    69 GLN  HG2     3.00   
         HB3    69 GLN  HE21    5.25   
         HB3    69 GLN  HE22    5.25   
         HB3    70 LYS+ HN      3.70   
         QB     69 GLN  HG3     2.75   
         QB     69 GLN  QE2     4.02   
         QB     70 LYS+ HN      3.25   
         HG3    72 ARG+ HB2     5.10   
         HG3    72 ARG+ HB3     6.00   
         HG3    72 ARG+ QD      4.88   
         QE2    72 ARG+ QD      7.74   
         O      73 ASP- N       3.30   
         O      73 ASP- HN      2.40   
 70 LYS+
         HN     70 LYS+ HB2     2.50   
         HN     70 LYS+ HB3     2.90   
         HN     70 LYS+ HG2     6.00   
         HN     70 LYS+ HG3     5.40   
         HN     71 ASN  HN      3.30   
         HA     70 LYS+ HB2     2.60   
         HA     70 LYS+ HB3     3.00   
         HA     70 LYS+ HG2     3.10   
         HA     70 LYS+ HG3     4.20   
         HA     70 LYS+ QD      5.40   
         HA     70 LYS+ QE      7.00   
         HA     73 ASP- HN      3.00   
         HA     73 ASP- HB2     2.50   
         HA     73 ASP- HB3     3.70   
         HB2    70 LYS+ HG3     2.80   
         HB2    70 LYS+ QE      7.00   
         HB2    71 ASN  HN      4.60   
         HB3    71 ASN  HN      2.90   
         HG2    71 ASN  HN      6.00   
         HG2    71 ASN  HA      5.80   
         HG2    74 PHE  HZ      5.30   
         HG3    70 LYS+ QE      4.00   
         HG3    71 ASN  HN      6.00   
         HG3    74 PHE  HZ      6.00   
         QD     71 ASN  HN      6.70   
         QD     71 ASN  HA      7.00   
         QD     74 PHE  QD      9.00   
         QD     74 PHE  QE      9.00   
         QD     74 PHE  HZ      7.00   
         O      74 PHE  N       3.30   
         O      74 PHE  HN      2.40   
 71 ASN 
         HN     71 ASN  HA      2.90   
         HN     71 ASN  HB2     2.40   
         HN     71 ASN  HB3     3.50   
         HN     71 ASN  QD2     3.40   
         HN     72 ARG+ HN      3.10   
         HA     71 ASN  HB2     3.00   
         HA     71 ASN  HB3     2.80   
         HA     74 PHE  HN      3.50   
         HA     74 PHE  HB2     3.90   
         HA     74 PHE  HB3     3.90   
         HA     74 PHE  QB      3.60   
         HA     75 PHE  QE      8.00   
         HB2    72 ARG+ HN      3.20   
         HB3    72 ARG+ HN      4.30   
 72 ARG+
         HN     72 ARG+ HB2     2.50   
         HN     72 ARG+ HB3     3.30   
         HN     72 ARG+ HG2     6.00   
         HN     72 ARG+ HG3     5.20   
         HN     73 ASP- HN      2.80   
         HA     72 ARG+ HB3     2.90   
         HA     72 ARG+ HG3     3.90   
         HA     72 ARG+ HD2     6.00   
         HA     72 ARG+ HD3     6.00   
         HA     72 ARG+ QD      5.79   
         HA     75 PHE  QB      5.18   
         HA     75 PHE  QD      7.00   
         HB2    72 ARG+ HE      5.20   
         HB2    73 ASP- HN      4.20   
         HB2    75 PHE  QD      8.00   
         HB2    76 LYS+ QE      7.00   
         HB3    72 ARG+ HG2     2.50   
         HB3    72 ARG+ HE      5.10   
         HB3    73 ASP- HN      3.00   
         HB3    76 LYS+ QD      5.50   
         HG2    73 ASP- HN      6.00   
         HG2    76 LYS+ QD      7.00   
         HG3    73 ASP- HN      6.00   
         HG3    76 LYS+ QE      7.00   
         O      75 PHE  N       3.30   
         O      75 PHE  HN      2.40   
 73 ASP-
         HN     73 ASP- HB2     2.80   
         HN     73 ASP- HB3     3.00   
         HN     74 PHE  HN      2.90   
         HN     74 PHE  QB      6.68   
         HA     73 ASP- HB2     2.70   
         HA     76 LYS+ HN      4.20   
         HA     76 LYS+ HB2     3.80   
         HA     76 LYS+ HB3     5.00   
         HA     76 LYS+ QG      6.80   
         HA     76 LYS+ QD      7.00   
         HB2    74 PHE  HN      3.30   
         HB3    74 PHE  HN      3.40   
 74 PHE 
         HN     74 PHE  HB2     3.40   
         HN     74 PHE  HB3     3.40   
         HN     74 PHE  QB      2.90   
         HN     74 PHE  QE      6.90   
         HN     75 PHE  HN      2.90   
         HB2    75 PHE  HN      3.40   
         HB2    75 PHE  QD      8.00   
         HB3    75 PHE  HN      3.40   
         HB3    75 PHE  QD      8.00   
         QB     75 PHE  HN      3.18   
         QD     75 PHE  QD      10.00  
         QD     75 PHE  QE      9.50   
         QD     75 PHE  HZ      7.60   
         QD     76 LYS+ QE      9.00   
         QE     75 PHE  QE      10.00  
 75 PHE 
         HN     75 PHE  HB2     3.60   
         HN     75 PHE  HB3     3.60   
         HN     75 PHE  QB      3.29   
         HN     76 LYS+ HN      2.80   
         HN     76 LYS+ HB2     4.50   
         HA     75 PHE  QB      2.71   
         HA     76 LYS+ HN      3.10   
 76 LYS+
         HN     76 LYS+ HB2     3.20   
         HN     76 LYS+ HB3     3.00   
         HN     76 LYS+ QG      5.20   
         HN     76 LYS+ QD      6.40   
         HN     77 LYS+ HN      4.40   
         HA     76 LYS+ HB2     2.80   
         HA     76 LYS+ HG2     3.90   
         HA     76 LYS+ HG3     3.90   
         HA     76 LYS+ QG      3.65   
         HA     77 LYS+ HN      3.60   
         HB3    77 LYS+ HN      5.30   
         HB3    77 LYS+ QG      4.60   
         QG     77 LYS+ HN      7.00   
         QG     77 LYS+ HB2     7.00   
         QG     77 LYS+ HB3     7.00   
         QG     77 LYS+ QB      6.51   
         QD     77 LYS+ HN      7.00   
 77 LYS+
         HN     77 LYS+ HB2     3.50   
         HN     77 LYS+ HB3     3.50   
         HN     77 LYS+ QB      3.29   
         HN     77 LYS+ QG      5.60   




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