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
2344 1bqx 4229 cing 1-original 1 DYANA/DIANA distance general distance simple


   1 ALA                                                                         
         HA     39 CYS  HB3     4.30                                            
         HA     41 ASP- HN      4.50                                            
         QB     36 PRO  HA      3.80                                            
         QB     36 PRO  HB3     4.10                                            
         QB     39 CYS  HB3     3.94                                            
  2 TYR                                                                         
         HN     39 CYS  HB3     3.50                                            
         HA      3 VAL  HN      2.90                                            
         HA      3 VAL  HB      4.60                                            
         HA      3 VAL  QQG     7.80                                            
         HA     56 HIS  HN      5.70                                            
         HA     56 HIS  HA      2.40                                            
         HA     56 HIS  HD2     6.00                                            
         HA     57 GLU- HN      3.10                                            
         QR     41 ASP- HN      4.80                                            
         QD     46 GLU- HA      8.00                                            
         QD     46 GLU- HB2     8.00                                            
         QD     46 GLU- HB3     8.00                                            
         QD     56 HIS  HN      8.00                                            
         QD     56 HIS  HB2     8.00                                            
         HE2    46 GLU- HB2     5.00                                            
         HE2    46 GLU- HB3     5.00                                            
         HE2    46 GLU- QB      4.77                                            
  3 VAL                                                                         
         N      55 TYR  O       3.30                                            
         HN      3 VAL  HB      2.80                                            
         HN      4 ILE  HN      5.20                                            
         HN     55 TYR  HN      3.10                                            
         HN     55 TYR  HB2     6.00                                            
         HN     55 TYR  QD      8.00                                            
         HN     55 TYR  O       2.40                                            
         HN     56 HIS  HA      3.30                                            
         HN     57 GLU- HN      4.80                                            
         HN     60 VAL  QQG     8.40                                            
         HA      4 ILE  HN      2.80                                            
         HA     34 ILE  HN      5.80                                            
         HB      4 ILE  HN      5.20                                            
         HB     55 TYR  HN      6.00                                            
         HB     57 GLU- HA      5.00                                            
         HB     57 GLU- HB2     6.00                                            
         HB     57 GLU- HB3     6.00                                            
         HB     57 GLU- QB      5.32                                            
         HB     68 ILE  QG2     6.70                                            
         HB     68 ILE  QG1     4.38                                            
         QQG     4 ILE  HN      6.20                                            
         QQG     5 THR  QG2     7.30                                            
         QQG    55 TYR  HN      8.40                                            
         QQG    57 GLU- HN      7.60                                            
         QQG    57 GLU- QB      7.78                                            
         QQG    67 TYR  HN      8.40                                            
         QQG    67 TYR  HB2     8.40                                            
         QQG    67 TYR  HB3     6.70                                            
         QQG    68 ILE  HN      7.60                                            
         QQG    68 ILE  HA      5.20                                            
         QQG    68 ILE  HB      8.40                                            
         QQG    68 ILE  QG1     8.88                                            
         QQG    68 ILE  QD1     6.00                                            
         QQG    71 ASN  HN      6.50                                            
         QQG    71 ASN  QD2     9.40                                            
  4 ILE                                                                         
         HN      4 ILE  HB      3.40                                            
         HN     34 ILE  HN      3.70                                            
         HN     71 ASN  QD2     7.00                                            
         HA      5 THR  HN      3.50                                            
         HA      5 THR  QG2     7.00                                            
         HA      8 CYS  HB3     5.00                                            
         HA     54 ILE  HA      3.30                                            
         HB     31 GLN  HE21    6.00                                            
         HB     31 GLN  HE22    6.00                                            
         HB     33 TYR  HA      5.80                                            
         HB     71 ASN  QD2     7.00                                            
  5 THR                                                                         
         HN      5 THR  QG2     4.10                                            
         HA      5 THR  HB      2.80                                            
         HA      5 THR  QG2     3.40                                            
         HA     67 TYR  HB3     4.30                                            
         HA     67 TYR  QD      6.10                                            
         HA     67 TYR  QE      8.00                                            
         HB      6 GLU- HB3     3.80                                            
         HB     64 TRP  HA      6.00                                            
         HB     64 TRP  HB2     6.00                                            
         HB     64 TRP  HD1     6.00                                            
         HB     64 TRP  HE3     3.70                                            
         HB     64 TRP  HE1     6.00                                            
         HB     67 TYR  QD      7.00                                            
         HB     67 TYR  QE      7.20                                            
         QG2    55 TYR  HN      4.70                                            
         QG2    55 TYR  QD      6.70                                            
         QG2    55 TYR  QE      7.80                                            
         QG2    60 VAL  HA      4.90                                            
         QG2    60 VAL  QQG     6.70                                            
         QG2    61 PRO  HD2     5.40                                            
         QG2    64 TRP  HA      7.00                                            
         QG2    64 TRP  HB2     5.60                                            
         QG2    64 TRP  HB3     4.60                                            
         QG2    64 TRP  HE3     5.70                                            
         QG2    67 TYR  HN      7.00                                            
         QG2    67 TYR  HB2     4.10                                            
         QG2    67 TYR  HB3     4.40                                            
         QG2    67 TYR  QD      7.90                                            
         QG2    67 TYR  QE      6.50                                            
         QG2    68 ILE  QD1     5.50                                            
  6 GLU-                                                                        
         HA      6 GLU- HB2     2.90                                            
         HA      6 GLU- HG2     3.30                                            
         HA      6 GLU- HG3     3.30                                            
         HA      6 GLU- QG      2.84                                            
         HA      9 ILE  HN      4.30                                            
         HA      9 ILE  HB      3.70                                            
         HA      9 ILE  HG12    5.10                                            
         HA      9 ILE  HG13    5.10                                            
         HA      9 ILE  QG1     4.63                                            
         HA      9 ILE  QD1     4.00                                            
         HA     67 TYR  QE      6.80                                            
         HB2     6 GLU- HG2     3.00                                            
         HB2     6 GLU- HG3     3.00                                            
         HB2     6 GLU- QG      2.67                                            
         HB2     7 PRO  QG      7.00                                            
         HB2     7 PRO  QD      6.58                                            
         HB2    64 TRP  HE1     4.90                                            
         HB2    64 TRP  HZ2     4.80                                            
         HB2    64 TRP  HH2     6.00                                            
         HB3     7 PRO  QG      5.20                                            
         HB3    64 TRP  HD1     6.00                                            
         HB3    64 TRP  HE1     6.00                                            
         HB3    64 TRP  HH2     6.00                                            
         HB3    67 TYR  QE      6.00                                            
         HG2    64 TRP  HZ2     5.20                                            
         HG2    64 TRP  HH2     5.60                                            
         HG3    64 TRP  HZ2     5.20                                            
         HG3    64 TRP  HH2     5.60                                            
         QG      9 ILE  QD1     4.88                                            
         QG     64 TRP  HD1     6.88                                            
         QG     64 TRP  HZ3     6.88                                            
         QG     64 TRP  HZ2     4.69                                            
         QG     64 TRP  HH2     5.38                                            
         O       9 ILE  N       3.30                                            
         O       9 ILE  HN      2.40                                            
  7 PRO                                                                         
         HA      9 ILE  HN      3.80                                            
         QG     55 TYR  QE      9.00                                            
         QG     64 TRP  HE1     7.00                                            
         QG     64 TRP  HZ3     7.00                                            
         QD     55 TYR  QE      8.88                                            
         QD     64 TRP  HE1     6.88                                            
  8 CYS                                                                         
         HN      8 CYS  HB3     3.50                                            
         HN      9 ILE  HN      3.50                                            
         SG     13 CYS  SG      6.38                                            
         SG     16 CYS  SG      6.38                                            
         SG     49 CYS  SG      6.38                                            
         FE     13 CYS  FE      2.66                                            
         FE     13 CYS  SE      2.32                                            
         FE     16 CYS  FE      2.66                                            
         FE     16 CYS  SE      2.32                                            
         FE     49 CYS  FE      2.66                                            
         SE     13 CYS  FE      2.32                                            
         SE     13 CYS  SE      3.51                                            
         SE     16 CYS  SE      3.51                                            
         SE     49 CYS  FE      2.32                                            
         SE     49 CYS  SE      3.51                                            
  9 ILE                                                                         
         HN      9 ILE  HB      2.70                                            
         HN      9 ILE  QG2     4.70                                            
         HN      9 ILE  QG1     3.58                                            
         HN      9 ILE  QD1     4.10                                            
         HA      9 ILE  QG2     3.50                                            
         HA      9 ILE  HG12    3.60                                            
         HA      9 ILE  HG13    3.60                                            
         HA      9 ILE  QD1     3.90                                            
         HA     10 GLY  HN      3.10                                            
         HA     31 GLN  HB2     5.40                                            
         HB     67 TYR  QE      8.00                                            
         QG2     9 ILE  HG12    3.70                                            
         QG2     9 ILE  HG13    3.70                                            
         QG2     9 ILE  QG1     3.44                                            
         QG2     9 ILE  QD1     4.40                                            
         QG2    10 GLY  HN      6.60                                            
         QG2    10 GLY  HA1     4.80                                            
         QG2    10 GLY  HA2     6.50                                            
         QG2    30 ASP- HB2     6.20                                            
         QG2    30 ASP- HB3     6.20                                            
         QG2    30 ASP- QB      5.89                                            
         HG12   31 GLN  HB2     5.30                                            
         HG13   31 GLN  HB2     5.30                                            
         QG1    31 GLN  HB2     4.61                                            
         QG1    31 GLN  HB3     5.38                                            
         QG1    67 TYR  QE      6.68                                            
         QD1    31 GLN  HB2     6.00                                            
         QD1    31 GLN  QG      5.98                                            
         QD1    67 TYR  QE      8.90                                            
 10 GLY                                                                         
         HN     11 THR  HN      3.90                                            
         HA1    11 THR  HN      2.90                                            
 11 THR                                                                         
         HN     11 THR  HB      3.20                                            
         HN     11 THR  QG2     4.50                                            
         HA     11 THR  HB      2.90                                            
 12 LYS+                                                                        
         NZ     27 GLU- HB2     6.00                                            
 13 CYS                                                                         
         HA     13 CYS  HB3     2.90                                            
         HB3    14 ALA  HA      5.00                                            
         HB3    31 GLN  HA      5.00                                            
         SG     16 CYS  SG      6.38                                            
         SG     49 CYS  SG      6.38                                            
         FE     16 CYS  FE      2.66                                            
         FE     49 CYS  FE      2.66                                            
         FE     49 CYS  SE      2.32                                            
         SE     16 CYS  FE      2.32                                            
         SE     16 CYS  SE      3.51                                            
         SE     49 CYS  SE      3.51                                            
 15 SER                                                                         
         HN     15 SER  HB2     4.20                                            
         HB3    48 VAL  HB      5.70                                            
 16 CYS                                                                         
         HA     16 CYS  HB2     2.80                                            
         HB2    19 VAL  QQG     6.06                                            
         HB2    25 ILE  QG2     4.10                                            
         HB2    25 ILE  QG1     4.50                                            
         HB2    34 ILE  QG1     4.50                                            
         HB2    45 CYS  HA      4.00                                            
         HB2    45 CYS  HB2     2.60                                            
         HB2    48 VAL  QQG     6.06                                            
         HB2    54 ILE  QD1     4.40                                            
         SG     49 CYS  SG      6.38                                            
         FE     49 CYS  FE      2.66                                            
         FE     49 CYS  SE      2.32                                            
         SE     49 CYS  FE      2.32                                            
         SE     49 CYS  SE      3.51                                            
 17 VAL                                                                         
         HA     17 VAL  HB      2.90                                            
         HA     25 ILE  HB      6.00                                            
         HB     18 GLU- HN      4.70                                            
         QQG    18 GLU- HB3     7.66                                            
         QQG    18 GLU- QG      8.14                                            
         QQG    32 TYR  HB2     6.96                                            
 18 GLU-                                                                        
         HN     18 GLU- HB2     3.80                                            
         HN     18 GLU- HB3     3.70                                            
         HN     18 GLU- HG2     4.50                                            
         HN     18 GLU- HG3     4.50                                            
         HN     19 VAL  HN      3.30                                            
         HA     18 GLU- HB2     2.70                                            
         HA     18 GLU- HB3     3.00                                            
         HA     18 GLU- QG      3.77                                            
         HB3    19 VAL  HN      4.60                                            
 19 VAL                                                                         
         HN     19 VAL  HB      3.80                                            
         HN     19 VAL  QG1     4.80                                            
         HN     19 VAL  QG2     4.80                                            
         HN     19 VAL  QQG     4.09                                            
         HN     20 CYS  HN      3.20                                            
         HN     20 CYS  HB3     4.40                                            
         HA     19 VAL  HB      2.90                                            
         QQG    45 CYS  HA      7.96                                            
         QQG    45 CYS  HB2     6.06                                            
         QQG    48 VAL  QQG     8.12                                            
 20 CYS                                                                         
         HB3    21 PRO  QD      4.30                                            
         HB3    23 ASP- HN      3.90                                            
         HB3    23 ASP- HA      3.30                                            
         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                                                                         
         HB2    42 CYS  HB3     5.10                                            
         QG     42 CYS  HB3     4.50                                            
 22 VAL                                                                         
         QQG    39 CYS  HA      7.26                                            
 23 ASP-                                                                        
         QB     24 CYSN HA      5.68                                            
         QB     24 CYSN QB      6.75                                            
 24 CYSN                                                                        
         HA     26 HIS  HD2     4.60                                            
         HA     35 ASP- HN      6.00                                            
         HA     35 ASP- HB2     6.00                                            
         HA     35 ASP- HB3     6.00                                            
         HA     38 VAL  HB      4.10                                            
         HA     38 VAL  QG1     7.00                                            
         HA     38 VAL  QG2     7.00                                            
         HA     38 VAL  QQG     6.62                                            
         HB2    35 ASP- HB2     5.40                                            
         HB2    38 VAL  QG1     7.00                                            
         HB2    38 VAL  QG2     7.00                                            
         HB3    35 ASP- HB2     5.40                                            
         HB3    38 VAL  QG1     7.00                                            
         HB3    38 VAL  QG2     7.00                                            
         QB     35 ASP- HN      6.88                                            
         QB     35 ASP- HB2     4.55                                            
         QB     35 ASP- HB3     6.88                                            
         QB     38 VAL  HB      4.48                                            
         QB     38 VAL  QQG     6.34                                            
 25 ILE                                                                         
         HA     26 HIS  HN      2.40                                            
         HA     26 HIS  HB3     5.60                                            
         HA     26 HIS  HD2     6.00                                            
         HA     33 TYR  HN      4.90                                            
         HA     34 ILE  HA      3.00                                            
         HA     35 ASP- HN      5.30                                            
         HA     75 PHE  HZ      6.00                                            
         QG2    26 HIS  HN      6.50                                            
         QG2    45 CYS  HB2     4.30                                            
 26 HIS                                                                         
         N      33 TYR  O       3.30                                            
         HN     26 HIS  HB2     3.00                                            
         HN     26 HIS  HB3     3.50                                            
         HN     26 HIS  HD2     4.30                                            
         HN     27 GLU- HN      5.30                                            
         HN     33 TYR  HN      2.50                                            
         HN     33 TYR  HB2     6.00                                            
         HN     33 TYR  HB3     6.00                                            
         HN     33 TYR  O       2.40                                            
         HN     34 ILE  HN      5.80                                            
         HN     34 ILE  HA      3.60                                            
         HN     35 ASP- HN      5.00                                            
         HN     75 PHE  QE      8.00                                            
         HN     75 PHE  HZ      4.10                                            
         HA     26 HIS  HB3     2.90                                            
         HA     26 HIS  HD2     4.50                                            
         HA     27 GLU- HN      2.50                                            
         HA     27 GLU- HG3     4.20                                            
         HB2    26 HIS  HD2     3.50                                            
         HB2    27 GLU- HN      4.30                                            
         HB2    33 TYR  HN      6.00                                            
         HB2    33 TYR  HB3     3.20                                            
         HB2    74 PHE  QE      6.50                                            
         HB2    75 PHE  QE      7.70                                            
         HB2    75 PHE  HZ      3.60                                            
         HB3    27 GLU- HN      3.00                                            
         HB3    33 TYR  HB3     6.00                                            
         HB3    74 PHE  QE      6.40                                            
         HB3    75 PHE  QE      6.50                                            
         HD2    35 ASP- HN      6.00                                            
         HD2    35 ASP- HB2     6.00                                            
         HD2    35 ASP- HB3     4.80                                            
         HD2    75 PHE  HZ      2.90                                            
         O      33 TYR  N       3.30                                            
         O      33 TYR  HN      2.40                                            
 27 GLU-                                                                        
         HN     27 GLU- HB2     2.70                                            
         HN     27 GLU- HG2     5.80                                            
         HN     27 GLU- HG3     2.80                                            
         HN     32 TYR  HH      6.00                                            
         HN     33 TYR  HN      4.70                                            
         HA     27 GLU- HG2     3.10                                            
         HA     27 GLU- HG3     3.30                                            
         HA     28 GLY  HN      2.80                                            
         HA     32 TYR  HH      6.00                                            
         HB2    27 GLU- HG3     2.60                                            
         HB2    28 GLY  HN      4.20                                            
         HB2    32 TYR  HH      6.00                                            
         HB3    27 GLU- HG2     2.40                                            
         HB3    28 GLY  HN      4.10                                            
         HB3    32 TYR  HH      5.10                                            
         HG2    28 GLY  HN      5.70                                            
         HG2    32 TYR  HH      3.90                                            
         HG3    28 GLY  HN      6.00                                            
         HG3    29 GLU- HN      6.00                                            
         HG3    31 GLN  HN      6.00                                            
         HG3    32 TYR  HH      4.20                                            
 28 GLY                                                                         
         HN     31 GLN  HN      5.70                                            
         HN     33 TYR  QD      8.00                                            
         HA1    33 TYR  QD      6.90                                            
         HA1    74 PHE  QE      6.50                                            
         HA1    74 PHE  HZ      3.70                                            
         HA2    29 GLU- HN      3.50                                            
         HA2    33 TYR  QD      5.10                                            
         HA2    33 TYR  QE      7.60                                            
         HA2    74 PHE  QE      6.70                                            
         HA2    74 PHE  HZ      4.60                                            
 29 GLU-                                                                        
         HN     29 GLU- QB      3.60                                            
         HN     29 GLU- HG2     5.80                                            
         HN     29 GLU- HG3     5.80                                            
         HN     29 GLU- QG      5.34                                            
         HN     30 ASP- HN      3.50                                            
         HN     31 GLN  HN      5.20                                            
         HA     29 GLU- HG2     4.10                                            
         HA     29 GLU- HG3     4.10                                            
         QG     30 ASP- HN      6.88                                            
 30 ASP-                                                                        
         HN     30 ASP- HB2     3.60                                            
         HN     30 ASP- HB3     3.60                                            
         HN     30 ASP- QB      3.34                                            
         HN     31 GLN  HN      3.20                                            
         HN     31 GLN  HG2     6.00                                            
         HN     31 GLN  HG3     6.00                                            
 31 GLN                                                                         
         HN     31 GLN  HB2     3.90                                            
         HN     31 GLN  HG2     5.70                                            
         HN     31 GLN  HG3     5.70                                            
         HN     31 GLN  QG      5.15                                            
         HN     31 GLN  HE21    4.40                                            
         HA     31 GLN  QG      3.91                                            
         HB2    31 GLN  HE22    4.10                                            
         HG2    31 GLN  HE21    3.50                                            
         HG2    33 TYR  QD      7.20                                            
         HG3    31 GLN  HE21    3.50                                            
         HG3    33 TYR  QD      7.20                                            
         QG     33 TYR  HA      6.88                                            
 32 TYR                                                                         
         HN     32 TYR  HB2     3.00                                            
         HN     32 TYR  HB3     3.80                                            
         HA     33 TYR  HN      3.00                                            
 33 TYR                                                                         
         HN     33 TYR  HB2     3.10                                            
         HN     33 TYR  QE      6.60                                            
         HN     34 ILE  HN      4.90                                            
         HN     75 PHE  HZ      5.30                                            
         HA     33 TYR  HB3     3.00                                            
         HA     33 TYR  QE      4.90                                            
         HA     34 ILE  HN      3.20                                            
         HA     75 PHE  HZ      6.00                                            
         HB2    34 ILE  HN      4.80                                            
         HB2    75 PHE  QE      7.40                                            
         HB2    75 PHE  HZ      4.10                                            
         HB3    34 ILE  HN      3.80                                            
         HB3    74 PHE  QD      7.80                                            
         HB3    75 PHE  QE      6.30                                            
         HB3    75 PHE  HZ      4.90                                            
         QD     70 LYS+ HB3     8.00                                            
         QD     70 LYS+ HG2     6.60                                            
         QD     70 LYS+ HG3     5.90                                            
         QD     70 LYS+ QE      8.70                                            
         QD     71 ASN  HN      8.00                                            
         QD     71 ASN  HA      6.60                                            
         QD     74 PHE  QB      8.88                                            
         QD     74 PHE  QD      10.00                                           
         QD     74 PHE  QE      10.00                                           
         QD     74 PHE  HZ      8.00                                            
         QE     71 ASN  HN      8.00                                            
         HH     67 TYR  QD      8.00                                            
 34 ILE                                                                         
         HN     34 ILE  HA      2.80                                            
         HN     34 ILE  HB      2.80                                            
         HN     34 ILE  QG1     5.20                                            
         HN     71 ASN  HB2     6.00                                            
         HN     71 ASN  HB3     6.00                                            
         HN     75 PHE  QE      8.00                                            
         HN     75 PHE  HZ      6.00                                            
         HA     35 ASP- HN      2.50                                            
         HA     75 PHE  QE      8.00                                            
         HB     35 ASP- HN      4.50                                            
         QG2    39 CYS  HB3     3.84                                            
         QG1    45 CYS  HB2     5.05                                            
         QD1    45 CYS  HB2     3.90                                            
 35 ASP-                                                                        
         HN     35 ASP- HB2     2.90                                            
         HN     35 ASP- HB3     3.40                                            
         HN     38 VAL  QQG     8.56                                            
         HN     75 PHE  QE      8.00                                            
         HN     75 PHE  HZ      6.00                                            
         HA     36 PRO  HG2     6.00                                            
         HA     36 PRO  HD2     3.00                                            
         HA     36 PRO  HD3     3.00                                            
         HA     36 PRO  QD      2.72                                            
         HA     37 ASP- HN      3.70                                            
         HA     75 PHE  QD      6.20                                            
         HA     75 PHE  QE      6.60                                            
         HA     75 PHE  HZ      4.80                                            
         HB2    38 VAL  HB      3.50                                            
         HB2    38 VAL  QQG     6.76                                            
         HB2    75 PHE  QD      8.00                                            
         HB2    75 PHE  QE      8.00                                            
         HB3    36 PRO  QD      6.88                                            
         HB3    38 VAL  HN      2.40                                            
         HB3    38 VAL  HB      5.20                                            
         HB3    38 VAL  QQG     5.56                                            
         HB3    39 CYS  HN      4.50                                            
         HB3    75 PHE  QD      8.00                                            
         HB3    75 PHE  QE      7.00                                            
         O      39 CYS  N       3.30                                            
         O      39 CYS  HN      2.40                                            
 36 PRO                                                                         
         HA     38 VAL  HN      4.40                                            
         HA     39 CYS  HB3     3.40                                            
         HA     75 PHE  QE      8.00                                            
         HB2    37 ASP- HN      3.60                                            
         HB2    72 ARG+ QD      6.58                                            
         HB2    72 ARG+ HE      5.50                                            
         HG2    37 ASP- HN      4.30                                            
         HG2    72 ARG+ QG      5.68                                            
         HG2    72 ARG+ HE      6.00                                            
         HG3    72 ARG+ HA      5.30                                            
         HG3    72 ARG+ QG      6.28                                            
         HD2    72 ARG+ HA      4.80                                            
         HD2    75 PHE  QD      8.00                                            
         HD3    72 ARG+ HA      4.80                                            
         HD3    75 PHE  QD      8.00                                            
         QD     37 ASP- HN      5.26                                            
         QD     72 ARG+ HA      4.62                                            
         QD     72 ARG+ QG      7.75                                            
         QD     75 PHE  QD      7.61                                            
         QD     75 PHE  QE      8.88                                            
         QD     76 LYS+ QD      6.38                                            
 37 ASP-                                                                        
         HN     37 ASP- QB      3.54                                            
         HN     38 VAL  HN      2.60                                            
         HN     38 VAL  HA      5.10                                            
         HN     38 VAL  HB      5.00                                            
         HN     38 VAL  QQG     7.66                                            
         HA     37 ASP- HB2     3.00                                            
         HA     37 ASP- HB3     3.00                                            
         HB2    38 VAL  HN      4.70                                            
         HB2    38 VAL  QG1     8.12                                            
         HB2    38 VAL  QG2     8.12                                            
         HB3    38 VAL  HN      4.70                                            
         HB3    38 VAL  QG1     8.12                                            
         HB3    38 VAL  QG2     8.12                                            
         QB     38 VAL  HN      4.14                                            
         QB     38 VAL  QQG     6.21                                            
 38 VAL                                                                         
         HN     38 VAL  HB      3.20                                            
         HN     38 VAL  QG1     4.80                                            
         HN     38 VAL  QG2     4.80                                            
         HN     38 VAL  QQG     3.86                                            
         HN     39 CYS  HN      3.30                                            
         HA     38 VAL  QG1     3.50                                            
         HA     38 VAL  QG2     3.50                                            
         HB     39 CYS  HN      4.30                                            
         QG1    39 CYS  HN      7.00                                            
         QG2    39 CYS  HN      7.00                                            
         QQG    39 CYS  HN      6.43                                            
 39 CYS                                                                         
         HN     39 CYS  HB3     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  QG2     3.40                                            
         HA     41 ASP- HN      2.90                                            
         HB     41 ASP- HN      4.50                                            
         HB     42 CYS  HB3     4.90                                            
         QG1    41 ASP- HN      4.40                                            
         QG1    42 CYS  HB3     3.30                                            
 41 ASP-                                                                        
         HN     41 ASP- HA      2.90                                            
         HN     41 ASP- HB2     3.60                                            
         HN     41 ASP- HB3     4.10                                            
 42 CYS                                                                         
         HA     42 CYS  HB3     2.70                                            
         SG     45 CYS  SG      6.38                                            
         FE     45 CYS  FE      2.66                                            
         SE     45 CYS  FE      2.32                                            
         SE     45 CYS  SE      3.51                                            
 45 CYS                                                                         
         HA     45 CYS  HB2     3.00                                            
         HA     48 VAL  QQG     8.56                                            
         HB2    46 GLU- HA      4.90                                            
         HB2    48 VAL  HN      5.20                                            
         HB2    54 ILE  QD1     4.60                                            
 46 GLU-                                                                        
         HA     46 GLU- QG      4.00                                            
         HA     54 ILE  HB      3.30                                            
 47 ALA                                                                         
         HN     47 ALA  QB      3.50                                            
         HN     48 VAL  HN      3.00                                            
         QB     48 VAL  HN      4.10                                            
         QB     48 VAL  HA      6.70                                            
         QB     48 VAL  QQG     8.06                                            
 48 VAL                                                                         
         HN     48 VAL  HB      4.00                                            
         HN     48 VAL  QG1     4.40                                            
         HN     48 VAL  QG2     4.40                                            
         HN     48 VAL  QQG     4.01                                            
         HA     48 VAL  HB      3.00                                            
 49 CYS                                                                         
         HN     49 CYS  HB3     2.80                                            
         HB3    50 PRO  QD      4.70                                            
         HB3    51 VAL  QG1     5.00                                            
         HB3    51 VAL  QG2     5.00                                            
         HB3    51 VAL  QQG     4.44                                            
         HB3    52 SER  HA      4.00                                            
         HB3    53 ALA  HN      3.80                                            
         HB3    54 ILE  HN      3.80                                            
         HB3    54 ILE  HB      5.00                                            
         HB3    54 ILE  QG1     5.00                                            
 52 SER                                                                         
         HN     52 SER  QB      3.68                                            
 54 ILE                                                                         
         HA     55 TYR  HN      2.80                                            
 55 TYR                                                                         
         HN     55 TYR  HB2     3.10                                            
         HN     55 TYR  HB3     3.60                                            
         HN     55 TYR  QE      7.00                                            
         HN     56 HIS  HN      6.00                                            
         HN     60 VAL  QQG     8.40                                            
         HB2    56 HIS  HN      3.60                                            
         HB2    59 PHE  HB2     5.50                                            
         HB2    60 VAL  HA      4.80                                            
         HB2    60 VAL  QQG     6.60                                            
         HB3    56 HIS  HN      3.20                                            
         HB3    59 PHE  HN      4.20                                            
         HB3    60 VAL  QQG     6.90                                            
         QD     56 HIS  HN      8.00                                            
         QD     59 PHE  HB2     8.00                                            
         QD     59 PHE  HB3     7.90                                            
         QD     61 PRO  HD2     8.00                                            
         QE     64 TRP  HE3     7.00                                            
         QE     64 TRP  HZ3     6.70                                            
 56 HIS                                                                         
         HN     56 HIS  HB2     2.80                                            
         HN     56 HIS  HB3     3.50                                            
         HN     56 HIS  HD2     6.00                                            
         HN     59 PHE  HN      5.50                                            
         HN     59 PHE  HB2     3.30                                            
         HN     59 PHE  HB3     3.90                                            
         HN     59 PHE  QR      8.40                                            
         HN     60 VAL  QQG     8.40                                            
         HA     56 HIS  HB2     2.90                                            
         HA     56 HIS  HB3     3.00                                            
         HA     56 HIS  HD2     3.90                                            
         HA     57 GLU- HN      2.70                                            
         HA     57 GLU- QB      6.08                                            
         HA     58 ASP- HN      4.20                                            
         HA     59 PHE  HN      6.00                                            
         HB2    56 HIS  HD2     3.80                                            
         HB2    57 GLU- HN      5.10                                            
         HB2    58 ASP- HN      4.70                                            
         HB2    59 PHE  HN      4.00                                            
         HB2    59 PHE  HB2     5.60                                            
         HB2    59 PHE  QR      8.40                                            
         HB3    57 GLU- HN      5.30                                            
         HB3    58 ASP- HN      3.30                                            
         HB3    59 PHE  HN      3.30                                            
         HB3    59 PHE  HB2     4.70                                            
         HB3    59 PHE  HB3     6.00                                            
         HB3    59 PHE  QR      7.80                                            
         HD2    57 GLU- HN      6.00                                            
         O      60 VAL  N       3.30                                            
         O      60 VAL  HN      2.40                                            
 57 GLU-                                                                        
         HN     57 GLU- HA      2.90                                            
         HN     57 GLU- HB2     3.40                                            
         HN     57 GLU- HB3     3.40                                            
         HN     57 GLU- QB      3.04                                            
         HN     57 GLU- HG2     4.70                                            
         HN     57 GLU- HG3     4.70                                            
         HN     57 GLU- QG      3.97                                            
         HN     58 ASP- HN      2.90                                            
         HN     58 ASP- QB      6.18                                            
         HN     59 PHE  HN      4.70                                            
         HN     60 VAL  QQG     8.40                                            
         HA     57 GLU- QG      3.51                                            
         HA     59 PHE  HN      3.70                                            
         HA     60 VAL  HN      3.50                                            
         HA     60 VAL  HB      3.10                                            
         HA     60 VAL  QQG     5.40                                            
         HA     68 ILE  QG2     4.80                                            
         HA     68 ILE  HG12    5.10                                            
         HA     68 ILE  HG13    5.10                                            
         HA     68 ILE  QD1     4.30                                            
         HB2    58 ASP- HN      4.20                                            
         HB2    68 ILE  HG12    5.65                                            
         HB2    68 ILE  HG13    5.65                                            
         HB3    58 ASP- HN      4.20                                            
         HB3    68 ILE  HG12    5.65                                            
         HB3    68 ILE  HG13    5.65                                            
         QB     57 GLU- QG      2.48                                            
         QB     58 ASP- HN      3.72                                            
         QB     68 ILE  QG2     6.88                                            
         QB     68 ILE  QG1     4.87                                            
         QG     58 ASP- HN      5.28                                            
         QG     68 ILE  QG2     6.08                                            
         QG     68 ILE  QG1     5.95                                            
 58 ASP-                                                                        
         HN     58 ASP- HB2     3.40                                            
         HN     58 ASP- HB3     3.40                                            
         HN     58 ASP- QB      2.99                                            
         HN     59 PHE  HN      2.80                                            
         HN     59 PHE  HB2     5.60                                            
         HN     60 VAL  HN      4.50                                            
         HN     60 VAL  QQG     8.40                                            
         HA     58 ASP- HB2     3.00                                            
         HA     58 ASP- HB3     3.00                                            
         HA     58 ASP- QB      2.72                                            
         HA     59 PHE  HN      3.40                                            
         HA     60 VAL  HN      4.80                                            
         HB2    59 PHE  HN      5.10                                            
         HB3    59 PHE  HN      5.10                                            
         QB     59 PHE  QR      9.28                                            
 59 PHE                                                                         
         HN     59 PHE  HB2     2.90                                            
         HN     59 PHE  HB3     3.40                                            
         HN     60 VAL  HN      2.50                                            
         HN     60 VAL  HB      4.50                                            
         HN     60 VAL  QQG     7.20                                            
         HA     59 PHE  HB3     3.00                                            
         HA     60 VAL  HN      3.60                                            
         HB2    60 VAL  HN      4.50                                            
         HB3    60 VAL  HN      4.80                                            
 60 VAL                                                                         
         HN     60 VAL  HB      2.60                                            
         HN     61 PRO  HD3     5.00                                            
         HN     68 ILE  QG1     6.88                                            
         HA     61 PRO  HD2     3.00                                            
         HA     61 PRO  HD3     2.40                                            
         HA     64 TRP  HB3     5.60                                            
         HB     65 LYS+ HA      5.00                                            
         HB     68 ILE  HG12    4.00                                            
         HB     68 ILE  HG13    4.00                                            
         HB     68 ILE  QG1     3.65                                            
         QQG    61 PRO  HD2     6.10                                            
         QQG    61 PRO  HD3     7.00                                            
         QQG    64 TRP  HN      8.40                                            
         QQG    64 TRP  HA      8.40                                            
         QQG    64 TRP  HB2     6.90                                            
         QQG    64 TRP  HB3     7.40                                            
         QQG    64 TRP  HE3     8.00                                            
         QQG    65 LYS+ HN      7.90                                            
         QQG    65 LYS+ HA      5.10                                            
         QQG    67 TYR  HN      8.40                                            
         QQG    67 TYR  QD      10.40                                           
         QQG    68 ILE  HN      7.70                                            
         QQG    68 ILE  QD1     8.20                                            
 61 PRO                                                                         
         HA     62 GLU- HN      2.40                                            
         HA     63 GLU- HN      5.40                                            
         HB2    62 GLU- HN      3.90                                            
         HB2    63 GLU- HN      3.60                                            
         HB2    64 TRP  HN      3.60                                            
         HB2    64 TRP  HB2     6.00                                            
         HB2    64 TRP  HB3     6.00                                            
         HB2    64 TRP  HE3     4.60                                            
         HB3    62 GLU- HN      3.60                                            
         HB3    63 GLU- HN      5.20                                            
         HB3    64 TRP  HE3     6.00                                            
         QG     64 TRP  HN      6.88                                            
         QG     64 TRP  HE3     5.08                                            
         QG     64 TRP  HZ3     6.88                                            
         HD2    64 TRP  HB2     3.70                                            
         HD2    64 TRP  HB3     4.10                                            
         HD2    64 TRP  HE3     4.00                                            
         HD3    64 TRP  HE3     6.00                                            
         O      64 TRP  N       3.30                                            
         O      64 TRP  HN      2.40                                            
 62 GLU-                                                                        
         HN     62 GLU- HA      2.90                                            
         HN     62 GLU- HB2     2.80                                            
         HN     62 GLU- HB3     3.00                                            
         HN     62 GLU- HG2     5.90                                            
         HN     62 GLU- HG3     5.90                                            
         HN     62 GLU- QG      5.40                                            
         HN     63 GLU- HN      3.90                                            
         HA     65 LYS+ HN      3.10                                            
         HA     65 LYS+ HB2     2.50                                            
         HA     65 LYS+ HB3     3.50                                            
         HA     65 LYS+ QG      6.10                                            
         HA     65 LYS+ QD      5.40                                            
         HA     65 LYS+ QE      5.90                                            
         HB2    63 GLU- HN      4.20                                            
         HB2    65 LYS+ QD      7.00                                            
         HB3    63 GLU- HN      3.20                                            
         HB3    65 LYS+ QG      5.70                                            
         HG2    63 GLU- HN      6.00                                            
         HG3    63 GLU- HN      6.00                                            
         QG     65 LYS+ HB2     5.48                                            
         QG     65 LYS+ HB3     6.88                                            
         O      65 LYS+ N       3.30                                            
         O      65 LYS+ HN      2.40                                            
 63 GLU-                                                                        
         HN     63 GLU- HB2     2.80                                            
         HN     63 GLU- HB3     3.90                                            
         HN     63 GLU- QG      5.40                                            
         HN     64 TRP  HN      3.10                                            
         HN     65 LYS+ HN      5.00                                            
         HA     63 GLU- HB2     3.00                                            
         HA     65 LYS+ HN      4.80                                            
         HB2    64 TRP  HN      4.20                                            
         HB2    64 TRP  HA      5.30                                            
         HB2    64 TRP  HE3     6.00                                            
         HB3    64 TRP  HN      4.80                                            
         HB3    64 TRP  HE1     6.00                                            
         QG     64 TRP  HN      7.00                                            
         QG     64 TRP  HD1     7.00                                            
         QG     64 TRP  HE1     7.00                                            
 64 TRP                                                                         
         HN     64 TRP  HB2     3.00                                            
         HN     64 TRP  HB3     3.60                                            
         HN     64 TRP  HE3     5.60                                            
         HN     65 LYS+ HN      2.90                                            
         HA     64 TRP  HB2     3.00                                            
         HA     64 TRP  HB3     2.70                                            
         HA     64 TRP  HD1     2.40                                            
         HA     64 TRP  HE1     5.30                                            
         HA     65 LYS+ HN      3.50                                            
         HA     67 TYR  HN      3.90                                            
         HA     67 TYR  HB2     4.40                                            
         HA     67 TYR  QD      5.50                                            
         HA     67 TYR  QE      7.10                                            
         HB2    64 TRP  HD1     3.80                                            
         HB2    64 TRP  HE3     2.90                                            
         HB2    65 LYS+ HN      4.40                                            
         HB2    67 TYR  QD      6.60                                            
         HB2    67 TYR  QE      7.60                                            
         HB3    64 TRP  HD1     3.60                                            
         HB3    64 TRP  HE3     3.70                                            
         HB3    65 LYS+ HN      5.10                                            
         HB3    67 TYR  HN      4.90                                            
         HB3    67 TYR  QD      5.30                                            
         HB3    67 TYR  QE      7.20                                            
         HD1    67 TYR  QD      6.30                                            
         HD1    67 TYR  QE      6.60                                            
         HE1    67 TYR  QD      8.00                                            
         HE1    67 TYR  QE      8.00                                            
 65 LYS+                                                                        
         HN     65 LYS+ HB2     2.80                                            
         HN     65 LYS+ HB3     3.20                                            
         HN     65 LYS+ QG      5.60                                            
         HN     65 LYS+ QD      5.10                                            
         HA     65 LYS+ HB3     2.80                                            
         HA     65 LYS+ QD      5.10                                            
         HA     65 LYS+ QE      6.70                                            
         HA     68 ILE  HN      3.80                                            
         HA     68 ILE  HB      2.80                                            
         HA     68 ILE  HG12    4.70                                            
         HA     68 ILE  HG13    4.70                                            
         HA     68 ILE  QG1     4.23                                            
         HA     68 ILE  QD1     7.00                                            
         HB2    65 LYS+ QE      7.00                                            
         HB3    65 LYS+ QE      7.00                                            
         QG     68 ILE  HB      7.00                                            
         QG     68 ILE  QD1     7.00                                            
         QD     68 ILE  QG2     8.00                                            
 66 SER                                                                         
         HA     66 SER  HB2     2.90                                            
         HA     66 SER  HB3     2.90                                            
         HA     66 SER  QB      2.66                                            
         HA     68 ILE  HN      4.30                                            
         HA     69 GLN  HN      5.70                                            
         HA     70 LYS+ HN      5.70                                            
         O      70 LYS+ N       3.30                                            
         O      70 LYS+ HN      2.40                                            
 67 TYR                                                                         
         HN     67 TYR  HB2     2.70                                            
         HN     67 TYR  QE      6.70                                            
         HN     68 ILE  HN      3.30                                            
         HN     68 ILE  QG2     7.00                                            
         HA     67 TYR  HB2     3.00                                            
         HA     69 GLN  HN      4.60                                            
         HA     70 LYS+ HN      3.20                                            
         HA     70 LYS+ HB2     2.90                                            
         HA     70 LYS+ HB3     2.60                                            
         HA     71 ASN  HN      3.70                                            
         HB2    68 ILE  HN      4.20                                            
         HB2    71 ASN  QD2     6.80                                            
         HB3    68 ILE  HN      4.90                                            
         HB3    71 ASN  HN      4.10                                            
         HB3    71 ASN  QD2     6.50                                            
         QD     68 ILE  HN      8.00                                            
         QD     70 LYS+ HB2     8.00                                            
         QD     70 LYS+ HB3     8.00                                            
         QD     70 LYS+ HG2     6.30                                            
         QD     70 LYS+ HG3     8.00                                            
         QD     71 ASN  HN      6.80                                            
         QD     71 ASN  QD2     8.40                                            
         O      71 ASN  N       3.30                                            
         O      71 ASN  HN      2.40                                            
 68 ILE                                                                         
         HN     68 ILE  HB      2.60                                            
         HN     68 ILE  QG2     4.20                                            
         HN     68 ILE  HG12    4.20                                            
         HN     68 ILE  HG13    4.20                                            
         HN     68 ILE  QG1     3.77                                            
         HN     68 ILE  QD1     3.50                                            
         HN     69 GLN  HN      3.00                                            
         HN     70 LYS+ HN      4.70                                            
         HA     68 ILE  QG2     3.40                                            
         HA     68 ILE  HG12    3.90                                            
         HA     68 ILE  HG13    3.90                                            
         HA     68 ILE  QG1     3.70                                            
         HA     71 ASN  HN      4.30                                            
         HA     71 ASN  HB2     2.90                                            
         HA     71 ASN  HB3     4.00                                            
         HA     71 ASN  QD2     7.00                                            
         HB     68 ILE  HG12    3.00                                            
         HB     68 ILE  HG13    3.00                                            
         HB     68 ILE  QD1     3.40                                            
         HB     69 GLN  HN      2.90                                            
         QG2    68 ILE  HG12    3.70                                            
         QG2    68 ILE  HG13    3.70                                            
         QG2    68 ILE  QG1     3.44                                            
         QG2    69 GLN  HN      4.70                                            
         QG2    71 ASN  HB3     6.20                                            
         QG2    72 ARG+ HE      7.20                                            
         HG12   69 GLN  HN      6.00                                            
         HG13   69 GLN  HN      6.00                                            
 69 GLN                                                                         
         HN     69 GLN  HB2     2.90                                            
         HN     69 GLN  HB3     2.80                                            
         HN     69 GLN  HG2     6.00                                            
         HN     69 GLN  HG3     6.00                                            
         HN     69 GLN  QG      5.74                                            
         HA     69 GLN  HB2     2.90                                            
         HA     69 GLN  HG2     4.00                                            
         HA     69 GLN  HG3     4.00                                            
         HA     69 GLN  QG      3.80                                            
         HA     69 GLN  QE2     6.77                                            
         HA     70 LYS+ HN      3.60                                            
         HA     72 ARG+ HN      3.60                                            
         HA     72 ARG+ QB      3.78                                            
         HB2    70 LYS+ HN      3.90                                            
         HB3    69 GLN  HE21    5.60                                            
         HB3    69 GLN  HE22    5.60                                            
         HB3    70 LYS+ HN      3.00                                            
         HG2    70 LYS+ HN      6.00                                            
         HG2    72 ARG+ HB2     7.75                                            
         HG2    72 ARG+ HB3     7.75                                            
         HG3    70 LYS+ HN      6.00                                            
         HG3    72 ARG+ HB2     7.75                                            
         HG3    72 ARG+ HB3     7.75                                            
         QG     72 ARG+ QB      6.82                                            
         QG     72 ARG+ QD      6.65                                            
         QE2    72 ARG+ QD      7.74                                            
         O      73 ASP- N       3.30                                            
         O      73 ASP- HN      2.40                                            
 70 LYS+                                                                        
         HN     70 LYS+ HB2     3.60                                            
         HN     70 LYS+ HB3     3.00                                            
         HN     70 LYS+ HG2     4.90                                            
         HN     70 LYS+ HG3     4.70                                            
         HN     71 ASN  HN      2.70                                            
         HA     70 LYS+ HB2     2.90                                            
         HA     70 LYS+ HB3     3.00                                            
         HA     70 LYS+ HG3     3.10                                            
         HA     71 ASN  HN      3.50                                            
         HA     73 ASP- HN      3.40                                            
         HA     73 ASP- HB2     3.70                                            
         HA     73 ASP- HB3     2.50                                            
         HA     74 PHE  QE      8.00                                            
         HB2    70 LYS+ HG2     2.90                                            
         HB2    70 LYS+ HG3     3.00                                            
         HB2    70 LYS+ QE      7.00                                            
         HB2    71 ASN  HN      3.70                                            
         HB3    70 LYS+ QE      7.00                                            
         HB3    71 ASN  HN      3.00                                            
         HB3    71 ASN  QD2     7.00                                            
         HG2    71 ASN  HN      5.00                                            
         HG2    74 PHE  QE      7.70                                            
         HG2    74 PHE  HZ      5.10                                            
         HG3    70 LYS+ QE      4.00                                            
         HG3    71 ASN  HN      6.00                                            
         HG3    74 PHE  HZ      6.00                                            
         QE     71 ASN  HA      7.00                                            
         QE     74 PHE  HZ      7.00                                            
         O      74 PHE  N       3.30                                            
         O      74 PHE  HN      2.40                                            
 71 ASN                                                                         
         HN     71 ASN  HB2     3.00                                            
         HN     71 ASN  QD2     3.90                                            
         HN     72 ARG+ HN      2.90                                            
         HA     71 ASN  HB2     2.90                                            
         HA     71 ASN  HB3     3.00                                            
         HA     72 ARG+ HN      3.60                                            
         HA     73 ASP- HN      5.10                                            
         HA     74 PHE  QB      3.68                                            
         HA     74 PHE  QD      8.00                                            
         HA     75 PHE  QE      8.00                                            
         HB2    72 ARG+ HN      3.70                                            
         HB2    75 PHE  QD      8.00                                            
         HB3    72 ARG+ HN      3.50                                            
 72 ARG+                                                                        
         HN     72 ARG+ HB2     2.80                                            
         HN     72 ARG+ HB3     2.80                                            
         HN     72 ARG+ QB      2.51                                            
         HN     72 ARG+ QG      5.78                                            
         HN     72 ARG+ HE      4.50                                            
         HN     73 ASP- HN      2.90                                            
         HN     73 ASP- HB2     4.70                                            
         HN     73 ASP- HB3     4.20                                            
         HA     72 ARG+ HB2     3.00                                            
         HA     72 ARG+ HB3     3.00                                            
         HA     72 ARG+ QG      3.73                                            
         HA     72 ARG+ HD2     4.90                                            
         HA     72 ARG+ HD3     4.90                                            
         HA     72 ARG+ QD      4.21                                            
         HA     72 ARG+ HE      3.00                                            
         HB2    72 ARG+ HD2     4.20                                            
         HB2    72 ARG+ HD3     4.20                                            
         HB2    72 ARG+ HE      4.40                                            
         HB2    73 ASP- HN      3.30                                            
         HB3    72 ARG+ HD2     4.20                                            
         HB3    72 ARG+ HD3     4.20                                            
         HB3    72 ARG+ HE      4.40                                            
         HB3    73 ASP- HN      3.30                                            
         QB     72 ARG+ QD      3.68                                            
         QB     72 ARG+ HE      4.21                                            
         HG2    73 ASP- HN      6.00                                            
         HG3    73 ASP- HN      6.00                                            
         QG     76 LYS+ HG2     4.28                                            
         QG     76 LYS+ HG3     6.48                                            
         QG     76 LYS+ QE      7.88                                            
         O      75 PHE  N       3.30                                            
         O      75 PHE  HN      2.40                                            
 73 ASP-                                                                        
         HN     73 ASP- HB2     3.30                                            
         HN     73 ASP- HB3     3.00                                            
         HN     74 PHE  HN      3.40                                            
         HN     77 LYS+ QE      7.00                                            
         HA     73 ASP- HB2     2.90                                            
         HA     76 LYS+ HN      3.30                                            
         HA     76 LYS+ HB2     2.90                                            
         HA     76 LYS+ HB3     3.70                                            
         HA     76 LYS+ HG2     4.80                                            
         HA     76 LYS+ HG3     5.70                                            
         HA     76 LYS+ QE      6.70                                            
         HB2    74 PHE  HN      3.90                                            
         HB3    74 PHE  HN      3.30                                            
         O      76 LYS+ N       3.30                                            
         O      76 LYS+ HN      2.40                                            
 74 PHE                                                                         
         HN     74 PHE  HB2     3.60                                            
         HN     74 PHE  HB3     3.60                                            
         HN     74 PHE  QB      3.15                                            
         HN     75 PHE  HN      3.20                                            
         HA     74 PHE  HB2     2.90                                            
         HA     74 PHE  HB3     2.90                                            
         HA     74 PHE  QB      2.66                                            
         HA     74 PHE  QE      5.90                                            
         HA     75 PHE  HN      3.60                                            
         HB2    75 PHE  HN      4.60                                            
         HB2    75 PHE  QD      8.00                                            
         HB3    75 PHE  HN      4.60                                            
         HB3    75 PHE  QD      8.00                                            
         QB     75 PHE  HN      3.99                                            
         QD     75 PHE  QD      10.00                                           
         QD     75 PHE  QE      9.50                                            
         QD     75 PHE  HZ      7.00                                            
         QE     75 PHE  QE      10.00                                           
 75 PHE                                                                         
         HN     75 PHE  HB2     2.80                                            
         HN     75 PHE  HB3     3.70                                            
         HN     75 PHE  QE      6.00                                            
         HN     76 LYS+ HN      3.00                                            
         HA     75 PHE  HB2     2.90                                            
         HA     75 PHE  HB3     2.70                                            
         HA     76 LYS+ HN      3.60                                            
         HB3    76 LYS+ HN      4.90                                            
 76 LYS+                                                                        
         HN     76 LYS+ HB2     3.00                                            
         HN     76 LYS+ HB3     3.70                                            
         HN     76 LYS+ HG2     5.30                                            
         HN     76 LYS+ HG3     5.00                                            
         HN     76 LYS+ QD      5.20                                            
         HN     76 LYS+ QE      6.40                                            
         HN     77 LYS+ HN      4.30                                            
         HA     76 LYS+ HB3     2.90                                            
         HA     76 LYS+ QD      7.00                                            
         HB2    76 LYS+ QE      7.00                                            
         HB2    77 LYS+ HN      4.90                                            
         HB3    77 LYS+ HN      5.50                                            
         HB3    77 LYS+ QB      5.38                                            
         QD     77 LYS+ HN      7.00                                            
 77 LYS+                                                                        
         HN     77 LYS+ HB2     3.80                                            
         HN     77 LYS+ HB3     3.80                                            
         HN     77 LYS+ QB      3.60                                            
         HN     77 LYS+ QG      6.30                                            
         HN     77 LYS+ QD      7.00                                            
         HA     77 LYS+ QD      4.40                                            
         HB2    77 LYS+ QE      5.80                                            
         HB3    77 LYS+ QE      5.80                                            
         QB     77 LYS+ QE      5.30                                            




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