NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type subtype subsubtype
12382 1sw8 cing 1-original 1 DYANA/DIANA distance NOE simple



  1 ALA  
         HN      2 ASP- HN      4.80                
         HN      3 GLN  HA      6.50                
         HN      3 GLN  QB      7.38                
         HN      6 GLU- HN      6.50                
         HA      2 ASP- QB      6.50                
         HA      3 GLN  HN      4.80                
         HA      3 GLN  QG      7.50                
         HA      4 LEU  HN      6.50                
         QB      3 GLN  HN      7.50                
         QB      4 LEU  HN      5.60                
         QB      4 LEU  HA      7.50                
         QB      4 LEU  QQD    10.07                
  2 ASP- 
         HN      3 GLN  HN      3.40                
         HN      3 GLN  HA      6.50                
         HN      3 GLN  QB      7.38                
         HN      3 GLN  QG      6.30                
         HN      4 LEU  HN      4.80                
         HN      4 LEU  QQD     9.07                
         HA      3 GLN  QB      6.28                
         QB      3 GLN  HA      6.80                
         QB      3 GLN  QG      8.50                
         QB      4 LEU  HN      7.50                
  3 GLN  
         HN      3 GLN  HB2     4.00                
         HN      3 GLN  HB3     4.00                
         HN      3 GLN  QB      3.75                
         HN      3 GLN  QG      4.60                
         HN      4 LEU  HN      3.80                
         HN      4 LEU  HA      6.50                
         HN      4 LEU  QB      5.38                
         HN      4 LEU  QQD     6.97                
         HN      5 THR  HN      6.50                
         HA      4 LEU  HN      3.60                
         HA      4 LEU  HA      5.60                
         HA      5 THR  HN      6.50                
         HB2     4 LEU  HN      4.70                
         HB3     4 LEU  HN      4.70                
         QB      4 LEU  HN      4.37                
         QB      4 LEU  QQD     9.95                
         QB      5 THR  HN      7.38                
         QB      5 THR  QG2     7.18                
         QB      6 GLU- HN      7.38                
         QG      4 LEU  HN      7.50                
         QG      4 LEU  QQD    10.07                
  4 LEU  
         HN      4 LEU  HG      6.50                
         HN      4 LEU  QQD     4.97                
         HN      5 THR  HN      5.60                
         HN      5 THR  HA      6.50                
         HN      5 THR  QG2     7.50                
         HA      5 THR  HN      3.60                
         HA      6 GLU- HN      4.30                
         HA      7 GLU- HN      6.50                
         HB2     5 THR  HN      4.70                
         HB3     5 THR  HN      4.70                
         QB      4 LEU  HG      2.68                
         QB      5 THR  HN      4.47                
         QB      5 THR  QG2     8.38                
         QB      6 GLU- HN      7.38                
         QB      7 GLU- HN      7.38                
         QB      8 GLN  QG      8.38                
         HG      7 GLU- QG      7.38                
         HG     73 ALA  HA      6.30                
         HG     73 ALA  QB      5.30                
         QD1    76 MET  HB2    10.64                
         QD1    76 MET  HB3    10.64                
         QD2    76 MET  HB2    10.64                
         QD2    76 MET  HB3    10.64                
         QQD     5 THR  HN      6.07                
         QQD     5 THR  HA      9.07                
         QQD     6 GLU- QB     10.07                
         QQD     6 GLU- QG     10.07                
         QQD     8 GLN  HN      9.07                
         QQD     8 GLN  QB      8.95                
         QQD     8 GLN  QG     10.07                
         QQD    12 PHE  QB     10.07                
         QQD    12 PHE  HE1     9.07                
         QQD    69 LEU  QQD    11.64                
         QQD    73 ALA  HA      7.57                
         QQD    73 ALA  QB      8.27                
         QQD    76 MET  QB      9.03                
         QQD    76 MET  QG      9.95                
  5 THR  
         HN      5 THR  HB      4.00                
         HN      6 GLU- HN      5.60                
         HN      7 GLU- HN      6.50                
         HN      7 GLU- QG      7.38                
         HN      8 GLN  HN      4.70                
         HN      8 GLN  QB      5.58                
         HN      8 GLN  QG      6.30                
         HN      9 ILE  HN      5.90                
         HN      9 ILE  QG1     6.38                
         HA      5 THR  QG2     3.60                
         HA      6 GLU- HA      6.50                
         HA      6 GLU- QB      7.50                
         HA      7 GLU- HN      4.90                
         HA      8 GLN  HN      5.10                
         HA      8 GLN  QG      6.50                
         HA      9 ILE  HN      6.50                
         HA      9 ILE  QD1     7.50                
         HB      6 GLU- HN      3.90                
         HB      6 GLU- QB      7.50                
         HB      7 GLU- HN      6.50                
         HB      7 GLU- QG      7.08                
         HB      8 GLN  HN      6.50                
         HB      9 ILE  QG1     6.78                
         QG2     6 GLU- HN      7.50                
         QG2     7 GLU- HN      7.50                
         QG2     8 GLN  HN      7.50                
         QG2     8 GLN  QB      7.48                
         QG2     8 GLN  QG      7.70                
         QG2     9 ILE  HN      7.50                
         QG2     9 ILE  QG1     6.38                
         QG2     9 ILE  QD1     7.40                
  6 GLU- 
         HN      6 GLU- QG      5.10                
         HN      7 GLU- HN      4.20                
         HN      7 GLU- HA      6.30                
         HN      7 GLU- QB      7.50                
         HN      7 GLU- HG2     4.70                
         HN      7 GLU- HG3     4.70                
         HN      8 GLN  HN      6.50                
         HN      9 ILE  HN      6.40                
         HN      9 ILE  QG2     7.50                
         HN      9 ILE  QG1     7.38                
         HN      9 ILE  QD1     7.50                
         HA      9 ILE  HN      4.60                
         HA      9 ILE  HB      6.50                
         HA      9 ILE  QG2     6.00                
         HA      9 ILE  HG12    6.20                
         HA      9 ILE  HG13    6.20                
         HA      9 ILE  QD1     7.50                
         HA     10 ALA  HN      4.90                
         QB      7 GLU- HA      5.50                
         QB      7 GLU- QG      5.68                
         QG      7 GLU- HA      7.50                
         QG      9 ILE  QG2     8.50                
         QG     10 ALA  HN      5.80                
         QG     10 ALA  QB      8.50                
  7 GLU- 
         HN      7 GLU- HG2     6.50                
         HN      7 GLU- HG3     6.50                
         HN      8 GLN  HN      4.00                
         HN      8 GLN  HA      5.80                
         HN      9 ILE  HN      6.50                
         HN      9 ILE  QG1     7.38                
         HN     10 ALA  HN      5.70                
         HA      8 GLN  HA      6.50                
         HA      9 ILE  HN      5.00                
         HA      9 ILE  QG2     7.50                
         HA     10 ALA  HN      5.00                
         HA     10 ALA  QB      7.50                
         HA     11 GLU- QG      7.38                
         QB      8 GLN  HA      6.00                
         QB      8 GLN  QB      7.38                
         QB     10 ALA  QB      6.30                
         HG2    10 ALA  QB      7.50                
         HG3    10 ALA  QB      7.50                
         QG      9 ILE  HN      6.38                
  8 GLN  
         HN      8 GLN  QG      7.50                
         HN      9 ILE  HN      4.20                
         HN      9 ILE  HA      6.20                
         HN      9 ILE  QG2     7.50                
         HN      9 ILE  HG12    6.50                
         HN      9 ILE  HG13    6.50                
         HN      9 ILE  QG1     5.65                
         HN     10 ALA  HN      6.50                
         HN     10 ALA  QB      7.50                
         HA      8 GLN  QG      3.40                
         HA     10 ALA  HN      6.50                
         HA     11 GLU- HN      4.40                
         HA     11 GLU- QB      7.38                
         HA     12 PHE  HN      6.10                
         QB      9 ILE  QG1     6.65                
         QB     10 ALA  HN      5.38                
         QG      9 ILE  HN      5.60                
         QG     11 GLU- QB      8.38                
  9 ILE  
         HN      9 ILE  HB      3.60                
         HN      9 ILE  HG12    3.50                
         HN      9 ILE  HG13    3.50                
         HN      9 ILE  QG1     3.29                
         HN      9 ILE  QD1     7.50                
         HN     10 ALA  HN      3.90                
         HN     10 ALA  QB      7.50                
         HN     11 GLU- HN      6.10                
         HN     12 PHE  HN      5.00                
         HA      9 ILE  QG2     3.40                
         HA      9 ILE  QG1     3.94                
         HA      9 ILE  QD1     4.70                
         HA     11 GLU- HN      6.50                
         HA     12 PHE  HN      4.60                
         HA     12 PHE  QB      5.80                
         HA     12 PHE  HD1     5.70                
         HA     13 LYS+ HN      5.80                
         HA     69 LEU  QQD     8.47                
         HB     10 ALA  HN      6.50                
         QG2    10 ALA  HN      5.10                
         QG2    10 ALA  QB      8.50                
         QG2    12 PHE  HN      7.50                
         QG2    12 PHE  QB      8.50                
         QG2    13 LYS+ QE      7.88                
         QG2    69 LEU  QQD     8.57                
         QG1    10 ALA  HN      4.78                
         QG1    12 PHE  QB      8.38                
         QG1    13 LYS+ QE      8.25                
         QG1    69 LEU  QQD     9.35                
         QD1    10 ALA  HN      7.50                
         QD1    13 LYS+ HN      6.80                
         QD1    13 LYS+ QE      8.38                
         QD1    69 LEU  QQD     9.27                
 10 ALA  
         HN     10 ALA  QB      3.40                
         HN     11 GLU- HN      3.70                
         HN     12 PHE  HN      4.40                
         HN     13 LYS+ HN      5.30                
         HA     11 GLU- QG      7.38                
         HA     12 PHE  HN      4.80                
         HA     12 PHE  QB      7.50                
         HA     13 LYS+ HN      6.50                
         HA     13 LYS+ QB      5.10                
         HA     13 LYS+ HG2     6.50                
         HA     13 LYS+ HG3     6.50                
         HA     13 LYS+ QG      6.19                
         HA     13 LYS+ HD2     6.50                
         HA     13 LYS+ HD3     6.50                
         HA     13 LYS+ QD      6.19                
         QB     11 GLU- HN      3.40                
         QB     11 GLU- HA      7.50                
         QB     11 GLU- QB      7.18                
         QB     11 GLU- QG      7.98                
         QB     12 PHE  HN      5.60                
         QB     13 LYS+ HN      5.60                
 11 GLU- 
         HN     11 GLU- HG2     6.50                
         HN     11 GLU- HG3     6.50                
         HN     12 PHE  HN      3.80                
         HN     12 PHE  HA      5.50                
         HN     12 PHE  QB      7.50                
         HN     12 PHE  HD1     6.50                
         HN     13 LYS+ HN      4.40                
         HN     14 GLU- QB      7.38                
         HA     11 GLU- HG2     2.90                
         HA     11 GLU- HG3     2.90                
         HA     11 GLU- QG      2.61                
         HA     14 GLU- QB      7.38                
         HA     15 ALA  HN      6.50                
         QG     12 PHE  HN      6.28                
 12 PHE  
         HN     12 PHE  HD1     3.80                
         HN     12 PHE  HE1     5.40                
         HN     13 LYS+ HN      4.10                
         HN     13 LYS+ HA      5.40                
         HN     13 LYS+ QB      5.10                
         HN     14 GLU- QB      7.38                
         HN     15 ALA  HN      5.90                
         HN     16 PHE  HN      6.50                
         HA     12 PHE  HD1     6.50                
         HA     15 ALA  HN      4.50                
         HA     15 ALA  QB      3.40                
         HA     16 PHE  HN      6.30                
         QB     13 LYS+ QB      8.50                
         QB     15 ALA  QB      8.50                
         QB     16 PHE  HN      7.20                
         QB     16 PHE  QB      8.38                
         QB     65 PHE  HZ      7.50                
         QB     68 PHE  HE1     7.50                
         QB     69 LEU  QQD     8.97                
         HD1    15 ALA  HN      6.50                
         HD1    15 ALA  QB      5.10                
         HD1    16 PHE  HN      6.50                
         HD1    69 LEU  HA      6.50                
 13 LYS+ 
         HN     13 LYS+ QG      4.98                
         HN     13 LYS+ QD      7.38                
         HN     14 GLU- HN      4.10                
         HN     14 GLU- QB      6.28                
         HN     15 ALA  HN      6.10                
         HN     16 PHE  HN      5.90                
         HN     65 PHE  HE1     4.70                
         HN     65 PHE  HZ      4.90                
         HA     13 LYS+ QD      5.08                
         HA     13 LYS+ QE      7.38                
         HA     15 ALA  HN      5.40                
         HA     16 PHE  HB2     6.30                
         HA     16 PHE  HB3     6.30                
         HA     16 PHE  HD1     6.50                
         HA     65 PHE  HE1     5.40                
         HA     65 PHE  HZ      6.50                
         QB     13 LYS+ QE      6.58                
         QB     14 GLU- QB      6.58                
         QB     65 PHE  HZ      7.50                
         QG     16 PHE  QB      8.25                
         QG     17 SER  HN      7.38                
         QG     65 PHE  HE1     7.38                
 14 GLU- 
         HN     14 GLU- QG      7.50                
         HN     15 ALA  HN      3.80                
         HN     16 PHE  HN      5.70                
         HA     14 GLU- QG      3.70                
         HA     18 LEU  HG      6.50                
         QB     15 ALA  QB      8.38                
         QG     17 SER  QB      8.50                
         QG     18 LEU  QQD     9.47                
 15 ALA  
         HN     16 PHE  HN      4.40                
         HN     16 PHE  QB      7.38                
         HN     18 LEU  HN      6.50                
         HN     18 LEU  QQD     9.07                
         HA     16 PHE  HA      6.50                
         HA     17 SER  HN      6.50                
         HA     18 LEU  HN      4.60                
         HA     18 LEU  QB      4.98                
         HA     18 LEU  HG      6.20                
         HA     18 LEU  QQD     8.77                
         QB     16 PHE  HN      3.40                
         QB     16 PHE  HA      7.50                
         QB     17 SER  HN      7.50                
         QB     18 LEU  HN      7.50                
         QB     18 LEU  QB      6.08                
         QB     18 LEU  QQD    10.07                
 16 PHE  
         HN     16 PHE  HD1     6.50                
         HN     17 SER  HN      3.90                
         HN     17 SER  HA      6.00                
         HN     17 SER  QB      6.20                
         HN     18 LEU  HN      5.60                
         HN     19 PHE  HN      6.50                
         HN     65 PHE  HD1     6.50                
         HA     16 PHE  HD1     6.50                
         HA     16 PHE  HE1     6.50                
         HA     18 LEU  HN      6.50                
         HA     19 PHE  HN      5.90                
         HA     19 PHE  QB      7.20                
         HA     20 ASP- HN      6.40                
         HA     27 ILE  QD1     7.20                
         HB2    17 SER  HN      4.70                
         HB2    17 SER  QB      7.50                
         HB2    65 PHE  HE1     6.50                
         HB3    17 SER  HN      4.70                
         HB3    17 SER  QB      7.50                
         HB3    65 PHE  HE1     6.50                
         QB     17 SER  HA      6.78                
         QB     18 LEU  HN      7.38                
         QB     65 PHE  HE1     6.15                
         QB     68 PHE  HD1     7.38                
         HD1    17 SER  HN      5.30                
         HD1    17 SER  HA      6.50                
         HD1    17 SER  QB      7.50                
         HD1    20 ASP- HN      5.80                
         HD1    68 PHE  HB2     6.20                
         HD1    68 PHE  HB3     6.20                
         HE1    20 ASP- HN      6.50                
         HE1    25 GLY  HN      6.50                
         HE1    25 GLY  HA1     5.90                
         HE1    25 GLY  HA2     5.90                
         HE1    26 THR  HN      6.50                
         HE1    26 THR  HA      6.50                
         HE1    27 ILE  HN      6.50                
         HE1    64 ASP- HA      6.50                
         HE1    65 PHE  HN      6.50                
 17 SER  
         HN     18 LEU  HN      4.10                
         HN     19 PHE  HN      6.00                
         HN     20 ASP- HN      6.50                
         HN     20 ASP- QB      7.38                
         HA     20 ASP- HN      4.40                
         HA     20 ASP- HB2     5.70                
         HA     20 ASP- HB3     5.70                
         HA     20 ASP- QB      5.43                
         QB     23 GLY  QA      8.38                
 18 LEU  
         HN     18 LEU  HB2     4.00                
         HN     18 LEU  HB3     4.00                
         HN     18 LEU  QB      3.75                
         HN     18 LEU  HG      3.50                
         HN     18 LEU  QD1     7.50                
         HN     18 LEU  QD2     7.50                
         HN     18 LEU  QQD     5.98                
         HN     19 PHE  HN      3.80                
         HN     20 ASP- HN      4.70                
         HA     19 PHE  HA      5.00                
         HA     21 LYS+ QG      7.38                
         HA     21 LYS+ QD      6.30                
         HA     35 VAL  HA      6.50                
         HA     35 VAL  QQG     9.06                
         HB2    19 PHE  HN      4.90                
         HB2    19 PHE  HA      5.50                
         HB2    35 VAL  QG1     9.25                
         HB2    35 VAL  QG2     9.25                
         HB3    19 PHE  HN      4.90                
         HB3    19 PHE  HA      5.50                
         HB3    35 VAL  QG1     9.25                
         HB3    35 VAL  QG2     9.25                
         QB     19 PHE  HA      5.09                
         QB     35 VAL  QQG     7.44                
         HG     19 PHE  HN      4.80                
         HG     35 VAL  QQG     7.86                
         QD1    19 PHE  HN      6.20                
         QD2    19 PHE  HN      6.20                
         QQD    19 PHE  HN      5.74                
         QQD    19 PHE  HA      8.67                
         QQD    35 VAL  HB      9.07                
         QQD    35 VAL  QQG    11.53                
         QQD    38 SER  HN      9.07                
         QQD    38 SER  QB      8.65                
         QQD    39 LEU  HG      9.07                
 19 PHE  
         HN     20 ASP- HN      3.80                
         HN     20 ASP- QB      6.38                
         HN     21 LYS+ HN      6.30                
         HN     27 ILE  QD1     7.50                
         HN     35 VAL  HB      6.50                
         HA     20 ASP- HA      6.20                
         HA     21 LYS+ HN      6.50                
         HA     21 LYS+ HA      6.50                
         HA     21 LYS+ HG2     6.50                
         HA     21 LYS+ HG3     6.50                
         HA     21 LYS+ QD      7.50                
         HA     35 VAL  QQG     7.36                
         QB     20 ASP- HA      6.20                
         QB     21 LYS+ QE      8.50                
         QB     27 ILE  QG2     8.50                
         QB     27 ILE  QD1     5.70                
 20 ASP- 
         HN     20 ASP- HB2     4.10                
         HN     20 ASP- HB3     4.10                
         HN     20 ASP- QB      3.90                
         HN     21 LYS+ HN      4.30                
         HN     21 LYS+ HA      6.50                
         HN     27 ILE  QG2     7.50                
         HN     27 ILE  QD1     7.50                
         HA     21 LYS+ HA      6.00                
         HA     21 LYS+ HG2     6.50                
         HA     21 LYS+ HG3     6.50                
         HA     21 LYS+ QD      7.50                
         HA     22 ASP- HN      4.40                
         HA     27 ILE  HA      6.40                
         HA     27 ILE  HB      6.50                
         HA     27 ILE  QG2     7.50                
         HA     27 ILE  QD1     7.50                
         HB2    22 ASP- HN      6.50                
         HB2    23 GLY  HN      6.00                
         HB3    22 ASP- HN      6.50                
         HB3    23 GLY  HN      6.00                
         QB     21 LYS+ QG      8.25                
         QB     21 LYS+ QE      8.38                
         QB     22 ASP- HN      6.00                
         QB     22 ASP- HA      7.38                
         QB     23 GLY  HN      5.84                
         QB     25 GLY  HN      7.38                
         QB     27 ILE  QG1     7.88                
         QB     27 ILE  QD1     7.08                
 21 LYS+ 
         HN     21 LYS+ HG2     3.60                
         HN     21 LYS+ HG3     3.60                
         HN     21 LYS+ QG      3.39                
         HN     21 LYS+ QD      5.30                
         HN     21 LYS+ QE      7.50                
         HN     22 ASP- HN      4.10                
         HN     22 ASP- QB      5.88                
         HN     27 ILE  QG2     7.50                
         HN     27 ILE  QG1     7.50                
         HN     27 ILE  QD1     6.80                
         HN     31 GLU- HN      6.50                
         HN     31 GLU- QG      6.90                
         HA     21 LYS+ QG      3.58                
         HA     21 LYS+ QD      7.50                
         HA     23 GLY  HN      6.50                
         HA     35 VAL  QQG     9.06                
         QB     22 ASP- HN      5.30                
         QB     22 ASP- HA      6.90                
         QB     23 GLY  HN      7.10                
         HG2    27 ILE  QG1     7.50                
         HG2    28 THR  HB      6.50                
         HG2    35 VAL  QG1     9.25                
         HG2    35 VAL  QG2     9.25                
         HG3    27 ILE  QG1     7.50                
         HG3    28 THR  HB      6.50                
         HG3    35 VAL  QG1     9.25                
         HG3    35 VAL  QG2     9.25                
         QG     22 ASP- HN      7.38                
         QG     31 GLU- QG      8.38                
         QG     34 THR  HB      7.38                
         QG     35 VAL  QQG     8.23                
         QD     22 ASP- HN      6.50                
         QD     31 GLU- QB      7.80                
         QD     32 LEU  HA      7.50                
         QD     35 VAL  HB      7.50                
         QE     27 ILE  QD1     8.50                
         QE     32 LEU  QB      8.38                
         QE     34 THR  HA      7.50                
         QE     34 THR  HB      7.50                
         QE     34 THR  QG2     8.40                
         QE     35 VAL  QQG     9.66                
 22 ASP- 
         HN     22 ASP- HB2     4.10                
         HN     22 ASP- HB3     4.10                
         HN     22 ASP- QB      3.81                
         HN     23 GLY  HN      3.30                
         HN     23 GLY  QA      5.68                
         HN     24 ASP- HN      6.50                
         HN     24 ASP- QB      7.38                
         HN     26 THR  HN      6.50                
         HN     28 THR  HN      6.50                
         HN     31 GLU- QG      7.50                
         HA     23 GLY  HA1     5.30                
         HA     23 GLY  HA2     5.30                
         HA     23 GLY  QA      5.13                
         HA     24 ASP- HN      5.90                
         HB2    23 GLY  HN      5.50                
         HB3    23 GLY  HN      5.50                
         QB     24 ASP- HN      7.38                
         QB     24 ASP- QB      8.25                
         QB     28 THR  HN      5.48                
 23 GLY  
         HN     24 ASP- HN      4.20                
         HN     24 ASP- HA      5.80                
         HN     24 ASP- HB2     6.50                
         HN     24 ASP- HB3     6.50                
         HN     25 GLY  HN      5.40                
         HN     25 GLY  QA      7.28                
         HN     26 THR  HN      6.50                
         HA1    25 GLY  HN      6.50                
         HA2    25 GLY  HN      6.50                
         QA     24 ASP- HA      5.98                
 24 ASP- 
         HN     25 GLY  HN      3.90                
         HN     25 GLY  HA1     5.20                
         HN     25 GLY  HA2     5.20                
         HN     26 THR  HN      4.60                
         HN     26 THR  QG2     7.50                
         HA     25 GLY  QA      7.28                
         HA     26 THR  HN      5.60                
         HB2    25 GLY  HN      6.50                
         HB2    26 THR  HN      6.50                
         HB3    25 GLY  HN      6.50                
         HB3    26 THR  HN      6.50                
         QB     25 GLY  QA      8.25                
         QB     26 THR  HB      7.38                
         QB     26 THR  QG2     8.38                
 25 GLY  
         HN     26 THR  HN      3.80                
         HN     26 THR  HA      6.50                
         HN     26 THR  QG2     7.50                
         HN     27 ILE  HN      6.50                
         HA1    26 THR  QG2     7.50                
         HA2    26 THR  QG2     7.50                
 26 THR  
         HN     26 THR  QG2     4.40                
         HN     27 ILE  HN      5.90                
         HN     27 ILE  HA      6.50                
         HA     26 THR  QG2     3.50                
         HA     27 ILE  HA      5.10                
         HA     27 ILE  QG1     7.50                
         HA     27 ILE  QD1     7.50                
         HA     64 ASP- QB      7.38                
         HA     65 PHE  HN      6.50                
         HB     27 ILE  HN      4.70                
         HB     27 ILE  HA      4.90                
         HB     27 ILE  QG1     7.50                
         HB     27 ILE  QD1     7.50                
         HB     28 THR  HB      6.00                
         HB     28 THR  QG2     7.50                
         HB     64 ASP- HA      6.50                
         QG2    27 ILE  HN      5.20                
         QG2    27 ILE  HA      6.80                
         QG2    28 THR  HN      7.50                
         QG2    64 ASP- HA      6.80                
         QG2    65 PHE  HN      7.50                
 27 ILE  
         HN     27 ILE  QG2     4.60                
         HN     27 ILE  QG1     5.60                
         HN     27 ILE  QD1     4.50                
         HN     28 THR  HN      6.10                
         HN     63 ILE  HN      6.50                
         HN     63 ILE  HB      4.90                
         HN     63 ILE  QG1     7.38                
         HN     64 ASP- HA      6.50                
         HA     27 ILE  QD1     3.60                
         HA     31 GLU- HN      6.50                
         HA     31 GLU- QB      6.90                
         HB     27 ILE  QD1     3.50                
         HB     28 THR  HN      5.00                
         HB     63 ILE  HN      4.20                
         HB     63 ILE  HB      4.60                
         HB     63 ILE  QG1     7.28                
         HB     65 PHE  HN      6.50                
         QG2    28 THR  HN      7.50                
         QG2    31 GLU- HN      7.50                
         QG2    31 GLU- QB      7.10                
         QG2    32 LEU  HA      7.40                
         QG2    32 LEU  QB      8.38                
         QG2    35 VAL  HB      6.70                
         QG1    31 GLU- QB      8.50                
         QG1    32 LEU  QB      8.08                
         QG1    35 VAL  QQG     8.66                
         QD1    28 THR  HN      5.70                
         QD1    63 ILE  HB      6.20                
         QD1    63 ILE  QG2     7.70                
         QD1    63 ILE  QD1     8.50                
         QD1    64 ASP- HA      7.50                
         QD1    68 PHE  HE1     7.50                
 28 THR  
         HN     30 LYS+ QG      7.38                
         HN     30 LYS+ QD      7.50                
         HN     31 GLU- HN      4.80                
         HN     31 GLU- QB      5.60                
         HN     31 GLU- QG      7.50                
         HN     32 LEU  HN      5.10                
         HN     62 THR  QG2     7.50                
         HA     29 THR  HA      5.10                
         HA     29 THR  QG2     7.50                
         HA     30 LYS+ HN      4.50                
         HA     31 GLU- HN      5.30                
         HA     62 THR  HB      6.50                
         HA     62 THR  QG2     6.90                
         HA     63 ILE  HN      6.50                
         HB     29 THR  HN      4.30                
         HB     30 LYS+ HB2     6.50                
         HB     30 LYS+ HB3     6.50                
         HB     30 LYS+ QG      7.38                
         HB     31 GLU- HA      4.90                
         HB     31 GLU- QG      7.50                
         HB     32 LEU  HN      6.50                
         HB     62 THR  QG2     5.30                
         QG2    62 THR  QG2     7.30                
 29 THR  
         HN     29 THR  QG2     3.50                
         HN     30 LYS+ HN      4.50                
         HN     30 LYS+ QB      5.98                
         HN     30 LYS+ QG      7.38                
         HN     30 LYS+ QD      7.50                
         HN     31 GLU- HN      6.50                
         HN     32 LEU  QQD     9.07                
         HN     52 ILE  QG2     7.50                
         HN     62 THR  HA      6.50                
         HN     62 THR  QG2     5.60                
         HN     63 ILE  HN      6.50                
         HA     29 THR  QG2     3.40                
         HA     30 LYS+ QG      6.38                
         HA     31 GLU- HN      5.70                
         HA     32 LEU  HN      5.30                
         HA     32 LEU  HA      5.50                
         HA     32 LEU  HB2     6.50                
         HA     32 LEU  HB3     6.50                
         HA     32 LEU  QB      6.10                
         HA     33 GLY  HN      5.70                
         HA     48 LEU  HG      6.50                
         HA     52 ILE  HA      6.50                
         HA     52 ILE  HB      6.50                
         HA     62 THR  HA      5.70                
         HA     63 ILE  QG1     7.38                
         HA     63 ILE  QD1     5.20                
         HB     30 LYS+ QG      6.68                
         HB     32 LEU  HN      6.50                
         HB     48 LEU  QB      7.18                
         HB     52 ILE  HB      6.50                
         HB     63 ILE  QG1     6.18                
         QG2    30 LYS+ HN      4.50                
         QG2    32 LEU  QB      7.08                
         QG2    52 ILE  HA      7.50                
         QG2    52 ILE  QG2     5.90                
         QG2    52 ILE  QG1     6.38                
         QG2    52 ILE  QD1     8.50                
         QG2    62 THR  HN      6.10                
 30 LYS+ 
         HN     30 LYS+ HB2     3.70                
         HN     30 LYS+ HB3     3.70                
         HN     30 LYS+ HG2     4.10                
         HN     30 LYS+ HG3     4.10                
         HN     30 LYS+ QG      3.81                
         HN     30 LYS+ QD      5.50                
         HN     31 GLU- QB      5.50                
         HN     31 GLU- QG      6.70                
         HN     32 LEU  HN      6.50                
         HN     32 LEU  QQD     9.07                
         HN     33 GLY  HN      5.40                
         HN     52 ILE  QG2     7.50                
         HB2    31 GLU- HN      6.50                
         HB3    31 GLU- HN      6.50                
         QB     31 GLU- HA      7.38                
         QB     31 GLU- QG      8.38                
         HG2    31 GLU- HN      5.40                
         HG3    31 GLU- HN      5.40                
         QG     31 GLU- HN      4.85                
         QG     34 THR  HA      7.38                
         QD     31 GLU- HN      7.00                
         QD     31 GLU- QB      8.50                
 31 GLU- 
         HN     31 GLU- QG      4.80                
         HN     32 LEU  HN      4.20                
         HN     32 LEU  QB      5.88                
         HN     33 GLY  HN      6.40                
         HN     34 THR  HN      6.50                
         HN     34 THR  QG2     7.50                
         HA     34 THR  HN      6.50                
         HA     34 THR  HB      6.50                
         QB     32 LEU  QB      6.58                
         QB     34 THR  HB      7.50                
         QG     32 LEU  HN      7.00                
         QG     34 THR  HN      7.00                
 32 LEU  
         HN     32 LEU  HB2     4.10                
         HN     32 LEU  HB3     4.10                
         HN     32 LEU  QQD     5.07                
         HN     33 GLY  HN      4.60                
         HN     33 GLY  HA1     6.50                
         HN     33 GLY  HA2     6.50                
         HN     34 THR  HN      4.70                
         HN     34 THR  QG2     7.50                
         HN     35 VAL  HN      6.50                
         HN     35 VAL  QQG     9.06                
         HN     36 MET  QG      7.38                
         HN     45 GLU- QB      6.70                
         HA     34 THR  HN      6.50                
         HA     35 VAL  HN      4.50                
         HB2    33 GLY  HN      4.70                
         HB3    33 GLY  HN      4.70                
         QB     33 GLY  HN      4.42                
         QB     34 THR  HN      7.38                
         QB     52 ILE  QG2     8.38                
         QD1    51 MET  HB2     9.25                
         QD1    51 MET  HB3     9.25                
         QD1    51 MET  HG2     8.15                
         QD1    51 MET  HG3     8.15                
         QD2    51 MET  HB2     9.25                
         QD2    51 MET  HB3     9.25                
         QD2    51 MET  HG2     8.15                
         QD2    51 MET  HG3     8.15                
         QQD    33 GLY  HN      5.77                
         QQD    34 THR  HN      9.07                
         QQD    34 THR  HA      9.07                
         QQD    35 VAL  HB      9.07                
         QQD    36 MET  QB      7.35                
         QQD    51 MET  QB      7.61                
         QQD    51 MET  QG      6.85                
         QQD    52 ILE  QD1    10.07                
 33 GLY  
         HN     34 THR  HN      4.20                
         HN     34 THR  HB      5.80                
         HN     34 THR  QG2     7.50                
         HN     35 VAL  HN      5.30                
         HN     35 VAL  HB      6.50                
         HN     48 LEU  HG      6.50                
         HN     48 LEU  QQD     9.07                
         HA1    36 MET  HN      6.50                
         HA1    43 PRO  QG      7.50                
         HA1    48 LEU  QD1     8.44                
         HA1    48 LEU  QD2     8.44                
         HA2    36 MET  HN      6.50                
         HA2    43 PRO  QG      7.50                
         HA2    48 LEU  QD1     8.44                
         HA2    48 LEU  QD2     8.44                
         QA     34 THR  HA      6.78                
         QA     36 MET  HN      6.19                
         QA     37 ARG+ HN      7.08                
         QA     48 LEU  QQD     6.71                
 34 THR  
         HN     34 THR  HB      3.70                
         HN     34 THR  QG2     4.70                
         HN     35 VAL  HN      4.00                
         HN     35 VAL  HA      6.50                
         HN     35 VAL  HB      6.50                
         HN     35 VAL  QQG     7.36                
         HN     36 MET  HN      6.50                
         HN     36 MET  QG      6.48                
         HN     37 ARG+ HN      6.50                
         HA     34 THR  QG2     3.60                
         HA     37 ARG+ HN      5.30                
         HA     37 ARG+ HA      6.50                
         HA     37 ARG+ QB      6.10                
         HA     37 ARG+ HD2     6.50                
         HA     37 ARG+ HD3     6.50                
         HA     38 SER  HN      6.50                
         HB     35 VAL  HN      4.00                
         HB     35 VAL  HA      6.50                
         HB     35 VAL  HB      6.50                
         HB     35 VAL  QQG     7.36                
         HB     36 MET  HN      6.20                
         HB     36 MET  QG      7.38                
         QG2    35 VAL  HN      4.80                
         QG2    36 MET  HN      7.50                
         QG2    37 ARG+ QG      7.90                
         QG2    37 ARG+ QD      8.38                
         QG2    38 SER  HN      5.90                
 35 VAL  
         HN     35 VAL  HB      3.60                
         HN     36 MET  HN      4.30                
         HN     36 MET  HG2     5.60                
         HN     36 MET  HG3     5.60                
         HN     36 MET  QG      5.38                
         HN     38 SER  HN      5.20                
         HN     39 LEU  QQD     9.07                
         HA     37 ARG+ HN      6.50                
         HA     38 SER  HN      6.50                
         HA     38 SER  HB2     6.50                
         HA     38 SER  HB3     6.50                
         HB     36 MET  HN      3.80                
         HB     36 MET  HA      6.50                
         HB     36 MET  QG      7.38                
         HB     38 SER  HN      6.50                
         HB     39 LEU  HN      6.50                
         QG1    36 MET  HN      5.90                
         QG1    36 MET  HA      7.50                
         QG1    36 MET  HG2     9.25                
         QG1    36 MET  HG3     9.25                
         QG1    39 LEU  HN      7.50                
         QG2    36 MET  HN      5.90                
         QG2    36 MET  HA      7.50                
         QG2    36 MET  HG2     9.25                
         QG2    36 MET  HG3     9.25                
         QG2    39 LEU  HN      7.50                
         QQG    36 MET  HN      5.49                
         QQG    36 MET  HA      6.66                
         QQG    36 MET  QG      8.23                
         QQG    37 ARG+ HN      9.06                
         QQG    38 SER  HN      9.06                
         QQG    39 LEU  HN      6.99                
         QQG    39 LEU  HG      9.06                
         QQG    39 LEU  QQD    10.33                
 36 MET  
         HN     36 MET  HG2     3.80                
         HN     36 MET  HG3     3.80                
         HN     36 MET  QG      3.55                
         HN     37 ARG+ HN      4.50                
         HN     39 LEU  HG      5.90                
         HN     39 LEU  QQD     7.17                
         HN     68 PHE  HE1     7.50                
         HA     36 MET  QG      3.65                
         HA     41 GLN  HN      6.50                
         HB2    37 ARG+ HN      6.50                
         HB2    38 SER  HB2     8.25                
         HB2    38 SER  HB3     8.25                
         HB3    37 ARG+ HN      6.50                
         HB3    38 SER  HB2     8.25                
         HB3    38 SER  HB3     8.25                
         QB     37 ARG+ HA      7.38                
         QB     38 SER  QB      7.13                
         HG2    41 GLN  HB2     7.95                
         HG2    41 GLN  HB3     7.95                
         HG2    48 LEU  QD1    10.64                
         HG2    48 LEU  QD2    10.64                
         HG3    41 GLN  HB2     7.95                
         HG3    41 GLN  HB3     7.95                
         HG3    48 LEU  QD1    10.64                
         HG3    48 LEU  QD2    10.64                
         QG     37 ARG+ HN      6.08                
         QG     37 ARG+ QG      8.38                
         QG     39 LEU  QQD     9.95                
         QG     41 GLN  QB      6.97                
         QG     41 GLN  QG      8.38                
         QG     43 PRO  QB      8.38                
         QG     43 PRO  QG      8.38                
         QG     43 PRO  QD      8.25                
         QG     48 LEU  QQD     9.03                
 37 ARG+ 
         HN     37 ARG+ QD      4.98                
         HN     38 SER  HN      3.70                
         HN     38 SER  QB      7.38                
         HN     39 LEU  HN      6.10                
         HN     39 LEU  HG      6.50                
         HN     39 LEU  QQD     9.07                
         HN     41 GLN  HN      6.00                
         HN     41 GLN  QB      7.38                
         HN     42 ASN  HA      6.50                
         HN     43 PRO  QD      7.38                
         HA     37 ARG+ QD      4.18                
         HA     39 LEU  HN      5.90                
         HA     40 GLY  HN      5.00                
         HA     40 GLY  QA      7.38                
         HA     41 GLN  HN      4.20                
         HA     41 GLN  HA      6.50                
         HA     42 ASN  HA      6.50                
         HA     42 ASN  QD2     7.37                
         HA     43 PRO  QD      7.38                
         QB     37 ARG+ HD2     4.00                
         QB     37 ARG+ HD3     4.00                
         QB     38 SER  HA      7.50                
         QB     38 SER  QB      7.38                
         QB     39 LEU  HN      6.20                
         QB     40 GLY  HN      7.50                
         QB     42 ASN  QD2     8.37                
         QG     41 GLN  HN      7.50                
         HD2    38 SER  HN      6.50                
         HD2    42 ASN  HD21    8.23                
         HD2    42 ASN  HD22    8.23                
         HD3    38 SER  HN      6.50                
         HD3    42 ASN  HD21    8.23                
         HD3    42 ASN  HD22    8.23                
         QD     42 ASN  HA      7.38                
         QD     42 ASN  QD2     7.26                
         QD     43 PRO  QD      8.25                
 38 SER  
         HN     38 SER  HB2     3.50                
         HN     38 SER  HB3     3.50                
         HN     39 LEU  HN      4.80                
         HN     39 LEU  HA      6.50                
         HN     39 LEU  QB      7.50                
         HN     39 LEU  HG      4.80                
         HN     39 LEU  QQD     9.07                
         HN     40 GLY  HN      6.50                
         HN     40 GLY  QA      7.38                
         HA     39 LEU  HG      6.50                
         HA     40 GLY  HN      5.70                
         HA     40 GLY  QA      7.38                
         HB2    40 GLY  HN      6.50                
         HB3    40 GLY  HN      6.50                
         QB     39 LEU  QQD     7.35                
         QB     40 GLY  HN      6.19                
 39 LEU  
         HN     39 LEU  HG      3.30                
         HN     39 LEU  QQD     5.47                
         HN     40 GLY  HN      4.00                
         HN     40 GLY  QA      6.68                
         HN     41 GLN  HN      4.60                
         HN     41 GLN  HB2     6.50                
         HN     41 GLN  HB3     6.50                
         HN     41 GLN  QG      7.50                
         HN     42 ASN  QD2     7.37                
         HA     39 LEU  HG      3.90                
         HA     39 LEU  QD1     4.50                
         HA     39 LEU  QD2     4.50                
         HA     39 LEU  QQD     3.67                
         HA     40 GLY  QA      4.68                
         HA     41 GLN  QG      7.00                
         QB     40 GLY  HN      7.50                
         QQD    40 GLY  HN      6.37                
         QQD    41 GLN  HN      7.17                
         QQD    68 PHE  HZ      9.07                
 40 GLY  
         HN     41 GLN  QG      7.50                
         HN     42 ASN  QB      8.38                
         HN     42 ASN  QD2     7.37                
 41 GLN  
         HN     41 GLN  QG      7.50                
         HN     42 ASN  HN      6.40                
         HN     43 PRO  HD2     6.50                
         HN     43 PRO  HD3     6.50                
         HA     42 ASN  HA      6.10                
         HA     42 ASN  QB      5.68                
         HA     43 PRO  QG      7.50                
         HA     43 PRO  HD2     6.50                
         HA     43 PRO  HD3     6.50                
         HB2    42 ASN  HN      5.60                
         HB2    42 ASN  HA      6.50                
         HB2    43 PRO  HD2     6.50                
         HB2    43 PRO  HD3     6.50                
         HB3    42 ASN  HN      5.60                
         HB3    42 ASN  HA      6.50                
         HB3    43 PRO  HD2     6.50                
         HB3    43 PRO  HD3     6.50                
         QB     42 ASN  HA      6.34                
         QB     43 PRO  QG      8.38                
         QB     43 PRO  QD      6.07                
         QG     42 ASN  HN      6.30                
         QG     42 ASN  HB2     7.50                
         QG     42 ASN  HB3     7.50                
         QG     43 PRO  QB      8.50                
         QG     43 PRO  QG      8.50                
         QG     43 PRO  HD2     7.30                
         QG     43 PRO  HD3     7.30                
         QG     43 PRO  QD      6.95                
 42 ASN  
         HN     43 PRO  QG      6.20                
         HN     43 PRO  HD2     5.20                
         HN     43 PRO  HD3     5.20                
         HA     43 PRO  HA      4.70                
         HB2    43 PRO  HD2     8.25                
         HB2    43 PRO  HD3     8.25                
         HB3    43 PRO  HD2     8.25                
         HB3    43 PRO  HD3     8.25                
         QB     43 PRO  QD      7.32                
         QB     44 THR  HN      7.38                
         QD2    43 PRO  HA      7.37                
 43 PRO  
         HA     44 THR  QG2     7.50                
         HA     48 LEU  HG      6.50                
         HB2    48 LEU  QD1    10.14                
         HB2    48 LEU  QD2    10.14                
         HB3    48 LEU  QD1    10.14                
         HB3    48 LEU  QD2    10.14                
         QB     44 THR  HA      7.38                
         QB     48 LEU  QB      8.18                
         QB     48 LEU  HG      4.48                
         QB     48 LEU  QQD     7.85                
         QG     48 LEU  HA      7.50                
         QG     48 LEU  QQD     8.67                
         HD2    48 LEU  QD1     7.85                
         HD2    48 LEU  QD2     7.85                
         HD3    48 LEU  QD1     7.85                
         HD3    48 LEU  QD2     7.85                
         QD     48 LEU  QQD     6.65                
 44 THR  
         HN     45 GLU- HN      6.50                
         HN     46 ALA  HN      6.50                
         HN     47 GLU- HN      4.70                
         HN     47 GLU- HA      6.50                
         HN     47 GLU- HB2     4.90                
         HN     47 GLU- HB3     4.90                
         HN     47 GLU- QG      4.80                
         HN     48 LEU  HN      5.20                
         HN     48 LEU  HG      6.50                
         HN     48 LEU  QQD     9.07                
         HA     44 THR  QG2     3.40                
         HA     45 GLU- HN      3.60                
         HA     45 GLU- HA      6.50                
         HA     45 GLU- QB      6.50                
         HA     45 GLU- QG      7.50                
         HA     46 ALA  HN      4.90                
         HA     48 LEU  HG      6.50                
         HA     48 LEU  QQD     8.77                
         HB     45 GLU- HN      3.30                
         HB     45 GLU- QB      7.50                
         HB     46 ALA  HN      4.60                
         HB     46 ALA  QB      6.10                
         HB     47 GLU- HN      6.50                
         HB     47 GLU- QB      7.38                
         HB     47 GLU- QG      7.20                
         QG2    45 GLU- HN      4.50                
         QG2    47 GLU- QG      7.10                
 45 GLU- 
         HN     45 GLU- QG      7.50                
         HN     46 ALA  HN      4.20                
         HN     46 ALA  HA      6.30                
         HN     47 GLU- HN      6.50                
         HN     48 LEU  HN      6.20                
         HN     48 LEU  QB      7.38                
         HN     48 LEU  QQD     7.77                
         HA     48 LEU  QB      7.38                
         HA     48 LEU  QQD     6.67                
         QB     48 LEU  QB      8.38                
         QG     48 LEU  QQD     9.57                
 46 ALA  
         HN     46 ALA  QB      3.40                
         HN     47 GLU- HN      3.70                
         HN     47 GLU- QB      6.08                
         HN     47 GLU- QG      5.70                
         HN     48 LEU  HN      6.50                
         HN     48 LEU  QB      7.38                
         HN     48 LEU  QQD     8.97                
         HN     49 GLN  HB2     6.50                
         HN     49 GLN  HB3     6.50                
         HN     49 GLN  QB      5.96                
         HN     49 GLN  QG      7.38                
         HA     48 LEU  QB      7.38                
         HA     49 GLN  HB2     4.60                
         HA     49 GLN  HB3     4.60                
         HA     49 GLN  QB      4.22                
         HA     49 GLN  QG      7.28                
         QB     47 GLU- HN      3.40                
         QB     47 GLU- QB      7.38                
         QB     47 GLU- QG      8.30                
         QB     48 LEU  HN      7.50                
 47 GLU- 
         HN     47 GLU- QB      3.72                
         HN     47 GLU- QG      4.10                
         HN     48 LEU  HN      3.80                
         HN     49 GLN  HN      5.70                
         HA     47 GLU- QG      3.70                
         HA     48 LEU  QB      7.38                
         HA     48 LEU  QQD     9.07                
         HA     50 ASP- HN      3.90                
         HA     50 ASP- HB2     4.60                
         HA     50 ASP- HB3     4.60                
         HA     50 ASP- QB      4.37                
         HA     51 MET  QG      7.38                
         QB     48 LEU  HA      7.38                
         QB     51 MET  QG      7.75                
         QG     48 LEU  HN      7.50                
         QG     49 GLN  HN      7.50                
 48 LEU  
         HN     48 LEU  HG      4.20                
         HN     48 LEU  QD1     7.50                
         HN     48 LEU  QD2     7.50                
         HN     49 GLN  HN      3.60                
         HN     49 GLN  HA      6.50                
         HN     49 GLN  QB      7.38                
         HN     50 ASP- QB      7.38                
         HA     49 GLN  HA      5.00                
         HA     51 MET  QB      7.38                
         HA     51 MET  QG      7.38                
         HB2    49 GLN  HG2     8.25                
         HB2    49 GLN  HG3     8.25                
         HB3    49 GLN  HG2     8.25                
         HB3    49 GLN  HG3     8.25                
         QB     49 GLN  HN      5.08                
         QB     49 GLN  HA      5.08                
         QB     49 GLN  QB      8.25                
         QB     49 GLN  QG      7.32                
         QB     50 ASP- HN      5.68                
         QB     51 MET  HN      6.88                
         QB     51 MET  QB      7.95                
         QB     52 ILE  HN      5.78                
         QB     52 ILE  HB      7.38                
         QB     52 ILE  QG2     7.88                
         HG     49 GLN  HN      6.50                
         HG     51 MET  QB      7.38                
         QQD    49 GLN  HN      6.47                
         QQD    50 ASP- HN      6.37                
         QQD    51 MET  QB      9.95                
 49 GLN  
         HN     49 GLN  HB2     3.90                
         HN     49 GLN  HB3     3.90                
         HN     49 GLN  QG      4.48                
         HN     50 ASP- HN      3.20                
         HN     50 ASP- HA      6.40                
         HN     50 ASP- QB      7.08                
         HN     51 MET  HN      4.00                
         HN     51 MET  QG      7.38                
         HN     52 ILE  QG2     6.10                
         HA     50 ASP- HA      6.50                
         HA     51 MET  HN      5.80                
         HA     51 MET  QB      7.38                
         HA     52 ILE  HN      4.90                
         HA     52 ILE  HB      5.00                
         HA     52 ILE  QD1     5.80                
         HB2    50 ASP- HN      6.50                
         HB3    50 ASP- HN      6.50                
         QB     50 ASP- HA      6.38                
         QB     52 ILE  HN      7.38                
         HG2    50 ASP- HN      5.00                
         HG2    52 ILE  HB      6.50                
         HG3    50 ASP- HN      5.00                
         HG3    52 ILE  HB      6.50                
         QG     50 ASP- HN      4.68                
         QG     52 ILE  HN      7.38                
         QG     53 ASN  QD2     8.24                
 50 ASP- 
         HN     50 ASP- HB2     3.70                
         HN     50 ASP- HB3     3.70                
         HN     50 ASP- QB      3.49                
         HN     51 MET  HN      3.60                
         HN     51 MET  QB      5.78                
         HN     52 ILE  HN      6.50                
         HN     53 ASN  HN      5.80                
         HA     52 ILE  QD1     7.30                
         HA     53 ASN  HB2     6.50                
         HA     53 ASN  HB3     6.50                
         HA     53 ASN  HD21    6.50                
         HA     53 ASN  HD22    6.50                
         HA     53 ASN  QD2     6.34                
         QB     51 MET  QG      8.25                
         QB     52 ILE  HN      6.78                
         QB     53 ASN  QB      8.25                
 51 MET  
         HN     51 MET  QB      3.81                
         HN     51 MET  QG      3.88                
         HN     52 ILE  HN      3.90                
         HN     52 ILE  HB      6.50                
         HN     52 ILE  QG1     5.48                
         HN     53 ASN  HN      6.50                
         HN     53 ASN  HB2     6.50                
         HN     53 ASN  HB3     6.50                
         HN     53 ASN  QB      6.34                
         HA     51 MET  QG      3.92                
         HA     53 ASN  QB      7.38                
         HA     54 GLU- QB      7.38                
         HA     54 GLU- QG      6.18                
         HA     55 VAL  QG1     7.50                
         HA     55 VAL  QG2     7.50                
         HB2    52 ILE  HG12    8.25                
         HB2    52 ILE  HG13    8.25                
         HB3    52 ILE  HG12    8.25                
         HB3    52 ILE  HG13    8.25                
         QB     52 ILE  QG1     7.32                
         QG     52 ILE  HN      5.58                
 52 ILE  
         HN     52 ILE  QG2     4.40                
         HN     52 ILE  HG12    3.70                
         HN     52 ILE  HG13    3.70                
         HN     52 ILE  QG1     3.44                
         HN     52 ILE  QD1     4.50                
         HN     53 ASN  HN      4.10                
         HN     53 ASN  QB      7.38                
         HN     54 GLU- HN      5.10                
         HN     54 GLU- QB      7.38                
         HN     55 VAL  QQG     6.06                
         HA     52 ILE  QG2     3.40                
         HA     52 ILE  QG1     3.80                
         HA     54 GLU- QB      7.38                
         HA     55 VAL  HN      5.30                
         HA     55 VAL  QQG     9.06                
         HA     56 ASP- HN      6.10                
         HB     52 ILE  QD1     3.40                
         HB     53 ASN  HN      6.50                
         HB     54 GLU- HN      5.40                
         HB     55 VAL  QQG     7.46                
         HB     62 THR  HA      6.30                
         QG2    52 ILE  HG12    3.40                
         QG2    52 ILE  HG13    3.40                
         QG2    53 ASN  HA      7.20                
         QG2    53 ASN  QB      8.38                
         QG2    55 VAL  QQG     7.56                
         QG2    61 GLY  HA1     7.30                
         QG2    61 GLY  HA2     7.30                
         QG2    61 GLY  QA      6.90                
         QG2    62 THR  HA      6.90                
         QG2    62 THR  QG2     7.80                
         QG2    63 ILE  HN      7.50                
         QG2    63 ILE  QG1     8.38                
         QG1    53 ASN  HN      5.28                
         QG1    53 ASN  QB      8.25                
         QG1    56 ASP- QB      8.25                
         QG1    62 THR  QG2     8.38                
         QD1    53 ASN  HN      4.80                
         QD1    53 ASN  HB2     7.50                
         QD1    53 ASN  HB3     7.50                
         QD1    54 GLU- HN      7.50                
         QD1    56 ASP- HN      7.50                
         QD1    56 ASP- HB2     6.40                
         QD1    56 ASP- HB3     6.40                
         QD1    56 ASP- QB      6.09                
         QD1    61 GLY  HN      6.20                
         QD1    62 THR  HN      5.20                
         QD1    62 THR  HA      6.50                
         QD1    63 ILE  HN      7.50                
         QD1    63 ILE  QG1     6.88                
 53 ASN  
         HN     53 ASN  HB2     4.00                
         HN     53 ASN  HB3     4.00                
         HN     54 GLU- HN      4.10                
         HN     54 GLU- HA      6.30                
         HN     54 GLU- QB      7.38                
         HN     54 GLU- QG      7.58                
         HN     55 VAL  QQG     9.06                
         HN     56 ASP- QB      7.38                
         HA     54 GLU- HA      6.50                
         HA     56 ASP- HN      3.90                
         HA     56 ASP- HB2     6.50                
         HA     56 ASP- HB3     6.50                
         HA     59 GLY  QA      7.38                
         HA     61 GLY  QA      5.08                
         HB2    53 ASN  HD21    4.00                
         HB2    53 ASN  HD22    4.00                
         HB2    54 GLU- HN      4.40                
         HB2    54 GLU- HB2     8.25                
         HB2    54 GLU- HB3     8.25                
         HB3    53 ASN  HD21    4.00                
         HB3    53 ASN  HD22    4.00                
         HB3    54 GLU- HN      4.40                
         HB3    54 GLU- HB2     8.25                
         HB3    54 GLU- HB3     8.25                
         QB     54 GLU- HA      6.28                
         QB     54 GLU- QB      7.32                
         QB     56 ASP- HN      7.38                
         QB     56 ASP- QB      7.35                
 54 GLU- 
         HN     54 GLU- HB2     3.70                
         HN     54 GLU- HB3     3.70                
         HN     54 GLU- QB      3.49                
         HN     54 GLU- QG      4.38                
         HN     55 VAL  HN      3.90                
         HN     55 VAL  QG1     5.30                
         HN     55 VAL  QG2     5.30                
         HN     55 VAL  QQG     4.96                
         HN     56 ASP- HN      4.10                
         HA     55 VAL  HA      6.50                
         HA     56 ASP- HN      6.10                
         HA     57 ALA  HA      6.50                
         HB2    55 VAL  HN      4.50                
         HB2    55 VAL  QG1    10.02                
         HB2    55 VAL  QG2    10.02                
         HB3    55 VAL  HN      4.50                
         HB3    55 VAL  QG1    10.02                
         HB3    55 VAL  QG2    10.02                
         QB     55 VAL  HA      6.08                
         QB     55 VAL  QQG     7.93                
         QB     56 ASP- HN      6.38                
         QG     55 VAL  HN      6.28                
         QG     71 MET  HA      6.08                
         QG     71 MET  QG      8.38                
 55 VAL  
         HN     55 VAL  QG1     3.80                
         HN     55 VAL  QG2     3.80                
         HN     55 VAL  QQG     3.36                
         HN     56 ASP- HN      3.70                
         HN     56 ASP- HB2     5.30                
         HN     56 ASP- HB3     5.30                
         HN     56 ASP- QB      5.13                
         HN     57 ALA  HN      6.50                
         HA     67 GLU- QB      7.38                
         HB     56 ASP- HN      5.70                
         HB     63 ILE  QG2     6.90                
         HB     63 ILE  QG1     7.18                
         HB     71 MET  HN      5.20                
         HB     71 MET  QB      7.50                
         HB     72 MET  HN      6.50                
         QG1    56 ASP- HN      4.60                
         QG1    63 ILE  HA      7.50                
         QG1    63 ILE  QG2     8.50                
         QG2    56 ASP- HN      4.60                
         QG2    63 ILE  HA      7.50                
         QG2    63 ILE  QG2     8.50                
         QQG    56 ASP- HN      4.22                
         QQG    56 ASP- HA      6.66                
         QQG    62 THR  HB      9.06                
         QQG    63 ILE  HA      6.99                
         QQG    63 ILE  QG2     7.77                
         QQG    64 ASP- HN      7.46                
         QQG    67 GLU- QG      9.94                
         QQG    71 MET  HN      7.26                
         QQG    71 MET  QG      9.66                
         QQG    72 MET  HN      7.76                
         QQG    75 LYS+ HN      8.76                
         QQG    75 LYS+ QG     10.06                
 56 ASP- 
         HN     56 ASP- HB2     3.90                
         HN     56 ASP- HB3     3.90                
         HN     56 ASP- QB      3.70                
         HN     57 ALA  HN      5.40                
         HA     57 ALA  HA      6.50                
         HA     57 ALA  QB      7.50                
         HA     58 ASP- HN      4.50                
         HA     59 GLY  QA      6.88                
         HA     63 ILE  QG1     7.38                
         HB2    57 ALA  HN      6.30                
         HB2    62 THR  HN      6.50                
         HB3    57 ALA  HN      6.30                
         HB3    62 THR  HN      6.50                
         QB     60 ASP- HN      7.38                
         QB     61 GLY  QA      8.25                
         QB     63 ILE  HA      7.18                
         QB     63 ILE  QG1     8.25                
         QB     63 ILE  QD1     8.38                
 57 ALA  
         HN     57 ALA  QB      3.40                
         HN     58 ASP- HN      3.90                
         HN     58 ASP- QB      5.98                
         HN     59 GLY  HN      5.40                
         HN     67 GLU- QG      7.38                
         HA     59 GLY  HN      5.00                
         QB     58 ASP- HN      3.40                
         QB     58 ASP- HA      7.50                
         QB     58 ASP- QB      8.08                
         QB     59 GLY  HN      5.00                
         QB     67 GLU- HB2     7.50                
         QB     67 GLU- HB3     7.50                
         QB     70 THR  QG2     8.50                
 58 ASP- 
         HN     59 GLY  HN      3.80                
         HN     59 GLY  HA1     5.80                
         HN     59 GLY  HA2     5.80                
         HN     59 GLY  QA      5.34                
         HN     60 ASP- QB      7.38                
         HA     59 GLY  HA1     6.50                
         HA     59 GLY  HA2     6.50                
         HA     59 GLY  QA      5.91                
         HB2    60 ASP- HB2     8.25                
         HB2    60 ASP- HB3     8.25                
         HB3    60 ASP- HB2     8.25                
         HB3    60 ASP- HB3     8.25                
         QB     60 ASP- QB      6.84                
 59 GLY  
         HN     60 ASP- HN      4.60                
         HN     60 ASP- QB      7.38                
         HN     61 GLY  HN      5.40                
         HA1    61 GLY  HN      5.90                
         HA2    61 GLY  HN      5.90                
         QA     60 ASP- HA      6.78                
         QA     61 GLY  QA      7.35                
 60 ASP- 
         HN     61 GLY  HN      3.70                
         HN     61 GLY  HA1     5.90                
         HN     61 GLY  HA2     5.90                
         HN     61 GLY  QA      5.44                
         HA     61 GLY  HA1     6.50                
         HA     61 GLY  HA2     6.50                
         HA     61 GLY  QA      5.78                
         HA     62 THR  HN      6.50                
         HB2    61 GLY  HN      6.50                
         HB2    62 THR  HN      6.50                
         HB3    61 GLY  HN      6.50                
         HB3    62 THR  HN      6.50                
         QB     62 THR  HN      6.34                
 61 GLY  
         HN     62 THR  HN      3.90                
         HN     62 THR  HA      6.50                
         HN     62 THR  QG2     6.30                
         HA1    62 THR  HA      6.50                
         HA1    62 THR  QG2     7.50                
         HA2    62 THR  HA      6.50                
         HA2    62 THR  QG2     7.50                
         QA     62 THR  HA      6.10                
         QA     62 THR  QG2     7.35                
 62 THR  
         HN     63 ILE  HN      5.10                
         HN     63 ILE  HA      6.50                
         HA     62 THR  QG2     3.40                
         HA     63 ILE  HA      4.90                
         HA     63 ILE  HB      5.80                
         HA     63 ILE  QG2     6.60                
         HA     63 ILE  QG1     7.38                
         HA     63 ILE  QD1     7.50                
         HB     63 ILE  HN      3.90                
         HB     63 ILE  HA      5.10                
         HB     63 ILE  QG2     7.50                
         QG2    63 ILE  HN      7.50                
         QG2    63 ILE  HA      7.50                
         QG2    63 ILE  QG2     7.30                
         QG2    63 ILE  QG1     8.38                
         QG2    64 ASP- HN      6.50                
 63 ILE  
         HN     63 ILE  QG1     4.88                
         HN     63 ILE  QD1     7.50                
         HA     63 ILE  QG2     3.50                
         HA     63 ILE  HG12    3.80                
         HA     63 ILE  HG13    3.80                
         HA     63 ILE  QG1     3.50                
         HA     63 ILE  QD1     4.50                
         HA     67 GLU- QB      6.68                
         HB     63 ILE  QD1     3.40                
         HB     64 ASP- HN      4.60                
         HB     67 GLU- QB      5.88                
         HB     68 PHE  HN      6.50                
         QG2    63 ILE  QD1     4.40                
         QG2    64 ASP- HN      4.80                
         QG2    65 PHE  HN      7.40                
         QG2    67 GLU- HN      5.30                
         QG2    67 GLU- HB2     6.60                
         QG2    67 GLU- HB3     6.60                
         QG2    67 GLU- QB      6.25                
         QG2    68 PHE  HN      4.40                
         QG2    68 PHE  HA      6.70                
         QG2    68 PHE  HB2     6.30                
         QG2    68 PHE  HB3     6.30                
         QG2    68 PHE  QB      6.09                
         QG2    68 PHE  HD1     5.70                
         HG12   64 ASP- HN      6.20                
         HG12   67 GLU- HB2     8.25                
         HG12   67 GLU- HB3     8.25                
         HG13   64 ASP- HN      6.20                
         HG13   67 GLU- HB2     8.25                
         HG13   67 GLU- HB3     8.25                
         QG1    64 ASP- HN      5.70                
         QG1    67 GLU- QB      6.89                
         QG1    68 PHE  HN      6.98                
         QG1    68 PHE  QB      8.25                
         QD1    68 PHE  HA      7.50                
         QD1    68 PHE  QB      7.08                
         QD1    68 PHE  HD1     7.50                
         QD1    71 MET  HN      7.50                
 64 ASP- 
         HN     65 PHE  HN      5.80                
         HN     67 GLU- HN      5.10                
         HN     67 GLU- QB      5.38                
         HA     65 PHE  QB      7.38                
         HA     66 PRO  QD      7.38                
         HA     67 GLU- QB      6.98                
         HB2    65 PHE  HN      4.50                
         HB2    66 PRO  HD2     8.25                
         HB2    66 PRO  HD3     8.25                
         HB3    65 PHE  HN      4.50                
         HB3    66 PRO  HD2     8.25                
         HB3    66 PRO  HD3     8.25                
         QB     65 PHE  HN      4.26                
         QB     66 PRO  QD      7.32                
         QB     67 GLU- HN      5.68                
         QB     67 GLU- QB      6.55                
 65 PHE  
         HN     65 PHE  HD1     6.50                
         HN     66 PRO  QD      5.58                
         HN     67 GLU- HN      6.50                
         HN     68 PHE  HN      6.50                
         HA     65 PHE  HD1     3.10                
         HA     65 PHE  HE1     6.50                
         HA     68 PHE  HB2     5.70                
         HA     68 PHE  HB3     5.70                
         HA     68 PHE  QB      5.20                
         HA     68 PHE  HD1     6.50                
         HA     69 LEU  QB      7.38                
         HB2    65 PHE  HD1     3.70                
         HB2    66 PRO  HD2     7.15                
         HB2    66 PRO  HD3     7.15                
         HB3    65 PHE  HD1     3.70                
         HB3    66 PRO  HD2     7.15                
         HB3    66 PRO  HD3     7.15                
         QB     66 PRO  QD      5.77                
         HD1    66 PRO  HD2     6.50                
         HD1    66 PRO  HD3     6.50                
         HD1    66 PRO  QD      6.34                
 66 PRO  
         HA     67 GLU- HA      6.50                
         HA     68 PHE  HN      6.50                
         HA     69 LEU  QB      6.78                
         HA     69 LEU  QQD     8.47                
         QB     67 GLU- QG      8.38                
         QB     69 LEU  HG      7.50                
         QG     67 GLU- HA      7.50                
         QG     67 GLU- QG      6.08                
         HD2    67 GLU- HG2     7.05                
         HD2    67 GLU- HG3     7.05                
         HD3    67 GLU- HG2     7.05                
         HD3    67 GLU- HG3     7.05                
         QD     67 GLU- QB      6.95                
         QD     67 GLU- QG      6.01                
 67 GLU- 
         HN     67 GLU- QG      4.68                
         HN     68 PHE  HN      4.50                
         HN     69 LEU  HN      5.10                
         QB     68 PHE  HA      7.38                
         QG     70 THR  HB      7.38                
         QG     70 THR  QG2     8.08                
 68 PHE  
         HN     68 PHE  HD1     5.60                
         HN     69 LEU  HN      4.50                
         HN     69 LEU  HA      6.50                
         HN     70 THR  HN      6.50                
         HA     68 PHE  HD1     6.50                
         HA     71 MET  QB      7.50                
         HB2    68 PHE  HD1     3.50                
         HB2    69 LEU  HN      4.80                
         HB3    68 PHE  HD1     3.50                
         HB3    69 LEU  HN      4.80                
         QB     71 MET  QB      8.38                
         HD1    69 LEU  HA      7.00                
 69 LEU  
         HN     69 LEU  HG      3.90                
         HN     69 LEU  QQD     6.07                
         HN     70 THR  HN      4.50                
         HA     69 LEU  HG      3.70                
         HA     70 THR  HA      5.20                
         HA     71 MET  HN      6.50                
         HA     72 MET  HN      6.50                
         HA     73 ALA  HN      5.90                
         QB     70 THR  HN      7.38                
         QB     73 ALA  HN      7.38                
         HG     70 THR  HN      5.30                
         QQD    70 THR  HN      7.17                
         QQD    73 ALA  HN      9.07                
         QQD    74 ARG+ HN      8.27                
 70 THR  
         HN     70 THR  HB      4.20                
         HN     71 MET  HN      4.30                
         HN     71 MET  QB      7.50                
         HN     73 ALA  QB      7.50                
         HN     74 ARG+ QG      6.20                
         HA     70 THR  QG2     3.40                
         HA     73 ALA  HN      5.10                
         HA     73 ALA  QB      3.40                
         HA     74 ARG+ HN      5.20                
         HB     71 MET  HN      4.40                
         QG2    71 MET  HN      4.80                
         QG2    71 MET  HA      7.50                
         QG2    74 ARG+ HN      5.40                
         QG2    74 ARG+ QG      7.60                
 71 MET  
         HN     71 MET  QG      4.70                
         HN     72 MET  HN      4.40                
         HN     72 MET  HA      6.50                
         HN     73 ALA  HN      5.70                
         HN     73 ALA  QB      6.00                
         HA     74 ARG+ QB      6.70                
         HA     74 ARG+ QD      7.50                
         QG     72 MET  HN      5.50                
         QG     74 ARG+ HN      7.50                
 72 MET  
         HN     72 MET  QG      4.80                
         HN     73 ALA  HN      3.70                
         HN     74 ARG+ HN      4.90                
         HN     75 LYS+ QG      7.50                
         HA     75 LYS+ HA      5.30                
         HA     75 LYS+ QB      6.30                
         QB     75 LYS+ QB      8.50                
 73 ALA  
         HN     73 ALA  QB      3.40                
         HN     74 ARG+ HN      4.10                
         HN     74 ARG+ QB      5.90                
         HN     75 LYS+ HN      6.50                
         HN     75 LYS+ QB      7.50                
         HN     76 MET  HN      6.50                
         HN     76 MET  QB      7.38                
         HA     75 LYS+ QB      7.50                
         HA     76 MET  HN      6.50                
         HA     76 MET  HA      6.50                
         HA     76 MET  HB2     6.50                
         HA     76 MET  HB3     6.50                
         HA     76 MET  QB      5.82                
         HA     76 MET  HG2     6.50                
         HA     76 MET  HG3     6.50                
         HA     76 MET  QG      5.91                
         HA     77 LYS+ HN      5.30                
         QB     74 ARG+ HN      3.40                
         QB     75 LYS+ HN      5.30                
         QB     76 MET  QB      8.38                
         QB     77 LYS+ QE      7.80                
 74 ARG+ 
         HN     74 ARG+ QG      5.30                
         HN     74 ARG+ QD      6.00                
         HN     75 LYS+ HA      5.10                
         HN     75 LYS+ QB      7.10                
         HN     75 LYS+ QG      7.40                
         HN     77 LYS+ HN      5.90                
         HA     78 ASP- HN      6.50                
         QB     75 LYS+ QG      8.50                
         QB     76 MET  HN      5.70                
         QG     77 LYS+ HB2     5.90                
         QG     77 LYS+ HB3     5.90                
 75 LYS+ 
         HN     75 LYS+ QG      4.90                
         HN     75 LYS+ QD      5.30                
         HN     76 MET  HN      3.70                
         HN     76 MET  QB      5.68                
         HN     77 LYS+ HN      5.00                
         HN     78 ASP- QB      7.38                
         HA     75 LYS+ QD      4.70                
         HA     76 MET  HG2     6.50                
         HA     76 MET  HG3     6.50                
         HA     77 LYS+ HN      6.50                
         HA     77 LYS+ HB2     6.50                
         HA     77 LYS+ HB3     6.50                
         HA     78 ASP- HN      6.50                
         QB     76 MET  HN      5.00                
         QB     76 MET  HA      6.00                
         QB     76 MET  HG2     7.50                
         QB     76 MET  HG3     7.50                
         QB     79 THR  QG2     8.50                
         QG     76 MET  HN      7.50                
         QG     76 MET  HA      7.50                
         QG     77 LYS+ QB      8.38                
         QG     78 ASP- HN      7.20                
         QG     79 THR  HN      6.50                
         QE     78 ASP- HA      6.40                
         QE     78 ASP- QB      8.38                
 76 MET  
         HN     76 MET  HB2     3.60                
         HN     76 MET  HB3     3.60                
         HN     76 MET  QB      3.34                
         HN     76 MET  HG2     3.90                
         HN     76 MET  HG3     3.90                
         HN     76 MET  QG      3.65                
         HN     77 LYS+ HN      6.50                
         HN     79 THR  HN      6.50                
         HA     76 MET  HG2     4.30                
         HA     76 MET  HG3     4.30                
         HA     79 THR  QG2     7.50                
         HB2    77 LYS+ HN      4.90                
         HB2    77 LYS+ HB2     8.25                
         HB2    77 LYS+ HB3     8.25                
         HB3    77 LYS+ HN      4.90                
         HB3    77 LYS+ HB2     8.25                
         HB3    77 LYS+ HB3     8.25                
         QB     77 LYS+ QB      6.87                
         QG     77 LYS+ HN      6.68                
         QG     77 LYS+ QG      8.38                
 77 LYS+ 
         HN     77 LYS+ QB      3.91                
         HN     77 LYS+ QG      7.50                
         HN     77 LYS+ QD      6.10                
         HN     77 LYS+ QE      7.50                
         HN     78 ASP- HN      4.80                
         HN     79 THR  HN      6.30                
         HA     77 LYS+ QE      5.20                
         HA     78 ASP- HA      5.90                
         HB2    78 ASP- HN      5.10                
         HB3    78 ASP- HN      5.10                
         QB     78 ASP- HN      4.83                
         QB     78 ASP- HA      5.48                
         QB     79 THR  HN      7.38                
         QG     78 ASP- HN      5.60                
 78 ASP- 
         HN     79 THR  HN      4.80                
         HN     79 THR  QG2     6.30                
         HA     79 THR  HA      5.70                
         HB2    79 THR  HA      5.80                
         HB3    79 THR  HA      5.80                
         QB     79 THR  HA      5.07                
         QB     79 THR  HB      7.38                


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

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