NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing in_recoord stage position program type subtype subsubtype
14365 1wkt 5255 cing recoord 1-original 1 DYANA/DIANA distance NOE simple


  1 GLY  
         HA1     2 ASP- HN      3.40
         HA2     2 ASP- HN      3.40
  2 ASP- 
         HN      2 ASP- HB2     4.10
         HN      2 ASP- HB3     4.10
         HN      2 ASP- QB      3.85
         HN      3 GLY  HN      3.70
         HA      3 GLY  HN      3.60
         HB2     3 GLY  HN      5.00
         HB3     3 GLY  HN      5.00
         QB      3 GLY  HN      4.27
  3 GLY  
         HN     42 SER  HA      5.50
         HN     42 SER  QB      6.28
         HA1     4 TYR  HN      2.80
         HA2     4 TYR  HN      2.80
  4 TYR  
         HN      4 TYR  HB3     3.70
         HN      4 TYR  QE      6.50
         HN     40 GLY  HN      3.50
         HA      4 TYR  HB2     2.80
         HA      4 TYR  HB3     2.80
         HA      5 LEU  HN      2.60
         HB2     5 LEU  HN      3.00
         HB2     6 ILE  QG2     5.70
         HB2    20 TRP  HZ3     4.60
         HB3     5 LEU  HN      3.40
         HB3    20 TRP  HZ3     5.40
         QD      5 LEU  HN      6.20
         QD      5 LEU  HA      7.00
         QD      6 ILE  HN      7.10
         QD      6 ILE  QG2     7.50
         QD      6 ILE  HG12    7.50
         QD      6 ILE  HG13    7.50
         QD      6 ILE  QG1     6.92
         QD      6 ILE  QD1     8.30
         QD     20 TRP  HH2     7.50
         QD     38 VAL  QG1     8.50
         QD     39 THR  HA      7.40
         QD     41 GLY  HA1     7.50
         QD     41 GLY  HA2     7.50
         QD     41 GLY  QA      7.30
         QE      5 LEU  HA      7.50
         QE      6 ILE  HN      7.50
         QE      6 ILE  QG2     8.50
         QE      6 ILE  HG12    7.50
         QE      6 ILE  HG13    7.50
         QE      6 ILE  QG1     7.01
         QE      6 ILE  QD1     7.50
         QE     13 PRO  HB3     7.50
         QE     13 PRO  QG      8.38
         QE     20 TRP  HH2     7.50
         QE     38 VAL  HB      7.50
         QE     38 VAL  QG1     7.00
         QE     39 THR  HA      7.50
         QE     40 GLY  HN      5.80
         QE     40 GLY  QA      8.38
         QE     41 GLY  HN      7.50
         QE     41 GLY  HA1     7.50
         QE     41 GLY  HA2     7.50
         QE     41 GLY  QA      7.35
  5 LEU  
         HN      5 LEU  HG      5.50
         HN      5 LEU  QD1     6.50
         HN      5 LEU  QD2     6.50
         HN      6 ILE  QG2     6.50
         HN     23 ASN  QD2     5.07
         HA      5 LEU  HG      3.10
         HA      5 LEU  QD1     6.40
         HA      5 LEU  QD2     6.40
         HA      6 ILE  HN      2.50
         HA     39 THR  HA      2.90
         HA     40 GLY  HN      4.10
         HG      6 ILE  HN      4.10
         QD1     6 ILE  HN      6.50
         QD1    49 CYSS HA      6.50
         QD2     6 ILE  HN      6.50
         QD2    49 CYSS HA      6.50
         QQD    49 CYSS HA      6.21
         QQD    86 ARG+ HE      8.07
  6 ILE  
         HN      6 ILE  HG12    3.60
         HN      6 ILE  HG13    3.60
         HN      6 ILE  QG1     3.20
         HN      6 ILE  QD1     6.50
         HN     39 THR  HA      3.60
         HA      6 ILE  HB      2.90
         HA      6 ILE  QG2     3.60
         HA      7 MET  HN      2.60
         HA     84 TYR  QE      7.50
         HB     18 CYSS HB3     3.40
         QG2    18 CYSS HB3     6.50
         QG2    19 ASP- HN      6.50
         QG2    20 TRP  HN      4.70
         QG2    20 TRP  HA      4.20
         QG2    20 TRP  HB3     6.50
         QG2    20 TRP  HD1     6.50
         QG2    20 TRP  HE3     5.30
         QG2    20 TRP  HE1     6.50
         QG2    20 TRP  HZ3     6.50
         QG2    20 TRP  HH2     6.50
         QG2    21 LYS+ HN      6.50
         QD1    18 CYSS HN      6.50
         QD1    18 CYSS HB2     4.90
         QD1    19 ASP- HN      6.50
         QD1    20 TRP  HN      6.50
         QD1    20 TRP  HD1     5.10
         QD1    20 TRP  HE1     6.50
         QD1    20 TRP  HZ3     6.50
         QD1    20 TRP  HH2     6.40
         QD1    38 VAL  HN      6.50
         QD1    38 VAL  HB      4.90
  7 MET  
         HN      7 MET  HB2     3.70
         HN      7 MET  HB3     3.50
         HN      7 MET  HG2     5.10
         HN      7 MET  HG3     5.10
         HN      7 MET  QG      4.29
         HA      7 MET  HB2     2.80
         HA      7 MET  HB3     2.80
         HA      8 CYSS HN      2.50
         HA     37 MET  HA      2.70
         HA     38 VAL  HN      3.30
         HB2     8 CYSS HN      3.60
         HB3     8 CYSS HN      4.40
         HB3    19 ASP- HN      5.50
         HB3    84 TYR  QE      7.50
         HG2    84 TYR  QE      7.30
         HG3    84 TYR  QE      7.30
         QG     84 TYR  QE      6.72
         QG     84 TYR  HH      6.38
  8 CYSS 
         HN      8 CYSS HB2     3.20
         HN      8 CYSS HB3     3.70
         HN     34 VAL  QQG     6.56
         HN     36 TRP  HN      3.60
         HN     36 TRP  HB2     4.90
         HN     36 TRP  HB3     5.50
         HN     37 MET  HA      3.40
         HN     38 VAL  QG2     6.50
         HN     75 ILE  QD1     6.50
         HA      8 CYSS HB3     2.90
         HA      9 LYS+ HN      2.60
         HA     10 ASN  HN      4.30
         HA     18 CYSS HA      2.60
         HA     18 CYSS HB2     5.50
         HA     18 CYSS HB3     4.40
         HA     19 ASP- HN      3.50
         HB2     9 LYS+ HN      4.10
         HB2    10 ASN  HN      3.20
         HB2    36 TRP  HB2     3.30
         HB2    36 TRP  HD1     5.50
         HB3     9 LYS+ HN      3.00
         HB3    10 ASN  HN      2.70
         HB3    36 TRP  HB2     5.50
  9 LYS+ 
         HN      9 LYS+ HB2     3.60
         HN      9 LYS+ HB3     3.60
         HN      9 LYS+ QB      3.10
         HN      9 LYS+ QG      5.28
         HN      9 LYS+ QD      4.38
         HN     10 ASN  HN      3.10
         HN     18 CYSS HA      3.50
         HN     34 VAL  QQG     7.86
         HA      9 LYS+ QD      6.38
         HA     34 VAL  HN      4.70
         HA     34 VAL  HA      2.70
         HA     35 HIS  HN      3.50
         HA     35 HIS  HD2     5.50
         HA     36 TRP  HD1     5.10
         HB2    10 ASN  HN      4.10
         HB3    10 ASN  HN      4.10
         QB     10 ASN  HN      3.85
         QG     34 VAL  HA      4.58
         QD     10 ASN  HN      6.38
         QD     34 VAL  HA      5.78
 10 ASN  
         HN     16 GLY  HA1     4.80
         HN     16 GLY  HA2     3.40
         HN     34 VAL  QQG     8.06
         HN     36 TRP  HB2     5.50
         HN     36 TRP  HD1     5.20
         HN     38 VAL  QG2     6.50
         HA     10 ASN  HB2     2.80
         HA     10 ASN  HB3     2.70
         HA     11 CYSS HN      3.20
         HA     36 TRP  HD1     3.40
         HA     36 TRP  HE1     4.20
         HB2    11 CYSS HN      2.80
         HB2    12 ASP- HN      4.00
         HB3    10 ASN  QD2     3.56
         HB3    11 CYSS HN      3.50
         HB3    12 ASP- HN      4.30
         QD2    15 THR  QG2     7.37
         QD2    16 GLY  HA2     6.37
 11 CYSS 
         HN     11 CYSS HB2     3.50
         HN     11 CYSS HB3     2.90
         HA     11 CYSS HB2     2.80
         HA     12 ASP- HN      3.20
         HA     38 VAL  QG2     4.30
         HB2    12 ASP- HN      4.30
         HB3    12 ASP- HN      4.70
 12 ASP- 
         HN     12 ASP- HB2     3.00
         HN     12 ASP- HB3     2.90
         HN     38 VAL  QG1     6.50
         HA     12 ASP- HB2     3.00
         HA     13 PRO  HD2     2.70
         HA     13 PRO  HD3     2.70
         HB3    15 THR  HN      3.80
         HB3    16 GLY  HN      4.10
 13 PRO  
         HB2    14 ASN  HN      3.70
         HB2    20 TRP  HE1     5.50
         HB2    20 TRP  HZ2     4.00
         HB2    20 TRP  HH2     5.20
         HB3    20 TRP  HZ2     3.80
         HD2    14 ASN  HN      5.40
         HD3    14 ASN  HN      5.40
         QD     38 VAL  QG1     6.48
 14 ASN  
         HN     14 ASN  HB2     3.00
         HN     14 ASN  HB3     2.90
         HN     14 ASN  QD2     6.37
         HN     15 THR  HN      4.00
         HN     15 THR  QG2     6.50
         HA     14 ASN  HB2     2.90
         HA     15 THR  HN      3.50
         HB2    15 THR  QG2     5.80
         HB3    15 THR  HN      3.40
         HB3    15 THR  QG2     6.00
 15 THR  
         HN     15 THR  QG2     4.60
         HN     16 GLY  HN      2.50
         HA     16 GLY  HN      3.10
         QG2    16 GLY  HN      6.50
 16 GLY  
         HN     16 GLY  HA1     2.90
         HN     16 GLY  HA2     2.90
         HA2    17 SER  HN      3.10
 17 SER  
         HA     18 CYSS HN      2.70
         HB2    18 CYSS HN      4.30
         HB3    18 CYSS HN      4.30
         QB     18 CYSS HN      4.01
 18 CYSS 
         HN     18 CYSS HB2     3.00
         HN     18 CYSS HB3     3.50
         HN     20 TRP  HD1     5.50
         HN     20 TRP  HE1     5.50
         HA     18 CYSS HB3     2.80
         HA     19 ASP- HN      2.60
         HB2    20 TRP  HD1     3.50
         HB2    20 TRP  HE1     4.10
         HB3    19 ASP- HN      3.10
         HB3    20 TRP  HE1     4.80
 19 ASP- 
         HN     19 ASP- HB2     3.60
         HN     19 ASP- HB3     3.00
         HA     19 ASP- HB2     2.80
         HA     19 ASP- HB3     2.80
         HA     20 TRP  HN      3.20
         HB2    20 TRP  HN      4.10
         HB2    21 LYS+ HN      4.50
         HB3    20 TRP  HN      4.20
 20 TRP  
         HN     20 TRP  HB2     3.50
         HN     20 TRP  HB3     3.90
         HN     20 TRP  HD1     4.60
         HN     21 LYS+ HN      3.20
         HA     20 TRP  HB3     2.70
         HA     20 TRP  HD1     5.50
         HA     20 TRP  HE3     3.30
         HA     21 LYS+ HN      2.80
         HB2    20 TRP  HD1     3.30
         HB2    20 TRP  HE3     4.10
         HB3    20 TRP  HE3     3.30
         HB3    21 LYS+ HN      5.20
 21 LYS+ 
         HN     21 LYS+ HB2     3.50
         HN     21 LYS+ HB3     3.50
         HN     21 LYS+ QB      3.14
         HN     21 LYS+ HG2     5.50
         HN     21 LYS+ HG3     5.50
         HN     21 LYS+ QG      4.90
         HN     21 LYS+ HD2     5.50
         HN     21 LYS+ HD3     5.50
         HN     21 LYS+ QD      4.90
         HA     21 LYS+ QG      3.89
         HA     21 LYS+ HD2     3.40
         HA     21 LYS+ HD3     3.40
         HA     21 LYS+ QD      3.18
         HA     22 GLN  HN      2.60
         QB     21 LYS+ QE      7.25
         QB     22 GLN  HN      5.40
         QG     22 GLN  HN      5.50
 22 GLN  
         HN     22 GLN  HB2     3.10
         HN     22 GLN  HB3     2.90
         HN     22 GLN  QG      6.40
         HA     22 GLN  QE2     5.57
         HA     23 ASN  HN      2.50
         HB2    22 GLN  HE21    5.50
         HB2    23 ASN  HN      4.10
         HB3    23 ASN  HN      3.70
         QG     23 ASN  HN      5.90
         QG     24 TRP  HN      6.50
         QG     24 TRP  HD1     6.50
         HE21   26 THR  QG2     6.50
         HE22   26 THR  QG2     6.50
         QE2    24 TRP  HN      5.97
 23 ASN  
         HN     23 ASN  HB2     4.00
         HN     23 ASN  HB3     4.00
         HN     23 ASN  QB      3.75
         HN     24 TRP  HN      2.80
         HN     28 VAL  QG2     6.50
         HA     24 TRP  HN      3.50
         HB2    84 TYR  QE      7.50
         HB2    86 ARG+ HN      5.50
         HB3    84 TYR  QE      7.50
         HB3    86 ARG+ HN      5.50
         QB     84 TYR  QE      7.20
         QB     86 ARG+ HN      5.13
         HD21   84 TYR  HH      5.50
         HD22   84 TYR  HH      5.50
         QD2    84 TYR  QE      6.67
 24 TRP  
         HN     24 TRP  HB2     3.30
         HN     24 TRP  HB3     3.30
         HN     24 TRP  QB      2.98
         HN     24 TRP  HD1     3.80
         HN     25 ASN  HN      4.30
         HN     26 THR  HN      5.00
         HA     24 TRP  HD1     5.50
         HA     24 TRP  HE3     3.70
         HA     25 ASN  HN      2.80
         HA     26 THR  HN      4.60
         HA     86 ARG+ HN      3.40
         HA     86 ARG+ QB      4.68
         HE3    87 VAL  HA      5.50
         HZ3    87 VAL  HA      4.40
         HZ2    88 GLU- HA      5.50
         HH2    88 GLU- HA      3.00
 25 ASN  
         HN     25 ASN  HB2     4.10
         HN     25 ASN  HB3     4.10
         HN     25 ASN  QB      3.90
         HN     26 THR  HN      3.50
         HA     26 THR  HN      3.50
         HB2    26 THR  HN      4.60
         HB3    26 THR  HN      4.60
 26 THR  
         HN     26 THR  HB      3.60
         HN     26 THR  QG2     4.90
         HN     27 CYSS HN      4.70
         HN     85 ARG+ QB      4.88
         HN     85 ARG+ HD2     4.60
         HN     85 ARG+ HD3     4.60
         HA     26 THR  HB      3.00
         HA     27 CYSS HN      2.70
         HB     27 CYSS HN      3.80
         HB     28 VAL  QG2     6.50
         QG2    27 CYSS HN      5.30
 27 CYSS 
         HN     27 CYSS HA      2.80
         HN     27 CYSS HB2     3.20
         HN     27 CYSS HB3     3.10
         HA     27 CYSS HB2     2.90
         HA     28 VAL  HN      2.50
         HB2    28 VAL  HN      5.40
         HB2    58 CYSS HB2     5.50
 28 VAL  
         HN     28 VAL  HB      2.90
         HN     84 TYR  HN      3.40
         HN     84 TYR  QD      7.50
         HA     28 VAL  QG1     3.70
         HA     29 GLY  HN      2.40
         HB     29 GLY  HN      4.40
         HB     84 TYR  HN      5.00
         HB     84 TYR  QD      6.60
         HB     84 TYR  QE      6.30
         QG1    29 GLY  HN      4.10
         QG1    29 GLY  QA      7.38
         QG1    83 SER  HA      6.50
         QG1    84 TYR  HN      6.50
         QG1    84 TYR  QD      8.50
         QG1    84 TYR  QE      6.30
         QG1    84 TYR  HH      6.50
         QG2    29 GLY  HN      6.50
         QG2    84 TYR  HN      6.50
 29 GLY  
         HN     29 GLY  HA1     2.80
         HN     29 GLY  HA2     2.80
         HA1    30 ILE  HN      3.00
         HA2    30 ILE  HN      3.00
         QA     30 ILE  HN      2.72
         QA     83 SER  HA      4.68
         QA     84 TYR  HN      6.38
 30 ILE  
         HN     30 ILE  HB      2.90
         HN     30 ILE  QG1     4.28
         HN     30 ILE  QD1     6.50
         HN     31 GLY  HN      5.50
         HN     82 ARG+ HA      3.70
         HN     83 SER  HA      3.20
         HA     30 ILE  HG12    4.00
         HA     30 ILE  HG13    4.00
         HA     30 ILE  QG1     3.65
         HA     31 GLY  HN      2.40
         HA     84 TYR  QE      7.50
         HB     31 GLY  HN      4.70
         HB     82 ARG+ HA      3.20
         HB     83 SER  HA      5.30
         QG2    31 GLY  HN      4.50
         QG2    34 VAL  HN      6.50
         QG2    82 ARG+ HA      6.50
         HG12   84 TYR  HN      5.50
         HG12   84 TYR  QD      5.40
         HG13   84 TYR  HN      5.50
         HG13   84 TYR  QD      5.40
         QG1    83 SER  HA      3.88
         QG1    84 TYR  HN      5.28
         QG1    84 TYR  QE      7.18
         QD1    31 GLY  HN      6.50
         QD1    82 ARG+ HA      6.50
         QD1    83 SER  HA      5.90
         QD1    84 TYR  HN      6.50
 31 GLY  
         HN     31 GLY  QA      2.64
         HN     32 ALA  HN      4.20
         HN     34 VAL  HB      3.70
         HN     34 VAL  QQG     6.26
         HA1    32 ALA  HN      2.90
         HA2    32 ALA  HN      2.90
         QA     32 ALA  HN      2.66
         QA     32 ALA  QB      7.38
         QA     33 ASN  HN      5.28
         QA     34 VAL  QQG     8.34
 32 ALA  
         HN     32 ALA  HA      2.50
         HN     32 ALA  QB      3.40
         HN     33 ASN  HN      3.70
         HN     34 VAL  QQG     8.06
         HA     33 ASN  HN      2.40
         HA     34 VAL  HN      3.70
         HA     80 TYR  QE      7.50
         QB     33 ASN  HN      4.40
         QB     33 ASN  HD21    6.50
         QB     33 ASN  HD22    6.50
         QB     33 ASN  QD2     6.34
         QB     34 VAL  HN      6.50
 33 ASN  
         HN     33 ASN  HA      2.50
         HN     34 VAL  HN      2.90
         HA     33 ASN  HD21    5.50
         HA     34 VAL  HN      3.20
         HA     35 HIS  HD2     4.80
         QB     35 HIS  HD2     6.50
 34 VAL  
         HN     34 VAL  HB      2.50
         HN     34 VAL  QQG     4.10
         HA     35 HIS  HN      2.70
         HA     35 HIS  HD2     5.50
         HA     36 TRP  HN      3.50
         HA     36 TRP  HD1     5.50
         QQG    35 HIS  HN      6.16
         QQG    36 TRP  HN      5.96
         QQG    36 TRP  HD1     8.06
 35 HIS  
         HN     35 HIS  HD2     3.70
         HN     36 TRP  HN      2.50
         HA     35 HIS  HB3     2.90
         HA     36 TRP  HN      3.30
         HA     75 ILE  HB      3.80
         HA     75 ILE  QD1     5.30
         HB2    36 TRP  HD1     4.50
         HB2    36 TRP  HE1     4.90
         HB2    75 ILE  QG1     5.98
         HB3    36 TRP  HD1     5.50
         HB3    36 TRP  HE1     5.50
         HB3    74 ASN  QD2     6.50
         HE1    36 TRP  HZ2     5.50
 36 TRP  
         HN     36 TRP  HB2     2.90
         HN     36 TRP  HD1     4.40
         HN     75 ILE  QD1     5.90
         HA     36 TRP  HB3     2.70
         HA     36 TRP  HD1     5.50
         HA     36 TRP  HE3     3.80
         HA     37 MET  HN      2.50
         HA     74 ASN  HA      2.70
         HA     75 ILE  HN      3.40
         HB2    36 TRP  HD1     3.70
         HB2    37 MET  HN      4.20
         HB3    36 TRP  HE3     3.30
         HB3    36 TRP  HZ3     5.50
         HB3    37 MET  HN      3.50
         HE3    37 MET  HN      5.50
         HE3    38 VAL  QG1     6.50
         HE3    72 CYSS HA      5.50
         HE3    72 CYSS HB2     5.50
         HE3    72 CYSS HB3     4.80
         HE3    73 CYSS HN      5.50
         HE3    74 ASN  HA      3.80
         HE3    74 ASN  QB      6.50
         HE1    74 ASN  QD2     6.50
         HZ3    73 CYSS HA      4.70
         HZ3    74 ASN  HA      4.80
         HZ3    74 ASN  QB      4.70
         HZ2    74 ASN  QB      6.50
         HH2    74 ASN  QB      6.10
 37 MET  
         HN     37 MET  HB2     3.20
         HN     37 MET  HB3     2.90
         HN     37 MET  HG2     4.70
         HN     37 MET  HG3     5.50
         HN     73 CYSS HN      3.50
         HN     74 ASN  HA      4.20
         HN     75 ILE  HN      4.50
         HN     75 ILE  QG2     6.10
         HN     75 ILE  QD1     6.40
         HA     37 MET  HB2     2.70
         HA     37 MET  HG2     3.90
         HA     37 MET  HG3     3.30
         HA     38 VAL  HN      2.50
         HB2    38 VAL  HN      4.30
         HB3    38 VAL  HN      4.40
         HB3    73 CYSS HN      5.20
         HG2    38 VAL  HN      4.80
         HG3    38 VAL  HN      4.70
 38 VAL  
         HN     38 VAL  HB      3.00
         HN     38 VAL  QG2     4.60
         HA     39 THR  HN      2.50
         HA     72 CYSS HA      2.60
         HA     73 CYSS HN      3.70
         QG1    39 THR  HN      4.70
         QG1    71 THR  HN      6.50
         QG1    73 CYSS HN      6.50
         QG2    39 THR  HN      6.40
         QG2    72 CYSS HA      4.30
         QG2    72 CYSS HB2     4.80
         QG2    73 CYSS HN      6.50
 39 THR  
         HN     39 THR  HB      4.10
         HN     71 THR  HN      3.40
         HN     72 CYSS HA      3.60
         HA     39 THR  HB      2.80
         HA     39 THR  QG2     3.80
         HA     40 GLY  HN      2.70
         QG2    40 GLY  HN      5.90
         QG2    48 GLY  HN      4.80
         QG2    67 CYSS HN      6.50
         QG2    67 CYSS HB3     4.20
         QG2    70 ASN  HN      6.50
         QG2    71 THR  HN      6.50
 40 GLY  
         HN     41 GLY  HN      5.50
         HA1    41 GLY  HN      2.90
         HA1    42 SER  HN      4.60
         HA2    41 GLY  HN      2.90
         HA2    42 SER  HN      4.60
         QA     42 SER  HN      4.22
         QA     70 ASN  HN      4.78
 41 GLY  
         HN     42 SER  HN      3.20
         HN     69 ALA  QB      6.50
 42 SER  
         HN     42 SER  HB2     3.40
         HN     42 SER  HB3     3.40
         HN     42 SER  QB      3.18
         HN     70 ASN  QD2     5.27
         HA     43 THR  HN      3.50
         HB2    43 THR  HN      4.80
         HB3    43 THR  HN      4.80
         QB     43 THR  HN      4.28
         QB     44 ASP- HN      4.58
         QB     69 ALA  QB      6.48
         QB     70 ASN  QD2     7.24
 43 THR  
         HN     44 ASP- HN      3.00
         HN     45 GLY  HN      5.50
         HB     44 ASP- HN      4.40
 44 ASP- 
         HN     44 ASP- HB2     3.40
         HN     44 ASP- HB3     3.40
         HA     45 GLY  HN      2.80
         QB     46 LYS+ HN      5.78
 45 GLY  
         HN     45 GLY  HA1     2.90
         HN     45 GLY  HA2     2.90
         HN     45 GLY  QA      2.61
         HN     46 LYS+ HN      2.50
         HA1    46 LYS+ HN      3.40
         HA2    46 LYS+ HN      3.40
         QA     69 ALA  QB      5.38
 46 LYS+ 
         HN     46 LYS+ QB      3.70
         HN     46 LYS+ HG2     3.50
         HN     46 LYS+ HG3     3.50
         HN     46 LYS+ QG      3.14
         HN     46 LYS+ QD      5.98
         HN     46 LYS+ QE      6.38
         HN     69 ALA  QB      5.20
         HA     46 LYS+ HG2     3.70
         HA     46 LYS+ HG3     3.70
         HA     46 LYS+ QG      3.44
         HA     46 LYS+ QD      4.98
         HA     46 LYS+ QE      5.88
         HA     47 GLN  HN      2.70
         QB     46 LYS+ QE      5.38
         QB     47 GLN  HN      3.90
         HG2    47 GLN  HN      5.50
         HG3    47 GLN  HN      5.50
         QG     47 GLN  HN      5.09
         QD     47 GLN  HN      6.38
 47 GLN  
         HN     47 GLN  HB2     4.10
         HN     47 GLN  HB3     2.60
         HN     47 GLN  HG2     2.80
         HN     47 GLN  HG3     3.80
         HN     68 PRO  HA      3.90
         HN     69 ALA  QB      5.70
         HA     47 GLN  HB2     2.70
         HA     47 GLN  HB3     2.70
         HA     48 GLY  HN      2.50
         HA     68 PRO  HA      2.70
         HA     69 ALA  HN      3.10
         HB2    48 GLY  HN      2.90
         HB3    47 GLN  HE21    5.50
         HG2    47 GLN  QE2     3.74
         HG3    48 GLY  HN      5.50
 48 GLY  
         HN     48 GLY  HA2     2.80
         HN     67 CYSS HN      3.40
         HN     68 PRO  HA      3.60
         HA1    49 CYSS HN      2.80
         HA2    49 CYSS HN      3.10
 49 CYSS 
         HN     49 CYSS HB2     3.40
         HN     49 CYSS HB3     3.70
         HN     86 ARG+ HE      5.50
         HN     87 VAL  HN      3.70
         HN     88 GLU- HN      3.20
         HN     88 GLU- HA      5.30
         HN     88 GLU- QB      4.58
         HA     49 CYSS HB3     2.70
         HA     50 ALA  HN      2.50
         HA     50 ALA  QB      6.50
         HA     66 CYSS HA      2.60
         HA     66 CYSS HB3     5.40
         HA     67 CYSS HN      3.20
         HB2    50 ALA  HN      3.60
         HB2    66 CYSS HA      5.50
         HB2    88 GLU- HN      5.50
         HB3    50 ALA  HN      3.00
         HB3    66 CYSS HA      4.30
         HB3    88 GLU- HN      5.30
 50 ALA  
         HN     65 MET  HN      3.40
         HN     66 CYSS HA      3.30
         HA     51 THR  HN      2.50
         HA     86 ARG+ HA      2.70
         HA     87 VAL  HN      2.90
         HA     87 VAL  QG1     6.00
         HA     87 VAL  QG2     4.70
         HA     88 GLU- HN      4.50
         QB     51 THR  HN      4.00
         QB     65 MET  HN      6.50
         QB     84 TYR  HA      6.50
         QB     84 TYR  HB2     6.10
         QB     84 TYR  HB3     5.20
         QB     84 TYR  QD      6.00
         QB     84 TYR  QE      8.50
         QB     86 ARG+ HA      5.30
         QB     87 VAL  HN      6.50
 51 THR  
         HN     51 THR  HB      2.80
         HN     86 ARG+ HA      3.60
         HN     87 VAL  QG1     4.70
         HN     87 VAL  QG2     5.30
         HA     51 THR  QG2     3.80
         HA     52 ILE  HN      2.50
         HA     64 THR  HA      2.70
         HA     65 MET  HN      3.20
         HB     52 ILE  HN      5.00
         HB     53 TRP  HE3     5.50
         HB     53 TRP  HH2     3.40
         QG2    52 ILE  HN      4.50
         QG2    52 ILE  HB      6.50
         QG2    53 TRP  HA      6.50
         QG2    53 TRP  HD1     6.50
         QG2    53 TRP  HE3     6.50
         QG2    53 TRP  HE1     6.50
         QG2    53 TRP  HZ3     6.00
         QG2    53 TRP  HZ2     4.70
         QG2    53 TRP  HH2     5.30
         QG2    62 SER  HA      6.50
         QG2    62 SER  HB2     4.10
         QG2    62 SER  HB3     5.40
         QG2    63 THR  HN      5.60
         QG2    64 THR  HA      6.50
         QG2    65 MET  HN      6.50
 52 ILE  
         HN     52 ILE  HB      2.70
         HN     52 ILE  QG1     6.50
         HN     52 ILE  QD1     6.50
         HN     63 THR  HN      3.30
         HN     64 THR  HA      3.70
         HA     52 ILE  HB      3.00
         HA     52 ILE  QG2     3.60
         HA     53 TRP  HN      2.50
         HA     53 TRP  HE3     4.30
         HA     84 TYR  HA      2.70
         HA     85 ARG+ HN      3.50
         HB     53 TRP  HN      4.10
         HB     62 SER  HA      5.50
         HB     65 MET  HN      5.50
         HB     84 TYR  HA      5.50
         QG2    53 TRP  HN      4.70
         QG2    53 TRP  HE3     6.50
         QG2    62 SER  HA      6.50
         QG2    65 MET  HN      6.50
         QG2    84 TYR  HA      6.50
         QG2    84 TYR  HB2     6.40
         QG2    84 TYR  HB3     6.50
         QG1    53 TRP  HN      6.50
         QG1    53 TRP  HE3     6.50
         QG1    84 TYR  HA      6.50
         QG1    84 TYR  HB2     4.70
         QG1    84 TYR  HB3     5.10
         QD1    65 MET  HN      6.50
         QD1    84 TYR  HA      6.50
         QD1    84 TYR  HB2     6.50
         QD1    84 TYR  HB3     6.50
 53 TRP  
         HN     53 TRP  QB      3.70
         HN     53 TRP  HE3     3.20
         HN     53 TRP  HZ3     5.50
         HN     54 GLU- HN      4.90
         HN     81 ILE  HB      5.50
         HN     82 ARG+ HN      4.90
         HN     83 SER  HN      3.50
         HN     83 SER  HG      5.50
         HN     84 TYR  HA      3.40
         HN     84 TYR  HB2     5.50
         HN     84 TYR  HB3     5.50
         HA     53 TRP  HD1     4.70
         HA     53 TRP  HE3     5.50
         HA     54 GLU- HN      2.50
         HA     54 GLU- HB2     4.70
         HA     54 GLU- HB3     4.60
         HA     62 SER  HA      2.60
         HA     62 SER  HB2     4.50
         HA     62 SER  HB3     4.30
         HA     63 THR  HN      3.70
         HA     79 PHE  QD      7.40
         HA     79 PHE  QE      7.50
         QB     54 GLU- HN      4.50
         QB     55 GLY  HN      4.10
         QB     59 VAL  HN      5.70
         QB     83 SER  HN      6.50
         HD1    54 GLU- HN      5.50
         HD1    55 GLY  HN      4.80
         HD1    58 CYSS HA      4.40
         HD1    58 CYSS HB2     5.50
         HD1    59 VAL  HN      5.40
         HD1    59 VAL  HA      3.60
         HD1    59 VAL  HB      5.50
         HD1    60 GLY  HN      4.10
         HD1    60 GLY  HA1     5.50
         HD1    60 GLY  HA2     5.50
         HD1    61 ARG+ HA      5.50
         HD1    62 SER  HA      5.50
         HD1    62 SER  HB2     4.40
         HD1    62 SER  HB3     3.40
         HE3    58 CYSS HB2     5.50
         HE3    84 TYR  HA      2.60
         HE3    84 TYR  HB2     5.50
         HE3    84 TYR  HB3     4.70
         HE3    85 ARG+ HN      4.90
         HE3    85 ARG+ QB      6.38
         HE1    58 CYSS HA      5.50
         HE1    58 CYSS HB2     5.50
         HE1    59 VAL  HN      5.50
         HE1    59 VAL  HA      4.50
         HE1    60 GLY  HN      5.50
         HE1    62 SER  HA      5.50
         HE1    62 SER  HB2     5.50
         HE1    62 SER  HB3     4.80
         HZ3    58 CYSS HB2     5.50
         HZ3    84 TYR  HA      3.50
         HZ3    85 ARG+ HN      3.40
         HZ3    85 ARG+ HB2     3.40
         HZ3    85 ARG+ HB3     3.40
         HZ3    85 ARG+ QB      3.13
         HZ3    85 ARG+ QG      6.38
         HZ2    58 CYSS HB2     5.50
         HH2    58 CYSS HB2     5.50
         HH2    85 ARG+ QB      4.58
 54 GLU- 
         HN     54 GLU- HB2     3.90
         HN     54 GLU- HB3     3.20
         HN     54 GLU- HG2     5.50
         HN     54 GLU- HG3     5.50
         HN     55 GLY  HN      3.30
         HN     61 ARG+ HN      3.30
         HN     61 ARG+ QB      6.50
         HN     62 SER  HA      3.50
         HN     62 SER  HB2     5.50
         HN     79 PHE  QD      7.00
         HA     54 GLU- HG2     4.00
         HA     54 GLU- HG3     4.00
         HA     54 GLU- QG      3.61
         HA     79 PHE  QD      5.50
         HA     82 ARG+ HN      3.30
         HA     83 SER  HN      4.30
         HB2    54 GLU- QG      2.70
         HB2    55 GLY  HN      3.90
         HB2    79 PHE  QD      5.80
         HB3    55 GLY  HN      3.30
         HB3    61 ARG+ HN      3.80
         HB3    79 PHE  QD      7.20
         HG2    79 PHE  QD      7.50
         HG3    79 PHE  QD      7.50
         QG     55 GLY  HN      6.38
         QG     61 ARG+ HN      6.38
         QG     79 PHE  QD      6.87
         QG     80 TYR  HN      5.88
 55 GLY  
         HN     55 GLY  HA1     2.90
         HN     55 GLY  HA2     2.90
         HN     55 GLY  QA      2.66
         HN     59 VAL  HN      3.80
         HA1    56 SER  HN      3.00
         HA1    59 VAL  HN      4.30
         HA2    56 SER  HN      3.00
         HA2    59 VAL  HN      4.30
         QA     56 SER  HN      2.72
 56 SER  
         HN     56 SER  QB      3.80
         HN     57 GLY  HN      4.30
         HN     82 ARG+ QB      6.50
         HN     82 ARG+ QD      6.38
         HA     57 GLY  HN      2.60
         HA     82 ARG+ QB      5.80
         HA     82 ARG+ QG      4.48
         HA     83 SER  HG      3.10
         QB     57 GLY  HN      4.30
 57 GLY  
         HN     57 GLY  HA1     2.80
         HN     57 GLY  HA2     2.80
         HN     58 CYSS HN      3.30
         HN     59 VAL  HN      5.30
         HN     59 VAL  QQG     7.90
         HN     83 SER  HA      5.30
         HN     83 SER  HB3     4.60
 58 CYSS 
         HN     58 CYSS HA      2.60
         HN     58 CYSS HB2     4.10
         HN     58 CYSS HB3     3.70
         HN     59 VAL  HN      3.00
         HN     83 SER  HG      3.20
         HA     58 CYSS HB2     2.80
         HA     58 CYSS HB3     2.80
         HA     59 VAL  HN      2.90
         HB2    59 VAL  HN      4.50
         HB3    59 VAL  HN      5.00
 59 VAL  
         HN     59 VAL  HB      3.60
         HN     83 SER  HG      5.20
         HA     59 VAL  HB      2.60
         HA     60 GLY  HN      2.50
         HB     60 GLY  HN      2.50
         QQG    60 GLY  HN      6.60
 60 GLY  
         HN     60 GLY  HA1     2.90
         HN     60 GLY  HA2     2.90
         HN     60 GLY  QA      2.61
         HA1    61 ARG+ HN      2.90
         HA2    61 ARG+ HN      2.90
 61 ARG+ 
         HN     61 ARG+ QB      3.70
         HN     61 ARG+ QG      5.58
         HN     61 ARG+ HD2     5.50
         HN     61 ARG+ HD3     5.50
         HN     79 PHE  QD      7.50
         HA     61 ARG+ HG2     3.50
         HA     61 ARG+ HG3     3.50
         HA     61 ARG+ HD2     5.50
         HA     61 ARG+ HD3     5.50
         HA     61 ARG+ HE      5.50
         HA     62 SER  HN      2.50
         HA     62 SER  HA      4.20
         QB     61 ARG+ HE      5.60
         QB     62 SER  HA      6.50
         QB     79 PHE  QD      8.50
         HG2    62 SER  HN      4.40
         HG3    62 SER  HN      4.40
         QG     62 SER  HA      6.38
         QG     79 PHE  QD      7.98
 62 SER  
         HN     62 SER  HB2     4.20
         HN     62 SER  HB3     3.70
         HA     62 SER  HB2     2.80
         HA     62 SER  HB3     2.90
         HA     63 THR  HN      2.50
         HA     79 PHE  QD      7.50
         HA     79 PHE  QE      6.20
         HB2    63 THR  HN      2.90
         HB3    63 THR  HN      3.50
 63 THR  
         HN     63 THR  HB      3.80
         HN     63 THR  QG2     4.40
         HN     77 THR  QG2     6.50
         HN     79 PHE  QD      7.50
         HN     79 PHE  QE      6.40
         HA     63 THR  HB      2.80
         HA     64 THR  HN      3.00
         HB     79 PHE  QD      7.00
         HB     79 PHE  QE      7.50
 64 THR  
         HN     64 THR  HB      3.50
         HA     65 MET  HN      2.60
         HB     65 MET  HN      4.60
         QG2    65 MET  HN      4.90
 65 MET  
         HN     65 MET  HB2     3.30
         HN     65 MET  HB3     3.30
         HN     65 MET  QB      3.08
         HN     65 MET  HG2     5.20
         HN     65 MET  HG3     5.20
         HN     65 MET  QG      4.98
         HA     66 CYSS HN      2.50
         HB2    66 CYSS HN      4.90
         HB3    66 CYSS HN      4.90
         HG2    66 CYSS HN      5.00
         HG3    66 CYSS HN      5.00
 66 CYSS 
         HN     66 CYSS HB2     3.20
         HN     66 CYSS HB3     4.10
         HA     66 CYSS HB3     2.80
         HA     67 CYSS HN      2.50
         HB2    67 CYSS HN      4.00
         HB3    67 CYSS HN      3.10
 67 CYSS 
         HN     67 CYSS HB2     3.00
         HN     67 CYSS HB3     3.10
         HA     67 CYSS HB2     2.80
         HA     68 PRO  HD2     2.70
         HA     68 PRO  HD3     2.40
         HA     71 THR  QG2     6.50
 68 PRO  
         HA     69 ALA  HN      2.40
         HA     69 ALA  QB      5.40
         HB3    69 ALA  HN      3.10
         HD2    71 THR  QG2     4.10
         HD3    71 THR  QG2     5.10
 69 ALA  
         HN     69 ALA  QB      3.40
         HA     70 ASN  HN      2.50
         QB     70 ASN  HD21    6.30
         QB     70 ASN  HD22    6.30
         QB     70 ASN  QD2     6.09
 70 ASN  
         HN     70 ASN  QB      3.91
         HN     71 THR  HN      3.20
         HA     70 ASN  HB2     3.00
         HA     70 ASN  HB3     3.00
         HA     71 THR  HN      3.10
 71 THR  
         HN     71 THR  HB      3.20
         QG2    72 CYSS HN      4.60
         QG2    72 CYSS HA      6.50
         QG2    73 CYSS HN      6.50
 72 CYSS 
         HN     72 CYSS HB2     3.20
         HN     72 CYSS HB3     3.10
         HA     72 CYSS HB2     2.80
         HA     73 CYSS HN      2.40
         HB2    73 CYSS HN      4.20
         HB3    73 CYSS HN      4.40
 73 CYSS 
         HN     73 CYSS HB2     3.00
         HN     73 CYSS HB3     3.60
         HA     73 CYSS HB2     3.00
         HA     73 CYSS HB3     2.70
         HA     74 ASN  HN      2.50
         HA     75 ILE  QD1     5.50
 74 ASN  
         HN     74 ASN  QB      3.60
         HA     75 ILE  HN      2.50
         HA     75 ILE  HB      4.30
         HA     75 ILE  QG1     6.38
         QD2    75 ILE  HN      6.50
 75 ILE  
         HN     75 ILE  HB      2.80
         HN     75 ILE  HG12    4.70
         HN     75 ILE  HG13    4.70
         HN     75 ILE  QG1     3.88
         HN     75 ILE  QD1     6.10
         HA     75 ILE  QG2     3.40
         HA     75 ILE  HG12    3.90
         HA     75 ILE  HG13    3.90
         HA     75 ILE  QG1     3.50
         HA     76 ASN  HN      2.60
         HB     75 ILE  QG1     2.59
         QG2    76 ASN  HN      6.00
 76 ASN  
         HA     76 ASN  HD21    5.50
         HA     77 THR  HN      2.40
 77 THR  
         HN     77 THR  QG2     4.30
         HA     77 THR  HB      2.80
         HA     78 GLY  HN      3.30
         HA     79 PHE  HN      5.00
         HB     78 GLY  HN      4.70
         HB     79 PHE  HN      3.60
         HB     79 PHE  QD      5.70
         HB     79 PHE  QE      7.50
         QG2    78 GLY  HN      6.50
         QG2    79 PHE  HN      6.50
         QG2    79 PHE  QD      7.80
         QG2    79 PHE  QE      8.50
 78 GLY  
         HN     79 PHE  HN      2.90
         QA     79 PHE  QD      8.38
 79 PHE  
         HN     79 PHE  HB2     3.60
         HN     79 PHE  HB3     3.60
         HA     79 PHE  HB2     2.70
         HA     79 PHE  HB3     2.70
         HA     80 TYR  HN      2.70
         HA     80 TYR  HA      4.10
         HB2    80 TYR  HN      2.80
         HB3    80 TYR  HN      3.50
         QD     80 TYR  HA      7.50
         QD     81 ILE  HA      6.00
         QD     81 ILE  HB      7.50
         QD     81 ILE  QD1     6.40
         QD     82 ARG+ HN      7.50
         QE     81 ILE  QD1     8.50
 80 TYR  
         HN     80 TYR  HB2     2.70
         HN     80 TYR  HB3     2.80
         HA     80 TYR  HB2     2.90
         HA     81 ILE  HN      2.50
         HB2    81 ILE  HN      4.10
         HB3    81 ILE  HN      4.10
         QD     82 ARG+ HA      7.50
 81 ILE  
         HN     81 ILE  HB      3.60
         HN     81 ILE  HG12    3.30
         HN     81 ILE  HG13    3.30
         HN     81 ILE  QG1     2.84
         HN     81 ILE  QD1     3.90
         HN     82 ARG+ HN      5.50
         HA     81 ILE  HB      2.70
         HA     81 ILE  QD1     4.10
         HA     82 ARG+ HN      2.70
         HB     81 ILE  HG12    2.90
         HB     81 ILE  HG13    2.90
         HB     81 ILE  QG1     2.51
         HB     82 ARG+ HN      3.20
 82 ARG+ 
         HN     82 ARG+ QB      3.80
         HN     82 ARG+ HG2     5.10
         HN     82 ARG+ HG3     5.10
         HN     82 ARG+ QG      4.78
         HN     82 ARG+ QD      6.38
         HN     83 SER  HN      2.70
         HA     82 ARG+ HG2     3.70
         HA     82 ARG+ HG3     3.70
         HA     82 ARG+ QG      3.03
         HA     82 ARG+ QD      5.68
         HA     83 SER  HN      3.60
         QB     82 ARG+ HE      5.40
         QB     83 SER  HN      4.20
         HG2    82 ARG+ HE      4.20
         HG3    82 ARG+ HE      4.20
         QG     82 ARG+ HE      3.91
         QG     83 SER  HN      4.88
         QD     83 SER  HN      5.98
 83 SER  
         HN     83 SER  HG      4.60
         HA     83 SER  HB2     2.90
         HA     83 SER  HB3     2.70
         HA     83 SER  HG      4.00
         HA     84 TYR  HN      2.80
         HA     84 TYR  QD      7.50
         HB2    84 TYR  HN      3.20
         HB3    84 TYR  HN      4.10
 84 TYR  
         HN     84 TYR  HB2     4.00
         HN     84 TYR  QE      6.50
         HA     84 TYR  HB2     2.70
         HA     84 TYR  HB3     2.70
         HA     85 ARG+ HN      2.70
         HA     85 ARG+ QB      5.48
         HB2    85 ARG+ HN      3.30
         HB3    85 ARG+ HN      4.00
         QD     85 ARG+ HN      6.70
         QE     85 ARG+ HN      7.50
 85 ARG+ 
         HN     85 ARG+ HB2     3.40
         HN     85 ARG+ HB3     3.40
         HN     85 ARG+ QG      5.28
         HN     85 ARG+ QD      4.68
         HA     86 ARG+ HN      2.60
         QB     85 ARG+ HE      4.28
         QB     86 ARG+ HN      4.38
 86 ARG+ 
         HN     86 ARG+ QB      3.50
         HA     87 VAL  HN      2.50
 87 VAL  
         HN     87 VAL  QG2     3.70
         HA     87 VAL  HB      2.70
         QG1    88 GLU- HN      6.50
         QG2    88 GLU- HN      5.00
 88 GLU- 
         HN     88 GLU- QB      3.63
         HN     88 GLU- HG2     5.50
         HN     88 GLU- HG3     5.50
  8 CYSS SG     18 CYSS SG      2.10
  8 CYSS SG     18 CYSS CB      3.10
  8 CYSS CB     18 CYSS SG      3.10
 11 CYSS SG     72 CYSS SG      2.10
 11 CYSS SG     72 CYSS CB      3.10
 11 CYSS CB     72 CYSS SG      3.10
 27 CYSS SG     58 CYSS SG      2.10
 27 CYSS SG     58 CYSS CB      3.10
 27 CYSS CB     58 CYSS SG      3.10
 49 CYSS SG     66 CYSS SG      2.10
 49 CYSS SG     66 CYSS CB      3.10
 49 CYSS CB     66 CYSS SG      3.10
 67 CYSS SG     73 CYSS SG      2.10
 67 CYSS SG     73 CYSS CB      3.10
 67 CYSS CB     73 CYSS SG      3.10




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