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
5395 1hdj cing 1-original 1 DYANA/DIANA distance general distance simple


  0 MET  
         HA      2 LYS+ HN      3.20
  2 LYS+ 
         HN      2 LYS+ HB2     3.50
         HN      2 LYS+ HB3     3.50
         HA      3 ASP- HN      3.30
         QB      3 ASP- HN      4.48
         QE      4 TYR  CZ      8.00
  3 ASP- 
         HN      3 ASP- HB2     3.70
         HN      3 ASP- HB3     3.70
         HA      4 TYR  HN      3.50
         HA     63 PHE  CZ      7.00
         HA     63 PHE  HZ      4.50
         QB      6 GLN  HN      5.88
  4 TYR  
         HN      4 TYR  HB2     3.80
         HN      4 TYR  HB3     4.10
         HA      4 TYR  HB3     3.00
         HA      7 THR  HN      3.80
         HA      7 THR  QG2     6.00
         HA     50 ALA  HA      3.80
         HB2     5 TYR  HN      4.60
         HB2    54 LEU  QD1     5.80
         HB2    54 LEU  QD2     5.80
         HB2    54 LEU  QQD     5.43
         HB3     5 TYR  HN      5.00
         HB3     5 TYR  CG      7.00
         HB3    54 LEU  QD1     6.00
         HB3    54 LEU  QD2     6.00
         HB3    54 LEU  QQD     5.49
         CG      5 TYR  HN      6.70
         CG      5 TYR  QB      7.88
         CG      7 THR  HB      7.00
         CG      7 THR  QG2     8.00
         CG     50 ALA  HN      7.00
         CG     50 ALA  HA      6.50
         CG     50 ALA  QB      6.50
         CG     53 VAL  HB      7.00
         CG     53 VAL  QG1     8.00
         CG     53 VAL  QG2     8.00
         CG     54 LEU  QD1     8.00
         CG     54 LEU  QD2     8.00
         CG     63 PHE  QB      8.00
         CG     63 PHE  CG      9.00
         CG     63 PHE  CZ      9.00
         CG     63 PHE  HZ      7.00
         CZ     49 GLU- HB2     7.00
         CZ     49 GLU- HB3     5.90
         CZ     49 GLU- QG      8.00
         CZ     50 ALA  HA      7.00
         CZ     50 ALA  QB      7.80
         CZ     53 VAL  QG1     7.70
         CZ     53 VAL  QG2     7.70
         CZ     63 PHE  QB      8.00
         CZ     63 PHE  CG      9.00
         CZ     63 PHE  CZ      9.00
         CZ     71 LEU  QD1     8.00
         CZ     71 LEU  QD2     8.00
         CZ     71 LEU  QQD     7.59
  5 TYR  
         HN      5 TYR  HB2     3.40
         HN      5 TYR  HB3     3.40
         HN     54 LEU  QD1     6.00
         HN     54 LEU  QD2     6.00
         HA      5 TYR  CZ      5.60
         HA     10 LEU  HN      4.60
         HA     10 LEU  QB      6.00
         HA     19 ILE  QD1     6.00
         HA     54 LEU  QD1     6.00
         HA     54 LEU  QD2     6.00
         HA     54 LEU  QQD     5.02
         HB2     6 GLN  HN      3.60
         HB2    54 LEU  QD1     9.14
         HB2    54 LEU  QD2     9.14
         HB3     6 GLN  HN      3.60
         HB3    54 LEU  QD1     9.14
         HB3    54 LEU  QD2     9.14
         QB     11 ALA  HN      5.88
         QB     54 LEU  QQD     7.52
         CG     10 LEU  QB      7.10
         CG     10 LEU  QD1     7.20
         CG     11 ALA  HN      7.00
         CG     12 ARG+ HA      7.00
         CG     12 ARG+ QB      8.00
         CG     14 ALA  QB      7.80
         CG     54 LEU  QD1     8.00
         CG     54 LEU  QD2     8.00
         CG     63 PHE  CZ      8.70
         CG     63 PHE  HZ      7.00
         CZ     10 LEU  QB      8.00
         CZ     10 LEU  QD1     8.00
         CZ     12 ARG+ HA      6.90
         CZ     12 ARG+ QB      8.00
         CZ     12 ARG+ QG      8.00
         CZ     14 ALA  QB      8.00
         CZ     19 ILE  QD1     8.00
         CZ     54 LEU  QD1     8.00
         CZ     54 LEU  QD2     8.00
         CZ     63 PHE  CG      9.00
         CZ     63 PHE  CZ      8.90
         CZ     63 PHE  HZ      7.00
         CZ     64 ASP- HA      7.00
  6 GLN  
         HN      6 GLN  HB2     3.10
         HN      6 GLN  HB3     3.40
         HN      6 GLN  QG      5.88
         HN      7 THR  HN      3.30
         HA      6 GLN  HB2     2.80
         HA      6 GLN  HB3     3.00
         HA      6 GLN  HG2     4.10
         HA      6 GLN  HG3     4.10
         HA      9 GLY  HN      3.80
         HA     10 LEU  HN      3.80
         HA     10 LEU  QD1     6.00
         HB2     7 THR  HN      3.90
         HB3     7 THR  HN      3.90
  7 THR  
         HN      7 THR  HB      3.10
         HN      8 LEU  HN      3.80
         HA      7 THR  QG2     3.70
         HA      8 LEU  HN      3.40
         HA      9 GLY  HN      3.80
         HA     50 ALA  QB      6.00
         HB      8 LEU  HN      3.10
         HB      8 LEU  QQD     7.57
         HB     50 ALA  QB      4.30
         QG2     8 LEU  HN      6.00
         QG2     8 LEU  HA      6.00
         QG2    46 GLU- HB2     6.00
         QG2    46 GLU- HB3     5.70
         QG2    46 GLU- HG2     6.00
         QG2    47 ILE  HN      6.00
         QG2    47 ILE  HA      4.60
         QG2    50 ALA  HN      6.00
  8 LEU  
         HN      8 LEU  HB2     3.00
         HN      8 LEU  HB3     3.00
         HN      8 LEU  HG      4.70
         HN      8 LEU  QD1     5.50
         HN      8 LEU  QD2     5.50
         HN      8 LEU  QQD     4.97
         HN      9 GLY  HN      3.20
         HN     10 LEU  HN      4.80
         HA      8 LEU  HB2     3.00
         HA      8 LEU  HB3     3.00
         HA      8 LEU  QD1     4.60
         HA      8 LEU  QD2     4.60
         HA     26 GLN  HB3     4.90
         HA     26 GLN  QG      4.38
         HA     26 GLN  HE21    5.00
         HA     26 GLN  HE22    5.00
         HA     47 ILE  QG1     5.88
         HA     50 ALA  QB      6.00
         HB2    54 LEU  QD1     6.85
         HB2    54 LEU  QD2     6.85
         HB3    54 LEU  QD1     6.85
         HB3    54 LEU  QD2     6.85
         QB      9 GLY  HN      4.78
         QB     54 LEU  QQD     5.75
         QD1    23 TYR  HN      6.00
         QD1    23 TYR  HB2     5.80
         QD1    23 TYR  HB3     6.00
         QD1    23 TYR  CG      7.50
         QD1    26 GLN  HN      6.00
         QD1    26 GLN  HB3     6.00
         QD1    26 GLN  HG2     7.75
         QD1    26 GLN  HG3     7.75
         QD1    51 TYR  CZ      8.00
         QD1    54 LEU  QD1    10.14
         QD1    54 LEU  QD2    10.14
         QD2    23 TYR  HN      6.00
         QD2    23 TYR  HB2     5.80
         QD2    23 TYR  HB3     6.00
         QD2    23 TYR  CG      7.50
         QD2    26 GLN  HN      6.00
         QD2    26 GLN  HB3     6.00
         QD2    26 GLN  HG2     7.75
         QD2    26 GLN  HG3     7.75
         QD2    51 TYR  CZ      8.00
         QD2    54 LEU  QD1    10.14
         QD2    54 LEU  QD2    10.14
         QQD     9 GLY  HN      7.57
         QQD    23 TYR  HN      5.20
         QQD    23 TYR  HB3     5.49
         QQD    23 TYR  CG      6.75
         QQD    26 GLN  HA      7.57
         QQD    26 GLN  HB3     5.34
         QQD    26 GLN  QG      6.54
         QQD    26 GLN  HE21    7.57
         QQD    47 ILE  HA      5.87
         QQD    51 TYR  HN      7.57
         QQD    51 TYR  HB2     7.57
         QQD    51 TYR  CZ      7.35
         QQD    54 LEU  QQD     7.39
  9 GLY  
         HN     10 LEU  HN      2.70
 10 LEU  
         HN     10 LEU  QB      3.50
         HN     10 LEU  HG      4.70
         HN     10 LEU  QD1     5.30
         HN     10 LEU  QD2     5.40
         HA     10 LEU  HG      3.70
         HA     10 LEU  QD1     4.90
         HA     10 LEU  QD2     3.80
         HA     11 ALA  QB      6.00
         HA     14 ALA  QB      6.00
         QD1    19 ILE  HA      4.60
         QD1    22 ALA  HA      6.00
         QD2    18 GLU- HB2     5.80
         QD2    18 GLU- QG      6.88
 11 ALA  
         HN     14 ALA  QB      5.10
         HA     12 ARG+ HN      2.50
         HA     12 ARG+ QB      5.30
         HA     12 ARG+ HD2     5.00
         HA     12 ARG+ HD3     5.00
         HA     12 ARG+ QD      4.44
         QB     12 ARG+ HN      3.80
         QB     13 GLY  HN      5.60
         QB     14 ALA  HN      6.00
 12 ARG+ 
         HN     12 ARG+ QB      3.50
         HN     12 ARG+ QG      6.00
         HN     12 ARG+ HD2     5.00
         HN     12 ARG+ HD3     5.00
         HA     13 GLY  HN      2.60
         HA     14 ALA  HN      4.10
         QB     12 ARG+ HE      6.00
         QB     13 GLY  HN      4.50
         QG     13 GLY  HN      6.00
 13 GLY  
         HN     14 ALA  HN      3.20
 14 ALA  
         HN     14 ALA  QB      3.50
         HN     15 SER  HN      4.60
         HA     15 SER  HN      2.60
         HA     18 GLU- HB2     4.00
         QB     19 ILE  HN      6.00
 15 SER  
         HN     15 SER  HB2     4.00
         HN     18 GLU- HN      4.40
         HN     18 GLU- HB2     3.20
         HN     18 GLU- HB3     3.80
         HN     18 GLU- HG2     5.00
         HN     18 GLU- HG3     5.00
         HN     18 GLU- QG      4.53
         HA     15 SER  HB2     2.80
         HA     15 SER  HB3     2.90
         HA     16 ASP- HA      4.10
         HB2    16 ASP- HN      3.60
         HB2    17 GLU- HN      3.90
         HB3    16 ASP- HN      4.70
 16 ASP- 
         HN     16 ASP- QB      3.70
         HN     17 GLU- HN      3.30
         HN     19 ILE  QD1     6.00
         HA     18 GLU- HN      4.40
         HA     19 ILE  HN      3.60
         HA     19 ILE  HB      3.30
         HA     19 ILE  QD1     4.50
         HA     20 LYS+ HN      4.10
         QB     17 GLU- HN      4.40
 17 GLU- 
         HN     17 GLU- HB2     3.10
         HN     17 GLU- HB3     3.10
         HN     17 GLU- QG      6.00
         HN     18 GLU- HN      3.40
         HN     18 GLU- HB2     4.20
         HA     17 GLU- HB2     3.00
         HA     17 GLU- HB3     3.00
         HA     21 ARG+ QB      5.08
 18 GLU- 
         HN     18 GLU- HB2     2.80
         HN     18 GLU- HB3     3.00
         HN     18 GLU- HG2     4.60
         HN     18 GLU- HG3     4.60
         HN     18 GLU- QG      4.22
         HN     19 ILE  HN      2.90
         HN     19 ILE  HA      4.70
         HN     19 ILE  QD1     6.00
         HN     21 ARG+ HN      5.00
         HA     18 GLU- HB2     2.90
         HA     18 GLU- HB3     3.00
         HB2    19 ILE  HN      3.30
 19 ILE  
         HN     19 ILE  HB      2.70
         HN     19 ILE  QG1     4.10
         HN     19 ILE  QD1     4.70
         HN     20 LYS+ HN      2.90
         HA     19 ILE  QG1     4.00
         HA     19 ILE  QD1     4.30
         HA     21 ARG+ HN      5.00
         HA     22 ALA  HN      4.90
         QG2    20 LYS+ HN      6.00
         QG2    20 LYS+ HA      5.50
         QG2    23 TYR  CZ      7.10
         QG2    55 SER  HN      6.00
         QG2    55 SER  HA      5.00
         QG2    55 SER  HB2     6.00
         QG2    55 SER  HB3     6.00
         QD1    54 LEU  HA      4.20
         QD1    54 LEU  QD1     7.00
         QD1    54 LEU  QD2     7.00
         QD1    54 LEU  QQD     6.28
         QD1    60 ARG+ HD2     6.00
         QD1    60 ARG+ HD3     6.00
         QD1    60 ARG+ QD      5.84
         QD1    60 ARG+ HE      6.00
         QD1    60 ARG+ QH2     7.00
 20 LYS+ 
         HN     20 LYS+ QB      3.50
         HN     20 LYS+ QG      4.38
         HN     21 ARG+ HN      2.90
         HN     23 TYR  CZ      7.00
         HA     20 LYS+ HG2     3.70
         HA     20 LYS+ HG3     3.70
         HA     23 TYR  HN      4.10
         HA     23 TYR  HB3     4.40
         HA     23 TYR  CZ      5.30
         QB     23 TYR  CZ      8.00
         HG2    23 TYR  CZ      7.00
         HG3    23 TYR  CZ      7.00
         QG     23 TYR  CZ      6.75
 21 ARG+ 
         HN     21 ARG+ HB2     3.20
         HN     21 ARG+ HB3     3.20
         HN     21 ARG+ QG      5.88
         HN     22 ALA  HN      2.90
         HN     22 ALA  QB      6.00
         HB2    22 ALA  HN      3.50
         HB3    22 ALA  HN      3.50
 22 ALA  
         HN     22 ALA  QB      3.40
         HA     25 ARG+ HN      3.80
         HA     26 GLN  HB2     4.70
 23 TYR  
         HN     23 TYR  HB2     3.00
         HN     23 TYR  HB3     3.00
         HN     23 TYR  CZ      6.00
         HN     24 ARG+ HN      3.50
         HA     26 GLN  HN      3.90
         HA     26 GLN  HB3     3.70
         HB2    24 ARG+ HN      4.30
         HB2    51 TYR  CZ      7.00
         HB3    24 ARG+ HN      3.40
         HB3    51 TYR  CZ      7.00
         CG     24 ARG+ HN      7.00
         CG     24 ARG+ HA      7.00
         CG     24 ARG+ QB      8.00
         CG     24 ARG+ QG      8.00
         CG     27 ALA  HN      7.00
         CG     27 ALA  QB      8.00
         CZ     55 SER  HA      7.00
         CZ     55 SER  HB2     7.00
         CZ     55 SER  HB3     6.00
 24 ARG+ 
         HN     24 ARG+ QB      3.50
         HN     24 ARG+ QG      5.60
         HN     25 ARG+ HN      2.80
         HA     27 ALA  HN      4.20
         HA     27 ALA  QB      4.80
         HA     28 LEU  QQD     7.40
         HA     51 TYR  CZ      7.00
         QB     51 TYR  CZ      8.00
         QG     51 TYR  CZ      8.00
 25 ARG+ 
         HN     25 ARG+ QB      3.50
         HN     25 ARG+ QG      5.10
         HN     26 GLN  HN      3.10
         HA     28 LEU  HN      4.20
         HA     28 LEU  QB      4.58
         HA     28 LEU  QQD     7.20
         QB     26 GLN  HN      4.30
 26 GLN  
         HN     26 GLN  HB2     2.70
         HN     26 GLN  HB3     3.70
         HN     26 GLN  HG2     5.00
         HN     26 GLN  HG3     5.00
         HN     26 GLN  QG      4.14
         HN     27 ALA  HN      3.10
         HN     27 ALA  QB      6.00
         HN     28 LEU  HN      5.00
         HA     26 GLN  HB2     3.00
         HA     26 GLN  HB3     3.00
         HA     26 GLN  HG2     3.70
         HA     26 GLN  HG3     3.70
         HA     27 ALA  HN      3.60
         HA     29 ARG+ HN      3.80
         HA     29 ARG+ HB2     3.10
         HA     29 ARG+ HB3     3.10
         HA     30 TYR  CG      7.00
         HA     30 TYR  CZ      7.00
         HA     47 ILE  QD1     6.00
         HB2    47 ILE  QG2     4.50
         HB3    27 ALA  HN      4.10
         HB3    30 TYR  CG      7.00
         HB3    30 TYR  CZ      7.00
         HB3    47 ILE  QG1     5.88
         HB3    47 ILE  QD1     4.70
         HG2    47 ILE  QD1     6.00
         HG3    47 ILE  QD1     6.00
         QG     47 ILE  QG1     6.75
         HE21   47 ILE  QD1     5.90
 27 ALA  
         HN     28 LEU  HN      3.00
         HN     29 ARG+ HN      4.70
         HN     47 ILE  QG2     6.00
         HN     47 ILE  QD1     6.00
         HA     30 TYR  HN      4.10
         HA     31 HIS  HN      5.00
         HA     44 PHE  CZ      6.80
         HA     47 ILE  HB      5.00
         HA     47 ILE  QG2     4.40
         QB     28 LEU  HN      4.40
         QB     28 LEU  HA      6.00
         QB     29 ARG+ HN      6.00
         QB     31 HIS  HD2     6.00
         QB     44 PHE  CG      8.00
         QB     44 PHE  CZ      7.50
         QB     51 TYR  CZ      7.90
 28 LEU  
         HN     28 LEU  HB2     3.10
         HN     28 LEU  HB3     3.10
         HN     28 LEU  QQD     8.40
         HA     28 LEU  HB2     3.00
         HA     28 LEU  HB3     3.00
         HA     31 HIS  HN      4.10
         HA     31 HIS  HB2     3.50
         HA     31 HIS  HB3     4.20
         HA     31 HIS  HD2     5.00
         QB     29 ARG+ HN      4.68
         QQD    31 HIS  HD2     7.40
 29 ARG+ 
         HN     29 ARG+ HB2     3.10
         HN     29 ARG+ HB3     3.10
         HN     29 ARG+ HG2     5.00
         HN     29 ARG+ HG3     4.20
         HN     30 TYR  HN      2.90
         HA     29 ARG+ HB2     3.00
         HA     29 ARG+ HB3     3.00
         HA     29 ARG+ HG2     4.10
         HA     29 ARG+ HG3     3.40
         HA     30 TYR  HN      3.60
         HB2    30 TYR  HN      4.10
         HB2    30 TYR  CZ      7.00
         HB3    30 TYR  HN      4.10
         HB3    30 TYR  CZ      7.00
         HG2    30 TYR  CZ      7.00
         QD     30 TYR  CZ      8.00
 30 TYR  
         HN     30 TYR  HB2     3.10
         HN     30 TYR  HB3     3.80
         HN     35 ASN  HD21    4.80
         HA     30 TYR  HB3     2.90
         HA     30 TYR  CZ      5.60
         HA     35 ASN  HB2     4.20
         HA     35 ASN  HB3     4.20
         HA     35 ASN  QB      3.96
         HA     35 ASN  HD21    5.00
         HA     40 ALA  QB      5.40
         HB2    31 HIS  HN      4.00
         HB2    47 ILE  QD1     6.00
         HB3    40 ALA  QB      6.00
         HB3    44 PHE  HN      5.00
         CG     35 ASN  HD21    7.00
         CG     40 ALA  HA      6.10
         CG     40 ALA  QB      7.00
         CG     43 LYS+ HB3     7.00
         CG     43 LYS+ QD      8.00
         CG     47 ILE  QD1     6.90
         CZ     40 ALA  HA      7.00
         CZ     40 ALA  QB      8.00
         CZ     43 LYS+ HB3     7.00
         CZ     43 LYS+ HG2     7.00
         CZ     43 LYS+ HG3     7.00
         CZ     43 LYS+ QD      8.00
         CZ     43 LYS+ QE      8.00
         CZ     47 ILE  QD1     8.00
 31 HIS  
         HN     31 HIS  HB2     2.90
         HN     31 HIS  HB3     3.10
         HA     31 HIS  HB2     3.00
         HA     31 HIS  HB3     3.00
         HA     31 HIS  HD2     5.00
         HA     32 PRO  QG      4.38
         HA     44 PHE  CG      7.00
         HA     44 PHE  CZ      7.00
         HB2    31 HIS  HD2     3.90
         HB2    44 PHE  CZ      7.00
         HB3    34 LYS+ HN      4.00
         HD2    34 LYS+ HB2     5.00
         HD2    44 PHE  CZ      6.80
         HE1    32 PRO  QG      5.88
         HE1    33 ASP- QB      5.40
 32 PRO  
         HG2    33 ASP- HN      5.00
         HG2    44 PHE  CZ      7.00
         HG3    33 ASP- HN      5.00
         HG3    44 PHE  CZ      7.00
         QD     33 ASP- HA      6.00
 33 ASP- 
         HN     34 LYS+ HN      3.40
         HA     34 LYS+ HN      3.50
 34 LYS+ 
         HN     34 LYS+ HB2     3.40
         HN     34 LYS+ HB3     2.90
         HN     34 LYS+ QD      6.00
         HN     35 ASN  HN      2.90
         HA     34 LYS+ HB2     3.00
         HA     34 LYS+ HB3     3.00
         HA     34 LYS+ QD      5.70
         HA     35 ASN  HN      3.60
         HB2    34 LYS+ QE      5.90
         HB3    34 LYS+ QE      5.80
         HB3    35 ASN  HN      3.50
         QG     35 ASN  HA      6.00
 35 ASN  
         HN     35 ASN  HB2     3.50
         HN     35 ASN  HB3     3.50
         HN     36 LYS+ HN      3.70
         HN     36 LYS+ HA      4.30
         QB     37 GLU- HA      5.28
         HD21   40 ALA  QB      6.00
         HD22   40 ALA  QB      6.00
 36 LYS+ 
         HN     36 LYS+ HB2     3.30
         HN     36 LYS+ HG2     5.00
         HN     36 LYS+ HG3     5.00
         HN     36 LYS+ QG      4.68
         HA     36 LYS+ HB2     2.90
         HA     36 LYS+ HB3     2.90
         HA     36 LYS+ HG2     4.20
         HA     36 LYS+ HG3     4.20
         HA     37 GLU- HN      3.50
 37 GLU- 
         HN     37 GLU- HB2     3.20
         HN     37 GLU- HB3     3.10
         HN     37 GLU- HG2     4.30
         HN     37 GLU- HG3     4.30
         HN     40 ALA  QB      5.70
         HA     37 GLU- HB2     2.70
         HA     38 PRO  HD2     3.30
         HA     38 PRO  HD3     2.90
         HA     40 ALA  QB      5.40
 38 PRO  
         HA     39 GLY  HN      2.90
         HB3    39 GLY  HN      4.00
 39 GLY  
         HN     40 ALA  HN      3.40
         HN     41 GLU- HN      4.50
 40 ALA  
         HN     40 ALA  HA      2.90
         HN     40 ALA  QB      3.60
         HN     41 GLU- HN      3.30
         HA     43 LYS+ HB3     3.20
         HA     43 LYS+ HG2     5.00
         HA     43 LYS+ HG3     5.00
         HA     43 LYS+ QD      6.00
         QB     42 GLU- HN      6.00
 41 GLU- 
         HN     41 GLU- HB2     3.00
         HN     41 GLU- HB3     2.70
         HN     41 GLU- HG2     5.00
         HN     41 GLU- HG3     5.00
         HN     42 GLU- HN      3.00
         HN     43 LYS+ HN      4.50
         HA     41 GLU- HB2     2.80
         HA     42 GLU- HN      3.50
         HA     44 PHE  HN      3.90
 42 GLU- 
         HN     42 GLU- HB2     2.80
         HN     42 GLU- HB3     2.80
         HN     42 GLU- HG2     4.80
         HN     42 GLU- HG3     4.80
         HN     43 LYS+ HN      3.00
         HN     44 PHE  HN      4.60
         HA     42 GLU- HG2     3.70
         HA     42 GLU- HG3     3.70
         HA     43 LYS+ HN      3.50
         HA     45 LYS+ HN      4.40
         HA     45 LYS+ QG      5.20
 43 LYS+ 
         HN     43 LYS+ HA      2.70
         HN     43 LYS+ HB2     2.60
         HN     43 LYS+ HB3     3.20
         HN     43 LYS+ HG2     4.90
         HN     43 LYS+ HG3     4.90
         HN     43 LYS+ QG      4.53
         HN     43 LYS+ QD      6.00
         HN     44 PHE  HN      3.00
         HA     43 LYS+ HB3     3.00
         HA     43 LYS+ QD      5.50
         HA     46 GLU- HN      4.40
         HB2    44 PHE  HN      3.30
         HB3    44 PHE  HN      3.50
 44 PHE  
         HN     44 PHE  HB2     2.90
         HN     44 PHE  HB3     3.00
         HN     45 LYS+ HN      3.20
         HA     44 PHE  HB2     3.00
         HA     47 ILE  QD1     4.50
         HB2    45 LYS+ HN      3.80
         HB3    45 LYS+ HN      3.20
         CG     45 LYS+ HN      7.00
         CG     45 LYS+ HA      7.00
         CG     47 ILE  HB      7.00
         CG     48 ALA  QB      8.00
         CZ     45 LYS+ HA      7.00
         CZ     47 ILE  QG2     8.00
         CZ     47 ILE  QD1     8.00
         CZ     48 ALA  QB      8.00
         CZ     51 TYR  CZ      9.00
 45 LYS+ 
         HN     45 LYS+ HA      2.80
         HN     45 LYS+ QB      3.70
         HN     45 LYS+ QG      4.60
         HN     46 GLU- HN      2.80
 46 GLU- 
         HN     46 GLU- HB2     2.90
         HN     46 GLU- HB3     3.10
         HN     46 GLU- HG2     3.90
         HN     46 GLU- HG3     4.00
         HN     47 ILE  HN      2.70
         HA     46 GLU- HB2     2.70
         HA     46 GLU- HG2     3.60
         HA     46 GLU- HG3     4.20
         HA     49 GLU- HN      3.80
         HB2    47 ILE  HN      3.30
         HB3    47 ILE  HN      3.30
         HG2    47 ILE  HN      5.00
 47 ILE  
         HN     47 ILE  HB      2.50
         HN     47 ILE  QG2     4.70
         HN     47 ILE  HG12    3.70
         HN     47 ILE  HG13    3.70
         HN     47 ILE  QG1     3.39
         HN     47 ILE  QD1     5.40
         HA     47 ILE  HG12    3.70
         HA     47 ILE  HG13    3.70
         HA     47 ILE  QD1     4.40
         HA     50 ALA  HN      3.60
         HA     50 ALA  QB      4.10
         HA     51 TYR  HN      4.30
         QG2    51 TYR  HN      6.00
         QG2    51 TYR  HB2     6.00
         QD1    51 TYR  CZ      8.00
 48 ALA  
         HN     48 ALA  HA      2.90
         HN     48 ALA  QB      3.60
         HN     49 GLU- HN      2.70
         HA     51 TYR  HB2     4.00
         HA     51 TYR  HB3     4.00
         HA     51 TYR  CZ      5.50
         HA     52 ASP- HN      4.00
         QB     49 GLU- HN      4.30
         QB     51 TYR  CZ      8.00
 49 GLU- 
         HN     49 GLU- HB2     2.80
         HN     49 GLU- HB3     3.20
         HN     49 GLU- QG      6.00
         HN     51 TYR  HN      3.70
         HA     49 GLU- HB2     2.80
         HA     49 GLU- HB3     3.00
         HA     52 ASP- HN      3.80
         HA     52 ASP- HB2     4.00
         HA     52 ASP- HB3     4.00
         QG     53 VAL  QG2     7.00
 50 ALA  
         HN     50 ALA  QB      3.60
         HN     51 TYR  HN      3.10
         HA     53 VAL  QG2     6.00
         QB     51 TYR  HN      4.40
         QB     54 LEU  QQD     8.57
 51 TYR  
         HN     51 TYR  HB2     2.40
         HN     51 TYR  HB3     2.80
         HA     51 TYR  HB2     3.00
         CG     52 ASP- HA      7.00
 52 ASP- 
         HN     52 ASP- HB2     2.90
         HN     52 ASP- HB3     3.00
         HN     53 VAL  HN      3.40
         HN     53 VAL  QG2     6.00
         HA     52 ASP- HB2     2.90
         HA     52 ASP- HB3     3.00
         HA     55 SER  HN      5.00
         HB2    53 VAL  HN      3.70
         HB2    53 VAL  QG2     6.00
         HB3    53 VAL  HN      3.40
         HB3    53 VAL  QG2     6.00
 53 VAL  
         HN     53 VAL  HB      2.80
         HN     53 VAL  QG2     4.30
         HN     54 LEU  HN      3.00
         HA     56 ASP- HN      5.00
         HB     54 LEU  HN      3.10
         QG1    54 LEU  HN      5.60
         QG1    54 LEU  HB3     6.00
         QG1    59 LYS+ HB3     6.00
         QG1    59 LYS+ HG2     6.00
         QG1    59 LYS+ HG3     6.00
         QG1    60 ARG+ HN      6.00
         QG1    60 ARG+ HA      4.40
         QG1    63 PHE  HN      6.00
         QG1    63 PHE  QB      6.00
         QG1    63 PHE  CG      8.00
         QG1    71 LEU  QQD     7.77
         QG2    54 LEU  HN      6.00
         QG2    59 LYS+ HB2     6.00
         QG2    59 LYS+ HB3     6.00
         QG2    59 LYS+ QG      6.88
         QG2    60 ARG+ QD      6.88
         QG2    71 LEU  QQD     7.97
 54 LEU  
         HN     54 LEU  HB2     3.20
         HN     54 LEU  HB3     3.40
         HN     54 LEU  HG      4.40
         HN     54 LEU  QD1     6.00
         HN     54 LEU  QD2     6.00
         HN     54 LEU  QQD     5.34
         HN     55 SER  HN      3.20
         HA     54 LEU  HB3     3.00
         HA     54 LEU  HG      3.30
         HA     54 LEU  QD1     5.40
         HA     54 LEU  QD2     5.40
         HA     56 ASP- HN      5.00
         HB2    55 SER  HN      4.30
         QD1    60 ARG+ HD2     9.14
         QD1    60 ARG+ HD3     9.14
         QD1    63 PHE  CZ      8.00
         QD2    60 ARG+ HD2     9.14
         QD2    60 ARG+ HD3     9.14
         QD2    63 PHE  CZ      8.00
         QQD    60 ARG+ HG2     7.57
         QQD    60 ARG+ HG3     7.57
         QQD    60 ARG+ QD      7.42
         QQD    60 ARG+ HE      7.57
         QQD    63 PHE  CG      9.27
 55 SER  
         HN     55 SER  HB2     4.20
         HN     55 SER  HB3     3.50
         HN     56 ASP- HN      3.20
         HA     55 SER  HB2     2.80
         HA     55 SER  HB3     2.90
 56 ASP- 
         HN     56 ASP- HB2     3.10
         HN     56 ASP- HB3     2.90
         HA     56 ASP- HB2     2.80
         HA     57 PRO  HA      4.60
         HA     57 PRO  QB      5.68
         HA     57 PRO  HD2     2.70
         HA     57 PRO  HD3     2.70
         HA     58 ARG+ HN      5.00
         HB2    59 LYS+ HN      5.00
 57 PRO  
         HA     60 ARG+ HN      3.90
         HA     60 ARG+ QB      4.60
         HA     60 ARG+ QD      5.88
         QB     58 ARG+ QD      6.35
 58 ARG+ 
         HN     58 ARG+ QB      3.50
         HN     58 ARG+ HG2     4.80
         HN     58 ARG+ HG3     4.80
         HN     58 ARG+ QG      4.57
         HN     59 LYS+ HN      3.20
         HN     60 ARG+ HN      5.00
         HA     58 ARG+ HG2     3.70
         HA     58 ARG+ HG3     3.70
         HA     58 ARG+ HD2     5.00
         HA     58 ARG+ HD3     5.00
         HA     61 GLU- HN      3.70
         HA     61 GLU- HB2     3.90
         HA     61 GLU- HB3     3.90
         HA     61 GLU- HG2     5.00
         HA     61 GLU- HG3     5.00
 59 LYS+ 
         HN     59 LYS+ HB2     2.70
         HN     59 LYS+ HB3     3.20
         HN     59 LYS+ QG      4.68
         HN     59 LYS+ QE      6.00
         HN     60 ARG+ HN      3.10
         HA     59 LYS+ HB2     2.60
         HA     62 ILE  HN      4.50
         HB3    60 ARG+ HN      3.40
         QE     60 ARG+ HN      6.00
 60 ARG+ 
         HN     60 ARG+ QB      3.80
         HN     60 ARG+ HG2     5.00
         HN     60 ARG+ HG3     3.70
         HN     61 GLU- HN      3.10
         HA     60 ARG+ HG2     3.20
         HA     60 ARG+ HG3     2.70
         HA     60 ARG+ HD2     4.70
         HA     60 ARG+ HD3     4.70
         HA     60 ARG+ QD      4.37
         HA     60 ARG+ HE      5.00
         HA     61 GLU- HN      3.60
         HA     63 PHE  HN      4.30
         HA     63 PHE  QB      4.30
         HA     63 PHE  CG      7.00
         HA     64 ASP- HN      4.90
         QB     60 ARG+ HE      5.30
         HG2    60 ARG+ HE      3.60
         HG3    60 ARG+ HE      3.70
 61 GLU- 
         HN     61 GLU- HB2     2.80
         HN     61 GLU- HB3     2.80
         HN     61 GLU- HG2     5.00
         HN     61 GLU- HG3     5.00
         HN     62 ILE  HN      3.00
         HN     64 ASP- HN      4.90
         HA     64 ASP- HN      3.60
         HA     64 ASP- HB2     3.40
         HA     64 ASP- HB3     3.40
         HA     64 ASP- QB      3.18
         HB2    62 ILE  HN      3.80
         HB3    62 ILE  HN      3.40
         HG2    62 ILE  HN      5.00
         HG3    62 ILE  HN      5.00
 62 ILE  
         HN     62 ILE  HB      2.80
         HN     62 ILE  HG12    3.30
         HN     62 ILE  HG13    3.30
         HN     62 ILE  QG1     3.08
         HN     62 ILE  QD1     5.50
         HN     63 PHE  HN      3.40
         HA     62 ILE  HG12    3.30
         HA     62 ILE  HG13    3.30
         HA     62 ILE  QD1     4.60
         HA     65 ARG+ HB2     4.90
         HA     65 ARG+ HB3     3.70
         HA     66 TYR  CG      6.00
         HA     66 TYR  CZ      7.00
         HB     63 PHE  HN      3.30
         HB     71 LEU  QQD     6.07
         QG2    63 PHE  HN      6.00
         QG2    66 TYR  HB3     6.00
         QG2    66 TYR  CG      6.70
         QG2    66 TYR  CZ      8.00
         QG2    70 GLY  QA      6.58
         QG2    71 LEU  HN      5.70
         QG2    71 LEU  HA      4.40
         QD1    63 PHE  HN      6.00
         QD1    66 TYR  CG      8.00
         QD1    66 TYR  CZ      8.00
         QD1    71 LEU  HA      6.00
 63 PHE  
         HN     63 PHE  QB      3.80
         HN     64 ASP- HN      3.70
         HN     71 LEU  QQD     7.57
         HA     66 TYR  HB2     3.80
         HA     71 LEU  QQD     7.57
         QB     64 ASP- HN      4.40
         QB     71 LEU  QD1     7.00
         QB     71 LEU  QD2     7.00
         CG     64 ASP- HN      7.00
         CG     64 ASP- HA      7.00
         CG     67 GLY  HA1     7.00
         CG     67 GLY  HA2     7.00
         CG     67 GLY  QA      6.55
         CG     68 GLU- HN      7.00
         CG     68 GLU- HA      6.70
         CG     71 LEU  HB2     7.00
         CG     71 LEU  QD1     8.00
         CG     71 LEU  QD2     8.00
         CZ     67 GLY  HA1     7.00
         CZ     67 GLY  HA2     7.00
         CZ     68 GLU- HN      7.00
         CZ     68 GLU- HA      7.00
         CZ     68 GLU- QB      7.88
         CZ     71 LEU  QQD     9.57
 64 ASP- 
         HN     64 ASP- HB2     3.40
         HN     64 ASP- HB3     3.40
         HN     65 ARG+ HN      3.40
         QB     65 ARG+ HA      5.88
 65 ARG+ 
         HN     65 ARG+ HB2     3.40
         HN     65 ARG+ HB3     3.30
         HN     65 ARG+ HG2     5.00
         HN     65 ARG+ HG3     5.00
         HN     65 ARG+ QG      4.82
         HN     66 TYR  HN      3.40
         HA     65 ARG+ HB2     2.90
         HA     65 ARG+ HB3     2.90
         HA     65 ARG+ HG2     3.90
         HA     65 ARG+ HG3     3.90
         HA     65 ARG+ QD      5.80
         HB2    66 TYR  HN      3.80
         HB2    66 TYR  CG      7.00
         HB2    66 TYR  CZ      7.00
         HB3    66 TYR  HN      4.00
         HB3    66 TYR  CG      7.00
         HB3    66 TYR  CZ      7.00
         QG     66 TYR  HN      5.88
         QG     66 TYR  HB3     5.88
         QG     66 TYR  CG      7.88
         QG     66 TYR  CZ      7.88
         QD     66 TYR  CZ      8.00
 66 TYR  
         HN     66 TYR  HB2     3.40
         HN     66 TYR  HB3     4.10
         HN     67 GLY  HN      3.00
         HA     66 TYR  HB3     2.90
         HA     66 TYR  CZ      5.60
         HB2    70 GLY  HN      4.10
         HB2    70 GLY  HA1     3.40
         HB2    70 GLY  HA2     3.40
         HB2    70 GLY  QA      3.13
         HB3    70 GLY  HN      4.60
         HB3    70 GLY  HA1     3.70
         HB3    70 GLY  HA2     3.70
         HB3    70 GLY  QA      3.25
         CG     67 GLY  HN      7.00
         CG     70 GLY  QA      7.88
 67 GLY  
         HN     68 GLU- HN      5.00
         HA1    68 GLU- HN      3.40
         HA2    68 GLU- HN      3.40
         QA     68 GLU- HN      3.13
 68 GLU- 
         HN     68 GLU- HB2     3.60
         HN     68 GLU- HB3     3.60
         HN     68 GLU- QG      5.88
         HN     69 GLU- HN      4.30
         HA     71 LEU  HN      4.20
 69 GLU- 
         HN     69 GLU- HB2     3.60
         HN     69 GLU- HB3     3.60
         HN     69 GLU- HG2     4.30
         HN     69 GLU- HG3     5.00
         HN     70 GLY  HN      3.70
 71 LEU  
         HN     71 LEU  HB2     2.80
         HN     71 LEU  HB3     2.80
         HN     71 LEU  QD1     6.00
         HN     71 LEU  QD2     6.00
         HA     71 LEU  HB2     2.60
         HA     71 LEU  QD1     5.80
         HA     71 LEU  QD2     5.80
 72 LYS+ 
         HN     72 LYS+ HB2     3.20
         HN     72 LYS+ HB3     3.20
         HN     73 GLY  HN      3.80
         HA     72 LYS+ QD      5.70
         HA     73 GLY  HN      3.40



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