NMR Restraints Grid

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

image mrblock_id pdb_id cing in_recoord stage program type subtype subsubtype
376858 1fvl cing recoord 3-converted-DOCR DYANA/DIANA distance general distance ambi


  2 GLU  H       3 GLU  H       5.00
  2 GLU  HA      3 GLU  H       2.50
  3 GLU  H       3 GLU  QB      3.72
  3 GLU  H       4 CYS  H       5.00
  3 GLU  HA      4 CYS  H       2.90
  3 GLU  HB2     4 CYS  H       6.00
  3 GLU  HB3     4 CYS  H       6.00
  3 GLU  QG      4 CYS  H       7.00
  4 CYS  H       4 CYS  HB2     3.40
  4 CYS  H       5 ASP  H       5.00
  4 CYS  H      20 LYS  QB      5.88
  4 CYS  HA      5 ASP  H       2.50
  4 CYS  HA      6 CYS  H       5.00
  4 CYS  HA     19 CYS  HB2     5.00
  4 CYS  HA     19 CYS  HB3     5.00
  4 CYS  HA     20 LYS  HG2     5.00
  4 CYS  HA     20 LYS  HG3     5.00
  4 CYS  HA     20 LYS  QG      4.18
  4 CYS  CB     19 CYS  SG      3.10
  4 CYS  HB2     5 ASP  H       5.00
  4 CYS  HB2    19 CYS  QB      5.88
  4 CYS  HB3     5 ASP  H       3.40
  4 CYS  HB3     6 CYS  H       5.00
  4 CYS  HB3    19 CYS  HA      6.00
  4 CYS  SG     19 CYS  CB      3.10
  4 CYS  SG     19 CYS  SG      2.10
  5 ASP  H       6 CYS  H       2.90
  5 ASP  H      19 CYS  QB      6.88
  5 ASP  H      20 LYS  H       6.00
  5 ASP  H      20 LYS  HA      5.00
  5 ASP  H      20 LYS  QG      7.00
  5 ASP  H      21 LEU  HB2     6.00
  5 ASP  H      21 LEU  HG      5.00
  5 ASP  QB     21 LEU  HG      5.00
  5 ASP  QB     21 LEU  QD1     6.00
  5 ASP  QB     21 LEU  QD2     6.00
  5 ASP  QB     21 LEU  QD2     5.29
  5 ASP  QB     21 LEU  QD1     0.00
  6 CYS  H      19 CYS  QB      6.88
  6 CYS  HA     28 ALA  QB      5.00
  6 CYS  CB     14 CYS  SG      3.10
  6 CYS  QB      8 SER  H       5.88
  6 CYS  SG     14 CYS  CB      3.10
  6 CYS  SG     14 CYS  SG      2.10
  7 GLY  H       8 SER  H       3.40
  7 GLY  H      28 ALA  QB      7.00
  7 GLY  H      29 ASP  QB      5.88
  8 SER  H       8 SER  QB      3.50
  8 SER  H       9 PRO  QD      6.00
  8 SER  H      11 ASN  QB      4.28
  8 SER  HA      9 PRO  HB3     6.00
  8 SER  HA      9 PRO  QD      3.50
  8 SER  HA     10 SER  H       5.00
  8 SER  HB2    11 ASN  HB2     6.75
  8 SER  HB2    11 ASN  HB3     6.75
  8 SER  HB3    11 ASN  HB2     6.75
  8 SER  HB3    11 ASN  HB3     6.75
  8 SER  QB     10 SER  H       5.88
  8 SER  QB     11 ASN  H       5.88
  8 SER  QB     11 ASN  QB      5.81
  8 SER  QB     11 ASN  HD22    5.88
  9 PRO  HA     10 SER  H       3.40
  9 PRO  HA     11 ASN  H       5.00
  9 PRO  HA     16 ALA  HA      5.00
  9 PRO  HA     16 ALA  QB      5.00
  9 PRO  HB2    10 SER  H       3.00
  9 PRO  HB2    11 ASN  H       5.00
  9 PRO  HB3    11 ASN  H       6.00
  9 PRO  HB3    16 ALA  QB      6.00
 10 SER  H      11 ASN  H       2.90
 10 SER  HA     11 ASN  H       3.40
 11 ASN  H      11 ASN  QB      3.50
 11 ASN  H      12 PRO  HD2     5.00
 11 ASN  H      12 PRO  HD3     5.00
 11 ASN  HA     12 PRO  HD2     2.90
 11 ASN  HA     12 PRO  HD3     2.90
 11 ASN  HA     13 CYS  H       5.00
 11 ASN  QB     11 ASN  HD21    3.13
 11 ASN  QB     11 ASN  HD22    3.72
 11 ASN  QB     13 CYS  H       5.88
 11 ASN  HD21   13 CYS  QB      5.88
 11 ASN  HD21   28 ALA  QB      6.00
 11 ASN  HD22   13 CYS  H       5.00
 11 ASN  HD22   28 ALA  QB      5.00
 12 PRO  HA     13 CYS  H       3.40
 12 PRO  HA     14 CYS  H       5.00
 12 PRO  QG     13 CYS  H       5.37
 12 PRO  QD     13 CYS  H       4.28
 13 CYS  H      14 CYS  H       2.90
 13 CYS  H      21 LEU  QD2    10.57
 13 CYS  H      21 LEU  QD1     0.00
 13 CYS  H      28 ALA  HA      5.00
 13 CYS  HA     25 ALA  QB      6.00
 13 CYS  HA     36 CYS  HB2     5.00
 13 CYS  HA     36 CYS  HB3     5.00
 13 CYS  CB     36 CYS  SG      3.10
 13 CYS  HB2    21 LEU  QD1     9.14
 13 CYS  HB2    21 LEU  QD2     9.14
 13 CYS  HB2    28 ALA  QB      5.00
 13 CYS  HB3    21 LEU  QD1     9.14
 13 CYS  HB3    21 LEU  QD2     9.14
 13 CYS  HB3    28 ALA  QB      5.00
 13 CYS  QB     14 CYS  H       5.88
 13 CYS  QB     21 LEU  QD2     7.03
 13 CYS  QB     21 LEU  QD1     0.00
 13 CYS  QB     28 ALA  HA      4.28
 13 CYS  SG     36 CYS  CB      3.10
 13 CYS  SG     36 CYS  SG      2.10
 14 CYS  HA     15 ASP  H       2.50
 14 CYS  HA     15 ASP  QB      6.88
 14 CYS  HA     21 LEU  HA      3.00
 14 CYS  HA     21 LEU  HB2     6.00
 14 CYS  HA     21 LEU  HB3     5.00
 14 CYS  HA     21 LEU  QD1     7.50
 14 CYS  HA     21 LEU  QD2     7.50
 14 CYS  HA     21 LEU  QD2     6.61
 14 CYS  HA     21 LEU  QD1     0.00
 14 CYS  HA     22 ARG  H       5.00
 14 CYS  QB     15 ASP  H       5.00
 14 CYS  QB     19 CYS  H       8.00
 14 CYS  QB     20 LYS  H       8.00
 14 CYS  QB     22 ARG  H       7.00
 15 ASP  H      15 ASP  QB      3.50
 15 ASP  H      20 LYS  H       5.00
 15 ASP  H      21 LEU  HA      5.00
 15 ASP  H      21 LEU  HB2     6.00
 15 ASP  HA     16 ALA  H       2.90
 15 ASP  HB2    16 ALA  H       6.00
 15 ASP  HB2    17 ALA  H       6.00
 15 ASP  HB3    16 ALA  H       6.00
 15 ASP  HB3    17 ALA  H       6.00
 15 ASP  QB     17 ALA  H       5.45
 15 ASP  QB     18 THR  H       5.38
 15 ASP  QB     18 THR  QG2     7.88
 15 ASP  QB     19 CYS  H       5.88
 15 ASP  QB     20 LYS  H       5.88
 16 ALA  H      16 ALA  QB      3.50
 16 ALA  H      17 ALA  H       3.40
 16 ALA  H      18 THR  H       5.00
 16 ALA  HA     17 ALA  H       3.40
 16 ALA  HA     18 THR  H       5.00
 16 ALA  HA     19 CYS  H       5.00
 16 ALA  QB     17 ALA  H       4.20
 17 ALA  H      17 ALA  QB      3.50
 17 ALA  H      18 THR  H       2.90
 17 ALA  QB     18 THR  H       4.40
 17 ALA  QB     19 CYS  H       7.00
 18 THR  H      18 THR  HB      3.40
 18 THR  H      19 CYS  H       2.50
 18 THR  H      20 LYS  H       5.00
 18 THR  HA     19 CYS  H       3.40
 18 THR  HB     19 CYS  H       5.00
 18 THR  HB     20 LYS  H       5.00
 18 THR  QG2    19 CYS  H       7.00
 18 THR  QG2    20 LYS  H       7.00
 19 CYS  H      19 CYS  HB2     3.50
 19 CYS  H      19 CYS  HB3     3.50
 19 CYS  H      20 LYS  H       3.40
 19 CYS  H      20 LYS  QB      6.88
 19 CYS  HA     20 LYS  H       3.40
 20 LYS  H      20 LYS  QG      6.00
 20 LYS  HA     21 LEU  H       2.90
 20 LYS  QB     21 LEU  H       4.28
 20 LYS  QG     21 LEU  H       7.00
 21 LEU  H      21 LEU  QD1     6.50
 21 LEU  H      21 LEU  QD2     6.50
 21 LEU  H      21 LEU  QD2     6.05
 21 LEU  H      21 LEU  QD1     0.00
 21 LEU  HA     22 ARG  H       2.50
 21 LEU  HB2    25 ALA  H       5.00
 21 LEU  QD1    22 ARG  H       9.00
 21 LEU  QD1    27 CYS  H       9.00
 21 LEU  QD1    27 CYS  HA      4.00
 21 LEU  QD1    28 ALA  HA      7.00
 21 LEU  QD2    22 ARG  H       9.00
 21 LEU  QD2    27 CYS  H       9.00
 21 LEU  QD2    27 CYS  HA      4.00
 21 LEU  QD2    28 ALA  HA      7.00
 21 LEU  QD2    22 ARG  H       8.09
 21 LEU  QD1    22 ARG  H       0.00
 21 LEU  QD2    25 ALA  H      10.57
 21 LEU  QD1    25 ALA  H       0.00
 21 LEU  QD2    26 GLN  HA      6.57
 21 LEU  QD1    26 GLN  HA      0.00
 21 LEU  QD2    27 CYS  H       8.09
 21 LEU  QD1    27 CYS  H       0.00
 21 LEU  QD2    28 ALA  HA      5.88
 21 LEU  QD1    28 ALA  HA      0.00
 21 LEU  QD2    29 ASP  H      10.57
 21 LEU  QD1    29 ASP  H       0.00
 21 LEU  QD2    29 ASP  HA      8.57
 21 LEU  QD1    29 ASP  HA      0.00
 22 ARG  H      22 ARG  HB2     4.00
 22 ARG  H      22 ARG  HB3     4.00
 22 ARG  H      22 ARG  QB      3.38
 22 ARG  H      22 ARG  QG      5.00
 22 ARG  H      22 ARG  QD      5.88
 22 ARG  H      25 ALA  H       5.00
 22 ARG  HA     23 PRO  HD2     4.00
 22 ARG  HA     23 PRO  HD3     3.40
 22 ARG  QB     22 ARG  HE      4.88
 22 ARG  O      25 ALA  N       3.40
 22 ARG  O      25 ALA  H       2.40
 23 PRO  HA     24 GLY  H       2.50
 23 PRO  HA     25 ALA  H       4.00
 23 PRO  HB2    24 GLY  H       4.00
 23 PRO  HB3    24 GLY  H       4.00
 23 PRO  QB     24 GLY  H       3.61
 24 GLY  H      25 ALA  H       2.90
 24 GLY  H      25 ALA  QB      7.00
 24 GLY  HA2    25 ALA  H       3.40
 24 GLY  HA3    25 ALA  H       3.40
 25 ALA  H      25 ALA  QB      3.50
 25 ALA  H      26 GLN  H       5.00
 25 ALA  HA     26 GLN  H       2.50
 25 ALA  QB     26 GLN  H       4.40
 25 ALA  QB     27 CYS  H       4.50
 25 ALA  QB     36 CYS  HB2     5.00
 25 ALA  QB     36 CYS  HB3     5.00
 26 GLN  H      26 GLN  HB2     3.40
 26 GLN  H      26 GLN  HB3     3.40
 26 GLN  H      27 CYS  H       2.50
 26 GLN  H      37 ARG  HD2     5.00
 26 GLN  H      37 ARG  HD3     5.00
 26 GLN  HA     26 GLN  HE21    5.00
 26 GLN  HA     26 GLN  HE22    5.00
 26 GLN  HA     27 CYS  H       3.40
 26 GLN  HB2    37 ARG  HA      3.40
 26 GLN  HB2    38 PHE  H       3.50
 26 GLN  HB2    38 PHE  CG      7.00
 26 GLN  HB2    38 PHE  CZ      7.00
 26 GLN  HB3    37 ARG  HA      3.40
 26 GLN  HB3    38 PHE  H       3.50
 26 GLN  HB3    38 PHE  CG      7.00
 26 GLN  HB3    38 PHE  CZ      7.00
 26 GLN  QB     37 ARG  HA      3.04
 26 GLN  QB     38 PHE  CG      6.70
 26 GLN  QB     38 PHE  CZ      6.70
 26 GLN  QB     38 PHE  HZ      5.88
 26 GLN  QG     27 CYS  H       6.00
 26 GLN  QG     37 ARG  HA      6.00
 26 GLN  QG     38 PHE  H       6.00
 26 GLN  QG     38 PHE  CG      7.00
 26 GLN  QG     38 PHE  CZ      7.00
 26 GLN  QG     38 PHE  HZ      6.00
 27 CYS  H      37 ARG  HB3     6.00
 27 CYS  HA     28 ALA  H       2.50
 27 CYS  CB     33 CYS  SG      3.10
 27 CYS  QB     28 ALA  H       4.28
 27 CYS  QB     29 ASP  H       4.28
 27 CYS  QB     38 PHE  CG      6.88
 27 CYS  QB     38 PHE  CZ      5.88
 27 CYS  QB     62 ASN  HD21    6.88
 27 CYS  SG     33 CYS  CB      3.10
 27 CYS  SG     33 CYS  SG      2.10
 28 ALA  H      28 ALA  QB      3.50
 28 ALA  H      29 ASP  H       2.50
 28 ALA  H      62 ASN  QB      5.88
 28 ALA  HA     29 ASP  H       3.40
 28 ALA  QB     29 ASP  H       4.40
 29 ASP  H      33 CYS  HB2     6.00
 29 ASP  H      33 CYS  HB3     5.00
 29 ASP  H      62 ASN  QB      6.88
 29 ASP  H      62 ASN  HD21    5.00
 29 ASP  HA     30 GLY  H       2.90
 29 ASP  QB     30 GLY  H       3.78
 30 GLY  H      31 LEU  H       5.00
 30 GLY  HA2    31 LEU  H       2.90
 30 GLY  HA2    33 CYS  H       5.00
 30 GLY  HA3    31 LEU  H       3.40
 30 GLY  HA3    33 CYS  H       5.00
 30 GLY  HA3    33 CYS  HA      5.00
 31 LEU  H      31 LEU  HB2     3.40
 31 LEU  H      31 LEU  HG      2.90
 31 LEU  H      31 LEU  QD2     7.00
 31 LEU  H      31 LEU  QD1     0.00
 31 LEU  H      32 CYS  H       3.40
 31 LEU  H      33 CYS  H       5.00
 31 LEU  HA     31 LEU  QD2     4.00
 31 LEU  HA     32 CYS  H       3.40
 31 LEU  HA     33 CYS  H       5.00
 31 LEU  HB2    45 CYS  HA      4.00
 31 LEU  HB2    64 CYS  HA      6.00
 31 LEU  HB3    45 CYS  HA      5.00
 31 LEU  HB3    64 CYS  HA      5.00
 31 LEU  HB3    64 CYS  HB2     5.00
 31 LEU  HB3    64 CYS  HB3     5.00
 31 LEU  HB3    64 CYS  QB      4.44
 31 LEU  HG     45 CYS  HA      5.00
 31 LEU  QD1    64 CYS  HA      7.00
 31 LEU  QD1    64 CYS  HB2     5.00
 31 LEU  QD1    64 CYS  HB3     5.00
 31 LEU  QD2    32 CYS  H       9.40
 31 LEU  QD1    32 CYS  H       0.00
 31 LEU  QD2    45 CYS  HA      7.00
 31 LEU  QD1    45 CYS  HA      0.00
 31 LEU  QD2    46 ARG  HE      7.40
 31 LEU  QD1    46 ARG  HE      0.00
 31 LEU  QD2    64 CYS  H       7.40
 31 LEU  QD1    64 CYS  H       0.00
 32 CYS  H      33 CYS  H       5.00
 32 CYS  H      62 ASN  HA      3.40
 32 CYS  H      62 ASN  QB      5.88
 32 CYS  HA     33 CYS  H       3.40
 32 CYS  CB     57 CYS  SG      3.10
 32 CYS  HB2    62 ASN  HA      3.40
 32 CYS  HB3    62 ASN  HA      3.40
 32 CYS  QB     33 CYS  H       5.88
 32 CYS  SG     57 CYS  CB      3.10
 32 CYS  SG     57 CYS  SG      2.10
 33 CYS  H      33 CYS  HB3     3.40
 33 CYS  H      34 ASP  H       5.00
 33 CYS  H      39 LYS  QG      6.88
 33 CYS  HA     34 ASP  H       2.50
 33 CYS  HA     34 ASP  QB      5.88
 33 CYS  HA     38 PHE  HA      3.40
 33 CYS  HA     38 PHE  CG      7.00
 33 CYS  HA     39 LYS  H       3.40
 33 CYS  HA     62 ASN  HA      5.00
 33 CYS  HA     62 ASN  HB2     6.00
 33 CYS  HA     62 ASN  HB3     6.00
 33 CYS  HB2    62 ASN  HA      4.00
 33 CYS  HB3    34 ASP  H       5.00
 33 CYS  HB3    38 PHE  CG      7.00
 33 CYS  HB3    62 ASN  HA      5.00
 33 CYS  HB3    62 ASN  QB      4.88
 34 ASP  N      37 ARG  O       3.40
 34 ASP  H      34 ASP  HB2     3.40
 34 ASP  H      34 ASP  HB3     3.40
 34 ASP  H      34 ASP  QB      3.04
 34 ASP  H      35 GLN  H       5.00
 34 ASP  H      36 CYS  H       5.00
 34 ASP  H      37 ARG  H       3.50
 34 ASP  H      37 ARG  HB2     6.00
 34 ASP  H      37 ARG  O       2.40
 34 ASP  H      38 PHE  HA      5.00
 34 ASP  H      38 PHE  CG      7.00
 34 ASP  H      39 LYS  H       5.00
 34 ASP  H      39 LYS  HA      5.00
 34 ASP  H      39 LYS  QB      7.00
 34 ASP  H      39 LYS  HG2     5.00
 34 ASP  H      39 LYS  HG3     5.00
 34 ASP  HA     35 GLN  H       2.50
 34 ASP  HA     36 CYS  H       5.00
 34 ASP  HA     39 LYS  HE2     4.00
 34 ASP  HA     39 LYS  HE3     4.00
 34 ASP  HB2    39 LYS  HE2     5.75
 34 ASP  HB2    39 LYS  HE3     5.75
 34 ASP  HB3    39 LYS  HE2     5.75
 34 ASP  HB3    39 LYS  HE3     5.75
 34 ASP  QB     39 LYS  QE      4.50
 35 GLN  H      35 GLN  HB2     4.00
 35 GLN  H      35 GLN  HB3     3.40
 35 GLN  H      35 GLN  HG2     3.40
 35 GLN  H      35 GLN  HG3     3.40
 35 GLN  H      35 GLN  QG      3.18
 35 GLN  H      36 CYS  H       3.40
 35 GLN  H      37 ARG  H       5.00
 35 GLN  HA     36 CYS  H       2.90
 35 GLN  HA     37 ARG  H       5.00
 35 GLN  HB2    36 CYS  H       5.00
 35 GLN  HB3    36 CYS  H       6.00
 36 CYS  H      37 ARG  H       2.90
 36 CYS  H      37 ARG  HB2     6.00
 37 ARG  H      37 ARG  HB2     2.90
 37 ARG  H      37 ARG  HB3     3.50
 37 ARG  HB2    37 ARG  HE      3.40
 37 ARG  HB2    38 PHE  H       3.40
 37 ARG  HB3    37 ARG  HE      4.00
 37 ARG  HB3    38 PHE  H       3.40
 38 PHE  H      38 PHE  HB2     2.90
 38 PHE  H      38 PHE  QE      7.00
 38 PHE  H      38 PHE  QD      0.00
 38 PHE  HA     39 LYS  H       2.50
 38 PHE  HA     62 ASN  HA      6.00
 38 PHE  HB2    39 LYS  H       5.00
 38 PHE  HB2    61 SER  H       6.00
 38 PHE  HB3    61 SER  H       6.00
 38 PHE  CG     39 LYS  H       7.00
 38 PHE  CG     60 LEU  HA      5.40
 38 PHE  CG     60 LEU  QD2     8.00
 38 PHE  CG     60 LEU  QD1     0.00
 38 PHE  CG     61 SER  HA      7.00
 38 PHE  CG     62 ASN  H       7.00
 38 PHE  CG     62 ASN  HA      7.00
 38 PHE  CG     62 ASN  HB2     7.00
 38 PHE  CG     62 ASN  HB3     7.00
 38 PHE  CZ     60 LEU  HA      7.00
 38 PHE  CZ     60 LEU  QD2     8.00
 38 PHE  CZ     60 LEU  QD1     0.00
 38 PHE  CZ     61 SER  HA      5.40
 38 PHE  CZ     62 ASN  H       7.00
 38 PHE  CZ     62 ASN  HA      7.00
 38 PHE  CZ     62 ASN  HB2     7.00
 38 PHE  CZ     62 ASN  HB3     7.00
 38 PHE  CZ     62 ASN  QB      6.19
 38 PHE  HZ     60 LEU  QD2     8.00
 38 PHE  HZ     60 LEU  QD1     0.00
 38 PHE  HZ     61 SER  HA      3.40
 39 LYS  H      39 LYS  QG      5.88
 39 LYS  HA     40 LYS  H       2.50
 39 LYS  QB     40 LYS  H       5.50
 39 LYS  QG     40 LYS  H       5.88
 39 LYS  QG     60 LEU  H       7.88
 39 LYS  QG     62 ASN  HD21    6.88
 40 LYS  H      40 LYS  QG      4.40
 40 LYS  H      41 LYS  H       5.00
 40 LYS  HA     41 LYS  H       2.50
 40 LYS  HA     59 GLY  H       5.00
 40 LYS  QG     41 LYS  H       6.00
 41 LYS  H      41 LYS  HB2     2.50
 41 LYS  H      41 LYS  HB3     2.90
 41 LYS  H      41 LYS  QG      6.00
 41 LYS  H      42 ARG  H       5.00
 41 LYS  H      58 THR  HA      5.00
 41 LYS  HA     42 ARG  H       2.50
 41 LYS  HA     43 THR  H       3.40
 41 LYS  HA     57 CYS  H       5.00
 41 LYS  HA     57 CYS  HB2     5.00
 41 LYS  HA     58 THR  HA      4.00
 41 LYS  HA     59 GLY  H       5.00
 41 LYS  HB3    43 THR  H       5.00
 41 LYS  QG     42 ARG  H       4.50
 42 ARG  H      43 THR  H       3.40
 42 ARG  H      43 THR  QG2     6.00
 42 ARG  H      56 ARG  HB3     5.00
 42 ARG  HA     56 ARG  HA      5.00
 42 ARG  HA     56 ARG  HB2     5.00
 42 ARG  HA     56 ARG  HB3     3.40
 42 ARG  HA     56 ARG  QG      5.00
 42 ARG  HA     56 ARG  HE      5.00
 42 ARG  HA     57 CYS  H       5.00
 42 ARG  HB2    43 THR  H       5.00
 42 ARG  HB3    43 THR  H       5.00
 43 THR  H      57 CYS  H       5.00
 43 THR  HA     44 ILE  H       2.50
 43 THR  HA     44 ILE  HG12    5.00
 43 THR  HA     44 ILE  HG13    5.00
 43 THR  HB     44 ILE  H       5.00
 43 THR  HB     57 CYS  H       5.00
 43 THR  HB     57 CYS  HB2     4.00
 43 THR  QG2    44 ILE  H       4.50
 43 THR  QG2    45 CYS  H       6.00
 43 THR  QG2    45 CYS  HA      6.00
 43 THR  O      57 CYS  N       3.40
 43 THR  O      57 CYS  H       2.40
 44 ILE  H      44 ILE  HB      2.90
 44 ILE  H      44 ILE  QG2     4.60
 44 ILE  H      44 ILE  QG1     3.90
 44 ILE  H      44 ILE  QD1     4.40
 44 ILE  H      45 CYS  H       5.00
 44 ILE  H      56 ARG  HA      5.00
 44 ILE  HA     45 CYS  H       2.50
 44 ILE  HA     46 ARG  H       5.00
 44 ILE  HA     56 ARG  HA      2.50
 44 ILE  HA     56 ARG  QG      5.00
 44 ILE  HA     57 CYS  H       5.00
 44 ILE  HB     45 CYS  H       6.00
 44 ILE  HB     56 ARG  HA      6.00
 44 ILE  QG2    45 CYS  H       5.80
 44 ILE  QG2    45 CYS  HA      5.00
 44 ILE  QG2    46 ARG  H       4.50
 44 ILE  QG2    54 ASP  H       7.00
 44 ILE  QG2    54 ASP  HA      7.00
 44 ILE  QG2    54 ASP  HB2     5.00
 44 ILE  QG2    54 ASP  HB3     5.00
 44 ILE  QG2    55 ASP  H       7.00
 44 ILE  QG2    56 ARG  HA      6.50
 44 ILE  QG2    57 CYS  H       7.00
 44 ILE  HG12   45 CYS  H       6.00
 44 ILE  HG13   45 CYS  H       6.00
 44 ILE  QG1    56 ARG  HA      5.88
 44 ILE  QD1    45 CYS  H       7.40
 44 ILE  QD1    54 ASP  H       7.00
 44 ILE  QD1    54 ASP  HA      8.00
 44 ILE  QD1    54 ASP  HB2     6.00
 44 ILE  QD1    54 ASP  HB3     6.00
 44 ILE  QD1    55 ASP  H       8.00
 44 ILE  QD1    56 ARG  HA      7.00
 44 ILE  QD1    56 ARG  HE      6.00
 44 ILE  QD1    57 CYS  H       7.00
 45 CYS  N      55 ASP  O       3.40
 45 CYS  H      46 ARG  H       2.50
 45 CYS  H      55 ASP  H       5.00
 45 CYS  H      55 ASP  O       2.40
 45 CYS  H      56 ARG  H       5.00
 45 CYS  H      56 ARG  HA      2.90
 45 CYS  H      56 ARG  QG      7.00
 45 CYS  H      57 CYS  H       5.00
 45 CYS  HA     46 ARG  H       3.40
 45 CYS  HA     57 CYS  H       6.00
 45 CYS  HA     64 CYS  QB      4.88
 45 CYS  CB     64 CYS  SG      3.10
 45 CYS  HB2    57 CYS  H       6.00
 45 CYS  HB3    57 CYS  H       6.00
 45 CYS  QB     57 CYS  H       5.45
 45 CYS  SG     64 CYS  CB      3.10
 45 CYS  SG     64 CYS  SG      2.10
 46 ARG  H      46 ARG  HG2     6.00
 46 ARG  H      46 ARG  HG3     6.00
 46 ARG  H      47 ILE  H       5.00
 46 ARG  H      55 ASP  H       3.40
 46 ARG  H      55 ASP  HB2     5.00
 46 ARG  H      55 ASP  HB3     3.40
 46 ARG  H      56 ARG  HA      5.00
 46 ARG  H      57 CYS  H       6.00
 46 ARG  HA     47 ILE  H       2.50
 46 ARG  HA     47 ILE  QG2     7.00
 46 ARG  HA     47 ILE  QD1     5.00
 46 ARG  QB     46 ARG  HE      5.00
 46 ARG  QB     55 ASP  H       5.00
 46 ARG  QB     55 ASP  HA      6.00
 46 ARG  QG     46 ARG  HE      3.75
 46 ARG  QG     47 ILE  H       6.88
 47 ILE  H      47 ILE  HB      2.90
 47 ILE  H      47 ILE  QG2     4.50
 47 ILE  H      47 ILE  HG12    3.40
 47 ILE  H      47 ILE  HG13    3.40
 47 ILE  H      47 ILE  QG1     3.04
 47 ILE  H      47 ILE  QD1     6.00
 47 ILE  H      48 ALA  H       5.00
 47 ILE  HA     48 ALA  H       2.50
 47 ILE  HA     48 ALA  QB      6.00
 47 ILE  HA     54 ASP  HA      5.00
 47 ILE  HA     54 ASP  HB2     4.00
 47 ILE  HA     54 ASP  HB3     4.00
 47 ILE  HA     55 ASP  H       4.00
 47 ILE  HB     48 ALA  H       3.40
 47 ILE  QG2    48 ALA  H       4.50
 47 ILE  QG2    48 ALA  HA      6.00
 47 ILE  QG2    49 ARG  H       7.00
 47 ILE  QG2    49 ARG  HA      6.00
 47 ILE  QG1    48 ALA  H       5.88
 47 ILE  QD1    48 ALA  H       6.00
 48 ALA  H      48 ALA  QB      3.50
 48 ALA  H      49 ARG  H       5.00
 48 ALA  H      54 ASP  H       5.00
 48 ALA  H      54 ASP  HA      3.40
 48 ALA  H      54 ASP  HB2     5.00
 48 ALA  H      54 ASP  HB3     5.00
 48 ALA  H      54 ASP  QB      4.44
 48 ALA  H      55 ASP  H       5.00
 48 ALA  HA     49 ARG  H       2.50
 48 ALA  HA     52 PHE  CG      7.00
 48 ALA  HA     52 PHE  CZ      7.00
 48 ALA  HA     54 ASP  HA      5.00
 48 ALA  QB     49 ARG  H       4.40
 48 ALA  QB     50 GLY  H       6.00
 48 ALA  QB     52 PHE  CG      6.00
 48 ALA  QB     52 PHE  CZ      7.00
 48 ALA  QB     54 ASP  H       6.00
 48 ALA  QB     54 ASP  HA      3.40
 49 ARG  H      49 ARG  HB2     3.50
 49 ARG  H      49 ARG  HB3     3.50
 49 ARG  H      49 ARG  QB      3.09
 49 ARG  H      49 ARG  QG      6.00
 49 ARG  H      49 ARG  HD2     5.00
 49 ARG  H      49 ARG  HD3     5.00
 49 ARG  H      52 PHE  H       5.00
 49 ARG  H      52 PHE  HB2     6.00
 49 ARG  H      52 PHE  HB3     6.00
 49 ARG  H      52 PHE  QB      5.45
 49 ARG  H      52 PHE  CG      7.00
 49 ARG  H      52 PHE  CZ      7.00
 49 ARG  HA     50 GLY  H       3.40
 49 ARG  HB2    50 GLY  H       5.00
 49 ARG  HB3    50 GLY  H       5.00
 49 ARG  HD2    50 GLY  H       6.00
 49 ARG  HD3    50 GLY  H       6.00
 50 GLY  H      51 ASP  H       5.00
 50 GLY  H      52 PHE  CG      7.00
 50 GLY  HA2    51 ASP  H       2.90
 50 GLY  HA2    52 PHE  CG      7.00
 50 GLY  HA2    52 PHE  CZ      7.00
 50 GLY  HA3    51 ASP  H       2.90
 50 GLY  HA3    52 PHE  CG      7.00
 50 GLY  HA3    52 PHE  CZ      7.00
 50 GLY  QA     51 ASP  H       2.56
 50 GLY  QA     52 PHE  CG      6.46
 50 GLY  QA     52 PHE  CZ      6.46
 51 ASP  H      51 ASP  HB2     3.40
 51 ASP  H      51 ASP  HB3     3.40
 51 ASP  H      52 PHE  H       2.90
 51 ASP  H      52 PHE  CG      6.00
 51 ASP  H      52 PHE  CZ      6.00
 51 ASP  HA     52 PHE  H       3.40
 51 ASP  HB2    52 PHE  H       5.00
 51 ASP  HB3    52 PHE  H       5.00
 52 PHE  HA     53 PRO  HD2     3.40
 52 PHE  HA     53 PRO  HD3     2.90
 52 PHE  QB     53 PRO  HD2     4.88
 52 PHE  QB     53 PRO  HD3     5.88
 53 PRO  HA     54 ASP  H       2.50
 53 PRO  QB     54 ASP  H       4.04
 54 ASP  H      54 ASP  HB2     3.40
 54 ASP  H      54 ASP  HB3     3.40
 54 ASP  H      54 ASP  QB      3.04
 54 ASP  HA     55 ASP  H       2.60
 54 ASP  HB2    55 ASP  H       4.00
 54 ASP  HB3    55 ASP  H       4.00
 54 ASP  QB     55 ASP  H       3.38
 55 ASP  H      55 ASP  HB2     3.40
 55 ASP  H      55 ASP  HB3     2.90
 55 ASP  HA     56 ARG  H       2.50
 55 ASP  HA     67 TRP  H       5.00
 55 ASP  HA     67 TRP  HB2     4.00
 55 ASP  HA     67 TRP  HB3     5.00
 55 ASP  HA     67 TRP  HE1     6.00
 55 ASP  HB2    56 ARG  H       4.00
 55 ASP  HB2    67 TRP  HD1     5.00
 55 ASP  HB2    67 TRP  HE1     5.00
 55 ASP  HB3    56 ARG  H       5.00
 56 ARG  H      56 ARG  HB2     3.40
 56 ARG  H      56 ARG  HB3     3.40
 56 ARG  H      56 ARG  QG      6.00
 56 ARG  H      57 CYS  H       5.00
 56 ARG  HA     56 ARG  HE      5.00
 56 ARG  HA     57 CYS  H       2.50
 56 ARG  HB2    56 ARG  HE      3.40
 56 ARG  HB2    57 CYS  H       4.00
 56 ARG  HB3    57 CYS  H       4.00
 56 ARG  QG     57 CYS  H       7.00
 57 CYS  H      57 CYS  HB2     2.90
 57 CYS  H      57 CYS  HB3     4.00
 57 CYS  H      58 THR  H       5.00
 57 CYS  HA     58 THR  H       2.90
 57 CYS  HA     58 THR  QG2     6.00
 57 CYS  HA     64 CYS  HA      5.00
 57 CYS  HB2    59 GLY  H       5.00
 57 CYS  HB3    58 THR  H       3.40
 57 CYS  HB3    59 GLY  H       5.00
 58 THR  H      58 THR  QG2     4.50
 58 THR  H      59 GLY  H       3.40
 58 THR  H      60 LEU  H       5.00
 58 THR  HB     60 LEU  H       5.00
 58 THR  HB     61 SER  H       6.00
 58 THR  QG2    61 SER  HB2     7.00
 58 THR  QG2    64 CYS  HA      7.00
 58 THR  QG2    65 PRO  HB2     8.00
 58 THR  QG2    65 PRO  HB3     8.00
 58 THR  QG2    65 PRO  HG2     5.00
 58 THR  QG2    65 PRO  HG3     5.00
 58 THR  QG2    65 PRO  HD2     6.00
 58 THR  QG2    65 PRO  HD3     6.00
 59 GLY  H      60 LEU  H       3.40
 59 GLY  H      61 SER  H       5.00
 60 LEU  H      60 LEU  QB      3.71
 60 LEU  H      60 LEU  HG      3.40
 60 LEU  H      60 LEU  QD2     7.50
 60 LEU  H      60 LEU  QD1     0.00
 60 LEU  H      61 SER  H       2.90
 60 LEU  HA     61 SER  H       3.40
 60 LEU  HB2    61 SER  H       5.00
 60 LEU  HB3    61 SER  H       5.00
 60 LEU  QB     61 SER  H       4.68
 60 LEU  HG     61 SER  H       6.00
 60 LEU  QD1    61 SER  H       8.00
 60 LEU  QD2    61 SER  H       8.00
 61 SER  H      61 SER  HB2     3.40
 61 SER  H      61 SER  HB3     4.20
 61 SER  H      62 ASN  H       5.00
 61 SER  HA     62 ASN  H       2.50
 61 SER  HA     63 ASP  H       5.00
 61 SER  HB2    62 ASN  H       3.40
 61 SER  HB2    63 ASP  H       5.00
 61 SER  HB3    62 ASN  H       2.90
 61 SER  HB3    63 ASP  H       3.40
 62 ASN  H      63 ASP  H       2.50
 62 ASN  H      63 ASP  HB2     5.00
 62 ASN  HA     63 ASP  H       3.40
 62 ASN  QB     62 ASN  HD22    3.72
 63 ASP  H      63 ASP  HB2     3.20
 63 ASP  H      63 ASP  HB3     3.40
 63 ASP  HA     64 CYS  H       2.60
 63 ASP  HB2    64 CYS  H       2.90
 63 ASP  HB3    64 CYS  H       3.40
 64 CYS  H      64 CYS  QB      3.50
 64 CYS  HA     65 PRO  HG2     5.00
 64 CYS  HA     65 PRO  HG3     5.00
 64 CYS  HA     65 PRO  HD2     2.50
 64 CYS  HA     65 PRO  HD3     2.50
 65 PRO  HB2    66 ARG  H       3.40
 65 PRO  HB3    66 ARG  H       4.00
 66 ARG  H      66 ARG  HB2     3.40
 66 ARG  H      66 ARG  HB3     3.40
 66 ARG  H      66 ARG  QB      3.04
 66 ARG  H      66 ARG  HD2     5.00
 66 ARG  H      66 ARG  HD3     5.00
 66 ARG  H      67 TRP  H       5.00
 66 ARG  HA     67 TRP  H       2.50
 66 ARG  HB2    67 TRP  H       4.50
 66 ARG  HB3    67 TRP  H       4.50
 66 ARG  QB     66 ARG  HE      6.88
 66 ARG  QB     67 TRP  H       3.89
 66 ARG  QB     68 ASN  H       5.88
 66 ARG  HD2    67 TRP  H       5.00
 66 ARG  HD3    67 TRP  H       5.00
 67 TRP  H      67 TRP  HB2     2.90
 67 TRP  H      67 TRP  HB3     2.90
 67 TRP  H      67 TRP  HD1     5.00
 67 TRP  H      67 TRP  HE3     5.00
 67 TRP  H      68 ASN  H       4.00
 67 TRP  HA     68 ASN  H       2.60
 67 TRP  HB2    68 ASN  H       5.00
 67 TRP  HB3    68 ASN  H       5.00
 67 TRP  HB3    69 ASP  H       6.00
 67 TRP  HD1    68 ASN  H       5.00
 67 TRP  HE3    68 ASN  QB      5.88
 68 ASN  H      68 ASN  HB2     3.40
 68 ASN  H      68 ASN  HB3     3.40
 68 ASN  HA     69 ASP  H       3.40
 68 ASN  HB2    69 ASP  H       5.00
 68 ASN  HB3    69 ASP  H       5.00
 68 ASN  QB     68 ASN  HD22    3.74
 69 ASP  H      69 ASP  HB2     3.40
 69 ASP  H      69 ASP  HB3     3.40
 69 ASP  H      69 ASP  QB      3.04
 69 ASP  H      70 LEU  H       5.00
 69 ASP  HA     70 LEU  H       2.90


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