NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage program type subtype subsubtype
39211 1ss3 6139 cing 2-parsed STAR distance NOE simple


data_1ss3_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1ss3 
    _Study_list.ID           1 

    loop_
        _Study.ID 
        _Study.Name 
        _Study.Type 
        _Study.Details 
        _Study.Entry_ID 
        _Study.Study_list_ID 

        1   "Conversion project"    NMR   .   parsed_1ss3   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1ss3 
    _Entry.Title                       "Original constraint list(s)" 
    _Entry.Version_type                 original 
    _Entry.Submission_date              . 
    _Entry.Accession_date               . 
    _Entry.Last_release_date            . 
    _Entry.Original_release_date        . 
    _Entry.Origination                  . 
    _Entry.NMR_STAR_version             3.1 
    _Entry.Original_NMR_STAR_version    . 
    _Entry.Experimental_method          NMR 
    _Entry.Experimental_method_subtype  . 

    loop_
        _Related_entries.Database_name 
        _Related_entries.Database_accession_code 
        _Related_entries.Relationship 
        _Related_entries.Entry_ID 

        PDB   1ss3   "Master copy"    parsed_1ss3   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1ss3 
    _Constraint_stat_list.ID           1 

    loop_
        _Constraint_file.ID 
        _Constraint_file.Constraint_filename 
        _Constraint_file.Software_ID 
        _Constraint_file.Software_label 
        _Constraint_file.Software_name 
        _Constraint_file.Block_ID 
        _Constraint_file.Constraint_type 
        _Constraint_file.Constraint_subtype 
        _Constraint_file.Constraint_subsubtype 
        _Constraint_file.Constraint_number 
        _Constraint_file.Entry_ID 
        _Constraint_file.Constraint_stat_list_ID 

        1   1ss3.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_1ss3   1   
        1   1ss3.mr   .   .    DYANA/DIANA   2    distance                  NOE                 simple             0   parsed_1ss3   1   
        1   1ss3.mr   .   .    DYANA/DIANA   3   "dihedral angle"          "Not applicable"    "Not applicable"    0   parsed_1ss3   1   
        1   1ss3.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_1ss3   1   
    stop_

save_


save_DYANA/DIANA_distance_constraints_2
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_1ss3 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type     NOE 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            2 
    _Distance_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Dist_constraint_parse_err.ID 
        _Dist_constraint_parse_err.Content 
        _Dist_constraint_parse_err.Begin_line 
        _Dist_constraint_parse_err.Begin_column 
        _Dist_constraint_parse_err.End_line 
        _Dist_constraint_parse_err.End_column 
        _Dist_constraint_parse_err.Entry_ID 
        _Dist_constraint_parse_err.Distance_constraint_list_ID 

          1   "1 ASP- HA      1 ASP- HB2     3,03                "       2   3     2   53   parsed_1ss3   1   
          2   "1 ASP- HA      1 ASP- HB3     3,03                "       3   3     3   53   parsed_1ss3   1   
          3   "1 ASP- HB2     3 ALA  HN      6,00                "       4   3     4   53   parsed_1ss3   1   
          4   "1 ASP- HB3     3 ALA  HN      6,00                "       5   3     5   53   parsed_1ss3   1   
          5   "1 ASP- QB      3 ALA  HN      5,21                "       6   3     6   53   parsed_1ss3   1   
          6   "2 GLU- HA      2 GLU- HB2     2,87                "       7   3     7   53   parsed_1ss3   1   
          7   "2 GLU- HA      2 GLU- HB3     2,87                "       8   3     8   53   parsed_1ss3   1   
          8   "2 GLU- HA      5 PHE  HB3     3,26                "       9   3     9   53   parsed_1ss3   1   
          9   "2 GLU- HB2     3 ALA  HN      3,99                "      10   3    10   53   parsed_1ss3   1   
         10   "2 GLU- HB3     3 ALA  HN      3,99                "      11   3    11   53   parsed_1ss3   1   
         11   "2 GLU- QB      3 ALA  HN      3,81                "      12   3    12   53   parsed_1ss3   1   
         12   "2 GLU- QB      6 LYS+ HN      5,53                "      13   3    13   53   parsed_1ss3   1   
         13   "2 GLU- QG      3 ALA  HN      6,88                "      14   3    14   53   parsed_1ss3   1   
         14   "3 ALA  HA      6 LYS+ HN      3,86                "      15   3    15   53   parsed_1ss3   1   
         15   "3 ALA  QB      6 LYS+ HN      4,85                "      16   3    16   53   parsed_1ss3   1   
         16   "3 ALA  QB      7 GLU- HN      5,84                "      17   3    17   53   parsed_1ss3   1   
         17   "4 GLN  HN      4 GLN  HA      2,70                "      18   3    18   53   parsed_1ss3   1   
         18   "4 GLN  HN      4 GLN  QB      3,71                "      19   3    19   53   parsed_1ss3   1   
         19   "4 GLN  HN      4 GLN  QG      3,78                "      20   3    20   53   parsed_1ss3   1   
         20   "4 GLN  HA      4 GLN  HG2     3,72                "      21   3    21   53   parsed_1ss3   1   
         21   "4 GLN  HA      4 GLN  HG3     3,72                "      22   3    22   53   parsed_1ss3   1   
         22   "4 GLN  QB      5 PHE  HN      3,94                "      23   3    23   53   parsed_1ss3   1   
         23   "5 PHE  HN      5 PHE  HB2     2,70                "      24   3    24   53   parsed_1ss3   1   
         24   "5 PHE  HN      5 PHE  HB3     2,70                "      25   3    25   53   parsed_1ss3   1   
         25   "5 PHE  HA      5 PHE  HB2     2,77                "      26   3    26   53   parsed_1ss3   1   
         26   "5 PHE  HA      5 PHE  HB3     3,03                "      27   3    27   53   parsed_1ss3   1   
         27   "5 PHE  HA      7 GLU- HN      3,82                "      28   3    28   53   parsed_1ss3   1   
         28   "5 PHE  HA      8 CYS  HB2     4,55                "      29   3    29   53   parsed_1ss3   1   
         29   "5 PHE  HA      8 CYS  HB3     4,55                "      30   3    30   53   parsed_1ss3   1   
         30   "5 PHE  HA      8 CYS  QB      3,76                "      31   3    31   53   parsed_1ss3   1   
         31   "5 PHE  HA      9 TYR  HN      4,19                "      32   3    32   53   parsed_1ss3   1   
         32   "5 PHE  HA     34 CYS  QB      6,74                "      33   3    33   53   parsed_1ss3   1   
         33   "5 PHE  HB2     6 LYS+ HN      3,69                "      34   3    34   53   parsed_1ss3   1   
         34   "5 PHE  HB3     6 LYS+ HN      2,80                "      35   3    35   53   parsed_1ss3   1   
         35   "5 PHE  QD      6 LYS+ HA      6,64                "      36   3    36   53   parsed_1ss3   1   
         36   "5 PHE  QD      6 LYS+ QB      9,00                "      37   3    37   53   parsed_1ss3   1   
         37   "5 PHE  QD      6 LYS+ QG      8,90                "      38   3    38   53   parsed_1ss3   1   
         38   "5 PHE  QR      6 LYS+ HN      8,35                "      39   3    39   53   parsed_1ss3   1   
         39   "5 PHE  QR      6 LYS+ HA      8,15                "      40   3    40   53   parsed_1ss3   1   
         40   "5 PHE  QR      6 LYS+ QB      9,36                "      41   3    41   53   parsed_1ss3   1   
         41   "5 PHE  QR      9 TYR  HN      7,72                "      42   3    42   53   parsed_1ss3   1   
         42   "5 PHE  QR      9 TYR  HB2     8,18                "      43   3    43   53   parsed_1ss3   1   
         43   "5 PHE  QR      9 TYR  HB3     8,48                "      44   3    44   53   parsed_1ss3   1   
         44   "5 PHE  QR      9 TYR  QD     10,62                "      45   3    45   53   parsed_1ss3   1   
         45   "5 PHE  QR      9 TYR  HD2     7,11                "      46   3    46   53   parsed_1ss3   1   
         46   "5 PHE  QR     31 ASP- HA      8,48                "      47   3    47   53   parsed_1ss3   1   
         47   "5 PHE  QR     34 CYS  QB      8,17                "      48   3    48   53   parsed_1ss3   1   
         48   "5 PHE  QR     35 SER  HN      8,48                "      49   3    49   53   parsed_1ss3   1   
         49   "5 PHE  QR     35 SER  HA      7,19                "      50   3    50   53   parsed_1ss3   1   
         50   "5 PHE  QR     35 SER  QB      9,36                "      51   3    51   53   parsed_1ss3   1   
         51   "5 PHE  HZ      9 TYR  HB2     6,00                "      52   3    52   53   parsed_1ss3   1   
         52   "5 PHE  HZ      9 TYR  QD      6,23                "      53   3    53   53   parsed_1ss3   1   
         53   "5 PHE  HZ      9 TYR  QE      7,87                "      54   3    54   53   parsed_1ss3   1   
         54   "5 PHE  HZ      9 TYR  HE2     4,80                "      55   3    55   53   parsed_1ss3   1   
         55   "5 PHE  HZ      9 TYR  HD2     3,43                "      56   3    56   53   parsed_1ss3   1   
         56   "5 PHE  HZ     31 ASP- HA      5,01                "      57   3    57   53   parsed_1ss3   1   
         57   "5 PHE  HD2     6 LYS+ HA      3,77                "      58   3    58   53   parsed_1ss3   1   
         58   "5 PHE  HD2     6 LYS+ QB      5,75                "      59   3    59   53   parsed_1ss3   1   
         59   "6 LYS+ HN      6 LYS+ HA      2,90                "      60   3    60   53   parsed_1ss3   1   
         60   "6 LYS+ HN      6 LYS+ QB      3,61                "      61   3    61   53   parsed_1ss3   1   
         61   "6 LYS+ HN      6 LYS+ QG      5,40                "      62   3    62   53   parsed_1ss3   1   
         62   "6 LYS+ HN      6 LYS+ QD      5,00                "      63   3    63   53   parsed_1ss3   1   
         63   "6 LYS+ HN      7 GLU- HN      2,93                "      64   3    64   53   parsed_1ss3   1   
         64   "6 LYS+ HA      6 LYS+ HG2     4,22                "      65   3    65   53   parsed_1ss3   1   
         65   "6 LYS+ HA      6 LYS+ HG3     4,22                "      66   3    66   53   parsed_1ss3   1   
         66   "6 LYS+ HA      6 LYS+ QG      3,96                "      67   3    67   53   parsed_1ss3   1   
         67   "6 LYS+ HA      6 LYS+ QD      6,88                "      68   3    68   53   parsed_1ss3   1   
         68   "6 LYS+ HA      7 GLU- HN      3,43                "      69   3    69   53   parsed_1ss3   1   
         69   "6 LYS+ HA      9 TYR  HN      3,46                "      70   3    70   53   parsed_1ss3   1   
         70   "6 LYS+ HA      9 TYR  HB2     3,66                "      71   3    71   53   parsed_1ss3   1   
         71   "6 LYS+ HA      9 TYR  HB3     2,93                "      72   3    72   53   parsed_1ss3   1   
         72   "6 LYS+ HA      9 TYR  QD      8,14                "      73   3    73   53   parsed_1ss3   1   
         73   "6 LYS+ HA     10 ASP- HN      3,69                "      74   3    74   53   parsed_1ss3   1   
         74   "6 LYS+ QB      7 GLU- HN      4,14                "      75   3    75   53   parsed_1ss3   1   
         75   "7 GLU- HN      7 GLU- HA      2,73                "      76   3    76   53   parsed_1ss3   1   
         76   "7 GLU- HN      7 GLU- QB      3,71                "      77   3    77   53   parsed_1ss3   1   
         77   "7 GLU- HN      7 GLU- QG      5,26                "      78   3    78   53   parsed_1ss3   1   
         78   "7 GLU- HN      9 TYR  HN      4,48                "      79   3    79   53   parsed_1ss3   1   
         79   "7 GLU- HA      7 GLU- QG      3,70                "      80   3    80   53   parsed_1ss3   1   
         80   "7 GLU- HA      8 CYS  HN      3,46                "      81   3    81   53   parsed_1ss3   1   
         81   "7 GLU- HA      9 TYR  HN      4,78                "      82   3    82   53   parsed_1ss3   1   
         82   "7 GLU- HA     10 ASP- HN      3,53                "      83   3    83   53   parsed_1ss3   1   
         83   "7 GLU- HA     10 ASP- HB2     4,32                "      84   3    84   53   parsed_1ss3   1   
         84   "7 GLU- HA     10 ASP- HB3     4,32                "      85   3    85   53   parsed_1ss3   1   
         85   "7 GLU- HA     10 ASP- QB      3,77                "      86   3    86   53   parsed_1ss3   1   
         86   "7 GLU- QB      8 CYS  HN      4,10                "      87   3    87   53   parsed_1ss3   1   
         87   "8 CYS  HN      8 CYS  HB2     2,77                "      88   3    88   53   parsed_1ss3   1   
         88   "8 CYS  HN      8 CYS  HB3     2,77                "      89   3    89   53   parsed_1ss3   1   
         89   "8 CYS  HN      9 TYR  HN      2,96                "      90   3    90   53   parsed_1ss3   1   
         90   "8 CYS  HA     12 CYS  HN      3,23                "      91   3    91   53   parsed_1ss3   1   
         91   "8 CYS  CB     34 CYS  SG      3,10                "      92   3    92   53   parsed_1ss3   1   
         92   "8 CYS  HB2     9 TYR  HN      3,39                "      93   3    93   53   parsed_1ss3   1   
         93   "8 CYS  HB3     9 TYR  HN      3,39                "      94   3    94   53   parsed_1ss3   1   
         94   "8 CYS  QB      9 TYR  HN      3,00                "      95   3    95   53   parsed_1ss3   1   
         95   "8 CYS  QB     34 CYS  QB      5,31                "      96   3    96   53   parsed_1ss3   1   
         96   "8 CYS  SG     34 CYS  CB      3,10                "      97   3    97   53   parsed_1ss3   1   
         97   "8 CYS  SG     34 CYS  SG      2,10                "      98   3    98   53   parsed_1ss3   1   
         98   "9 TYR  HN      9 TYR  HB2     2,77                "      99   3    99   53   parsed_1ss3   1   
         99   "9 TYR  HN      9 TYR  HB3     2,77                "     100   3   100   53   parsed_1ss3   1   
        100   "9 TYR  HN     10 ASP- HN      3,16                "     101   3   101   53   parsed_1ss3   1   
        101   "9 TYR  HN     34 CYS  QB      6,38                "     102   3   102   53   parsed_1ss3   1   
        102   "9 TYR  HA      9 TYR  HB2     2,70                "     103   3   103   53   parsed_1ss3   1   
        103   "9 TYR  HA     12 CYS  HN      3,62                "     104   3   104   53   parsed_1ss3   1   
        104   "9 TYR  HA     12 CYS  QB      3,94                "     105   3   105   53   parsed_1ss3   1   
        105   "9 TYR  HA     30 CYS  HB2     4,88                "     106   3   106   53   parsed_1ss3   1   
        106   "9 TYR  HA     30 CYS  HB3     2,70                "     107   3   107   53   parsed_1ss3   1   
        107   "9 TYR  HA     34 CYS  QB      6,88                "     108   3   108   53   parsed_1ss3   1   
        108   "9 TYR  HB2    10 ASP- HN      3,46                "     109   3   109   53   parsed_1ss3   1   
        109   "9 TYR  HB3    10 ASP- HN      3,26                "     110   3   110   53   parsed_1ss3   1   
        110   "9 TYR  QD     10 ASP- HN      6,69                "     111   3   111   53   parsed_1ss3   1   
        111   "9 TYR  QD     10 ASP- HA      6,09                "     112   3   112   53   parsed_1ss3   1   
        112   "9 TYR  QD     13 HIS  HD2     8,14                "     113   3   113   53   parsed_1ss3   1   
        113   "9 TYR  QD     27 GLU- HA      8,14                "     114   3   114   53   parsed_1ss3   1   
        114   "9 TYR  QD     30 CYS  HB2     6,52                "     115   3   115   53   parsed_1ss3   1   
        115   "9 TYR  QD     30 CYS  HB3     5,83                "     116   3   116   53   parsed_1ss3   1   
        116   "9 TYR  QD     31 ASP- HN      7,84                "     117   3   117   53   parsed_1ss3   1   
        117   "9 TYR  QD     31 ASP- HA      7,41                "     118   3   118   53   parsed_1ss3   1   
        118   "9 TYR  QD     31 ASP- HB2     8,14                "     119   3   119   53   parsed_1ss3   1   
        119   "9 TYR  QD     34 CYS  QB      8,95                "     120   3   120   53   parsed_1ss3   1   
        120   "9 TYR  QE     10 ASP- HA      8,13                "     121   3   121   53   parsed_1ss3   1   
        121   "9 TYR  QE     13 HIS  HD2     6,88                "     122   3   122   53   parsed_1ss3   1   
        122   "9 TYR  QE     27 GLU- HA      5,62                "     123   3   123   53   parsed_1ss3   1   
        123   "9 TYR  QE     27 GLU- QB      8,98                "     124   3   124   53   parsed_1ss3   1   
        124   "9 TYR  QE     30 CYS  HB2     6,35                "     125   3   125   53   parsed_1ss3   1   
        125   "9 TYR  QE     30 CYS  HB3     6,09                "     126   3   126   53   parsed_1ss3   1   
        126   "9 TYR  QE     31 ASP- HN      6,15                "     127   3   127   53   parsed_1ss3   1   
        127   "9 TYR  QE     31 ASP- HA      8,13                "     128   3   128   53   parsed_1ss3   1   
        128   "9 TYR  QE     31 ASP- HB2     6,28                "     129   3   129   53   parsed_1ss3   1   
        129   "9 TYR  HD1    10 ASP- HN      3,81                "     130   3   130   53   parsed_1ss3   1   
        130   "9 TYR  HD1    10 ASP- HA      3,31                "     131   3   131   53   parsed_1ss3   1   
        131   "9 TYR  HE1    10 ASP- HA      5,02                "     132   3   132   53   parsed_1ss3   1   
        132   "9 TYR  HE2    31 ASP- HN      3,36                "     133   3   133   53   parsed_1ss3   1   
        133   "9 TYR  HE2    31 ASP- HA      5,02                "     134   3   134   53   parsed_1ss3   1   
        134   "9 TYR  HE2    31 ASP- HB2     3,47                "     135   3   135   53   parsed_1ss3   1   
        135   "9 TYR  HD2    31 ASP- HN      4,78                "     136   3   136   53   parsed_1ss3   1   
        136   "9 TYR  HD2    31 ASP- HA      4,42                "     137   3   137   53   parsed_1ss3   1   
        137   "9 TYR  HD2    31 ASP- HB2     5,03                "     138   3   138   53   parsed_1ss3   1   
        138   "9 TYR  HD2    34 CYS  QB      5,71                "     139   3   139   53   parsed_1ss3   1   
        139   "10 ASP- HN     10 ASP- HA      2,90                "    140   2   140   53   parsed_1ss3   1   
        140   "10 ASP- HN     10 ASP- HB2     3,10                "    141   2   141   53   parsed_1ss3   1   
        141   "10 ASP- HN     10 ASP- HB3     3,10                "    142   2   142   53   parsed_1ss3   1   
        142   "10 ASP- HN     10 ASP- QB      2,77                "    143   2   143   53   parsed_1ss3   1   
        143   "10 ASP- HN     11 THR  HN      3,06                "    144   2   144   53   parsed_1ss3   1   
        144   "10 ASP- HN     12 CYS  HN      6,00                "    145   2   145   53   parsed_1ss3   1   
        145   "10 ASP- HA     13 HIS  HN      3,59                "    146   2   146   53   parsed_1ss3   1   
        146   "10 ASP- HA     13 HIS  HB2     3,69                "    147   2   147   53   parsed_1ss3   1   
        147   "10 ASP- HA     13 HIS  HB3     4,32                "    148   2   148   53   parsed_1ss3   1   
        148   "10 ASP- HA     14 LYS+ HN      4,61                "    149   2   149   53   parsed_1ss3   1   
        149   "10 ASP- HB2    11 THR  HN      3,36                "    150   2   150   53   parsed_1ss3   1   
        150   "10 ASP- HB3    11 THR  HN      3,36                "    151   2   151   53   parsed_1ss3   1   
        151   "10 ASP- QB     11 THR  HN      3,11                "    152   2   152   53   parsed_1ss3   1   
        152   "11 THR  HN     11 THR  HB      2,70                "    153   2   153   53   parsed_1ss3   1   
        153   "11 THR  HN     11 THR  QG2     4,62                "    154   2   154   53   parsed_1ss3   1   
        154   "11 THR  HN     12 CYS  HN      2,90                "    155   2   155   53   parsed_1ss3   1   
        155   "11 THR  HA     11 THR  QG2     3,79                "    156   2   156   53   parsed_1ss3   1   
        156   "11 THR  HA     12 CYS  HN      3,59                "    157   2   157   53   parsed_1ss3   1   
        157   "11 THR  HA     14 LYS+ HN      3,62                "    158   2   158   53   parsed_1ss3   1   
        158   "11 THR  HA     14 LYS+ QB      4,20                "    159   2   159   53   parsed_1ss3   1   
        159   "11 THR  HB     12 CYS  HN      3,23                "    160   2   160   53   parsed_1ss3   1   
        160   "11 THR  QG2    12 CYS  HN      5,01                "    161   2   161   53   parsed_1ss3   1   
        161   "12 CYS  HN     12 CYS  QB      3,58                "    162   2   162   53   parsed_1ss3   1   
        162   "12 CYS  HN     13 HIS  HN      2,96                "    163   2   163   53   parsed_1ss3   1   
        163   "12 CYS  HN     14 LYS+ HN      4,22                "    164   2   164   53   parsed_1ss3   1   
        164   "12 CYS  HA     13 HIS  HN      3,56                "    165   2   165   53   parsed_1ss3   1   
        165   "12 CYS  CB     30 CYS  SG      3,10                "    166   2   166   53   parsed_1ss3   1   
        166   "12 CYS  QB     13 HIS  HN      3,94                "    167   2   167   53   parsed_1ss3   1   
        167   "12 CYS  QB     30 CYS  HB2     6,25                "    168   2   168   53   parsed_1ss3   1   
        168   "12 CYS  QB     30 CYS  HB3     4,20                "    169   2   169   53   parsed_1ss3   1   
        169   "12 CYS  SG     30 CYS  CB      3,10                "    170   2   170   53   parsed_1ss3   1   
        170   "12 CYS  SG     30 CYS  SG      2,10                "    171   2   171   53   parsed_1ss3   1   
        171   "13 HIS  HN     13 HIS  HA      2,83                "    172   2   172   53   parsed_1ss3   1   
        172   "13 HIS  HN     13 HIS  HB2     2,70                "    173   2   173   53   parsed_1ss3   1   
        173   "13 HIS  HN     13 HIS  HB3     2,87                "    174   2   174   53   parsed_1ss3   1   
        174   "13 HIS  HN     14 LYS+ HN      2,96                "    175   2   175   53   parsed_1ss3   1   
        175   "13 HIS  HN     14 LYS+ QB      5,79                "    176   2   176   53   parsed_1ss3   1   
        176   "13 HIS  HA     13 HIS  HB3     2,93                "    177   2   177   53   parsed_1ss3   1   
        177   "13 HIS  HA     13 HIS  HD2     4,75                "    178   2   178   53   parsed_1ss3   1   
        178   "13 HIS  HA     14 LYS+ HN      3,62                "    179   2   179   53   parsed_1ss3   1   
        179   "13 HIS  HA     16 CYS  HN      3,62                "    180   2   180   53   parsed_1ss3   1   
        180   "13 HIS  HA     16 CYS  HB2     3,53                "    181   2   181   53   parsed_1ss3   1   
        181   "13 HIS  HA     16 CYS  HB3     2,73                "    182   2   182   53   parsed_1ss3   1   
        182   "13 HIS  HA     17 SER  HN      4,15                "    183   2   183   53   parsed_1ss3   1   
        183   "13 HIS  HA     26 CYS  HB2     5,14                "    184   2   184   53   parsed_1ss3   1   
        184   "13 HIS  HA     26 CYS  HB3     3,33                "    185   2   185   53   parsed_1ss3   1   
        185   "13 HIS  HB2    13 HIS  HD2     3,33                "    186   2   186   53   parsed_1ss3   1   
        186   "13 HIS  HB2    14 LYS+ HN      3,59                "    187   2   187   53   parsed_1ss3   1   
        187   "13 HIS  HB3    14 LYS+ HN      3,13                "    188   2   188   53   parsed_1ss3   1   
        188   "13 HIS  HD2    26 CYS  HB2     4,38                "    189   2   189   53   parsed_1ss3   1   
        189   "13 HIS  HD2    26 CYS  HB3     4,35                "    190   2   190   53   parsed_1ss3   1   
        190   "13 HIS  HD2    27 GLU- HN      5,44                "    191   2   191   53   parsed_1ss3   1   
        191   "13 HIS  HD2    27 GLU- HA      2,73                "    192   2   192   53   parsed_1ss3   1   
        192   "13 HIS  HD2    27 GLU- QB      4,93                "    193   2   193   53   parsed_1ss3   1   
        193   "13 HIS  HD2    30 CYS  HB2     5,08                "    194   2   194   53   parsed_1ss3   1   
        194   "14 LYS+ HN     14 LYS+ HA      2,83                "    195   2   195   53   parsed_1ss3   1   
        195   "14 LYS+ HN     14 LYS+ QB      3,58                "    196   2   196   53   parsed_1ss3   1   
        196   "14 LYS+ HN     14 LYS+ HG2     6,00                "    197   2   197   53   parsed_1ss3   1   
        197   "14 LYS+ HN     14 LYS+ HG3     6,00                "    198   2   198   53   parsed_1ss3   1   
        198   "14 LYS+ HN     14 LYS+ QG      5,52                "    199   2   199   53   parsed_1ss3   1   
        199   "14 LYS+ HN     15 GLU- HN      3,13                "    200   2   200   53   parsed_1ss3   1   
        200   "14 LYS+ HA     17 SER  HN      4,09                "    201   2   201   53   parsed_1ss3   1   
        201   "14 LYS+ HA     18 ASP- HN      5,08                "    202   2   202   53   parsed_1ss3   1   
        202   "14 LYS+ QB     15 GLU- HN      5,49                "    203   2   203   53   parsed_1ss3   1   
        203   "14 LYS+ HG2    15 GLU- HN      6,00                "    204   2   204   53   parsed_1ss3   1   
        204   "14 LYS+ HG3    15 GLU- HN      6,00                "    205   2   205   53   parsed_1ss3   1   
        205   "15 GLU- HN     15 GLU- HB2     2,80                "    206   2   206   53   parsed_1ss3   1   
        206   "15 GLU- HN     15 GLU- HB3     2,80                "    207   2   207   53   parsed_1ss3   1   
        207   "15 GLU- HN     15 GLU- HG2     4,98                "    208   2   208   53   parsed_1ss3   1   
        208   "15 GLU- HN     15 GLU- HG3     4,98                "    209   2   209   53   parsed_1ss3   1   
        209   "15 GLU- HN     15 GLU- QG      4,40                "    210   2   210   53   parsed_1ss3   1   
        210   "15 GLU- HN     16 CYS  HN      2,96                "    211   2   211   53   parsed_1ss3   1   
        211   "15 GLU- HA     18 ASP- HN      3,53                "    212   2   212   53   parsed_1ss3   1   
        212   "15 GLU- HA     18 ASP- HB2     3,62                "    213   2   213   53   parsed_1ss3   1   
        213   "15 GLU- HA     18 ASP- HB3     3,29                "    214   2   214   53   parsed_1ss3   1   
        214   "15 GLU- HB2    16 CYS  HN      4,78                "    215   2   215   53   parsed_1ss3   1   
        215   "15 GLU- HB3    16 CYS  HN      4,78                "    216   2   216   53   parsed_1ss3   1   
        216   "15 GLU- QB     16 CYS  HN      4,49                "    217   2   217   53   parsed_1ss3   1   
        217   "16 CYS  HN     16 CYS  HA      2,70                "    218   2   218   53   parsed_1ss3   1   
        218   "16 CYS  HN     16 CYS  HB2     2,70                "    219   2   219   53   parsed_1ss3   1   
        219   "16 CYS  HN     16 CYS  HB3     2,73                "    220   2   220   53   parsed_1ss3   1   
        220   "16 CYS  HN     17 SER  HN      2,87                "    221   2   221   53   parsed_1ss3   1   
        221   "16 CYS  CB     26 CYS  SG      3,10                "    222   2   222   53   parsed_1ss3   1   
        222   "16 CYS  HB2    17 SER  HN      3,46                "    223   2   223   53   parsed_1ss3   1   
        223   "16 CYS  HB2    26 CYS  HB3     4,91                "    224   2   224   53   parsed_1ss3   1   
        224   "16 CYS  HB3    17 SER  HN      3,00                "    225   2   225   53   parsed_1ss3   1   
        225   "16 CYS  HB3    26 CYS  HB2     5,11                "    226   2   226   53   parsed_1ss3   1   
        226   "16 CYS  HB3    26 CYS  HB3     3,33                "    227   2   227   53   parsed_1ss3   1   
        227   "16 CYS  SG     26 CYS  CB      3,10                "    228   2   228   53   parsed_1ss3   1   
        228   "16 CYS  SG     26 CYS  SG      2,10                "    229   2   229   53   parsed_1ss3   1   
        229   "17 SER  HN     17 SER  HB2     3,16                "    230   2   230   53   parsed_1ss3   1   
        230   "17 SER  HN     17 SER  HB3     3,16                "    231   2   231   53   parsed_1ss3   1   
        231   "17 SER  HN     17 SER  QB      2,95                "    232   2   232   53   parsed_1ss3   1   
        232   "17 SER  HN     18 ASP- HN      3,06                "    233   2   233   53   parsed_1ss3   1   
        233   "17 SER  HA     17 SER  HB2     3,00                "    234   2   234   53   parsed_1ss3   1   
        234   "17 SER  HA     17 SER  HB3     3,00                "    235   2   235   53   parsed_1ss3   1   
        235   "17 SER  HA     21 ASN  HN      3,39                "    236   2   236   53   parsed_1ss3   1   
        236   "17 SER  HB2    18 ASP- HN      3,59                "    237   2   237   53   parsed_1ss3   1   
        237   "17 SER  HB3    18 ASP- HN      3,59                "    238   2   238   53   parsed_1ss3   1   
        238   "17 SER  QB     18 ASP- HN      3,29                "    239   2   239   53   parsed_1ss3   1   
        239   "18 ASP- HN     18 ASP- HB2     3,16                "    240   2   240   53   parsed_1ss3   1   
        240   "18 ASP- HN     18 ASP- HB3     2,73                "    241   2   241   53   parsed_1ss3   1   
        241   "18 ASP- HN     19 LYS+ HN      3,06                "    242   2   242   53   parsed_1ss3   1   
        242   "18 ASP- HA     18 ASP- HB3     2,96                "    243   2   243   53   parsed_1ss3   1   
        243   "18 ASP- HB2    19 LYS+ HN      4,52                "    244   2   244   53   parsed_1ss3   1   
        244   "18 ASP- HB3    19 LYS+ HN      3,39                "    245   2   245   53   parsed_1ss3   1   
        245   "19 LYS+ HN     19 LYS+ HA      2,70                "    246   2   246   53   parsed_1ss3   1   
        246   "19 LYS+ HN     19 LYS+ HB2     3,10                "    247   2   247   53   parsed_1ss3   1   
        247   "19 LYS+ HN     19 LYS+ HB3     3,10                "    248   2   248   53   parsed_1ss3   1   
        248   "19 LYS+ HN     19 LYS+ QB      2,77                "    249   2   249   53   parsed_1ss3   1   
        249   "19 LYS+ HN     19 LYS+ HG2     3,59                "    250   2   250   53   parsed_1ss3   1   
        250   "19 LYS+ HN     19 LYS+ HG3     3,59                "    251   2   251   53   parsed_1ss3   1   
        251   "19 LYS+ HN     20 GLY  HN      2,87                "    252   2   252   53   parsed_1ss3   1   
        252   "19 LYS+ HA     19 LYS+ QG      3,46                "    253   2   253   53   parsed_1ss3   1   
        253   "19 LYS+ HA     20 GLY  HN      3,29                "    254   2   254   53   parsed_1ss3   1   
        254   "19 LYS+ HB2    20 GLY  HN      4,22                "    255   2   255   53   parsed_1ss3   1   
        255   "19 LYS+ HB2    21 ASN  HD21    5,68                "    256   2   256   53   parsed_1ss3   1   
        256   "19 LYS+ HB2    21 ASN  HD22    5,68                "    257   2   257   53   parsed_1ss3   1   
        257   "19 LYS+ HB3    20 GLY  HN      4,22                "    258   2   258   53   parsed_1ss3   1   
        258   "19 LYS+ HB3    21 ASN  HD21    5,68                "    259   2   259   53   parsed_1ss3   1   
        259   "19 LYS+ HB3    21 ASN  HD22    5,68                "    260   2   260   53   parsed_1ss3   1   
        260   "19 LYS+ QB     20 GLY  HN      3,99                "    261   2   261   53   parsed_1ss3   1   
        261   "19 LYS+ QB     21 ASN  HN      5,40                "    262   2   262   53   parsed_1ss3   1   
        262   "19 LYS+ QB     21 ASN  QD2     4,66                "    263   2   263   53   parsed_1ss3   1   
        263   "20 GLY  HN     20 GLY  HA1     2,70                "    264   2   264   53   parsed_1ss3   1   
        264   "20 GLY  HN     21 ASN  HN      2,87                "    265   2   265   53   parsed_1ss3   1   
        265   "20 GLY  HA1    21 ASN  HN      3,23                "    266   2   266   53   parsed_1ss3   1   
        266   "20 GLY  HA2    21 ASN  HN      3,49                "    267   2   267   53   parsed_1ss3   1   
        267   "21 ASN  HN     21 ASN  HB2     3,49                "    268   2   268   53   parsed_1ss3   1   
        268   "21 ASN  HN     21 ASN  HB3     3,49                "    269   2   269   53   parsed_1ss3   1   
        269   "21 ASN  HN     21 ASN  QB      3,01                "    270   2   270   53   parsed_1ss3   1   
        270   "21 ASN  HN     21 ASN  QD2     4,36                "    271   2   271   53   parsed_1ss3   1   
        271   "21 ASN  HN     22 GLY  HN      4,42                "    272   2   272   53   parsed_1ss3   1   
        272   "21 ASN  HA     21 ASN  HB2     2,77                "    273   2   273   53   parsed_1ss3   1   
        273   "21 ASN  HA     21 ASN  HB3     2,77                "    274   2   274   53   parsed_1ss3   1   
        274   "21 ASN  HA     22 GLY  HN      2,70                "    275   2   275   53   parsed_1ss3   1   
        275   "21 ASN  HB2    21 ASN  HD21    3,82                "    276   2   276   53   parsed_1ss3   1   
        276   "21 ASN  HB2    21 ASN  HD22    3,82                "    277   2   277   53   parsed_1ss3   1   
        277   "21 ASN  HB2    22 GLY  HN      3,76                "    278   2   278   53   parsed_1ss3   1   
        278   "21 ASN  HB2    25 PHE  QD      6,01                "    279   2   279   53   parsed_1ss3   1   
        279   "21 ASN  HB2    25 PHE  HD1     3,24                "    280   2   280   53   parsed_1ss3   1   
        280   "21 ASN  HB3    21 ASN  HD21    3,82                "    281   2   281   53   parsed_1ss3   1   
        281   "21 ASN  HB3    21 ASN  HD22    3,82                "    282   2   282   53   parsed_1ss3   1   
        282   "21 ASN  HB3    22 GLY  HN      3,76                "    283   2   283   53   parsed_1ss3   1   
        283   "21 ASN  HB3    25 PHE  QD      6,01                "    284   2   284   53   parsed_1ss3   1   
        284   "21 ASN  HB3    25 PHE  HD1     3,24                "    285   2   285   53   parsed_1ss3   1   
        285   "21 ASN  QB     22 GLY  HN      3,31                "    286   2   286   53   parsed_1ss3   1   
        286   "21 ASN  QB     25 PHE  HB2     6,88                "    287   2   287   53   parsed_1ss3   1   
        287   "21 ASN  QB     25 PHE  HB3     6,02                "    288   2   288   53   parsed_1ss3   1   
        288   "21 ASN  QB     25 PHE  QD      5,56                "    289   2   289   53   parsed_1ss3   1   
        289   "21 ASN  QB     25 PHE  HD1     2,79                "    290   2   290   53   parsed_1ss3   1   
        290   "22 GLY  HN     23 PHE  HN      5,44                "    291   2   291   53   parsed_1ss3   1   
        291   "22 GLY  HN     25 PHE  HB2     4,45                "    292   2   292   53   parsed_1ss3   1   
        292   "22 GLY  HN     25 PHE  HB3     3,59                "    293   2   293   53   parsed_1ss3   1   
        293   "22 GLY  HN     25 PHE  QD      8,12                "    294   2   294   53   parsed_1ss3   1   
        294   "22 GLY  HN     25 PHE  HD1     5,01                "    295   2   295   53   parsed_1ss3   1   
        295   "23 PHE  HN     23 PHE  HB2     3,43                "    296   2   296   53   parsed_1ss3   1   
        296   "23 PHE  HN     23 PHE  HB3     3,43                "    297   2   297   53   parsed_1ss3   1   
        297   "23 PHE  HN     23 PHE  QB      3,10                "    298   2   298   53   parsed_1ss3   1   
        298   "23 PHE  HA     26 CYS  HB2     4,28                "    299   2   299   53   parsed_1ss3   1   
        299   "23 PHE  HA     26 CYS  HB3     3,49                "    300   2   300   53   parsed_1ss3   1   
        300   "23 PHE  HB2    24 THR  HN      3,86                "    301   2   301   53   parsed_1ss3   1   
        301   "23 PHE  HB3    24 THR  HN      3,86                "    302   2   302   53   parsed_1ss3   1   
        302   "23 PHE  QB     24 THR  HN      3,61                "    303   2   303   53   parsed_1ss3   1   
        303   "23 PHE  QR     24 THR  HN      8,48                "    304   2   304   53   parsed_1ss3   1   
        304   "23 PHE  QR     24 THR  HA      8,48                "    305   2   305   53   parsed_1ss3   1   
        305   "23 PHE  QR     24 THR  QG2     9,24                "    306   2   306   53   parsed_1ss3   1   
        306   "23 PHE  QR     27 GLU- QB      9,23                "    307   2   307   53   parsed_1ss3   1   
        307   "23 PHE  QR     27 GLU- QG      9,36                "    308   2   308   53   parsed_1ss3   1   
        308   "24 THR  HN     24 THR  HB      2,90                "    309   2   309   53   parsed_1ss3   1   
        309   "24 THR  HN     24 THR  QG2     4,68                "    310   2   310   53   parsed_1ss3   1   
        310   "24 THR  HN     25 PHE  HN      3,20                "    311   2   311   53   parsed_1ss3   1   
        311   "24 THR  HA     27 GLU- HN      3,29                "    312   2   312   53   parsed_1ss3   1   
        312   "24 THR  HB     25 PHE  HN      2,90                "    313   2   313   53   parsed_1ss3   1   
        313   "24 THR  QG2    25 PHE  HN      5,21                "    314   2   314   53   parsed_1ss3   1   
        314   "24 THR  QG2    25 PHE  QE      8,59                "    315   2   315   53   parsed_1ss3   1   
        315   "24 THR  QG2    28 MET  HN      7,03                "    316   2   316   53   parsed_1ss3   1   
        316   "25 PHE  HN     25 PHE  HA      2,87                "    317   2   317   53   parsed_1ss3   1   
        317   "25 PHE  HN     25 PHE  HB2     2,77                "    318   2   318   53   parsed_1ss3   1   
        318   "25 PHE  HN     25 PHE  HB3     2,90                "    319   2   319   53   parsed_1ss3   1   
        319   "25 PHE  HN     26 CYS  HN      3,03                "    320   2   320   53   parsed_1ss3   1   
        320   "25 PHE  HA     25 PHE  HB2     2,70                "    321   2   321   53   parsed_1ss3   1   
        321   "25 PHE  HA     25 PHE  HB3     3,06                "    322   2   322   53   parsed_1ss3   1   
        322   "25 PHE  HA     28 MET  HN      4,02                "    323   2   323   53   parsed_1ss3   1   
        323   "25 PHE  HA     28 MET  QB      4,83                "    324   2   324   53   parsed_1ss3   1   
        324   "25 PHE  HA     29 LYS+ HN      6,00                "    325   2   325   53   parsed_1ss3   1   
        325   "25 PHE  HB2    26 CYS  HN      4,22                "    326   2   326   53   parsed_1ss3   1   
        326   "25 PHE  HB3    26 CYS  HN      3,06                "    327   2   327   53   parsed_1ss3   1   
        327   "25 PHE  QD     26 CYS  HN      6,57                "    328   2   328   53   parsed_1ss3   1   
        328   "25 PHE  QD     26 CYS  HA      6,04                "    329   2   329   53   parsed_1ss3   1   
        329   "25 PHE  QD     28 MET  QB      9,00                "    330   2   330   53   parsed_1ss3   1   
        330   "25 PHE  QD     29 LYS+ HB2     7,40                "    331   2   331   53   parsed_1ss3   1   
        331   "25 PHE  QD     29 LYS+ HB3     8,12                "    332   2   332   53   parsed_1ss3   1   
        332   "25 PHE  QD     29 LYS+ QG      9,00                "    333   2   333   53   parsed_1ss3   1   
        333   "25 PHE  QE     29 LYS+ HB2     6,08                "    334   2   334   53   parsed_1ss3   1   
        334   "25 PHE  QE     29 LYS+ HB3     8,12                "    335   2   335   53   parsed_1ss3   1   
        335   "25 PHE  QE     29 LYS+ HG2     7,69                "    336   2   336   53   parsed_1ss3   1   
        336   "25 PHE  QE     29 LYS+ HG3     7,69                "    337   2   337   53   parsed_1ss3   1   
        337   "25 PHE  QE     29 LYS+ QG      7,08                "    338   2   338   53   parsed_1ss3   1   
        338   "25 PHE  QE     29 LYS+ QD      7,28                "    339   2   339   53   parsed_1ss3   1   
        339   "25 PHE  HD1    26 CYS  HN      3,71                "    340   2   340   53   parsed_1ss3   1   
        340   "25 PHE  HD1    26 CYS  HA      3,27                "    341   2   341   53   parsed_1ss3   1   
        341   "26 CYS  HN     26 CYS  HA      2,70                "    342   2   342   53   parsed_1ss3   1   
        342   "26 CYS  HN     26 CYS  HB2     2,73                "    343   2   343   53   parsed_1ss3   1   
        343   "26 CYS  HN     26 CYS  HB3     3,20                "    344   2   344   53   parsed_1ss3   1   
        344   "26 CYS  HN     27 GLU- HN      3,06                "    345   2   345   53   parsed_1ss3   1   
        345   "26 CYS  HB2    27 GLU- HN      3,23                "    346   2   346   53   parsed_1ss3   1   
        346   "26 CYS  HB3    27 GLU- HN      3,59                "    347   2   347   53   parsed_1ss3   1   
        347   "27 GLU- HN     27 GLU- HA      2,83                "    348   2   348   53   parsed_1ss3   1   
        348   "27 GLU- HN     27 GLU- HB2     3,23                "    349   2   349   53   parsed_1ss3   1   
        349   "27 GLU- HN     27 GLU- HB3     3,23                "    350   2   350   53   parsed_1ss3   1   
        350   "27 GLU- HN     27 GLU- QG      4,37                "    351   2   351   53   parsed_1ss3   1   
        351   "27 GLU- HN     28 MET  HN      2,87                "    352   2   352   53   parsed_1ss3   1   
        352   "27 GLU- HA     30 CYS  HB2     5,44                "    353   2   353   53   parsed_1ss3   1   
        353   "27 GLU- HA     31 ASP- HN      4,75                "    354   2   354   53   parsed_1ss3   1   
        354   "27 GLU- QB     28 MET  HN      3,98                "    355   2   355   53   parsed_1ss3   1   
        355   "28 MET  HN     28 MET  HA      2,90                "    356   2   356   53   parsed_1ss3   1   
        356   "28 MET  HN     28 MET  QB      3,71                "    357   2   357   53   parsed_1ss3   1   
        357   "28 MET  HN     28 MET  QG      5,16                "    358   2   358   53   parsed_1ss3   1   
        358   "28 MET  HN     29 LYS+ HN      2,93                "    359   2   359   53   parsed_1ss3   1   
        359   "28 MET  HA     31 ASP- HN      3,89                "    360   2   360   53   parsed_1ss3   1   
        360   "28 MET  HA     31 ASP- HB3     3,72                "    361   2   361   53   parsed_1ss3   1   
        361   "28 MET  HA     32 THR  HN      6,00                "    362   2   362   53   parsed_1ss3   1   
        362   "28 MET  QB     29 LYS+ HN      3,68                "    363   2   363   53   parsed_1ss3   1   
        363   "28 MET  QB     32 THR  HN      6,88                "    364   2   364   53   parsed_1ss3   1   
        364   "29 LYS+ HN     29 LYS+ HB2     2,70                "    365   2   365   53   parsed_1ss3   1   
        365   "29 LYS+ HN     29 LYS+ HB3     2,70                "    366   2   366   53   parsed_1ss3   1   
        366   "29 LYS+ HN     29 LYS+ QG      6,06                "    367   2   367   53   parsed_1ss3   1   
        367   "29 LYS+ HA     29 LYS+ HB2     2,70                "    368   2   368   53   parsed_1ss3   1   
        368   "29 LYS+ HA     29 LYS+ HB3     3,00                "    369   2   369   53   parsed_1ss3   1   
        369   "29 LYS+ HA     29 LYS+ QG      3,87                "    370   2   370   53   parsed_1ss3   1   
        370   "29 LYS+ HA     30 CYS  HN      3,56                "    371   2   371   53   parsed_1ss3   1   
        371   "29 LYS+ HA     32 THR  HN      4,25                "    372   2   372   53   parsed_1ss3   1   
        372   "29 LYS+ HA     32 THR  HB      3,23                "    373   2   373   53   parsed_1ss3   1   
        373   "29 LYS+ HA     33 ASP- HN      5,01                "    374   2   374   53   parsed_1ss3   1   
        374   "29 LYS+ HB2    29 LYS+ QG      2,75                "    375   2   375   53   parsed_1ss3   1   
        375   "29 LYS+ HB2    29 LYS+ HE2     6,00                "    376   2   376   53   parsed_1ss3   1   
        376   "29 LYS+ HB2    29 LYS+ HE3     6,00                "    377   2   377   53   parsed_1ss3   1   
        377   "29 LYS+ HB2    29 LYS+ QE      5,18                "    378   2   378   53   parsed_1ss3   1   
        378   "29 LYS+ HB2    30 CYS  HN      3,46                "    379   2   379   53   parsed_1ss3   1   
        379   "29 LYS+ HB3    30 CYS  HN      3,10                "    380   2   380   53   parsed_1ss3   1   
        380   "29 LYS+ QG     30 CYS  HN      5,16                "    381   2   381   53   parsed_1ss3   1   
        381   "30 CYS  HN     30 CYS  HB2     3,33                "    382   2   382   53   parsed_1ss3   1   
        382   "30 CYS  HN     30 CYS  HB3     3,46                "    383   2   383   53   parsed_1ss3   1   
        383   "30 CYS  HN     31 ASP- HN      2,80                "    384   2   384   53   parsed_1ss3   1   
        384   "30 CYS  HN     32 THR  HN      4,75                "    385   2   385   53   parsed_1ss3   1   
        385   "30 CYS  HA     30 CYS  HB3     2,83                "    386   2   386   53   parsed_1ss3   1   
        386   "30 CYS  HA     33 ASP- HN      3,23                "    387   2   387   53   parsed_1ss3   1   
        387   "30 CYS  HA     33 ASP- HB2     3,20                "    388   2   388   53   parsed_1ss3   1   
        388   "30 CYS  HA     33 ASP- HB3     3,20                "    389   2   389   53   parsed_1ss3   1   
        389   "30 CYS  HA     33 ASP- QB      2,83                "    390   2   390   53   parsed_1ss3   1   
        390   "30 CYS  HA     34 CYS  HN      4,75                "    391   2   391   53   parsed_1ss3   1   
        391   "30 CYS  HB2    31 ASP- HN      3,46                "    392   2   392   53   parsed_1ss3   1   
        392   "30 CYS  HB3    31 ASP- HN      3,89                "    393   2   393   53   parsed_1ss3   1   
        393   "31 ASP- HN     31 ASP- HB2     2,70                "    394   2   394   53   parsed_1ss3   1   
        394   "31 ASP- HN     31 ASP- HB3     2,80                "    395   2   395   53   parsed_1ss3   1   
        395   "31 ASP- HN     32 THR  HN      2,87                "    396   2   396   53   parsed_1ss3   1   
        396   "31 ASP- HN     33 ASP- HN      6,00                "    397   2   397   53   parsed_1ss3   1   
        397   "31 ASP- HB2    32 THR  HN      3,26                "    398   2   398   53   parsed_1ss3   1   
        398   "31 ASP- HB3    32 THR  HN      3,00                "    399   2   399   53   parsed_1ss3   1   
        399   "32 THR  HN     32 THR  HA      2,93                "    400   2   400   53   parsed_1ss3   1   
        400   "32 THR  HN     32 THR  HB      2,70                "    401   2   401   53   parsed_1ss3   1   
        401   "32 THR  HN     32 THR  QG2     4,72                "    402   2   402   53   parsed_1ss3   1   
        402   "32 THR  HN     33 ASP- HN      2,93                "    403   2   403   53   parsed_1ss3   1   
        403   "32 THR  HA     32 THR  HB      3,03                "    404   2   404   53   parsed_1ss3   1   
        404   "32 THR  HA     33 ASP- HN      3,53                "    405   2   405   53   parsed_1ss3   1   
        405   "32 THR  HA     35 SER  HN      5,47                "    406   2   406   53   parsed_1ss3   1   
        406   "32 THR  QG2    33 ASP- HN      4,39                "    407   2   407   53   parsed_1ss3   1   
        407   "33 ASP- HN     33 ASP- HA      2,70                "    408   2   408   53   parsed_1ss3   1   
        408   "33 ASP- HN     33 ASP- HB2     3,23                "    409   2   409   53   parsed_1ss3   1   
        409   "33 ASP- HN     33 ASP- HB3     3,23                "    410   2   410   53   parsed_1ss3   1   
        410   "33 ASP- HN     33 ASP- QB      2,86                "    411   2   411   53   parsed_1ss3   1   
        411   "33 ASP- HN     34 CYS  HN      3,13                "    412   2   412   53   parsed_1ss3   1   
        412   "33 ASP- HA     33 ASP- QB      2,75                "    413   2   413   53   parsed_1ss3   1   
        413   "33 ASP- HB2    34 CYS  HN      3,86                "    414   2   414   53   parsed_1ss3   1   
        414   "33 ASP- HB3    34 CYS  HN      3,86                "    415   2   415   53   parsed_1ss3   1   
        415   "33 ASP- QB     34 CYS  HN      3,39                "    416   2   416   53   parsed_1ss3   1   
        416   "34 CYS  HN     34 CYS  QB      3,77                "    417   2   417   53   parsed_1ss3   1   
        417   "34 CYS  QB     35 SER  HN      5,09                "    418   2   418   53   parsed_1ss3   1   
        418   "35 SER  HN     36 VAL  HN      4,15                "    419   2   419   53   parsed_1ss3   1   
        419   "35 SER  HA     36 VAL  HN      2,70                "    420   2   420   53   parsed_1ss3   1   
        420   "36 VAL  HN     36 VAL  HA      2,70                "    421   2   421   53   parsed_1ss3   1   
        421   "36 VAL  HN     36 VAL  HB      2,77                "    422   2   422   53   parsed_1ss3   1   
        422   "36 VAL  HN     36 VAL  QG1     4,49                "    423   2   423   53   parsed_1ss3   1   
        423   "36 VAL  HN     36 VAL  QG2     4,49                "    424   2   424   53   parsed_1ss3   1   
        424   "36 VAL  HN     36 VAL  QQG     3,82                "    425   2   425   53   parsed_1ss3   1   
        425   "36 VAL  HN     37 LYS+ HN      4,35                "    426   2   426   53   parsed_1ss3   1   
        426   "36 VAL  HA     36 VAL  HB      2,90                "    427   2   427   53   parsed_1ss3   1   
        427   "36 VAL  HA     37 LYS+ HN      2,70                "    428   2   428   53   parsed_1ss3   1   
        428   "36 VAL  HB     37 LYS+ HN      3,46                "    429   2   429   53   parsed_1ss3   1   
        429   "36 VAL  QG1    37 LYS+ HN      7,03                "    430   2   430   53   parsed_1ss3   1   
        430   "36 VAL  QG2    37 LYS+ HN      7,03                "    431   2   431   53   parsed_1ss3   1   
        431   "36 VAL  QQG    37 LYS+ HN      5,61                "    432   2   432   53   parsed_1ss3   1   
        432   "37 LYS+ HN     37 LYS+ QB      3,74                "    433   2   433   53   parsed_1ss3   1   
        433   "37 LYS+ HN     37 LYS+ QG      4,63                "    434   2   434   53   parsed_1ss3   1   
        434   "38 ASP- HN     38 ASP- HB2     3,16                "    435   2   435   53   parsed_1ss3   1   
        435   "38 ASP- HN     38 ASP- HB3     3,16                "    436   2   436   53   parsed_1ss3   1   
        436   "38 ASP- HA     39 VAL  HN      2,70                "    437   2   437   53   parsed_1ss3   1   
        437   "38 ASP- HB2    39 VAL  HN      4,61                "    438   2   438   53   parsed_1ss3   1   
        438   "38 ASP- HB3    39 VAL  HN      4,61                "    439   2   439   53   parsed_1ss3   1   
        439   "38 ASP- QB     39 VAL  HN      4,22                "    440   2   440   53   parsed_1ss3   1   
        440   "39 VAL  HN     39 VAL  HB      2,87                "    441   2   441   53   parsed_1ss3   1   
        441   "39 VAL  HN     40 LYS+ HN      3,36                "    442   2   442   53   parsed_1ss3   1   
        442   "39 VAL  HA     40 LYS+ HN      2,80                "    443   2   443   53   parsed_1ss3   1   
        443   "39 VAL  HB     40 LYS+ HN      5,08                "    444   2   444   53   parsed_1ss3   1   
        444   "39 VAL  QQG    40 LYS+ HN      6,04                "    445   2   445   53   parsed_1ss3   1   
        445   "39 VAL  QQG    41 GLU- HN      7,23                "    446   2   446   53   parsed_1ss3   1   
        446   "40 LYS+ HN     40 LYS+ HA      2,70                "    447   2   447   53   parsed_1ss3   1   
        447   "40 LYS+ HN     40 LYS+ QG      5,89                "    448   2   448   53   parsed_1ss3   1   
        448   "40 LYS+ QB     41 GLU- HN      4,50                "    449   2   449   53   parsed_1ss3   1   
        449   "40 LYS+ QB     43 LEU  HN      6,12                "    450   2   450   53   parsed_1ss3   1   
        450   "41 GLU- HN     41 GLU- HB2     3,56                "    451   2   451   53   parsed_1ss3   1   
        451   "41 GLU- HN     41 GLU- HB3     3,56                "    452   2   452   53   parsed_1ss3   1   
        452   "41 GLU- HN     41 GLU- QB      3,17                "    453   2   453   53   parsed_1ss3   1   
        453   "41 GLU- HN     41 GLU- QG      6,84                "    454   2   454   53   parsed_1ss3   1   
        454   "41 GLU- HA     42 LYS+ HN      2,80                "    455   2   455   53   parsed_1ss3   1   
        455   "41 GLU- HB2    42 LYS+ HN      4,75                "    456   2   456   53   parsed_1ss3   1   
        456   "41 GLU- HB3    42 LYS+ HN      4,75                "    457   2   457   53   parsed_1ss3   1   
        457   "41 GLU- QB     42 LYS+ HN      4,27                "    458   2   458   53   parsed_1ss3   1   
        458   "42 LYS+ HN     42 LYS+ HB2     3,29                "    459   2   459   53   parsed_1ss3   1   
        459   "42 LYS+ HN     42 LYS+ HB3     3,29                "    460   2   460   53   parsed_1ss3   1   
        460   "42 LYS+ HN     42 LYS+ QB      3,07                "    461   2   461   53   parsed_1ss3   1   
        461   "42 LYS+ HN     42 LYS+ QG      6,39                "    462   2   462   53   parsed_1ss3   1   
        462   "42 LYS+ HA     43 LEU  HN      3,29                "    463   2   463   53   parsed_1ss3   1   
        463   "43 LEU  HN     43 LEU  HA      2,70                "    464   2   464   53   parsed_1ss3   1   
        464   "43 LEU  HN     43 LEU  HB2     3,89                "    465   2   465   53   parsed_1ss3   1   
        465   "43 LEU  HN     43 LEU  HB3     3,89                "    466   2   466   53   parsed_1ss3   1   
        466   "43 LEU  HN     43 LEU  QB      3,29                "    467   2   467   53   parsed_1ss3   1   
        467   "43 LEU  HN     43 LEU  HG      3,95                "    468   2   468   53   parsed_1ss3   1   
        468   "43 LEU  HN     43 LEU  QQD     8,60                "    469   2   469   53   parsed_1ss3   1   
        469   "43 LEU  HA     44 GLU- HN      3,23                "    470   2   470   53   parsed_1ss3   1   
        470   "43 LEU  HB2    44 GLU- HN      4,38                "    471   2   471   53   parsed_1ss3   1   
        471   "43 LEU  HB3    44 GLU- HN      4,38                "    472   2   472   53   parsed_1ss3   1   
        472   "43 LEU  QB     44 GLU- HN      4,05                "    473   2   473   53   parsed_1ss3   1   
        473   "44 GLU- HN     44 GLU- HB2     3,99                "    474   2   474   53   parsed_1ss3   1   
        474   "44 GLU- HN     44 GLU- HB3     3,99                "    475   2   475   53   parsed_1ss3   1   
        475   "44 GLU- HN     44 GLU- QB      3,43                "    476   2   476   53   parsed_1ss3   1   
        476   "44 GLU- HN     44 GLU- QG      6,22                "    477   2   477   53   parsed_1ss3   1   
        477   "45 ASN  QB     46 TYR  HN      4,11                "    478   2   478   53   parsed_1ss3   1   
        478   "46 TYR  HA     47 LYS+ HN      2,77                "    479   2   479   53   parsed_1ss3   1   
        479   "47 LYS+ HN     47 LYS+ HB2     3,82                "    480   2   480   53   parsed_1ss3   1   
        480   "47 LYS+ HN     47 LYS+ HB3     3,82                "    481   2   481   53   parsed_1ss3   1   
        481   "47 LYS+ HN     47 LYS+ QB      3,50                "    482   2   482   53   parsed_1ss3   1   
        482   "47 LYS+ HN     47 LYS+ QG      6,88                "    483   2   483   53   parsed_1ss3   1   
        483   "47 LYS+ HA     47 LYS+ QE      6,88                "    484   2   484   53   parsed_1ss3   1   
        484   "47 LYS+ QB     49 LYS+ HA      6,88                "    485   2   485   53   parsed_1ss3   1   
        485   "48 PRO  HA     49 LYS+ HN      2,77                "    486   2   486   53   parsed_1ss3   1   
        486   
;
49 LYS+ QB     50 ASN  QB      6,53                

;
   487   2   488    1   parsed_1ss3   1   
    stop_

save_





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