NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type
638227 6osw 30608 cing 1-original 1 STAR chemical shift


# Restraints file 1: FoxM1_cs_QRBLEUp.str
data_nef_csrosetta_test_1

#######################
#  Entry information  #
#######################

save_nef_nmr_meta_data
   _Entry.Sf_category                 entry_information
   _Entry.Sf_framecode                nef_nmr_meta_data
   _Entry.NMR_STAR_version            3.2.0.4
   _Entry.Source_data_format          nmr_exchange_format
   _Entry.Source_data_format_version  1.1
   _Entry.Generated_software_name     CS-Rosetta
   _Entry.Generated_software_version  3.4
   _Entry.Generated_date              2019-01-03
   _Entry.UUID                        CS-Rosetta_Thu_Jan_3_21:43:48_PST_bf8fe124-46b4-4575-81b5-7151a341a58f
save_

#############################################
#  Molecular system (assembly) description  #
#############################################

save_nef_molecular_system
   _Assembly.Sf_category   assembly
   _Assembly.Sf_framecode  nef_molecular_system

   loop_
      _Chem_comp_assembly.Entity_assembly_ID
      _Chem_comp_assembly.Comp_index_ID
      _Chem_comp_assembly.Comp_ID
      _Chem_comp_assembly.Auth_asym_ID
      _Chem_comp_assembly.Auth_seq_ID
      _Chem_comp_assembly.Auth_comp_ID
      _Chem_comp_assembly.Auth_variant_ID
      _Chem_comp_assembly.Sequence_linking
      _Chem_comp_assembly.NEF_index

     1   1    GLY   A   32   GLY   .   start    1
     1   2    ILE   A   33   ILE   .   middle   2
     1   3    ARG   A   34   ARG   .   middle   3
     1   4    VAL   A   35   VAL   .   middle   4
     1   5    MET   A   36   MET   .   middle   5
     1   6    ASP   A   37   ASP   .   middle   6
     1   7    HIS   A   38   HIS   .   middle   7
     1   8    PRO   A   39   PRO   .   middle   8
     1   9    THR   A   40   THR   .   middle   9
     1   10   MET   A   41   MET   .   middle   10
     1   11   PRO   A   42   PRO   .   middle   11
     1   12   ASP   A   43   ASP   .   middle   12
     1   13   THR   A   44   THR   .   middle   13
     1   14   GLN   A   45   GLN   .   middle   14
     1   15   VAL   A   46   VAL   .   middle   15
     1   16   VAL   A   47   VAL   .   middle   16
     1   17   VAL   A   48   VAL   .   middle   17
     1   18   ILE   A   49   ILE   .   middle   18
     1   19   PRO   A   50   PRO   .   middle   19
     1   20   LYS   A   51   LYS   .   middle   20
     1   21   SER   A   52   SER   .   middle   21
     1   22   ALA   A   53   ALA   .   middle   22
     1   23   ASP   A   54   ASP   .   middle   23
     1   24   LEU   A   55   LEU   .   middle   24
     1   25   GLN   A   56   GLN   .   middle   25
     1   26   SER   A   57   SER   .   middle   26
     1   27   VAL   A   58   VAL   .   middle   27
     1   28   ILE   A   59   ILE   .   middle   28
     1   29   SER   A   60   SER   .   middle   29
     1   30   VAL   A   61   VAL   .   middle   30
     1   31   LEU   A   62   LEU   .   middle   31
     1   32   THR   A   63   THR   .   middle   32
     1   33   ALA   A   64   ALA   .   middle   33
     1   34   LYS   A   65   LYS   .   middle   34
     1   35   GLY   A   66   GLY   .   middle   35
     1   36   LYS   A   67   LYS   .   middle   36
     1   37   GLU   A   68   GLU   .   middle   37
     1   38   ALA   A   69   ALA   .   middle   38
     1   39   GLY   A   70   GLY   .   middle   39
     1   40   PRO   A   71   PRO   .   middle   40
     1   41   GLN   A   72   GLN   .   middle   41
     1   42   GLY   A   73   GLY   .   middle   42
     1   43   ARG   A   74   ARG   .   middle   43
     1   44   ASN   A   75   ASN   .   middle   44
     1   45   LYS   A   76   LYS   .   middle   45
     1   46   PHE   A   77   PHE   .   middle   46
     1   47   ILE   A   78   ILE   .   middle   47
     1   48   LEU   A   79   LEU   .   middle   48
     1   49   LEU   A   80   LEU   .   middle   49
     1   50   SER   A   81   SER   .   middle   50
     1   51   GLY   A   82   GLY   .   middle   51
     1   52   ASP   A   83   ASP   .   middle   52
     1   53   THR   A   84   THR   .   middle   53
     1   54   SER   A   85   SER   .   middle   54
     1   55   ALA   B   569  ALA   .   middle   55
     1   56   GLN   B   570  GLN   .   middle   56
     1   57   ALA   B   571  ALA   .   middle   57
     1   58   GLY   B   572  GLY   .   middle   58
     1   59   ALA   B   573  ALA   .   middle   59
     1   60   ALA   B   574  ALA   .   middle   60
     1   61   ASN   B   575  ASN   .   middle   61
     1   62   ARG   B   576  ARG   .   middle   62
     1   63   SER   B   577  SER   .   middle   63
     1   64   LEU   B   578  LEU   .   middle   64
     1   65   THR   B   579  THR   .   middle   65
     1   66   GLU   B   580  GLU   .   middle   66
     1   67   GLY   B   581  GLY   .   middle   67
     1   68   PHE   B   582  PHE   .   middle   68
     1   69   VAL   B   583  VAL   .   middle   69
     1   70   LEU   B   584  LEU   .   middle   70
     1   71   ASP   B   585  ASP   .   middle   71
     1   72   THR   B   586  THR   .   middle   72
     1   73   MET   B   587  MET   .   middle   73
     1   74   ASN   B   588  ASN   .   middle   74
     1   75   ASP   B   589  ASP   .   middle   75
     1   76   SER   B   590  SER   .   middle   76
     1   77   LEU   B   591  LEU   .   middle   77
     1   78   SER   B   592  SER   .   middle   78
     1   79   LYS   B   593  LYS   .   end      79
   stop_
save_

     ###################################
     #  Assigned chemical shift lists  #
     ###################################

###################################################################
#       Chemical Shift Ambiguity Index Value Definitions          #
#                                                                 #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains.                              #
#                                                                 #
#   Index Value            Definition                             #
#                                                                 #
#      1             Unique (including isolated methyl protons,   #
#                         geminal atoms, and geminal methyl       #
#                         groups with identical chemical shifts)  #
#                         (e.g. ILE HD11, HD12, HD13 protons)     #
#      2             Ambiguity of geminal atoms or geminal methyl #
#                         proton groups (e.g. ASP HB2 and HB3     #
#                         protons, LEU CD1 and CD2 carbons, or    #
#                         LEU HD11, HD12, HD13 and HD21, HD22,    #
#                         HD23 methyl protons)                    #
#      3             Aromatic atoms on opposite sides of          #
#                         symmetrical rings (e.g. TYR HE1 and HE2 #
#                         protons)                                #
#      4             Intraresidue ambiguities (e.g. LYS HG and    #
#                         HD protons or TRP HZ2 and HZ3 protons)  #
#      5             Interresidue ambiguities (LYS 12 vs. LYS 27) #
#      6             Intermolecular ambiguities (e.g. ASP 31 CA   #
#                         in monomer 1 and ASP 31 CA in monomer 2 #
#                         of an asymmetrical homodimer, duplex    #
#                         DNA assignments, or other assignments   #
#                         that may apply to atoms in one or more  #
#                         molecule in the molecular assembly)     #
#      9             Ambiguous, specific ambiguity not defined    #
#                                                                 #
###################################################################

save_nef_chemical_shift_list_1
   _Assigned_chem_shift_list.Sf_category   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode  nef_chemical_shift_list_1

   loop_
      _Atom_chem_shift.ID
      _Atom_chem_shift.Entity_assembly_ID
      _Atom_chem_shift.Comp_index_ID
      _Atom_chem_shift.Comp_ID
      _Atom_chem_shift.Atom_ID
      _Atom_chem_shift.Val
      _Atom_chem_shift.Val_err
      _Atom_chem_shift.Ambiguity_code
      _Atom_chem_shift.Auth_asym_ID
      _Atom_chem_shift.Auth_seq_ID
      _Atom_chem_shift.Auth_comp_ID
      _Atom_chem_shift.Auth_atom_ID
      _Atom_chem_shift.Assigned_chem_shift_list_ID

      1     1     32    GLY   CA    44.680   .     1     A    
32    GLY   CA    1
      2     1     32    GLY   H     8.270    .     1     A    
32     GLY   H     1
      3     1     32    GLY   N     107.870  .     1     A    
32     GLY   N     1
      4     1     33    ILE   C     175.110  .     1     A    
33     ILE   C     1
      5     1     33    ILE   CA    60.910   .     1     A    
33     ILE   CA    1
      6     1     33    ILE   CB    37.310   .     1     A    
33     ILE   CB    1
      7     1     34    ARG   C     176.660  .     1     A    
34     ARG   C     1
      8     1     34    ARG   CA    54.070   .     1     A    
34     ARG   CA    1
      9     1     34    ARG   CB    31.718   .     1     A    
34     ARG   CB    1
      10    1     34    ARG   H     8.030    .     1     A    
34     ARG   H     1
      11    1     34    ARG   N     125.710  .     1     A    
34     ARG   N     1
      12    1     35    VAL   C     175.190  .     1     A    
35     VAL   C     1
      13    1     35    VAL   CA    60.710   .     1     A    
35     VAL   CA    1
      14    1     35    VAL   CB    33.420   .     1     A    
35     VAL   CB    1
      15    1     35    VAL   H     8.790    .     1     A    
35     VAL   H     1
      16    1     35    VAL   N     118.600  .     1     A    
35     VAL   N     1
      17    1     36    MET   C     175.010  .     1     A    
36     MET   C     1
      18    1     36    MET   CA    53.630   .     1     A    
36     MET   CA    1
      19    1     36    MET   CB    35.740   .     1     A    
36     MET   CB    1
      20    1     36    MET   H     9.210    .     1     A    
36     MET   H     1
      21    1     36    MET   N     124.740  .     1     A    
36     MET   N     1
      22    1     37    ASP   C     175.470  .     1     A    
37     ASP   C     1
      23    1     37    ASP   CA    55.150   .     1     A    
37     ASP   CA    1
      24    1     37    ASP   CB    38.890   .     1     A   
37     ASP   CB    1
      25    1     37    ASP   H     9.000    .     1     A    
37     ASP   H     1
      26    1     37    ASP   N     125.300  .     1     A    
37     ASP   N     1
      27    1     38    HIS   CA    55.960   .     1     A    
38     HIS   CA    1
      28    1     38    HIS   H     7.940    .     1     A    
38     HIS   H     1
      29    1     38    HIS   N     125.450  .     1     A    
38     HIS   N     1
      30    1     39    PRO   C     177.720  .     1     A    
39     PRO   C     1
      31    1     39    PRO   CA    64.420   .     1     A    
39     PRO   CA    1
      32    1     39    PRO   CB    31.870   .     1     A    
39     PRO   CB    1
      33    1     40    THR   C     176.430  .     1     A    
40     THR   C     1
      34    1     40    THR   CA    61.680   .     1     A    
40     THR   CA    1
      35    1     40    THR   CB    69.220   .     1     A   
40     THR   CB    1
      36    1     40    THR   H     9.370    .     1     A   
40     THR   H     1
      37    1     40    THR   N     109.340  .     1     A   
40     THR   N     1
      38    1     41    MET   CA    56.410   .     1     A   
41    MET   CA    1
      39    1     41    MET   H     8.170    .     1     A   
41    MET   H     1
      40    1     41    MET   N     123.140  .     1     A   
41    MET   N     1
      41    1     42    PRO   CA    64.270   .     1     A 
42    PRO   CA    1
      42    1     42    PRO   CB    31.000   .     1     A     42    PRO   CB    1
      43    1     43    ASP   C     175.780  .     1     A     43    ASP   C     1
      44    1     43    ASP   CA    52.080   .     1     A     43    ASP   CA    1
      45    1     43    ASP   CB    40.620   .     1     A     43    ASP   CB    1
      46    1     43    ASP   H     7.800    .     1     A     43    ASP   H     1
      47    1     43    ASP   N     114.270  .     1     A     43    ASP   N     1
      48    1     44    THR   CA    62.520   .     1     A     44    THR   CA    1
      49    1     44    THR   CB    71.210   .     1     A     44    THR   CB    1
      50    1     44    THR   H     7.580    .     1     A     44    THR   H     1
      51    1     44    THR   N     116.370  .     1     A     44    THR   N     1
      52    1     45    GLN   C     173.570  .     1     A     45    GLN   C     1
      53    1     45    GLN   CA    54.940   .     1     A     45    GLN   CA    1
      54    1     45    GLN   CB    32.130   .     1     A     45    GLN   CB    1
      55    1     45    GLN   H     8.860    .     1     A     45    GLN   H     1
      56    1     45    GLN   N     126.110  .     1     A     45    GLN   N     1
      57    1     46    VAL   C     173.680  .     1     A     46    VAL   C     1
      58    1     46    VAL   CA    61.570   .     1     A     46    VAL   CA    1
      59    1     46    VAL   CB    32.290   .     1     A     46    VAL   CB    1
      60    1     46    VAL   H     9.550    .     1     A     46    VAL   H     1
      61    1     46    VAL   N     124.250  .     1     A     46    VAL   N     1
      62    1     47    VAL   C     173.980  .     1     A     47    VAL   C     1
      63    1     47    VAL   CA    60.030   .     1     A     47    VAL   CA    1
      64    1     47    VAL   CB    33.450   .     1     A     47    VAL   CB    1
      65    1     47    VAL   H     9.560    .     1     A     47    VAL   H     1
      66    1     47    VAL   N     128.510  .     1     A     47    VAL   N     1
      67    1     48    VAL   C     175.990  .     1     A     48    VAL   C     1
      68    1     48    VAL   CA    61.160   .     1     A     48    VAL   CA    1
      69    1     48    VAL   CB    31.710   .     1     A     48    VAL   CB    1
      70    1     48    VAL   H     8.940    .     1     A     48    VAL   H     1
      71    1     48    VAL   N     126.790  .     1     A     48    VAL   N     1
      72    1     49    ILE   CA    57.760   .     1     A     49    ILE   CA    1
      73    1     49    ILE   H     8.920    .     1     A     49    ILE   H     1
      74    1     49    ILE   N     127.680  .     1     A     49    ILE   N     1
      75    1     50    PRO   C     176.690  .     1     A     50    PRO   C     1
      76    1     50    PRO   CA    62.780   .     1     A     50    PRO   CA    1
      77    1     50    PRO   CB    31.240   .     1     A     50    PRO   CB    1
      78    1     51    LYS   C     176.110  .     1     A     51    LYS   C     1
      79    1     51    LYS   CA    55.970   .     1     A     51    LYS   CA    1
      80    1     51    LYS   CB    29.630   .     1     A     51    LYS   CB    1
      81    1     51    LYS   H     8.350    .     1     A     51    LYS   H     1
      82    1     51    LYS   N     121.390  .     1     A     51    LYS   N     1
      83    1     52    SER   C     174.620  .     1     A     52    SER   C     1
      84    1     52    SER   CA    58.170   .     1     A     52    SER   CA    1
      85    1     52    SER   CB    62.550   .     1     A     52    SER   CB    1
      86    1     52    SER   H     8.350    .     1     A     52    SER   H     1
      87    1     52    SER   N     119.110  .     1     A     52    SER   N     1
      88    1     53    ALA   CA    51.444   .     1     A     53    ALA   CA    1
      89    1     53    ALA   CB    18.920   .     1     A     53    ALA   CB    1
      90    1     53    ALA   H     7.530    .     1     A     53    ALA   H     1
      91    1     53    ALA   N     124.880  .     1     A     53    ALA   N     1
      92    1     54    ASP   C     176.190  .     1     A     54    ASP   C     1
      93    1     54    ASP   CA    53.190   .     1     A     54    ASP   CA    1
      94    1     54    ASP   CB    40.790   .     1     A     54    ASP   CB    1
      95    1     54    ASP   H     8.410    .     1     A     54    ASP   H     1
      96    1     54    ASP   N     120.930  .     1     A     54    ASP   N     1
      97    1     55    LEU   CA    58.090   .     1     A     55    LEU   CA    1
      98    1     55    LEU   CB    40.760   .     1     A     55    LEU   CB    1
      99    1     55    LEU   H     8.540    .     1     A     55    LEU   H     1
      100   1     55    LEU   N     129.010  .     1     A     55    LEU   N     1
      101   1     56    GLN   C     179.050  .     1     A     56    GLN   C     1
      102   1     56    GLN   CA    58.920   .     1     A     56    GLN   CA    1
      103   1     56    GLN   CB    26.800   .     1     A     56    GLN   CB    1
      104   1     56    GLN   H     8.290    .     1     A     56    GLN   H     1
      105   1     56    GLN   N     116.780  .     1     A     56    GLN   N     1
      106   1     57    SER   C     176.670  .     1     A     57    SER   C     1
      107   1     57    SER   CA    61.350   .     1     A     57    SER   CA    1
      108   1     57    SER   CB    62.010   .     1     A     57    SER   CB    1
      109   1     57    SER   H     7.810    .     1     A     57    SER   H     1
      110   1     57    SER   N     116.610  .     1     A     57    SER   N     1
      111   1     58    VAL   C     177.690  .     1     A     58    VAL   C     1
      112   1     58    VAL   CA    66.370   .     1     A     58    VAL   CA    1
      113   1     58    VAL   CB    30.560   .     1     A     58    VAL   CB    1
      114   1     58    VAL   H     7.710    .     1     A     58    VAL   H     1
      115   1     58    VAL   N     122.230  .     1     A     58    VAL   N     1
      116   1     59    ILE   C     179.300  .     1     A     59    ILE   C     1
      117   1     59    ILE   CA    65.590   .     1     A     59    ILE   CA    1
      118   1     59    ILE   CB    36.360   .     1     A     59    ILE   CB    1
      119   1     59    ILE   H     8.530    .     1     A     59    ILE   H     1
      120   1     59    ILE   N     119.830  .     1     A     59    ILE   N     1
      121   1     60    SER   C     177.240  .     1     A     60    SER   C     1
      122   1     60    SER   CA    62.140   .     1     A     60    SER   CA    1
      123   1     60    SER   H     8.090    .     1     A     60    SER   H     1
      124   1     60    SER   N     118.420  .     1     A     60    SER   N     1
      125   1     61    VAL   CA    65.890   .     1     A     61    VAL   CA    1
      126   1     61    VAL   CB    30.870   .     1     A     61    VAL   CB    1
      127   1     61    VAL   H     7.650    .     1     A     61    VAL   H     1
      128   1     61    VAL   N     123.050  .     1     A     61    VAL   N     1
      129   1     62    LEU   CA    55.440   .     1     A     62    LEU   CA    1
      130   1     62    LEU   CB    39.440   .     1     A     62    LEU   CB    1
      131   1     62    LEU   H     8.340    .     1     A     62    LEU   H     1
      132   1     62    LEU   N     119.730  .     1     A     62    LEU   N     1
      133   1     63    THR   C     175.320  .     1     A     63    THR   C     1
      134   1     63    THR   CA    67.330   .     1     A     63    THR   CA    1
      135   1     63    THR   CB    68.100   .     1     A     63    THR   CB    1
      136   1     63    THR   H     8.390    .     1     A     63    THR   H     1
      137   1     63    THR   N     116.590  .     1     A     63    THR   N     1
      138   1     64    ALA   C     180.520  .     1     A     64    ALA   C     1
      139   1     64    ALA   CA    54.710   .     1     A     64    ALA   CA    1
      140   1     64    ALA   CB    17.020   .     1     A     64    ALA   CB    1
      141   1     64    ALA   H     7.050    .     1     A     64    ALA   H     1
      142   1     64    ALA   N     122.450  .     1     A     64    ALA   N     1
      143   1     65    LYS   C     180.320  .     1     A     65    LYS   C     1
      144   1     65    LYS   CA    58.680   .     1     A     65    LYS   CA    1
      145   1     65    LYS   CB    31.570   .     1     A     65    LYS   CB    1
      146   1     65    LYS   H     7.920    .     1     A     65    LYS   H     1
      147   1     65    LYS   N     119.130  .     1     A     65    LYS   N     1
      148   1     66    GLY   C     176.160  .     1     A     66    GLY   C     1
      149   1     66    GLY   CA    46.760   .     1     A     66    GLY   CA    1
      150   1     66    GLY   H     9.280    .     1     A     66    GLY   H     1
      151   1     66    GLY   N     109.500  .     1     A     66    GLY   N     1
      152   1     67    LYS   C     179.980  .     1     A     67    LYS   C     1
      153   1     67    LYS   CA    58.960   .     1     A     67    LYS   CA    1
      154   1     67    LYS   CB    31.320   .     1     A     67    LYS   CB    1
      155   1     67    LYS   H     8.180    .     1     A     67    LYS   H     1
      156   1     67    LYS   N     119.760  .     1     A     67    LYS   N     1
      157   1     68    GLU   C     177.910  .     1     A     68    GLU   C     1
      158   1     68    GLU   CA    58.040   .     1     A     68    GLU   CA    1
      159   1     68    GLU   CB    28.770   .     1     A     68    GLU   CB    1
      160   1     68    GLU   H     7.720    .     1     A     68    GLU   H     1
      161   1     68    GLU   N     119.370  .     1     A     68    GLU   N     1
      162   1     69    ALA   C     179.886  .     1     A     69    ALA   C     1
      163   1     69    ALA   CA    53.770   .     1     A     69    ALA   CA    1
      164   1     69    ALA   CB    18.200   .     1     A     69    ALA   CB    1
      165   1     69    ALA   H     7.820    .     1     A     69    ALA   H     1
      166   1     69    ALA   N     123.120  .     1     A     69    ALA   N     1
      167   1     70    GLY   CA    44.300   .     1     A     70    GLY   CA    1
      168   1     70    GLY   H     7.680    .     1     A     70    GLY   H     1
      169   1     70    GLY   N     103.250  .     1     A     70    GLY   N     1
      170   1     71    PRO   C     177.950  .     1     A     71    PRO   C     1
      171   1     71    PRO   CA    64.620   .     1     A     71    PRO   CA    1
      172   1     71    PRO   CB    31.380   .     1     A     71    PRO   CB    1
      173   1     72    GLN   C     176.090  .     1     A     72    GLN   C     1
      174   1     72    GLN   CA    55.270   .     1     A     72    GLN   CA    1
      175   1     72    GLN   CB    27.700   .     1     A     72    GLN   CB    1
      176   1     72    GLN   H     8.630    .     1     A     72    GLN   H     1
      177   1     73    GLN   N     115.870  .     1     A     72    GLN   N     1
      178   1     73    GLY   C     172.720  .     1     A     73    GLY   C     1
      179   1     73    GLY   CA    43.110   .     1     A     73    GLY   CA    1
      180   1     73    GLY   H     7.250    .     1     A     73    GLY   H     1
      181   1     73    GLY   N     108.960  .     1     A     73    GLY   N     1
      182   1     74    ARG   C     173.380  .     1     A     74    ARG   C     1
      183   1     74    ARG   CA    55.110   .     1     A     74    ARG   CA    1
      184   1     74    ARG   CB    26.540   .     1     A     74    ARG   CB    1
      185   1     74    ARG   H     8.380    .     1     A     74    ARG   H     1
      186   1     74    ARG   N     119.030  .     1     A     74    ARG   N     1
      187   1     75    ASN   CA    51.740   .     1     A     75    ASN   CA    1
      188   1     75    ASN   CB    39.760   .     1     A     75    ASN   CB    1
      189   1     75    ASN   H     7.290    .     1     A     75    ASN   H     1
      190   1     75    ASN   N     119.600  .     1     A     75    ASN   N     1
      191   1     76    LYS   C     174.420  .     1     A     76    LYS   C     1
      192   1     76    LYS   CA    54.330   .     1     A     76    LYS   CA    1
      193   1     76    LYS   CB    33.700   .     1     A     76    LYS   CB    1
      194   1     76    LYS   H     8.010    .     1     A     76    LYS   H     1
      195   1     76    LYS   N     123.220  .     1     A     76    LYS   N     1
      196   1     77    PHE   C     174.960  .     1     A     77    PHE   C     1
      197   1     77    PHE   CA    55.400   .     1     A     77    PHE   CA    1
      198   1     77    PHE   CB    42.190   .     1     A     77    PHE   CB    1
      199   1     77    PHE   H     8.980    .     1     A     77    PHE   H     1
      200   1     77    PHE   N     118.700  .     1     A     77    PHE   N     1
      201   1     78    ILE   C     174.040  .     1     A     78    ILE   C     1
      202   1     78    ILE   CA    59.890   .     1     A     78    ILE   CA    1
      203   1     78    ILE   H     9.060    .     1     A     78    ILE   H     1
      204   1     78    ILE   N     125.200  .     1     A     78    ILE   N     1
      205   1     79    LEU   C     175.390  .     1     A     79    LEU   C     1
      206   1     79    LEU   CA    53.900   .     1     A     79    LEU   CA    1
      207   1     79    LEU   CB    41.160   .     1     A     79    LEU   CB    1
      208   1     79    LEU   H     9.600    .     1     A     79    LEU   H     1
      209   1     79    LEU   N     128.200  .     1     A     79    LEU   N     1
      210   1     80    LEU   C     175.530  .     1     A     80    LEU   C     1
      211   1     80    LEU   CA    52.720   .     1     A     80    LEU   CA    1
      212   1     80    LEU   CB    43.640   .     1     A     80    LEU   CB    1
      213   1     80    LEU   H     8.950    .     1     A     80    LEU   H     1
      214   1     80    LEU   N     123.340  .     1     A     80    LEU   N     1
      215   1     81    SER   C     175.170  .     1     A     81    SER   C     1
      216   1     81    SER   CA    56.870   .     1     A     81    SER   CA    1
      217   1     81    SER   CB    63.840   .     1     A     81    SER   CB    1
      218   1     81    SER   H     8.660    .     1     A     81    SER   H     1
      219   1     81    SER   N     116.790  .     1     A     81    SER   N     1
      220   1     82    GLY   CA    44.660   .     1     A     82    GLY   CA    1
      221   1     82    GLY   H     8.350    .     1     A     82    GLY   H     1
      222   1     82    GLY   N     112.380  .     1     A     82    GLY   N     1
      223   1     83    ASP   CA    53.510   .     1     A     83    ASP   CA    1
      224   1     83    ASP   CB    41.360   .     1     A     83    ASP   CB    1
      225   1     83    ASP   H     8.250    .     1     A     83    ASP   H     1
      226   1     83    ASP   N     120.450  .     1     A     83    ASP   N     1
      227   1     84    THR   CA    61.620   .     1     A     84    THR   CA    1
      228   1     84    THR   CB    69.240   .     1     A     84    THR   CB    1
      229   1     84    THR   H     8.190    .     1     A     84    THR   H     1
      230   1     84    THR   N     114.870  .     1     A     84    THR   N     1
      231   1     85    SER   CA    58.480   .     1     A     85    SER   CA    1
      232   1     85    SER   CB    63.460   .     1     A     85    SER   CB    1
      233   1     85    SER   H     8.400    .     1     A     85    SER   H     1
      234   1     85    SER   N     118.670  .     1     A     85    SER   N     1
      235   1     569   ALA   CA    52.090   .     1     B     569   ALA   CA    1
      236   1     569   ALA   CB    18.540   .     1     B     569   ALA   CB    1
      237   1     569   ALA   H     8.180    .     1     B     569   ALA   H     1
      238   1     569   ALA   N     126.410  .     1     B     569   ALA   N     1
      239   1     570   GLN   C     174.560  .     1     B     570   GLN   C     1
      240   1     570   GLN   CA    55.330   .     1     B     570   GLN   CA    1
      241   1     570   GLN   CB    28.650   .     1     B     570   GLN   CB    1
      242   1     570   GLN   H     8.440    .     1     B     570   GLN   H     1
      243   1     570   GLN   N     120.460  .     1     B     570   GLN   N     1
      244   1     571   ALA   CA    52.260   .     1     B     571   ALA   CA    1
      245   1     571   ALA   CB    18.390   .     1     B     571   ALA   CB    1
      246   1     571   ALA   H     8.370    .     1     B     571   ALA   H     1
      247   1     571   ALA   N     126.290  .     1     B     571   ALA   N     1
      248   1     572   GLY   C     173.950  .     1     B     572   GLY   C     1
      249   1     572   GLY   CA    44.530   .     1     B     572   GLY   CA    1
      250   1     572   GLY   H     8.340    .     1     B     572   GLY   H     1
      251   1     572   GLY   N     109.020  .     1     B     572   GLY   N     1
      252   1     573   ALA   CA    51.950   .     1     B     573   ALA   CA    1
      253   1     573   ALA   H     8.050    .     1     B     573   ALA   H     1
      254   1     573   ALA   N     124.130  .     1     B     573   ALA   N     1
      255   1     574   ALA   C     177.570  .     1     B     574   ALA   C     1
      256   1     574   ALA   CA    52.140   .     1     B     574   ALA   CA    1
      257   1     574   ALA   CB    18.340   .     1     B     574   ALA   CB    1
      258   1     575   ASN   CA    52.840   .     1     B     575   ASN   CA    1
      259   1     575   ASN   CB    38.250   .     1     B     575   ASN   CB    1
      260   1     575   ASN   H     8.260    .     1     B     575   ASN   H     1
      261   1     575   ASN   N     117.860  .     1     B     575   ASN   N     1
      262   1     576   ARG   CA    55.540   .     1     B     576   ARG   CA    1
      263   1     576   ARG   CB    30.180   .     1     B     576   ARG   CB    1
      264   1     576   ARG   H     8.130    .     1     B     576   ARG   H     1
      265   1     576   ARG   N     121.700  .     1     B     576   ARG   N     1
      266   1     577   SER   C     174.970  .     1     B     577   SER   C     1
      267   1     577   SER   CA    57.800   .     1     B     577   SER   CA    1
      268   1     577   SER   CB    63.480   .     1     B     577   SER   CB    1
      269   1     577   SER   H     8.470    .     1     B     577   SER   H     1
      270   1     577   SER   N     118.150  .     1     B     577   SER   N     1
      271   1     578   LEU   C     176.550  .     1     B     578   LEU   C     1
      272   1     578   LEU   CA    53.880   .     1     B     578   LEU   CA    1
      273   1     578   LEU   H     8.100    .     1     B     578   LEU   H     1
      274   1     578   LEU   N     124.110  .     1     B     578   LEU   N     1
      275   1     579   THR   H     8.000    .     1     B     579   THR   H     1
      276   1     579   THR   N     114.170  .     1     B     579   THR   N     1
      277   1     580   GLU   CA    51.980   .     1     B     580   GLU   CA    1
      278   1     580   GLY   CA    43.970   .     1     B     581   GLY   CA    1
      279   1     581   GLY   H     8.110    .     1     B     581   GLY   H     1
      280   1     581   GLY   N     108.390  .     1     B     581   GLY   N     1
      281   1     582   PHE   C     175.070  .     1     B     582   PHE   C     1
      282   1     582   PHE   CA    56.110   .     1     B     582   PHE   CA    1
      283   1     582   PHE   CB    43.490   .     1     B     582   PHE   CB    1
      284   1     582   PHE   H     8.460    .     1     B     582   PHE   H     1
      285   1     582   PHE   N     117.350  .     1     B     582   PHE   N     1
      286   1     583   VAL   C     174.780  .     1     B     583   VAL   C     1
      287   1     583   VAL   CA    60.060   .     1     B     583   VAL   CA    1
      288   1     583   VAL   CB    33.140   .     1     B     583   VAL   CB    1
      289   1     583   VAL   H     9.430    .     1     B     583   VAL   H     1
      290   1     583   VAL   N     119.540  .     1     B     583   VAL   N     1
      291   1     584   LEU   C     174.100  .     1     B     584   LEU   C     1
      292   1     584   LEU   CA    52.760   .     1     B     584   LEU   CA    1
      293   1     584   LEU   CB    43.730   .     1     B     584   LEU   CB    1
      294   1     584   LEU   H     9.650    .     1     B     584   LEU   H     1
      295   1     584   LEU   N     133.000  .     1     B     584   LEU   N     1
      296   1     585   ASP   C     177.620  .     1     B     585   ASP   C     1
      297   1     585   ASP   CA    52.120   .     1     B     585   ASP   CA    1
      298   1     585   ASP   CB    40.730   .     1     B     585   ASP   CB    1
      299   1     585   ASP   H     9.070    .     1     B     585   ASP   H     1
      300   1     585   ASP   N     127.950  .     1     B     585   ASP   N     1
      301   1     586   THR   C     175.600  .     1     B     586   THR   C     1
      302   1     586   THR   CA    64.370   .     1     B     586   THR   CA    1
      303   1     586   THR   CB    68.530   .     1     B     586   THR   CB    1
      304   1     586   THR   H     7.930    .     1     B     586   THR   H     1
      305   1     586   THR   N     113.770  .     1     B     586   THR   N     1
      306   1     587   MET   C     177.850  .     1     B     587   MET   C     1
      307   1     587   MET   CA    55.870   .     1     B     587   MET   CA    1
      308   1     587   MET   CB    32.160   .     1     B     587   MET   CB    1
      309   1     587   MET   H     8.570    .     1     B     587   MET   H     1
      310   1     587   MET   N     120.640  .     1     B     587   MET   N     1
      311   1     588   ASN   C     174.030  .     1     B     588   ASN   C     1
      312   1     588   ASN   CA    51.890   .     1     B     588   ASN   CA    1
      313   1     588   ASN   CB    38.630   .     1     B     588   ASN   CB    1
      314   1     588   ASN   H     7.330    .     1     B     588   ASN   H     1
      315   1     588   ASN   N     115.470  .     1     B     588   ASN   N     1
      316   1     589   ASP   C     173.950  .     1     B     589   ASP   C     1
      317   1     589   ASP   CA    55.200   .     1     B     589   ASP   CA    1
      318   1     589   ASP   CB    38.690   .     1     B     589   ASP   CB    1
      319   1     589   ASP   H     7.610    .     1     B     589   ASP   H     1
      320   1     589   ASP   N     118.160  .     1     B     589   ASP   N     1
      321   1     590   SER   C     172.330  .     1     B     590   SER   C     1
      322   1     590   SER   CA    56.280   .     1     B     590   SER   CA    1
      323   1     590   SER   CB    66.120   .     1     B     590   SER   CB    1
      324   1     590   SER   H     8.100    .     1     B     590   SER   H     1
      325   1     590   SER   N     111.880  .     1     B     590   SER   N     1
      326   1     591   LEU   CA    53.570   .     1     B     591   LEU   CA    1
      327   1     591   LEU   CB    43.980   .     1     B     591   LEU   CB    1
      328   1     591   LEU   H     8.520    .     1     B     591   LEU   H     1
      329   1     591   LEU   N     126.820  .     1     B     591   LEU   N     1
      330   1     592   SER   H     8.620    .     1     B     592   SER   H     1
      331   1     592   SER   N     120.420  .     1     B     592   SER   N     1
   stop_
save_



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