*HEADER    TRANSCRIPTION                           08-OCT-07   2JW6              
*TITLE     SOLUTION STRUCTURE OF THE DEAF1 MYND DOMAIN                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DEFORMED EPIDERMAL AUTOREGULATORY FACTOR 1                 
*COMPND   3 HOMOLOG;                                                             
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 FRAGMENT: MYND DOMAIN;                                               
*COMPND   6 SYNONYM: NUCLEAR DEAF-1- RELATED TRANSCRIPTIONAL REGULATOR,          
*COMPND   7 NUDR, SUPPRESSIN, ZINC FINGER MYND DOMAIN-CONTAINING                 
*COMPND   8 PROTEIN 5;                                                           
*COMPND   9 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PET24D                                    
*KEYWDS    ZINC BINDING DOMAIN, TRANSCRIPTION, ALTERNATIVE SPLICING,             
*KEYWDS   2 DISEASE MUTATION, DNA-BINDING, METAL-BINDING, NUCLEUS,               
*KEYWDS   3 PHOSPHORYLATION, SECRETED, TRANSCRIPTION REGULATION, ZINC-           
*KEYWDS   4 FINGER                                                               
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    R.SPADACCINI, H.PERRIN, M.BOTTOMLEY, S.ANSIEU, M.SATTLER              
*REVDAT   1   25-DEC-07 2JW6    0                                                


data_distance_constraints

#######################
#  Entry information  #
#######################
save_entry_information
   _Saveframe_category   entry_information

   _NMR_STAR_version    "Aria 1.1 development"

save_


############################
#  Computer software used  #
############################
save_Aria
   _Saveframe_category   software

   _Name                 Aria
   _Version              1.1
   _Details             "ARIA 1.1 is using CNS 1.1"

   loop_
      _Vendor
      _Address
      _Electronic_address

      "Dr. Michael Nilges, Institut Pasteur" 
      
;
Unite de Bioinformatique Structurale, 
Institut Pasteur, 25-28 rue du Dr Roux,
75015 Paris, France
; 
       nilges@pasteur.fr 
      

   stop_

   loop_
      _Task

      "Automated NOE assignment"  
      "NMR structure calculation" 

   stop_

   loop_
      _Citation_label

      $reference_1 
      $reference_2 

   stop_

save_


##########################
#  Distance Constraints  #
##########################
save_distance_constraints
   _Saveframe_category           distance_constraints

   _Details
;
Derived from the file(s):
/nmr/sattler8/data/sattler/aria/mynd/run1018/structures/it8/13c.list
May contain ambiguous and non-ambiguous distance constraints
;
   _Constraint_type              NOE
   _Software_label              $Aria
   _Original_atom_nomenclature   Aria
   _Averaging_method             SUM
   _Floating_chirality           ?
        # Determines how violations are calculated
        # Enumeration:
        # all           All stereo groups were left floating
        # none          All stereo groups were stereospecifically assigned
        # aromatics     Only PHE and TYR ring atoms were left floating  
        # partial       Some stereo groups were floating
        #               An assignment save_frame (presented below)
        #               should be filled out to identify those floats
   _Potential_function           ?
        # Please provide a value like:
        # biharmonic, square, "soft square"
   _Function_detail
;
Described in:

-1-  M. Nilges and S.I. O'Donoghue. Ambiguous NOEs and automated NOE 
assignment. Prog.NMR spectr. 32:107-139, 1998.

-2-  Linge,J.P., O'Donoghue,S.I. and Nilges,M. in Methods Enzymol., Nuclear
Magnetic Resonance of Biological Macromolecules Part B.:71-90, Academic
Press, 2001.
;

   loop_
      _Constraint_ID
      _Constraint_tree_node_ID
      _Constraint_tree_down_node_ID
      _Constraint_tree_right_node_ID
      _Constraint_tree_logic_operation

         1    1    .    .    .
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       448    1    .    .    .

   stop_

   loop_
      _Constraint_tree_node_member_constraint_ID
      _Constraint_tree_node_member_node_ID
      _Constraint_tree_node_member_ID
      _Mol_system_component_ID
      _Residue_seq_code
      _Residue_label
      _Atom_name


         1    1    1  .   24  THR HB  
         1    1    2  .   24  THR MG  
         2    1    1  .   34  THR HB  
         2    1    2  .   34  THR MG  
         3    1    1  .   36  CYS HA  
         3    1    2  .   36  CYS HB2 
         4    1    1  .   36  CYS HA  
         4    1    2  .   36  CYS HB1 
         5    1    1  .   34  THR HA  
         5    1    2  .   37  GLN HB2 
         6    1    1  .   34  THR HA  
         6    1    2  .   37  GLN HB1 
         7    1    1  .   11  SER HB2 
         7    1    2  .   11  SER HA  
         8    1    1  .   13  VAL HA  
         8    1    2  .   13  VAL HB  
         9    1    1  .   13  VAL HA  
         9    1    2  .   13  VAL MG2 
        10    1    1  .   24  THR HA  
        10    1    2  .   24  THR MG  
        11    1    1  .   35  PHE HB2 
        11    1    2  .   35  PHE HB1 
        12    1    1  .   48  CYS HA  
        12    1    2  .   48  CYS HB2 
        13    1    1  .   48  CYS HA  
        13    1    2  .   48  CYS HB1 
        14    1    1  .   35  PHE HB2 
        14    1    2  .   35  PHE QD  
        15    1    1  .   23  CYS HA  
        15    1    2  .   23  CYS HB2 
        16    1    1  .   23  CYS HA  
        16    1    2  .   23  CYS HB1 
        17    1    1  .   47  ILE HA  
        17    1    2  .   47  ILE HB  
        18    1    1  .   47  ILE HA  
        18    1    2  .   47  ILE MG  
        19    1    1  .   42  LYS HA  
        19    1    2  .   42  LYS HB2 
        20    1    1  .   42  LYS HA  
        20    1    2  .   42  LYS HG2 
        21    1    1  .   15  CYS HA  
        21    1    2  .   15  CYS HB2 
        22    1    1  .   15  CYS HA  
        22    1    2  .   15  CYS HB1 
        23    1    1  .   29  VAL HA  
        23    1    2  .   29  VAL HB  
        24    1    1  .   29  VAL HA  
        24    1    2  .   13  VAL MG2 
        25    1    1  .   29  VAL HA  
        25    1    2  .   29  VAL MG1 
        26    1    1  .   12  CYS HA  
        26    1    2  .   31  TYR HA  
        27    1    1  .   44  HIS HA  
        27    1    2  .   44  HIS HB2 
        28    1    1  .   44  HIS HA  
        28    1    2  .   44  HIS HB1 
        29    1    1  .   12  CYS HA  
        29    1    2  .   12  CYS HB1 
        30    1    1  .   18  GLU HA  
        30    1    2  .   18  GLU HG2 
        31    1    1  .   12  CYS HA  
        31    1    2  .   19  ALA MB  
        32    1    1  .   27  HIS HA  
        32    1    2  .   22  GLU HB2 
        33    1    1  .   18  GLU HA  
        33    1    2  .   18  GLU HB2 
        34    1    1  .   46  HIS HA  
        34    1    2  .   46  HIS HB2 
        35    1    1  .   46  HIS HA  
        35    1    2  .   46  HIS HB1 
        36    1    1  .   21  SER HA  
        36    1    2  .   21  SER HB2 
        37    1    1  .   26  CYS HA  
        37    1    2  .   26  CYS HB1 
        38    1    1  .   28  LYS HA  
        38    1    2  .   28  LYS HB2 
        39    1    1  .   28  LYS HA  
        39    1    2  .   28  LYS HD2 
        40    1    1  .   28  LYS HA  
        40    1    2  .   28  LYS HG2 
        41    1    1  .   45  GLN HA  
        41    1    2  .   45  GLN HB2 
        42    1    1  .   45  GLN HA  
        42    1    2  .   45  GLN HB1 
        43    1    1  .   45  GLN HA  
        43    1    2  .   41  TRP HZ3 
        44    1    1  .   45  GLN HA  
        44    1    2  .   48  CYS HB2 
        45    1    1  .   45  GLN HA  
        45    1    2  .   48  CYS HB1 
        46    1    1  .   37  GLN HA  
        46    1    2  .   37  GLN HB1 
        47    1    1  .   37  GLN HA  
        47    1    2  .   34  THR HA  
        48    1    1  .   37  GLN HA  
        48    1    2  .   31  TYR QE  
        49    1    1  .   31  TYR HA  
        49    1    2  .   31  TYR QD  
        50    1    1  .   31  TYR HA  
        50    1    2  .   31  TYR QE  
        51    1    1  .   31  TYR HA  
        51    1    2  .   31  TYR HB2 
        52    1    1  .   31  TYR HA  
        52    1    2  .   31  TYR HB1 
        53    1    1  .   31  TYR HA  
        53    1    2  .   19  ALA MB  
        54    1    1  .   14  ASN HA  
        54    1    2  .   14  ASN HB1 
        55    1    1  .   43  ASP HA  
        55    1    2  .   43  ASP HB2 
        56    1    1  .   43  ASP HA  
        56    1    2  .   46  HIS HD2 
        57    1    1  .   22  GLU HA  
        57    1    2  .   22  GLU HB2 
        58    1    1  .   10  GLN HA  
        58    1    2  .   10  GLN HG2 
        59    1    1  .   10  GLN HA  
        59    1    2  .   10  GLN HB2 
        60    1    1  .   10  GLN HA  
        60    1    2  .   10  GLN HB1 
        61    1    1  .    4  ASP HA  
        61    1    2  .    4  ASP HB2 
        62    1    1  .   20  MET HA  
        62    1    2  .   20  MET HB2 
        63    1    1  .   20  MET HA  
        63    1    2  .   20  MET HB1 
        64    1    1  .   40  ASP HA  
        64    1    2  .   40  ASP HB2 
        65    1    1  .   40  ASP HA  
        65    1    2  .   40  ASP HB1 
        66    1    1  .   50  GLN HA  
        66    1    2  .   50  GLN HB2 
        67    1    1  .    6  GLU HA  
        67    1    2  .    6  GLU HG2 
        68    1    1  .    6  GLU HA  
        68    1    2  .    6  GLU HB2 
        69    1    1  .    7  ARG HA  
        69    1    2  .    7  ARG HB2 
        70    1    1  .    7  ARG HA  
        70    1    2  .    7  ARG HG2 
        71    1    1  .    8  LYS HA  
        71    1    2  .    5  ALA MB  
        72    1    1  .    5  ALA HA  
        72    1    2  .    5  ALA MB  
        73    1    1  .   30  ASN HA  
        73    1    2  .   30  ASN HB2 
        74    1    1  .   30  ASN HA  
        74    1    2  .   30  ASN HB1 
        75    1    1  .   19  ALA HA  
        75    1    2  .   19  ALA MB  
        76    1    1  .   25  GLY HA1 
        76    1    2  .   25  GLY HA2 
        77    1    1  .   25  GLY HA2 
        77    1    2  .   25  GLY HA1 
        78    1    1  .   31  TYR HB2 
        78    1    2  .   31  TYR HB1 
        79    1    1  .   31  TYR HB1 
        79    1    2  .   31  TYR HB2 
        80    1    1  .    7  ARG HD2 
        80    1    2  .    7  ARG HB2 
        81    1    1  .    7  ARG HD2 
        81    1    2  .    7  ARG HG2 
        82    1    1  .    8  LYS HE2 
        82    1    2  .    8  LYS HD2 
        83    1    1  .    8  LYS HE2 
        83    1    2  .    8  LYS HG2 
        84    1    1  .   31  TYR HB2 
        84    1    2  .   31  TYR HA  
        85    1    1  .   31  TYR HB2 
        85    1    2  .   31  TYR QE  
        86    1    1  .   17  ARG HD2 
        86    1    2  .   17  ARG HA  
        87    1    1  .   40  ASP HB2 
        87    1    2  .   40  ASP HB1 
        88    1    1  .   40  ASP HB1 
        88    1    2  .   40  ASP HB2 
        89    1    1  .   30  ASN HB1 
        89    1    2  .   30  ASN HB2 
        90    1    1  .   30  ASN HB2 
        90    1    2  .   30  ASN HB1 
        91    1    1  .   30  ASN HB2 
        91    1    2  .   30  ASN HA  
        92    1    1  .   30  ASN HB1 
        92    1    2  .   30  ASN HA  
        93    1    1  .   14  ASN HB2 
        93    1    2  .   14  ASN HB1 
        94    1    1  .   14  ASN HB1 
        94    1    2  .   14  ASN HB2 
        95    1    1  .   35  PHE HB1 
        95    1    2  .   35  PHE QD  
        96    1    1  .   47  ILE HB  
        96    1    2  .   47  ILE HA  
        97    1    1  .   35  PHE HB1 
        97    1    2  .   35  PHE HB2 
        98    1    1  .   47  ILE HB  
        98    1    2  .   47  ILE HG11
        99    1    1  .   47  ILE HB  
        99    1    2  .   47  ILE MG  
       100    1    1  .    6  GLU HG2 
       100    1    2  .    6  GLU HA  
       101    1    1  .   18  GLU HG2 
       101    1    2  .   18  GLU HA  
       102    1    1  .   29  VAL HB  
       102    1    2  .   29  VAL HA  
       103    1    1  .   29  VAL HB  
       103    1    2  .   29  VAL MG2 
       104    1    1  .   29  VAL HB  
       104    1    2  .   29  VAL MG1 
       105    1    1  .   28  LYS HB2 
       105    1    2  .   28  LYS HD2 
       106    1    1  .   28  LYS HB2 
       106    1    2  .   28  LYS HG2 
       107    1    1  .   28  LYS HB2 
       107    1    2  .   28  LYS HE2 
       108    1    1  .   26  CYS HB1 
       108    1    2  .   26  CYS HB2 
       109    1    1  .   26  CYS HB2 
       109    1    2  .   26  CYS HB1 
       110    1    1  .   15  CYS HB1 
       110    1    2  .   15  CYS HB2 
       111    1    1  .   10  GLN HG2 
       111    1    2  .   10  GLN HA  
       112    1    1  .    8  LYS HB2 
       112    1    2  .    8  LYS HA  
       113    1    1  .    8  LYS HB2 
       113    1    2  .    8  LYS HG2 
       114    1    1  .   10  GLN HG2 
       114    1    2  .   10  GLN HB2 
       115    1    1  .   10  GLN HG2 
       115    1    2  .   10  GLN HB1 
       116    1    1  .   22  GLU HB2 
       116    1    2  .   27  HIS HA  
       117    1    1  .   45  GLN HG1 
       117    1    2  .   45  GLN HG2 
       118    1    1  .   45  GLN HG1 
       118    1    2  .   45  GLN HB2 
       119    1    1  .   45  GLN HG2 
       119    1    2  .   45  GLN HB2 
       120    1    1  .   45  GLN HG2 
       120    1    2  .   45  GLN HG1 
       121    1    1  .   13  VAL HB  
       121    1    2  .   29  VAL HB  
       122    1    1  .   36  CYS HB1 
       122    1    2  .   36  CYS HB2 
       123    1    1  .   36  CYS HB2 
       123    1    2  .   36  CYS HB1 
       124    1    1  .   20  MET HG1 
       124    1    2  .   20  MET HB2 
       125    1    1  .   41  TRP HB2 
       125    1    2  .   41  TRP HB1 
       126    1    1  .   44  HIS HB2 
       126    1    2  .   44  HIS HB1 
       127    1    1  .   12  CYS HB2 
       127    1    2  .   12  CYS HB1 
       128    1    1  .   46  HIS HB2 
       128    1    2  .   46  HIS HB1 
       129    1    1  .   32  CYS HB2 
       129    1    2  .   32  CYS HB1 
       130    1    1  .   48  CYS HB2 
       130    1    2  .   48  CYS HB1 
       131    1    1  .   12  CYS HB1 
       131    1    2  .   12  CYS HB2 
       132    1    1  .   41  TRP HB2 
       132    1    2  .   41  TRP HD1 
       133    1    1  .   41  TRP HB1 
       133    1    2  .   41  TRP HD1 
       134    1    1  .   46  HIS HB2 
       134    1    2  .   46  HIS HD2 
       135    1    1  .   46  HIS HB1 
       135    1    2  .   46  HIS HD2 
       136    1    1  .   48  CYS HB1 
       136    1    2  .   44  HIS HD2 
       137    1    1  .   48  CYS HB1 
       137    1    2  .   41  TRP HZ3 
       138    1    1  .   41  TRP HB1 
       138    1    2  .   41  TRP HB2 
       139    1    1  .   28  LYS HD2 
       139    1    2  .   28  LYS HE2 
       140    1    1  .   38  ARG HB2 
       140    1    2  .   38  ARG HD2 
       141    1    1  .   48  CYS HB1 
       141    1    2  .   48  CYS HB2 
       142    1    1  .   10  GLN HB2 
       142    1    2  .   10  GLN HA  
       143    1    1  .    9  GLU HB2 
       143    1    2  .    9  GLU HA  
       144    1    1  .   18  GLU HB2 
       144    1    2  .   18  GLU HA  
       145    1    1  .   48  CYS HB1 
       145    1    2  .   48  CYS HA  
       146    1    1  .   42  LYS HD2 
       146    1    2  .   42  LYS HA  
       147    1    1  .    8  LYS HD2 
       147    1    2  .    8  LYS HA  
       148    1    1  .   27  HIS HB1 
       148    1    2  .   27  HIS HB2 
       149    1    1  .    7  ARG HG2 
       149    1    2  .    7  ARG HA  
       150    1    1  .   38  ARG HB2 
       150    1    2  .   38  ARG HA  
       151    1    1  .   38  ARG HG2 
       151    1    2  .   38  ARG HA  
       152    1    1  .   45  GLN HB2 
       152    1    2  .   45  GLN HA  
       153    1    1  .   38  ARG HG2 
       153    1    2  .   38  ARG HD2 
       154    1    1  .    7  ARG HG2 
       154    1    2  .    7  ARG HD2 
       155    1    1  .   38  ARG HB2 
       155    1    2  .   38  ARG HD2 
       156    1    1  .   38  ARG HB2 
       156    1    2  .   38  ARG HG2 
       157    1    1  .   45  GLN HB2 
       157    1    2  .   45  GLN HB1 
       158    1    1  .   45  GLN HB2 
       158    1    2  .   45  GLN HG2 
       159    1    1  .   24  THR MG  
       159    1    2  .   24  THR HB  
       160    1    1  .   13  VAL MG2 
       160    1    2  .   29  VAL HA  
       161    1    1  .   29  VAL MG2 
       161    1    2  .   29  VAL HA  
       162    1    1  .   34  THR MG  
       162    1    2  .   34  THR HB  
       163    1    1  .   13  VAL MG2 
       163    1    2  .   13  VAL HA  
       164    1    1  .   24  THR MG  
       164    1    2  .   24  THR HA  
       165    1    1  .   34  THR MG  
       165    1    2  .   38  ARG HD2 
       166    1    1  .   13  VAL MG2 
       166    1    2  .   13  VAL HB  
       167    1    1  .   29  VAL MG2 
       167    1    2  .   13  VAL HB  
       168    1    1  .   29  VAL MG2 
       168    1    2  .   28  LYS HB2 
       169    1    1  .   34  THR MG  
       169    1    2  .   38  ARG HB2 
       170    1    1  .   29  VAL MG2 
       170    1    2  .   29  VAL HB  
       171    1    1  .   29  VAL MG2 
       171    1    2  .   29  VAL MG1 
       172    1    1  .   29  VAL MG1 
       172    1    2  .   29  VAL HA  
       173    1    1  .   29  VAL MG1 
       173    1    2  .   29  VAL HB  
       174    1    1  .   29  VAL MG1 
       174    1    2  .   29  VAL MG2 
       175    1    1  .    5  ALA MB  
       175    1    2  .    5  ALA HA  
       176    1    1  .   47  ILE MG  
       176    1    2  .   47  ILE HB  
       177    1    1  .   47  ILE MG  
       177    1    2  .   46  HIS HB1 
       178    1    1  .   47  ILE MG  
       178    1    2  .   46  HIS HB2 
       179    1    1  .   47  ILE MG  
       179    1    2  .   47  ILE HA  
       180    1    1  .   47  ILE MD  
       180    1    2  .   47  ILE HB  
       181    1    1  .   47  ILE MD  
       181    1    2  .   44  HIS HA  
       182    1    1  .   47  ILE MD  
       182    1    2  .   47  ILE HA  
       183    1    1  .   44  HIS HB1 
       183    1    2  .   44  HIS HD2 
       184    1    1  .   27  HIS HB1 
       184    1    2  .   27  HIS HA  
       185    1    1  .   45  GLN HB1 
       185    1    2  .   45  GLN HG1 
       186    1    1  .   45  GLN HB1 
       186    1    2  .   45  GLN HB2 
       187    1    1  .   45  GLN HB1 
       187    1    2  .   45  GLN HG2 
       188    1    1  .   45  GLN HB1 
       188    1    2  .   45  GLN HA  
       189    1    1  .   47  ILE HB  
       189    1    2  .   47  ILE MG  
       190    1    1  .    4  ASP HB2 
       190    1    2  .    4  ASP HA  
       191    1    1  .    2  ALA MB  
       191    1    2  .    3  MET HB2 
       192    1    1  .    5  ALA MB  
       192    1    2  .    5  ALA H   
       193    1    1  .    6  GLU HA  
       193    1    2  .    6  GLU HB1 
       194    1    1  .    8  LYS HA  
       194    1    2  .    8  LYS HG2 
       195    1    1  .    7  ARG HA  
       195    1    2  .    7  ARG HB2 
       196    1    1  .    9  GLU HB2 
       196    1    2  .    9  GLU HA  
       197    1    1  .    6  GLU HG2 
       197    1    2  .    6  GLU HB2 
       198    1    1  .   18  GLU HG2 
       198    1    2  .   18  GLU HB2 
       199    1    1  .    7  ARG HA  
       199    1    2  .    7  ARG HD2 
       200    1    1  .    7  ARG HB2 
       200    1    2  .    7  ARG HA  
       201    1    1  .    7  ARG HB2 
       201    1    2  .    7  ARG HD2 
       202    1    1  .    7  ARG HB2 
       202    1    2  .    7  ARG HG2 
       203    1    1  .    6  GLU HB1 
       203    1    2  .    6  GLU HG2 
       204    1    1  .    7  ARG HG2 
       204    1    2  .    7  ARG HB2 
       205    1    1  .    8  LYS HG2 
       205    1    2  .    8  LYS HA  
       206    1    1  .    8  LYS HG2 
       206    1    2  .    8  LYS HE2 
       207    1    1  .    8  LYS HG2 
       207    1    2  .    8  LYS HD2 
       208    1    1  .    8  LYS HD2 
       208    1    2  .    8  LYS HG2 
       209    1    1  .   10  GLN HB1 
       209    1    2  .   10  GLN HA  
       210    1    1  .   17  ARG HB2 
       210    1    2  .   17  ARG HA  
       211    1    1  .   11  SER HA  
       211    1    2  .   11  SER HB2 
       212    1    1  .   11  SER HB2 
       212    1    2  .   18  GLU HA  
       213    1    1  .   12  CYS HA  
       213    1    2  .   12  CYS HB2 
       214    1    1  .   12  CYS HB1 
       214    1    2  .   12  CYS HA  
       215    1    1  .   12  CYS HB2 
       215    1    2  .   12  CYS HA  
       216    1    1  .   13  VAL HB  
       216    1    2  .   13  VAL HA  
       217    1    1  .   13  VAL HB  
       217    1    2  .   13  VAL MG2 
       218    1    1  .   14  ASN HA  
       218    1    2  .   14  ASN HB2 
       219    1    1  .   14  ASN HB1 
       219    1    2  .   14  ASN HA  
       220    1    1  .    3  MET HB2 
       220    1    2  .    4  ASP HB2 
       221    1    1  .   15  CYS HB1 
       221    1    2  .   15  CYS HA  
       222    1    1  .   15  CYS HB2 
       222    1    2  .   15  CYS HA  
       223    1    1  .   15  CYS HB2 
       223    1    2  .   15  CYS HB1 
       224    1    1  .    9  GLU HB1 
       224    1    2  .    9  GLU HA  
       225    1    1  .   19  ALA MB  
       225    1    2  .   19  ALA HA  
       226    1    1  .   20  MET HA  
       226    1    2  .   20  MET HG1 
       227    1    1  .   22  GLU HB2 
       227    1    2  .   22  GLU HA  
       228    1    1  .   22  GLU HB2 
       228    1    2  .   22  GLU HG2 
       229    1    1  .   36  CYS HB1 
       229    1    2  .   36  CYS HA  
       230    1    1  .   36  CYS HB2 
       230    1    2  .   36  CYS HA  
       231    1    1  .   23  CYS HB2 
       231    1    2  .   24  THR HA  
       232    1    1  .   36  CYS HB2 
       232    1    2  .   31  TYR HB1 
       233    1    1  .   24  THR HA  
       233    1    2  .   24  THR HB  
       234    1    1  .   26  CYS HB1 
       234    1    2  .   26  CYS HA  
       235    1    1  .   26  CYS HB2 
       235    1    2  .   26  CYS HA  
       236    1    1  .   27  HIS HB2 
       236    1    2  .   27  HIS HA  
       237    1    1  .   27  HIS HB2 
       237    1    2  .   27  HIS HB1 
       238    1    1  .   27  HIS HB1 
       238    1    2  .   27  HIS HB2 
       239    1    1  .   28  LYS HB2 
       239    1    2  .   28  LYS HA  
       240    1    1  .   28  LYS HB2 
       240    1    2  .   29  VAL MG2 
       241    1    1  .   28  LYS HG2 
       241    1    2  .   28  LYS HE2 
       242    1    1  .   28  LYS HG2 
       242    1    2  .   28  LYS HB2 
       243    1    1  .   28  LYS HG2 
       243    1    2  .   28  LYS HD2 
       244    1    1  .   17  ARG HB2 
       244    1    2  .   17  ARG HD2 
       245    1    1  .   42  LYS HD2 
       245    1    2  .   42  LYS HG2 
       246    1    1  .   28  LYS HE2 
       246    1    2  .   28  LYS HB2 
       247    1    1  .   42  LYS HE2 
       247    1    2  .   42  LYS HB2 
       248    1    1  .   42  LYS HE2 
       248    1    2  .   42  LYS HD2 
       249    1    1  .   42  LYS HE2 
       249    1    2  .   42  LYS HG2 
       250    1    1  .   29  VAL HA  
       250    1    2  .   29  VAL MG2 
       251    1    1  .   30  ASN HA  
       251    1    2  .   19  ALA MB  
       252    1    1  .   31  TYR HB1 
       252    1    2  .   31  TYR QD  
       253    1    1  .   31  TYR HB2 
       253    1    2  .   31  TYR QD  
       254    1    1  .   31  TYR HB1 
       254    1    2  .   31  TYR HA  
       255    1    1  .   37  GLN HA  
       255    1    2  .   37  GLN HB2 
       256    1    1  .   37  GLN HB1 
       256    1    2  .   37  GLN HE21
       257    1    1  .   37  GLN HB1 
       257    1    2  .   37  GLN HB2 
       258    1    1  .   37  GLN HB1 
       258    1    2  .   37  GLN HA  
       259    1    1  .   37  GLN HB2 
       259    1    2  .   37  GLN HB1 
       260    1    1  .   37  GLN HB2 
       260    1    2  .   34  THR HA  
       261    1    1  .   38  ARG HA  
       261    1    2  .   38  ARG HG2 
       262    1    1  .   38  ARG HA  
       262    1    2  .   38  ARG HB2 
       263    1    1  .   38  ARG HA  
       263    1    2  .   38  ARG HD2 
       264    1    1  .   38  ARG HA  
       264    1    2  .   41  TRP HB1 
       265    1    1  .   38  ARG HA  
       265    1    2  .   41  TRP HB2 
       266    1    1  .   38  ARG HG2 
       266    1    2  .   38  ARG HB2 
       267    1    1  .   41  TRP HB2 
       267    1    2  .   38  ARG HA  
       268    1    1  .   41  TRP HB1 
       268    1    2  .   38  ARG HA  
       269    1    1  .   46  HIS HB2 
       269    1    2  .   46  HIS HE1 
       270    1    1  .   42  LYS HA  
       270    1    2  .   42  LYS HD2 
       271    1    1  .   42  LYS HB2 
       271    1    2  .   42  LYS HA  
       272    1    1  .   42  LYS HB2 
       272    1    2  .   42  LYS HE2 
       273    1    1  .   42  LYS HG2 
       273    1    2  .   42  LYS HB2 
       274    1    1  .   44  HIS HB2 
       274    1    2  .   44  HIS HA  
       275    1    1  .   44  HIS HB1 
       275    1    2  .   44  HIS HA  
       276    1    1  .   44  HIS HB1 
       276    1    2  .   44  HIS HB2 
       277    1    1  .   45  GLN HG1 
       277    1    2  .   45  GLN HB1 
       278    1    1  .   45  GLN HG2 
       278    1    2  .   45  GLN HB1 
       279    1    1  .   46  HIS HB2 
       279    1    2  .   46  HIS HA  
       280    1    1  .   46  HIS HB1 
       280    1    2  .   46  HIS HA  
       281    1    1  .   48  CYS HB2 
       281    1    2  .   48  CYS HA  
       282    1    1  .   24  THR HB  
       282    1    2  .   24  THR HA  
       283    1    1  .   47  ILE MG  
       283    1    2  .   47  ILE HG12
       284    1    1  .   47  ILE MG  
       284    1    2  .   47  ILE HG11
       285    1    1  .   44  HIS HB2 
       285    1    2  .   44  HIS HD2 
       286    1    1  .   51  SER HB2 
       286    1    2  .   51  SER HA  
       287    1    1  .   51  SER HA  
       287    1    2  .   51  SER HB2 
       288    1    1  .   50  GLN HG2 
       288    1    2  .   50  GLN HA  
       289    1    1  .   48  CYS HB2 
       289    1    2  .   48  CYS H   
       290    1    1  .   47  ILE HB  
       290    1    2  .   47  ILE HG12
       291    1    1  .   47  ILE MD  
       291    1    2  .   47  ILE HG11
       292    1    1  .   47  ILE MD  
       292    1    2  .   47  ILE HG12
       293    1    1  .   45  GLN HB2 
       293    1    2  .   45  GLN HG1 
       294    1    1  .   44  HIS HA  
       294    1    2  .   47  ILE HG11
       295    1    1  .   42  LYS HB2 
       295    1    2  .   42  LYS HG2 
       296    1    1  .   28  LYS HD2 
       296    1    2  .   28  LYS HB2 
       297    1    1  .   42  LYS HE2 
       297    1    2  .   42  LYS HA  
       298    1    1  .   37  GLN HB2 
       298    1    2  .   37  GLN HA  
       299    1    1  .   34  THR MG  
       299    1    2  .   34  THR HA  
       300    1    1  .   33  SER HA  
       300    1    2  .   33  SER HB2 
       301    1    1  .   33  SER HA  
       301    1    2  .   33  SER HB1 
       302    1    1  .   32  CYS HA  
       302    1    2  .   19  ALA MB  
       303    1    1  .   32  CYS HA  
       303    1    2  .   32  CYS HB2 
       304    1    1  .   32  CYS HA  
       304    1    2  .   19  ALA HA  
       305    1    1  .   29  VAL HB  
       305    1    2  .   30  ASN HB2 
       306    1    1  .   27  HIS HB1 
       306    1    2  .   27  HIS HD2 
       307    1    1  .   24  THR HB  
       307    1    2  .   27  HIS HE1 
       308    1    1  .   24  THR MG  
       308    1    2  .   24  THR H   
       309    1    1  .   20  MET HB1 
       309    1    2  .   20  MET HA  
       310    1    1  .   20  MET HB1 
       310    1    2  .   20  MET HG2 
       311    1    1  .   20  MET HB1 
       311    1    2  .   20  MET HG1 
       312    1    1  .   20  MET HG2 
       312    1    2  .   20  MET HB1 
       313    1    1  .   19  ALA MB  
       313    1    2  .   31  TYR HA  
       314    1    1  .   18  GLU HA  
       314    1    2  .   11  SER HA  
       315    1    1  .   14  ASN HB2 
       315    1    2  .   36  CYS HB2 
       316    1    1  .   13  VAL HB  
       316    1    2  .   29  VAL HA  
       317    1    1  .   12  CYS HA  
       317    1    2  .   19  ALA MB  
       318    1    1  .   27  HIS HA  
       318    1    2  .   27  HIS HB2 
       319    1    1  .   27  HIS HA  
       319    1    2  .   27  HIS HB1 
       320    1    1  .   11  SER HA  
       320    1    2  .   10  GLN HG2 
       321    1    1  .   11  SER HA  
       321    1    2  .   18  GLU HB2 
       322    1    1  .   11  SER HA  
       322    1    2  .   10  GLN HB1 
       323    1    1  .   26  CYS HA  
       323    1    2  .   26  CYS HB2 
       324    1    1  .   26  CYS HA  
       324    1    2  .   25  GLY HA1 
       325    1    1  .   45  GLN HA  
       325    1    2  .   41  TRP HZ2 
       326    1    1  .   31  TYR HA  
       326    1    2  .   12  CYS HB2 
       327    1    1  .   22  GLU HA  
       327    1    2  .   22  GLU HG1 
       328    1    1  .   22  GLU HA  
       328    1    2  .   22  GLU HG2 
       329    1    1  .   22  GLU HA  
       329    1    2  .   22  GLU HG1 
       330    1    1  .    3  MET HA  
       330    1    2  .    3  MET HB1 
       331    1    1  .    3  MET HA  
       331    1    2  .    3  MET HB2 
       332    1    1  .   20  MET HA  
       332    1    2  .   20  MET HG2 
       333    1    1  .   10  GLN HA  
       333    1    2  .   10  GLN HG2 
       334    1    1  .   50  GLN HA  
       334    1    2  .   50  GLN HG2 
       335    1    1  .   40  ASP HB2 
       335    1    2  .   43  ASP HB2 
       336    1    1  .    8  LYS HE2 
       336    1    2  .    8  LYS HD2 
       337    1    1  .   28  LYS HB2 
       337    1    2  .   28  LYS HD2 
       338    1    1  .   22  GLU HG1 
       338    1    2  .   22  GLU HB2 
       339    1    1  .   26  CYS HB1 
       339    1    2  .   25  GLY HA1 
       340    1    1  .   39  LYS HB1 
       340    1    2  .   39  LYS HA  
       341    1    1  .   39  LYS HB2 
       341    1    2  .   36  CYS HA  
       342    1    1  .    3  MET HB1 
       342    1    2  .    3  MET HA  
       343    1    1  .   23  CYS HB1 
       343    1    2  .   23  CYS HB2 
       344    1    1  .   12  CYS HB1 
       344    1    2  .   12  CYS HB2 
       345    1    1  .   20  MET HG2 
       345    1    2  .   20  MET HB2 
       346    1    1  .   32  CYS HB1 
       346    1    2  .   32  CYS HB2 
       347    1    1  .   38  ARG HB2 
       347    1    2  .   38  ARG HA  
       348    1    1  .   28  LYS HD2 
       348    1    2  .   26  CYS HB2 
       349    1    1  .   19  ALA MB  
       349    1    2  .   31  TYR HB2 
       350    1    1  .   28  LYS HD2 
       350    1    2  .   28  LYS HE2 
       351    1    1  .    8  LYS HD2 
       351    1    2  .    8  LYS HG2 
       352    1    1  .   12  CYS HA  
       352    1    2  .   31  TYR HB2 
       353    1    1  .   18  GLU HA  
       353    1    2  .   11  SER HB2 
       354    1    1  .   14  ASN HB1 
       354    1    2  .   36  CYS HB2 
       355    1    1  .   14  ASN HB1 
       355    1    2  .   36  CYS HB1 
       356    1    1  .   23  CYS HB2 
       356    1    2  .   23  CYS HB1 
       357    1    1  .   46  HIS HB1 
       357    1    2  .   46  HIS HB2 
       358    1    1  .   14  ASN HB1 
       358    1    2  .   40  ASP HB2 
       359    1    1  .   11  SER HB2 
       359    1    2  .   12  CYS HB2 
       360    1    1  .   33  SER HB2 
       360    1    2  .   33  SER HA  
       361    1    1  .   33  SER HB1 
       361    1    2  .   33  SER HA  
       362    1    1  .   33  SER HB2 
       362    1    2  .   33  SER HB1 
       363    1    1  .   33  SER HB1 
       363    1    2  .   33  SER HB2 
       364    1    1  .   21  SER HB2 
       364    1    2  .   20  MET HB2 
       365    1    1  .   21  SER HB2 
       365    1    2  .   27  HIS HB1 
       366    1    1  .   24  THR HA  
       366    1    2  .   27  HIS HE1 
       367    1    1  .   24  THR HA  
       367    1    2  .   27  HIS HD2 
       368    1    1  .   21  SER HB2 
       368    1    2  .   21  SER HA  
       369    1    1  .   33  SER HB1 
       369    1    2  .   33  SER H   
       370    1    1  .   48  CYS H   
       370    1    2  .   48  CYS HA  
       371    1    1  .   35  PHE QD  
       371    1    2  .   35  PHE HB1 
       372    1    1  .   35  PHE QD  
       372    1    2  .   35  PHE HB1 
       373    1    1  .   48  CYS H   
       373    1    2  .   48  CYS HB2 
       374    1    1  .   48  CYS H   
       374    1    2  .   48  CYS HB1 
       375    1    1  .   35  PHE HB2 
       375    1    2  .   35  PHE HA  
       376    1    1  .   42  LYS HA  
       376    1    2  .   42  LYS H   
       377    1    1  .   42  LYS HA  
       377    1    2  .   41  TRP HD1 
       378    1    1  .   47  ILE HA  
       378    1    2  .   47  ILE H   
       379    1    1  .   47  ILE HA  
       379    1    2  .   47  ILE HG11
       380    1    1  .   47  ILE HA  
       380    1    2  .   47  ILE MG  
       381    1    1  .   41  TRP HA  
       381    1    2  .   42  LYS HE2 
       382    1    1  .   41  TRP HA  
       382    1    2  .   41  TRP HB2 
       383    1    1  .   41  TRP HA  
       383    1    2  .   41  TRP HB2 
       384    1    1  .   15  CYS HA  
       384    1    2  .   35  PHE QE  
       385    1    1  .   27  HIS HA  
       385    1    2  .   27  HIS HD2 
       386    1    1  .   46  HIS HA  
       386    1    2  .   46  HIS HD2 
       387    1    1  .   26  CYS HA  
       387    1    2  .   27  HIS HD2 
       388    1    1  .   31  TYR HA  
       388    1    2  .   19  ALA HA  
       389    1    1  .   21  SER HA  
       389    1    2  .   21  SER HB2 
       390    1    1  .   11  SER HA  
       390    1    2  .   19  ALA MB  
       391    1    1  .   46  HIS HA  
       391    1    2  .   45  GLN HG1 
       392    1    1  .   26  CYS HA  
       392    1    2  .   28  LYS HD2 
       393    1    1  .   14  ASN HA  
       393    1    2  .   14  ASN HB2 
       394    1    1  .   31  TYR QD  
       394    1    2  .   31  TYR HB2 
       395    1    1  .   31  TYR QD  
       395    1    2  .   31  TYR HB2 
       396    1    1  .   31  TYR QD  
       396    1    2  .   31  TYR HB2 
       397    1    1  .   46  HIS HD2 
       397    1    2  .   43  ASP HA  
       398    1    1  .   52  ALA HA  
       398    1    2  .   52  ALA MB  
       399    1    1  .   30  ASN HA  
       399    1    2  .   37  GLN HA  
       400    1    1  .   19  ALA HA  
       400    1    2  .   31  TYR HB2 
       401    1    1  .   19  ALA HA  
       401    1    2  .   30  ASN HB2 
       402    1    1  .   16  GLY HA2 
       402    1    2  .   32  CYS HA  
       403    1    1  .   25  GLY HA1 
       403    1    2  .   25  GLY HA2 
       404    1    1  .   40  ASP HB2 
       404    1    2  .   40  ASP HA  
       405    1    1  .   40  ASP HB1 
       405    1    2  .   40  ASP HA  
       406    1    1  .   40  ASP HB1 
       406    1    2  .   37  GLN HA  
       407    1    1  .   40  ASP HB2 
       407    1    2  .   37  GLN HA  
       408    1    1  .   30  ASN HB1 
       408    1    2  .   19  ALA MB  
       409    1    1  .   30  ASN HB2 
       409    1    2  .   19  ALA MB  
       410    1    1  .   29  VAL HB  
       410    1    2  .   13  VAL MG2 
       411    1    1  .   22  GLU HG1 
       411    1    2  .   22  GLU HA  
       412    1    1  .   22  GLU HG2 
       412    1    2  .   22  GLU HA  
       413    1    1  .   22  GLU HG1 
       413    1    2  .   27  HIS HB2 
       414    1    1  .   22  GLU HG2 
       414    1    2  .   27  HIS HB2 
       415    1    1  .    6  GLU HG2 
       415    1    2  .    7  ARG HD2 
       416    1    1  .   45  GLN HG1 
       416    1    2  .   45  GLN HA  
       417    1    1  .   42  LYS HG2 
       417    1    2  .   42  LYS HA  
       418    1    1  .   45  GLN HG2 
       418    1    2  .   45  GLN HA  
       419    1    1  .   44  HIS HB1 
       419    1    2  .   47  ILE MG  
       420    1    1  .   48  CYS HB2 
       420    1    2  .   45  GLN HA  
       421    1    1  .   48  CYS HB1 
       421    1    2  .   45  GLN HA  
       422    1    1  .   28  LYS HG2 
       422    1    2  .   26  CYS HA  
       423    1    1  .   28  LYS HG2 
       423    1    2  .   28  LYS HA  
       424    1    1  .   28  LYS HD2 
       424    1    2  .   28  LYS HA  
       425    1    1  .   28  LYS HD2 
       425    1    2  .   26  CYS HB2 
       426    1    1  .   28  LYS HG2 
       426    1    2  .   26  CYS HB2 
       427    1    1  .   13  VAL MG2 
       427    1    2  .   31  TYR QD  
       428    1    1  .   13  VAL MG2 
       428    1    2  .   31  TYR QE  
       429    1    1  .   29  VAL MG2 
       429    1    2  .   31  TYR QE  
       430    1    1  .   19  ALA MB  
       430    1    2  .   30  ASN HA  
       431    1    1  .   29  VAL MG1 
       431    1    2  .   31  TYR QE  
       432    1    1  .   47  ILE MD  
       432    1    2  .   48  CYS HA  
       433    1    1  .   47  ILE MG  
       433    1    2  .   44  HIS HA  
       434    1    1  .   26  CYS HB2 
       434    1    2  .   25  GLY HA2 
       435    1    1  .   26  CYS HB1 
       435    1    2  .   25  GLY HA2 
       436    1    1  .   48  CYS HB1 
       436    1    2  .   48  CYS HB2 
       437    1    1  .   41  TRP HB2 
       437    1    2  .   41  TRP HA  
       438    1    1  .   34  THR HB  
       438    1    2  .   34  THR HA  
       439    1    1  .   34  THR HB  
       439    1    2  .   34  THR HA  
       440    1    1  .   34  THR HA  
       440    1    2  .   38  ARG HB2 
       441    1    1  .   34  THR HA  
       441    1    2  .   37  GLN HB2 
       442    1    1  .   26  CYS HA  
       442    1    2  .   26  CYS H   
       443    1    1  .   29  VAL MG2 
       443    1    2  .   30  ASN HA  
       444    1    1  .   29  VAL MG2 
       444    1    2  .   44  HIS HE1 
       445    1    1  .   14  ASN HB1 
       445    1    2  .   31  TYR QE  
       446    1    1  .   14  ASN HB1 
       446    1    2  .   31  TYR QD  
       447    1    1  .   14  ASN HB2 
       447    1    2  .   31  TYR QE  
       448    1    1  .   14  ASN HB2 
       448    1    2  .   31  TYR QD  

   stop_

   loop_
      _Distance_constraint_ID
      _Distance_constraint_tree_node_ID
      _Source_experiment_code
      _Spectral_peak_ID
      _Contribution_fractional_value
      _Distance_value
      _Distance_lower_bound_value
      _Distance_upper_bound_value


         1    1     2     1   1.00      .   1.80   3.40
         2    1     2     1   1.00      .   1.80   3.80
         3    1     2     2   1.00      .   2.00   6.00
         4    1     2     3   1.00      .   2.00   6.00
         5    1     2     4   1.00      .   1.90   4.70
         6    1     2     5   1.00      .   0.00   6.00
         7    1     2     6   1.00      .   1.80   3.60
         8    1     2     7   1.00      .   1.90   3.70
         9    1     2     8   1.00      .   1.90   4.10
        10    1     2     9   1.00      .   0.00   6.00
        11    1     2    10   1.00      .   1.80   4.00
        12    1     2    11   1.00      .   2.00   4.60
        13    1     2    12   1.00      .   2.00   4.80
        14    1     2    13   1.00      .   2.00   6.00
        15    1     2    14   1.00      .   1.90   4.50
        16    1     2    15   1.00      .   2.00   5.80
        17    1     2    16   1.00      .   1.90   4.50
        18    1     2    17   1.00      .   1.90   4.50
        19    1     2    18   1.00      .   2.00   5.20
        20    1     2    19   1.00      .   2.00   5.00
        21    1     2    20   1.00      .   2.00   5.00
        22    1     2    21   1.00      .   1.90   4.70
        23    1     2    22   1.00      .   1.70   3.50
        24    1     2    23   1.00      .   2.00   5.40
        25    1     2    24   1.00      .   1.90   4.30
        26    1     2    25   1.00      .   1.80   4.00
        27    1     2    27   1.00      .   2.00   4.80
        28    1     2    28   1.00      .   2.00   5.80
        29    1     2    29   1.00      .   2.00   5.00
        30    1     2    30   1.00      .   1.90   4.50
        31    1     2    31   1.00      .   0.00   6.00
        32    1     2    32   1.00      .   1.90   4.50
        33    1     2    33   1.00      .   1.90   4.50
        34    1     2    34   1.00      .   1.90   4.30
        35    1     2    35   1.00      .   1.90   4.10
        36    1     2    36   1.00      .   2.00   4.40
        37    1     2    37   1.00      .   1.90   4.30
        38    1     2    38   1.00      .   1.90   4.10
        39    1     2    39   1.00      .   2.00   6.00
        40    1     2    40   1.00      .   1.90   3.90
        41    1     2    41   1.00      .   1.90   4.10
        42    1     2    42   1.00      .   1.90   4.10
        43    1     2    43   1.00      .   0.00   6.00
        44    1     2    44   1.00      .   2.00   4.80
        45    1     2    45   1.00      .   2.00   5.40
        46    1     2    46   1.00      .   2.00   5.00
        47    1     2    47   1.00      .   1.90   6.00
        48    1     2    48   1.00      .   2.00   5.80
        49    1     2    49   1.00      .   2.00   5.00
        50    1     2    50   1.00      .   0.00   6.00
        51    1     2    51   1.00      .   2.00   5.20
        52    1     2    52   1.00      .   2.00   4.40
        53    1     2    53   1.00      .   2.00   6.00
        54    1     2    54   1.00      .   2.00   5.20
        55    1     2    55   1.00      .   1.90   4.50
        56    1     2    56   1.00      .   1.80   4.00
        57    1     2    57   1.00      .   1.80   3.80
        58    1     2    58   1.00      .   1.80   3.80
        59    1     2    59   1.00      .   1.70   3.50
        60    1     2    60   1.00      .   1.80   3.80
        61    1     2    61   1.00      .   1.90   4.30
        62    1     2    62   1.00      .   1.90   4.30
        63    1     2    63   1.00      .   1.80   4.20
        64    1     2    64   1.00      .   2.00   5.00
        65    1     2    65   1.00      .   2.00   5.40
        66    1     2    66   1.00      .   0.00   6.00
        67    1     2    67   1.00      .   1.90   5.10
        68    1     2    68   1.00      .   0.00   6.00
        69    1     2    69   1.00      .   0.00   6.00
        70    1     2    70   1.00      .   1.90   4.50
        71    1     2    71   1.00      .   0.00   6.00
        72    1     2    72   1.00      .   1.80   3.60
        73    1     2    73   1.00      .   1.90   4.50
        74    1     2    74   1.00      .   0.00   6.00
        75    1     2    75   1.00      .   1.90   4.30
        76    1     2    76   1.00      .   1.80   3.40
        77    1     2    77   1.00      .   1.70   3.50
        78    1     2    78   1.00      .   0.00   6.00
        79    1     2    79   1.00      .   0.00   6.00
        80    1     2    80   1.00      .   0.00   6.00
        81    1     2    81   1.00      .   1.90   4.50
        82    1     2    82   1.00      .   1.90   3.90
        83    1     2    83   1.00      .   1.90   6.00
        84    1     2    84   1.00      .   2.00   6.00
        85    1     2    85   1.00      .   0.00   6.00
        86    1     2    87   1.00      .   2.00   4.40
        87    1     2    88   1.00      .   0.00   6.00
        88    1     2    89   1.00      .   0.00   6.00
        89    1     2    90   1.00      .   1.70   3.30
        90    1     2    91   1.00      .   1.70   3.30
        91    1     2    92   1.00      .   2.00   4.80
        92    1     2    93   1.00      .   1.90   4.10
        93    1     2    94   1.00      .   0.00   6.00
        94    1     2    95   1.00      .   1.80   4.20
        95    1     2    96   1.00      .   2.00   5.00
        96    1     2    97   1.00      .   1.80   3.80
        97    1     2    98   1.00      .   1.80   4.00
        98    1     2    99   1.00      .   1.90   4.50
        99    1     2   100   1.00      .   0.00   6.00
       100    1     2   101   1.00      .   1.80   4.00
       101    1     2   102   1.00      .   2.00   5.00
       102    1     2   104   1.00      .   1.90   4.10
       103    1     2   105   1.00      .   1.90   4.10
       104    1     2   106   1.00      .   1.90   4.30
       105    1     2   107   1.00      .   1.90   4.50
       106    1     2   108   1.00      .   1.90   4.90
       107    1     2   109   1.00      .   2.00   5.60
       108    1     2   110   1.00      .   1.70   3.50
       109    1     2   111   1.00      .   1.80   3.60
       110    1     2   112   1.00      .   0.00   6.00
       111    1     2   113   1.00      .   0.00   6.00
       112    1     2   114   1.00      .   1.80   4.00
       113    1     2   115   1.00      .   0.00   6.00
       114    1     2   116   1.00      .   1.90   3.70
       115    1     2   117   1.00      .   0.00   6.00
       116    1     2   119   1.00      .   1.80   4.00
       117    1     2   120   1.00      .   1.70   3.30
       118    1     2   121   1.00      .   1.90   4.50
       119    1     2   122   1.00      .   2.00   6.00
       120    1     2   123   1.00      .   1.70   3.30
       121    1     2   124   1.00      .   2.00   5.40
       122    1     2   125   1.00      .   0.00   6.00
       123    1     2   126   1.00      .   1.80   4.20
       124    1     2   127   1.00      .   1.80   4.00
       125    1     2   128   1.00      .   1.80   3.40
       126    1     2   129   1.00      .   0.00   6.00
       127    1     2   130   1.00      .   0.00   6.00
       128    1     2   131   1.00      .   1.70   3.10
       129    1     2   132   1.00      .   0.00   6.00
       130    1     2   133   1.00      .   1.80   4.00
       131    1     2   134   1.00      .   0.00   6.00
       132    1     2   135   1.00      .   2.00   5.80
       133    1     2   136   1.00      .   2.00   5.40
       134    1     2   137   1.00      .   2.00   4.80
       135    1     2   138   1.00      .   2.00   6.00
       136    1     2   139   1.00      .   1.80   6.00
       137    1     2   140   1.00      .   2.00   6.00
       138    1     2   141   1.00      .   1.80   3.60
       139    1     2   142   1.00      .   0.00   6.00
       140    1     2   143   1.00      .   0.00   6.00
       141    1     2   144   1.00      .   0.00   6.00
       142    1     2   145   1.00      .   1.80   3.60
       143    1     2   146   1.00      .   0.00   6.00
       144    1     2   147   1.00      .   1.90   3.90
       145    1     2   148   1.00      .   2.00   5.80
       146    1     2   149   1.00      .   2.00   5.60
       147    1     2   150   1.00      .   2.00   5.60
       148    1     2   151   1.00      .   0.00   6.00
       149    1     2   152   1.00      .   0.00   6.00
       150    1     2   153   1.00      .   0.00   6.00
       151    1     2   154   1.00      .   1.90   4.10
       152    1     2   155   1.00      .   1.90   4.50
       153    1     2   156   1.00      .   1.80   4.00
       154    1     2   157   1.00      .   1.70   3.30
       155    1     2   158   1.00      .   0.00   6.00
       156    1     2   159   1.00      .   0.00   6.00
       157    1     2   160   1.00      .   1.80   3.60
       158    1     2   161   1.00      .   2.00   5.80
       159    1     2   162   1.00      .   1.60   2.80
       160    1     2   163   1.00      .   2.00   5.60
       161    1     2   164   1.00      .   1.90   4.50
       162    1     2   165   1.00      .   1.60   3.00
       163    1     2   166   1.00      .   1.80   4.00
       164    1     2   167   1.00      .   1.60   3.00
       165    1     2   168   1.00      .   0.00   6.00
       166    1     2   169   1.00      .   1.80   3.60
       167    1     2   170   1.00      .   1.90   6.00
       168    1     2   171   1.00      .   2.00   5.00
       169    1     2   172   1.00      .   0.00   6.00
       170    1     2   173   1.00      .   1.80   3.60
       171    1     2   174   1.00      .   1.90   4.30
       172    1     2   175   1.00      .   1.80   4.00
       173    1     2   176   1.00      .   1.70   3.50
       174    1     2   177   1.00      .   1.70   3.30
       175    1     2   178   1.00      .   1.70   3.10
       176    1     2   179   1.00      .   1.70   3.10
       177    1     2   180   1.00      .   0.00   6.00
       178    1     2   181   1.00      .   2.00   4.60
       179    1     2   182   1.00      .   1.80   3.40
       180    1     2   183   1.00      .   1.80   3.40
       181    1     2   184   1.00      .   2.00   5.00
       182    1     2   185   1.00      .   2.00   6.00
       183    1     2   186   1.00      .   2.00   5.40
       184    1     2   187   1.00      .   1.90   4.10
       185    1     2   188   1.00      .   2.00   6.00
       186    1     2   189   1.00      .   1.80   3.80
       187    1     2   190   1.00      .   1.90   4.90
       188    1     2   191   1.00      .   1.90   4.70
       189    1     2   192   1.00      .   1.80   3.40
       190    1     2   193   1.00      .   1.80   3.80
       191    1     2   194   1.00      .   0.00   6.00
       192    1     2   195   1.00      .   0.00   6.00
       193    1     2   196   1.00      .   0.00   6.00
       194    1     2   197   1.00      .   0.00   6.00
       195    1     2   198   1.00      .   0.00   6.00
       196    1     2   199   1.00      .   1.90   4.30
       197    1     2   200   1.00      .   0.00   6.00
       198    1     2   201   1.00      .   1.80   4.00
       199    1     2   202   1.00      .   2.00   5.00
       200    1     2   203   1.00      .   0.00   6.00
       201    1     2   204   1.00      .   1.90   4.30
       202    1     2   205   1.00      .   1.80   3.60
       203    1     2   206   1.00      .   0.00   6.00
       204    1     2   207   1.00      .   0.00   6.00
       205    1     2   208   1.00      .   0.00   6.00
       206    1     2   209   1.00      .   0.00   6.00
       207    1     2   210   1.00      .   0.00   6.00
       208    1     2   211   1.00      .   0.00   6.00
       209    1     2   212   1.00      .   0.00   6.00
       210    1     2   213   1.00      .   0.00   6.00
       211    1     2   214   1.00      .   1.80   3.60
       212    1     2   215   1.00      .   1.90   4.30
       213    1     2   216   1.00      .   1.90   4.30
       214    1     2   217   1.00      .   2.00   5.60
       215    1     2   218   1.00      .   1.90   4.70
       216    1     2   219   1.00      .   1.80   3.80
       217    1     2   220   1.00      .   1.70   3.50
       218    1     2   221   1.00      .   2.00   6.00
       219    1     2   222   1.00      .   0.00   6.00
       220    1     2   223   1.00      .   0.00   6.00
       221    1     2   224   1.00      .   2.00   6.00
       222    1     2   225   1.00      .   2.00   5.40
       223    1     2   226   1.00      .   0.00   6.00
       224    1     2   227   1.00      .   1.80   3.40
       225    1     2   228   1.00      .   1.60   3.00
       226    1     2   229   1.00      .   2.00   5.20
       227    1     2   230   1.00      .   1.70   3.50
       228    1     2   231   1.00      .   1.90   3.90
       229    1     2   232   1.00      .   2.00   5.80
       230    1     2   233   1.00      .   2.00   6.00
       231    1     2   234   1.00      .   0.00   6.00
       232    1     2   235   1.00      .   0.00   6.00
       233    1     2   236   1.00      .   1.70   3.50
       234    1     2   237   1.00      .   1.90   3.90
       235    1     2   238   1.00      .   1.90   4.70
       236    1     2   239   1.00      .   1.90   4.70
       237    1     2   240   1.00      .   1.70   3.30
       238    1     2   241   1.00      .   1.80   3.40
       239    1     2   242   1.00      .   1.90   4.10
       240    1     2   243   1.00      .   1.90   5.50
       241    1     2   244   1.00      .   1.90   4.50
       242    1     2   245   1.00      .   1.90   4.10
       243    1     2   246   1.00      .   1.90   4.10
       244    1     2   247   1.00      .   0.00   6.00
       245    1     2   248   1.00      .   1.70   3.10
       246    1     2   250   1.00      .   2.00   4.80
       247    1     2   251   1.00      .   1.90   6.00
       248    1     2   252   1.00      .   1.70   3.10
       249    1     2   253   1.00      .   2.00   4.40
       250    1     2   254   1.00      .   1.90   4.30
       251    1     2   255   1.00      .   1.80   6.00
       252    1     2   256   1.00      .   2.00   5.60
       253    1     2   257   1.00      .   2.00   5.80
       254    1     2   258   1.00      .   2.00   5.20
       255    1     2   259   1.00      .   1.80   3.80
       256    1     2   260   1.00      .   1.90   6.00
       257    1     2   261   1.00      .   1.70   3.50
       258    1     2   262   1.00      .   0.00   6.00
       259    1     2   263   1.00      .   1.80   3.80
       260    1     2   264   1.00      .   2.00   5.20
       261    1     2   265   1.00      .   2.00   4.60
       262    1     2   266   1.00      .   1.90   4.10
       263    1     2   267   1.00      .   2.00   6.00
       264    1     2   268   1.00      .   2.00   4.80
       265    1     2   269   1.00      .   0.00   6.00
       266    1     2   270   1.00      .   1.80   3.40
       267    1     2   271   1.00      .   0.00   6.00
       268    1     2   272   1.00      .   0.00   6.00
       269    1     2   273   1.00      .   2.00   6.00
       270    1     2   274   1.00      .   1.90   6.00
       271    1     2   275   1.00      .   1.80   3.60
       272    1     2   276   1.00      .   1.90   6.00
       273    1     2   279   1.00      .   1.80   3.60
       274    1     2   280   1.00      .   1.90   4.50
       275    1     2   281   1.00      .   2.00   5.40
       276    1     2   282   1.00      .   1.80   3.60
       277    1     2   283   1.00      .   2.00   6.00
       278    1     2   284   1.00      .   2.00   4.40
       279    1     2   285   1.00      .   2.00   5.40
       280    1     2   286   1.00      .   2.00   5.00
       281    1     2   287   1.00      .   1.90   4.30
       282    1     2   288   1.00      .   1.80   3.60
       283    1     2   291   1.00      .   1.90   3.70
       284    1     2   292   1.00      .   2.00   5.20
       285    1     2   293   1.00      .   2.00   6.00
       286    1     2   294   1.00      .   1.70   3.30
       287    1     2   295   1.00      .   1.80   3.60
       288    1     2   296   1.00      .   2.00   4.60
       289    1     2   297   1.00      .   1.90   5.10
       290    1     2   298   1.00      .   1.90   4.70
       291    1     2   299   1.00      .   1.70   3.10
       292    1     2   300   1.00      .   1.70   3.10
       293    1     2   301   1.00      .   1.90   4.70
       294    1     2   302   1.00      .   0.00   6.00
       295    1     2   303   1.00      .   1.70   3.50
       296    1     2   304   1.00      .   1.80   3.40
       297    1     2   305   1.00      .   2.00   6.00
       298    1     2   306   1.00      .   0.00   6.00
       299    1     2   307   1.00      .   1.90   4.30
       300    1     2   308   1.00      .   1.90   4.30
       301    1     2   309   1.00      .   0.00   6.00
       302    1     2   310   1.00      .   2.00   6.00
       303    1     2   311   1.00      .   1.90   4.10
       304    1     2   312   1.00      .   1.80   3.80
       305    1     2   313   1.00      .   0.00   6.00
       306    1     2   314   1.00      .   2.00   6.00
       307    1     2   315   1.00      .   1.90   6.00
       308    1     2   316   1.00      .   0.00   6.00
       309    1     2   317   1.00      .   1.90   4.10
       310    1     2   318   1.00      .   1.90   3.90
       311    1     2   319   1.00      .   1.90   4.30
       312    1     2   320   1.00      .   1.80   4.00
       313    1     2   321   1.00      .   1.90   4.50
       314    1     2   322   1.00      .   1.80   3.60
       315    1     2   323   1.00      .   2.00   6.00
       316    1     2   324   1.00      .   2.00   6.00
       317    1     2   325   1.00      .   2.00   5.20
       318    1     2   327   1.00      .   1.90   4.70
       319    1     2   328   1.00      .   1.80   3.80
       320    1     2   330   1.00      .   1.80   3.80
       321    1     2   331   1.00      .   1.90   4.50
       322    1     2   332   1.00      .   0.00   6.00
       323    1     2   333   1.00      .   1.50   2.30
       324    1     2   334   1.00      .   0.00   6.00
       325    1     2   335   1.00      .   1.90   4.10
       326    1     2   339   1.00      .   2.00   4.80
       327    1     2   340   1.00      .   1.70   2.90
       328    1     2   341   1.00      .   1.60   2.60
       329    1     2   342   1.00      .   0.00   6.00
       330    1     2   343   1.00      .   0.00   6.00
       331    1     2   344   1.00      .   0.00   6.00
       332    1     2   345   1.00      .   1.80   3.60
       333    1     2   346   1.00      .   0.00   6.00
       334    1     2   347   1.00      .   1.60   3.00
       335    1     2   355   1.00      .   0.00   6.00
       336    1     2   360   1.00      .   1.40   2.40
       337    1     2   379   1.00      .   0.00   6.00
       338    1     2   380   1.00      .   0.00   6.00
       339    1     2   381   1.00      .   0.00   6.00
       340    1     2   384   1.00      .   0.00   6.00
       341    1     2   386   1.00      .   0.00   6.00
       342    1     2   388   1.00      .   0.00   6.00
       343    1     2   393   1.00      .   0.00   6.00
       344    1     2   394   1.00      .   0.00   6.00
       345    1     2   395   1.00      .   0.00   6.00
       346    1     2   396   1.00      .   0.00   6.00
       347    1     2   398   1.00      .   0.00   6.00
       348    1     2   399   1.00      .   0.00   6.00
       349    1     2   404   1.00      .   0.00   6.00
       350    1     2   406   1.00      .   0.00   6.00
       351    1     2   408   1.00      .   0.00   6.00
       352    1     2   409   1.00      .   1.90   5.10
       353    1     2   410   1.00      .   1.70   3.50
       354    1     2   412   1.00      .   1.80   3.60
       355    1     2   413   1.00      .   1.70   3.10
       356    1     2   414   1.00      .   0.00   6.00
       357    1     2   415   1.00      .   1.30   2.20
       358    1     2   417   1.00      .   0.00   6.00
       359    1     2   430   1.00      .   0.00   6.00
       360    1     2   433   1.00      .   1.50   2.50
       361    1     2   434   1.00      .   0.00   6.00
       362    1     2   435   1.00      .   1.30   2.20
       363    1     2   436   1.00      .   0.00   6.00
       364    1     2   439   1.00      .   0.00   6.00
       365    1     2   442   1.00      .   0.00   6.00
       366    1     2   444   1.00      .   1.90   4.30
       367    1     2   445   1.00      .   1.80   4.00
       368    1     2   446   1.00      .   0.00   6.00
       369    1     2   448   1.00      .   0.00   6.00
       370    1     2   450   1.00      .   1.60   3.00
       371    1     2   451   1.00      .   0.00   6.00
       372    1     2   452   1.00      .   0.00   6.00
       373    1     2   453   1.00      .   2.00   4.60
       374    1     2   454   1.00      .   2.00   5.00
       375    1     2   456   1.00      .   1.70   3.30
       376    1     2   457   1.00      .   0.00   6.00
       377    1     2   458   1.00      .   1.80   3.80
       378    1     2   461   1.00      .   0.00   6.00
       379    1     2   462   1.00      .   0.00   6.00
       380    1     2   463   1.00      .   0.00   6.00
       381    1     2   465   1.00      .   0.00   6.00
       382    1     2   466   1.00      .   0.00   6.00
       383    1     2   467   1.00      .   1.50   2.50
       384    1     2   468   1.00      .   0.00   6.00
       385    1     2   471   1.00      .   1.90   3.90
       386    1     2   472   1.00      .   1.90   4.30
       387    1     2   473   1.00      .   2.00   4.60
       388    1     2   475   1.00      .   0.00   6.00
       389    1     2   476   1.00      .   0.00   6.00
       390    1     2   477   1.00      .   0.00   6.00
       391    1     2   478   1.00      .   1.80   3.80
       392    1     2   480   1.00      .   0.00   6.00
       393    1     2   481   1.00      .   0.00   6.00
       394    1     2   484   1.00      .   1.80   3.60
       395    1     2   485   1.00      .   1.80   3.40
       396    1     2   486   1.00      .   1.80   3.40
       397    1     2   487   1.00      .   1.60   2.80
       398    1     2   497   1.00      .   1.70   3.50
       399    1     2   498   1.00      .   0.00   6.00
       400    1     2   499   1.00      .   0.00   6.00
       401    1     2   501   1.00      .   2.00   6.00
       402    1     2   506   1.00      .   0.00   6.00
       403    1     2   507   1.00      .   1.50   2.70
       404    1     2   512   1.00      .   1.60   3.00
       405    1     2   513   1.00      .   1.60   3.00
       406    1     2   516   1.00      .   1.90   4.10
       407    1     2   518   1.00      .   2.00   5.00
       408    1     2   519   1.00      .   1.70   3.30
       409    1     2   520   1.00      .   0.00   6.00
       410    1     2   521   1.00      .   0.00   6.00
       411    1     2   526   1.00      .   0.00   6.00
       412    1     2   527   1.00      .   1.60   2.60
       413    1     2   530   1.00      .   2.00   5.60
       414    1     2   531   1.00      .   2.00   5.60
       415    1     2   533   1.00      .   0.00   6.00
       416    1     2   534   1.00      .   1.80   3.80
       417    1     2   537   1.00      .   0.00   6.00
       418    1     2   538   1.00      .   1.90   4.10
       419    1     2   540   1.00      .   0.00   6.00
       420    1     2   543   1.00      .   1.70   3.10
       421    1     2   544   1.00      .   1.80   3.40
       422    1     2   550   1.00      .   0.00   6.00
       423    1     2   551   1.00      .   1.50   2.50
       424    1     2   552   1.00      .   0.00   6.00
       425    1     2   553   1.00      .   0.00   6.00
       426    1     2   554   1.00      .   2.00   6.00
       427    1     2   555   1.00      .   0.00   6.00
       428    1     2   556   1.00      .   0.00   6.00
       429    1     2   558   1.00      .   0.00   6.00
       430    1     2   560   1.00      .   0.00   6.00
       431    1     2   574   1.00      .   1.70   3.30
       432    1     2   579   1.00      .   0.00   6.00
       433    1     2   580   1.00      .   0.00   6.00
       434    1     2   581   1.00      .   1.90   6.00
       435    1     2   582   1.00      .   2.00   6.00
       436    1     2   584   1.00      .   1.40   2.20
       437    1     2   587   1.00      .   0.00   6.00
       438    1     2   589   1.00      .   0.00   6.00
       439    1     2   590   1.00      .   0.00   6.00
       440    1     2   591   1.00      .   0.00   6.00
       441    1     2   592   1.00      .   0.00   6.00
       442    1     2   601   1.00      .   0.00   6.00
       443    1     2   606   1.00      .   0.00   6.00
       444    1     2   608   1.00      .   0.00   6.00
       445    1     2   636   1.00      .   2.00   5.40
       446    1     2   637   1.00      .   1.90   4.70
       447    1     2   638   1.00      .   2.00   5.20
       448    1     2   639   1.00      .   1.90   6.00

   stop_

save_



#####################################
# Stereo assignments                #
#####################################
save_stereoassignments
  _Saveframe_category   stereoassignments

# This saveframe is MANDATORY when one or more save_frames have a value for
# _Floating_chirality of partial (aromatics etc. do not need to be identified).
# Notes:
# * Distance constraints with a pseudoatom can exist though the group is 
# defined to be assigned here.
# * The closely related atom nomenclature issues are dealt with in the 
# saveframe category conformer_atom_nom_map. Here the stereoassignments of the
# distance constraints with respect to the IUPAC nomenclature is described.
# A stereogroup is considered floating if the assignements differs over the 
# different models in the ensemble.
# Only fields marked with a question mark need to be filled in.

   _Details
;
Derived from an Aria sequence file
;
    
   loop_
      _Stereo_assignment_ID       # Runs from 1 to the number of groups defined
                                  # here.
      _Mol_system_component_ID
      _Residue_seq_code
      _Residue_label
      _Atom_pseudo_name           # use IUPAC pseudo atom names if available
      _Atom_pseudo_type           # Based on AQUA definitions
      _Assignment_code
      _Atom_one_atom_name         
      _Atom_two_atom_name         
      _Atom_three_atom_name       


# example:
##          1   30   VAL   QG   4  .  swap   MG1   MG2   .
##          2   43   LYS   QB   1  .  asis   HB2   HB3   .
##          3   50   PHE   QR   7  .  float  QD    QE    HZ
##          4    1  DADE  "Q2'" 1  .  asis  "H2'" "H2''" .

      # Enumeration for _Assignment_code:
      # asis      Stereo group is assigned as is
      # swap      Stereo group is assigned but needs to be swapped
      #           (This can be done at the BMRB)
      # float     Stereo group is left to float
    
           1  .    13  PRO  QB    1 ?     HB2  HB3  .   
           2  .    13  PRO  QD    1 ?     HD2  HD3  .   
           3  .    13  PRO  QG    1 ?     HG2  HG3  .   
           4  .    30  GLY  QA    1 ?     HA2  HA3  .   
           5  .    34  GLY  QA    1 ?     HA2  HA3  .   
           6  .    37  CYS  QB    1 ?     HB2  HB3  .   
           7  .    38  GLY  QA    1 ?     HA2  HA3  .   
           8  .    42  GLY  QA    1 ?     HA2  HA3  .   
           9  .    45  ASN  QB    1 ?     HB2  HB3  .   
          10  .    45  ASN  QD    1 ?     HD21 HD22 .   
          11  .    46  GLY  QA    1 ?     HA2  HA3  .   
          12  .    50  GLY  QA    1 ?     HA2  HA3  .   
          13  .    54  GLY  QA    1 ?     HA2  HA3  .   
          14  .    58  GLY  QA    1 ?     HA2  HA3  .   
          15  .    62  GLY  QA    1 ?     HA2  HA3  .   
          16  .    65  ASN  QB    1 ?     HB2  HB3  .   
          17  .    65  ASN  QD    1 ?     HD21 HD22 .   
          18  .    97  CYS  QB    1 ?     HB2  HB3  .   
          19  .   105  ASN  QB    1 ?     HB2  HB3  .   
          20  .   105  ASN  QD    1 ?     HD21 HD22 .   
          21  .   106  MET  QB    1 ?     HB2  HB3  .   
          22  .   106  MET  QG    1 ?     HG2  HG3  .   
          23  .   110  MET  QB    1 ?     HB2  HB3  .   
          24  .   110  MET  QG    1 ?     HG2  HG3  .   
          25  .   114  MET  QB    1 ?     HB2  HB3  .   
          26  .   114  MET  QG    1 ?     HG2  HG3  .   
          27  .   118  MET  QB    1 ?     HB2  HB3  .   
          28  .   118  MET  QG    1 ?     HG2  HG3  .   
          29  .   122  MET  QB    1 ?     HB2  HB3  .   
          30  .   122  MET  QG    1 ?     HG2  HG3  .   
          31  .   126  MET  QB    1 ?     HB2  HB3  .   
          32  .   126  MET  QG    1 ?     HG2  HG3  .   
          33  .   130  MET  QB    1 ?     HB2  HB3  .   
          34  .   130  MET  QG    1 ?     HG2  HG3  .   
          35  .   134  MET  QB    1 ?     HB2  HB3  .   
          36  .   134  MET  QG    1 ?     HG2  HG3  .   
          37  .   138  MET  QB    1 ?     HB2  HB3  .   
          38  .   138  MET  QG    1 ?     HG2  HG3  .   
          39  .   142  MET  QB    1 ?     HB2  HB3  .   
          40  .   142  MET  QG    1 ?     HG2  HG3  .   
          41  .   146  MET  QB    1 ?     HB2  HB3  .   
          42  .   146  MET  QG    1 ?     HG2  HG3  .   
          43  .   150  MET  QB    1 ?     HB2  HB3  .   
          44  .   150  MET  QG    1 ?     HG2  HG3  .   
          45  .   154  MET  QB    1 ?     HB2  HB3  .   
          46  .   154  MET  QG    1 ?     HG2  HG3  .   
          47  .   158  MET  QB    1 ?     HB2  HB3  .   
          48  .   158  MET  QG    1 ?     HG2  HG3  .   
          49  .   162  MET  QB    1 ?     HB2  HB3  .   
          50  .   162  MET  QG    1 ?     HG2  HG3  .   
          51  .   165  CYS  QB    1 ?     HB2  HB3  .   
          52  .   166  MET  QB    1 ?     HB2  HB3  .   
          53  .   166  MET  QG    1 ?     HG2  HG3  .   
          54  .   170  MET  QB    1 ?     HB2  HB3  .   
          55  .   170  MET  QG    1 ?     HG2  HG3  .   
          56  .   173  ASN  QB    1 ?     HB2  HB3  .   
          57  .   173  ASN  QD    1 ?     HD21 HD22 .   
          58  .   174  ASP  QB    1 ?     HB2  HB3  .   
          59  .   178  ASP  QB    1 ?     HB2  HB3  .   
          60  .   182  ASP  QB    1 ?     HB2  HB3  .   
          61  .   186  ASP  QB    1 ?     HB2  HB3  .   
          62  .   190  ASP  QB    1 ?     HB2  HB3  .   
          63  .   194  ASP  QB    1 ?     HB2  HB3  .   
          64  .   198  ASP  QB    1 ?     HB2  HB3  .   
          65  .   202  ASP  QB    1 ?     HB2  HB3  .   
          66  .   206  ASP  QB    1 ?     HB2  HB3  .   
          67  .   210  ASP  QB    1 ?     HB2  HB3  .   
          68  .   213  CYS  QB    1 ?     HB2  HB3  .   
          69  .   214  ASP  QB    1 ?     HB2  HB3  .   
          70  .   218  ASP  QB    1 ?     HB2  HB3  .   
          71  .   221  ASN  QB    1 ?     HB2  HB3  .   
          72  .   221  ASN  QD    1 ?     HD21 HD22 .   
          73  .   253  CYS  QB    1 ?     HB2  HB3  .   
          74  .   261  ASN  QB    1 ?     HB2  HB3  .   
          75  .   261  ASN  QD    1 ?     HD21 HD22 .   
          76  .   262  GLU  QB    1 ?     HB2  HB3  .   
          77  .   262  GLU  QG    1 ?     HG2  HG3  .   
          78  .   266  GLU  QB    1 ?     HB2  HB3  .   
          79  .   266  GLU  QG    1 ?     HG2  HG3  .   
          80  .   270  GLU  QB    1 ?     HB2  HB3  .   
          81  .   270  GLU  QG    1 ?     HG2  HG3  .   
          82  .   274  GLU  QB    1 ?     HB2  HB3  .   
          83  .   274  GLU  QG    1 ?     HG2  HG3  .   
          84  .   278  GLU  QB    1 ?     HB2  HB3  .   
          85  .   278  GLU  QG    1 ?     HG2  HG3  .   
          86  .   282  GLU  QB    1 ?     HB2  HB3  .   
          87  .   282  GLU  QG    1 ?     HG2  HG3  .   
          88  .   286  GLU  QB    1 ?     HB2  HB3  .   
          89  .   286  GLU  QG    1 ?     HG2  HG3  .   
          90  .   290  GLU  QB    1 ?     HB2  HB3  .   
          91  .   290  GLU  QG    1 ?     HG2  HG3  .   
          92  .   294  GLU  QB    1 ?     HB2  HB3  .   
          93  .   294  GLU  QG    1 ?     HG2  HG3  .   
          94  .   298  GLU  QB    1 ?     HB2  HB3  .   
          95  .   298  GLU  QG    1 ?     HG2  HG3  .   
          96  .   302  GLU  QB    1 ?     HB2  HB3  .   
          97  .   302  GLU  QG    1 ?     HG2  HG3  .   
          98  .   306  GLU  QB    1 ?     HB2  HB3  .   
          99  .   306  GLU  QG    1 ?     HG2  HG3  .   
         100  .   310  GLU  QB    1 ?     HB2  HB3  .   
         101  .   310  GLU  QG    1 ?     HG2  HG3  .   
         102  .   313  CYS  QB    1 ?     HB2  HB3  .   
         103  .   314  GLU  QB    1 ?     HB2  HB3  .   
         104  .   314  GLU  QG    1 ?     HG2  HG3  .   
         105  .   318  GLU  QB    1 ?     HB2  HB3  .   
         106  .   318  GLU  QG    1 ?     HG2  HG3  .   
         107  .   321  ASN  QB    1 ?     HB2  HB3  .   
         108  .   321  ASN  QD    1 ?     HD21 HD22 .   
         109  .   322  ARG  QH2   1 ?     HH21 HH22 .   
         110  .   322  ARG  QB    1 ?     HB2  HB3  .   
         111  .   322  ARG  QH1   1 ?     HH11 HH12 .   
         112  .   322  ARG  QD    1 ?     HD2  HD3  .   
         113  .   322  ARG  QG    1 ?     HG2  HG3  .   
         114  .   322  ARG  QH    3 ?     QH1  QH2  .   
         115  .   326  ARG  QH2   1 ?     HH21 HH22 .   
         116  .   326  ARG  QB    1 ?     HB2  HB3  .   
         117  .   326  ARG  QH1   1 ?     HH11 HH12 .   
         118  .   326  ARG  QD    1 ?     HD2  HD3  .   
         119  .   326  ARG  QG    1 ?     HG2  HG3  .   
         120  .   326  ARG  QH    3 ?     QH1  QH2  .   
         121  .   330  ARG  QH2   1 ?     HH21 HH22 .   
         122  .   330  ARG  QB    1 ?     HB2  HB3  .   
         123  .   330  ARG  QH1   1 ?     HH11 HH12 .   
         124  .   330  ARG  QD    1 ?     HD2  HD3  .   
         125  .   330  ARG  QG    1 ?     HG2  HG3  .   
         126  .   330  ARG  QH    3 ?     QH1  QH2  .   
         127  .   334  ARG  QH2   1 ?     HH21 HH22 .   
         128  .   334  ARG  QB    1 ?     HB2  HB3  .   
         129  .   334  ARG  QH1   1 ?     HH11 HH12 .   
         130  .   334  ARG  QD    1 ?     HD2  HD3  .   
         131  .   334  ARG  QG    1 ?     HG2  HG3  .   
         132  .   334  ARG  QH    3 ?     QH1  QH2  .   
         133  .   338  ARG  QH2   1 ?     HH21 HH22 .   
         134  .   338  ARG  QB    1 ?     HB2  HB3  .   
         135  .   338  ARG  QH1   1 ?     HH11 HH12 .   
         136  .   338  ARG  QD    1 ?     HD2  HD3  .   
         137  .   338  ARG  QG    1 ?     HG2  HG3  .   
         138  .   338  ARG  QH    3 ?     QH1  QH2  .   
         139  .   342  ARG  QH2   1 ?     HH21 HH22 .   
         140  .   342  ARG  QB    1 ?     HB2  HB3  .   
         141  .   342  ARG  QH1   1 ?     HH11 HH12 .   
         142  .   342  ARG  QD    1 ?     HD2  HD3  .   
         143  .   342  ARG  QG    1 ?     HG2  HG3  .   
         144  .   342  ARG  QH    3 ?     QH1  QH2  .   
         145  .   346  ARG  QH2   1 ?     HH21 HH22 .   
         146  .   346  ARG  QB    1 ?     HB2  HB3  .   
         147  .   346  ARG  QH1   1 ?     HH11 HH12 .   
         148  .   346  ARG  QD    1 ?     HD2  HD3  .   
         149  .   346  ARG  QG    1 ?     HG2  HG3  .   
         150  .   346  ARG  QH    3 ?     QH1  QH2  .   
         151  .   350  ARG  QH2   1 ?     HH21 HH22 .   
         152  .   350  ARG  QB    1 ?     HB2  HB3  .   
         153  .   350  ARG  QH1   1 ?     HH11 HH12 .   
         154  .   350  ARG  QD    1 ?     HD2  HD3  .   
         155  .   350  ARG  QG    1 ?     HG2  HG3  .   
         156  .   350  ARG  QH    3 ?     QH1  QH2  .   
         157  .   354  ARG  QH2   1 ?     HH21 HH22 .   
         158  .   354  ARG  QB    1 ?     HB2  HB3  .   
         159  .   354  ARG  QH1   1 ?     HH11 HH12 .   
         160  .   354  ARG  QD    1 ?     HD2  HD3  .   
         161  .   354  ARG  QG    1 ?     HG2  HG3  .   
         162  .   354  ARG  QH    3 ?     QH1  QH2  .   
         163  .   358  ARG  QH2   1 ?     HH21 HH22 .   
         164  .   358  ARG  QB    1 ?     HB2  HB3  .   
         165  .   358  ARG  QH1   1 ?     HH11 HH12 .   
         166  .   358  ARG  QD    1 ?     HD2  HD3  .   
         167  .   358  ARG  QG    1 ?     HG2  HG3  .   
         168  .   358  ARG  QH    3 ?     QH1  QH2  .   
         169  .   362  ARG  QH2   1 ?     HH21 HH22 .   
         170  .   362  ARG  QB    1 ?     HB2  HB3  .   
         171  .   362  ARG  QH1   1 ?     HH11 HH12 .   
         172  .   362  ARG  QD    1 ?     HD2  HD3  .   
         173  .   362  ARG  QG    1 ?     HG2  HG3  .   
         174  .   362  ARG  QH    3 ?     QH1  QH2  .   
         175  .   366  ARG  QH2   1 ?     HH21 HH22 .   
         176  .   366  ARG  QB    1 ?     HB2  HB3  .   
         177  .   366  ARG  QH1   1 ?     HH11 HH12 .   
         178  .   366  ARG  QD    1 ?     HD2  HD3  .   
         179  .   366  ARG  QG    1 ?     HG2  HG3  .   
         180  .   366  ARG  QH    3 ?     QH1  QH2  .   
         181  .   370  ARG  QH2   1 ?     HH21 HH22 .   
         182  .   370  ARG  QB    1 ?     HB2  HB3  .   
         183  .   370  ARG  QH1   1 ?     HH11 HH12 .   
         184  .   370  ARG  QD    1 ?     HD2  HD3  .   
         185  .   370  ARG  QG    1 ?     HG2  HG3  .   
         186  .   370  ARG  QH    3 ?     QH1  QH2  .   
         187  .   374  ARG  QH2   1 ?     HH21 HH22 .   
         188  .   374  ARG  QB    1 ?     HB2  HB3  .   
         189  .   374  ARG  QH1   1 ?     HH11 HH12 .   
         190  .   374  ARG  QD    1 ?     HD2  HD3  .   
         191  .   374  ARG  QG    1 ?     HG2  HG3  .   
         192  .   374  ARG  QH    3 ?     QH1  QH2  .   
         193  .   378  ARG  QH2   1 ?     HH21 HH22 .   
         194  .   378  ARG  QB    1 ?     HB2  HB3  .   
         195  .   378  ARG  QH1   1 ?     HH11 HH12 .   
         196  .   378  ARG  QD    1 ?     HD2  HD3  .   
         197  .   378  ARG  QG    1 ?     HG2  HG3  .   
         198  .   378  ARG  QH    3 ?     QH1  QH2  .   
         199  .   382  ARG  QH2   1 ?     HH21 HH22 .   
         200  .   382  ARG  QB    1 ?     HB2  HB3  .   
         201  .   382  ARG  QH1   1 ?     HH11 HH12 .   
         202  .   382  ARG  QD    1 ?     HD2  HD3  .   
         203  .   382  ARG  QG    1 ?     HG2  HG3  .   
         204  .   382  ARG  QH    3 ?     QH1  QH2  .   
         205  .   386  ARG  QH2   1 ?     HH21 HH22 .   
         206  .   386  ARG  QB    1 ?     HB2  HB3  .   
         207  .   386  ARG  QH1   1 ?     HH11 HH12 .   
         208  .   386  ARG  QD    1 ?     HD2  HD3  .   
         209  .   386  ARG  QG    1 ?     HG2  HG3  .   
         210  .   386  ARG  QH    3 ?     QH1  QH2  .   
         211  .   390  ARG  QH2   1 ?     HH21 HH22 .   
         212  .   390  ARG  QB    1 ?     HB2  HB3  .   
         213  .   390  ARG  QH1   1 ?     HH11 HH12 .   
         214  .   390  ARG  QD    1 ?     HD2  HD3  .   
         215  .   390  ARG  QG    1 ?     HG2  HG3  .   
         216  .   390  ARG  QH    3 ?     QH1  QH2  .   
         217  .   394  ARG  QH2   1 ?     HH21 HH22 .   
         218  .   394  ARG  QB    1 ?     HB2  HB3  .   
         219  .   394  ARG  QH1   1 ?     HH11 HH12 .   
         220  .   394  ARG  QD    1 ?     HD2  HD3  .   
         221  .   394  ARG  QG    1 ?     HG2  HG3  .   
         222  .   394  ARG  QH    3 ?     QH1  QH2  .   
         223  .   398  ARG  QH2   1 ?     HH21 HH22 .   
         224  .   398  ARG  QB    1 ?     HB2  HB3  .   
         225  .   398  ARG  QH1   1 ?     HH11 HH12 .   
         226  .   398  ARG  QD    1 ?     HD2  HD3  .   
         227  .   398  ARG  QG    1 ?     HG2  HG3  .   
         228  .   398  ARG  QH    3 ?     QH1  QH2  .   
         229  .   402  ARG  QH2   1 ?     HH21 HH22 .   
         230  .   402  ARG  QB    1 ?     HB2  HB3  .   
         231  .   402  ARG  QH1   1 ?     HH11 HH12 .   
         232  .   402  ARG  QD    1 ?     HD2  HD3  .   
         233  .   402  ARG  QG    1 ?     HG2  HG3  .   
         234  .   402  ARG  QH    3 ?     QH1  QH2  .   
         235  .   406  ARG  QH2   1 ?     HH21 HH22 .   
         236  .   406  ARG  QB    1 ?     HB2  HB3  .   
         237  .   406  ARG  QH1   1 ?     HH11 HH12 .   
         238  .   406  ARG  QD    1 ?     HD2  HD3  .   
         239  .   406  ARG  QG    1 ?     HG2  HG3  .   
         240  .   406  ARG  QH    3 ?     QH1  QH2  .   
         241  .   409  CYS  QB    1 ?     HB2  HB3  .   
         242  .   410  ARG  QH2   1 ?     HH21 HH22 .   
         243  .   410  ARG  QB    1 ?     HB2  HB3  .   
         244  .   410  ARG  QH1   1 ?     HH11 HH12 .   
         245  .   410  ARG  QD    1 ?     HD2  HD3  .   
         246  .   410  ARG  QG    1 ?     HG2  HG3  .   
         247  .   410  ARG  QH    3 ?     QH1  QH2  .   
         248  .   414  ARG  QH2   1 ?     HH21 HH22 .   
         249  .   414  ARG  QB    1 ?     HB2  HB3  .   
         250  .   414  ARG  QH1   1 ?     HH11 HH12 .   
         251  .   414  ARG  QD    1 ?     HD2  HD3  .   
         252  .   414  ARG  QG    1 ?     HG2  HG3  .   
         253  .   414  ARG  QH    3 ?     QH1  QH2  .   
         254  .   417  ASN  QB    1 ?     HB2  HB3  .   
         255  .   417  ASN  QD    1 ?     HD21 HD22 .   
         256  .   418  LYS  QB    1 ?     HB2  HB3  .   
         257  .   418  LYS  QE    1 ?     HE2  HE3  .   
         258  .   418  LYS  QD    1 ?     HD2  HD3  .   
         259  .   418  LYS  QG    1 ?     HG2  HG3  .   
         260  .   422  LYS  QB    1 ?     HB2  HB3  .   
         261  .   422  LYS  QE    1 ?     HE2  HE3  .   
         262  .   422  LYS  QD    1 ?     HD2  HD3  .   
         263  .   422  LYS  QG    1 ?     HG2  HG3  .   
         264  .   426  LYS  QB    1 ?     HB2  HB3  .   
         265  .   426  LYS  QE    1 ?     HE2  HE3  .   
         266  .   426  LYS  QD    1 ?     HD2  HD3  .   
         267  .   426  LYS  QG    1 ?     HG2  HG3  .   
         268  .   430  LYS  QB    1 ?     HB2  HB3  .   
         269  .   430  LYS  QE    1 ?     HE2  HE3  .   
         270  .   430  LYS  QD    1 ?     HD2  HD3  .   
         271  .   430  LYS  QG    1 ?     HG2  HG3  .   
         272  .   434  LYS  QB    1 ?     HB2  HB3  .   
         273  .   434  LYS  QE    1 ?     HE2  HE3  .   
         274  .   434  LYS  QD    1 ?     HD2  HD3  .   
         275  .   434  LYS  QG    1 ?     HG2  HG3  .   
         276  .   438  LYS  QB    1 ?     HB2  HB3  .   
         277  .   438  LYS  QE    1 ?     HE2  HE3  .   
         278  .   438  LYS  QD    1 ?     HD2  HD3  .   
         279  .   438  LYS  QG    1 ?     HG2  HG3  .   
         280  .   442  LYS  QB    1 ?     HB2  HB3  .   
         281  .   442  LYS  QE    1 ?     HE2  HE3  .   
         282  .   442  LYS  QD    1 ?     HD2  HD3  .   
         283  .   442  LYS  QG    1 ?     HG2  HG3  .   
         284  .   446  LYS  QB    1 ?     HB2  HB3  .   
         285  .   446  LYS  QE    1 ?     HE2  HE3  .   
         286  .   446  LYS  QD    1 ?     HD2  HD3  .   
         287  .   446  LYS  QG    1 ?     HG2  HG3  .   
         288  .   450  LYS  QB    1 ?     HB2  HB3  .   
         289  .   450  LYS  QE    1 ?     HE2  HE3  .   
         290  .   450  LYS  QD    1 ?     HD2  HD3  .   
         291  .   450  LYS  QG    1 ?     HG2  HG3  .   
         292  .   454  LYS  QB    1 ?     HB2  HB3  .   
         293  .   454  LYS  QE    1 ?     HE2  HE3  .   
         294  .   454  LYS  QD    1 ?     HD2  HD3  .   
         295  .   454  LYS  QG    1 ?     HG2  HG3  .   
         296  .   458  LYS  QB    1 ?     HB2  HB3  .   
         297  .   458  LYS  QE    1 ?     HE2  HE3  .   
         298  .   458  LYS  QD    1 ?     HD2  HD3  .   
         299  .   458  LYS  QG    1 ?     HG2  HG3  .   
         300  .   462  LYS  QB    1 ?     HB2  HB3  .   
         301  .   462  LYS  QE    1 ?     HE2  HE3  .   
         302  .   462  LYS  QD    1 ?     HD2  HD3  .   
         303  .   462  LYS  QG    1 ?     HG2  HG3  .   
         304  .   466  LYS  QB    1 ?     HB2  HB3  .   
         305  .   466  LYS  QE    1 ?     HE2  HE3  .   
         306  .   466  LYS  QD    1 ?     HD2  HD3  .   
         307  .   466  LYS  QG    1 ?     HG2  HG3  .   
         308  .   470  LYS  QB    1 ?     HB2  HB3  .   
         309  .   470  LYS  QE    1 ?     HE2  HE3  .   
         310  .   470  LYS  QD    1 ?     HD2  HD3  .   
         311  .   470  LYS  QG    1 ?     HG2  HG3  .   
         312  .   474  LYS  QB    1 ?     HB2  HB3  .   
         313  .   474  LYS  QE    1 ?     HE2  HE3  .   
         314  .   474  LYS  QD    1 ?     HD2  HD3  .   
         315  .   474  LYS  QG    1 ?     HG2  HG3  .   
         316  .   478  LYS  QB    1 ?     HB2  HB3  .   
         317  .   478  LYS  QE    1 ?     HE2  HE3  .   
         318  .   478  LYS  QD    1 ?     HD2  HD3  .   
         319  .   478  LYS  QG    1 ?     HG2  HG3  .   
         320  .   482  LYS  QB    1 ?     HB2  HB3  .   
         321  .   482  LYS  QE    1 ?     HE2  HE3  .   
         322  .   482  LYS  QD    1 ?     HD2  HD3  .   
         323  .   482  LYS  QG    1 ?     HG2  HG3  .   
         324  .   486  LYS  QB    1 ?     HB2  HB3  .   
         325  .   486  LYS  QE    1 ?     HE2  HE3  .   
         326  .   486  LYS  QD    1 ?     HD2  HD3  .   
         327  .   486  LYS  QG    1 ?     HG2  HG3  .   
         328  .   490  LYS  QB    1 ?     HB2  HB3  .   
         329  .   490  LYS  QE    1 ?     HE2  HE3  .   
         330  .   490  LYS  QD    1 ?     HD2  HD3  .   
         331  .   490  LYS  QG    1 ?     HG2  HG3  .   
         332  .   494  LYS  QB    1 ?     HB2  HB3  .   
         333  .   494  LYS  QE    1 ?     HE2  HE3  .   
         334  .   494  LYS  QD    1 ?     HD2  HD3  .   
         335  .   494  LYS  QG    1 ?     HG2  HG3  .   
         336  .   497  CYS  QB    1 ?     HB2  HB3  .   
         337  .   498  LYS  QB    1 ?     HB2  HB3  .   
         338  .   498  LYS  QE    1 ?     HE2  HE3  .   
         339  .   498  LYS  QD    1 ?     HD2  HD3  .   
         340  .   498  LYS  QG    1 ?     HG2  HG3  .   
         341  .   502  LYS  QB    1 ?     HB2  HB3  .   
         342  .   502  LYS  QE    1 ?     HE2  HE3  .   
         343  .   502  LYS  QD    1 ?     HD2  HD3  .   
         344  .   502  LYS  QG    1 ?     HG2  HG3  .   
         345  .   505  ASN  QB    1 ?     HB2  HB3  .   
         346  .   505  ASN  QD    1 ?     HD21 HD22 .   
         347  .   506  GLU  QB    1 ?     HB2  HB3  .   
         348  .   506  GLU  QG    1 ?     HG2  HG3  .   
         349  .   510  GLU  QB    1 ?     HB2  HB3  .   
         350  .   510  GLU  QG    1 ?     HG2  HG3  .   
         351  .   514  GLU  QB    1 ?     HB2  HB3  .   
         352  .   514  GLU  QG    1 ?     HG2  HG3  .   
         353  .   518  GLU  QB    1 ?     HB2  HB3  .   
         354  .   518  GLU  QG    1 ?     HG2  HG3  .   
         355  .   522  GLU  QB    1 ?     HB2  HB3  .   
         356  .   522  GLU  QG    1 ?     HG2  HG3  .   
         357  .   526  GLU  QB    1 ?     HB2  HB3  .   
         358  .   526  GLU  QG    1 ?     HG2  HG3  .   
         359  .   530  GLU  QB    1 ?     HB2  HB3  .   
         360  .   530  GLU  QG    1 ?     HG2  HG3  .   
         361  .   534  GLU  QB    1 ?     HB2  HB3  .   
         362  .   534  GLU  QG    1 ?     HG2  HG3  .   
         363  .   538  GLU  QB    1 ?     HB2  HB3  .   
         364  .   538  GLU  QG    1 ?     HG2  HG3  .   
         365  .   542  GLU  QB    1 ?     HB2  HB3  .   
         366  .   542  GLU  QG    1 ?     HG2  HG3  .   
         367  .   546  GLU  QB    1 ?     HB2  HB3  .   
         368  .   546  GLU  QG    1 ?     HG2  HG3  .   
         369  .   550  GLU  QB    1 ?     HB2  HB3  .   
         370  .   550  GLU  QG    1 ?     HG2  HG3  .   
         371  .   554  GLU  QB    1 ?     HB2  HB3  .   
         372  .   554  GLU  QG    1 ?     HG2  HG3  .   
         373  .   557  CYS  QB    1 ?     HB2  HB3  .   
         374  .   558  GLU  QB    1 ?     HB2  HB3  .   
         375  .   558  GLU  QG    1 ?     HG2  HG3  .   
         376  .   562  GLU  QB    1 ?     HB2  HB3  .   
         377  .   562  GLU  QG    1 ?     HG2  HG3  .   
         378  .   565  ASN  QB    1 ?     HB2  HB3  .   
         379  .   565  ASN  QD    1 ?     HD21 HD22 .   
         380  .   566  GLN  QB    1 ?     HB2  HB3  .   
         381  .   566  GLN  QE    1 ?     HE21 HE22 .   
         382  .   566  GLN  QG    1 ?     HG2  HG3  .   
         383  .   570  GLN  QB    1 ?     HB2  HB3  .   
         384  .   570  GLN  QE    1 ?     HE21 HE22 .   
         385  .   570  GLN  QG    1 ?     HG2  HG3  .   
         386  .   574  GLN  QB    1 ?     HB2  HB3  .   
         387  .   574  GLN  QE    1 ?     HE21 HE22 .   
         388  .   574  GLN  QG    1 ?     HG2  HG3  .   
         389  .   578  GLN  QB    1 ?     HB2  HB3  .   
         390  .   578  GLN  QE    1 ?     HE21 HE22 .   
         391  .   578  GLN  QG    1 ?     HG2  HG3  .   
         392  .   582  GLN  QB    1 ?     HB2  HB3  .   
         393  .   582  GLN  QE    1 ?     HE21 HE22 .   
         394  .   582  GLN  QG    1 ?     HG2  HG3  .   
         395  .   586  GLN  QB    1 ?     HB2  HB3  .   
         396  .   586  GLN  QE    1 ?     HE21 HE22 .   
         397  .   586  GLN  QG    1 ?     HG2  HG3  .   
         398  .   590  GLN  QB    1 ?     HB2  HB3  .   
         399  .   590  GLN  QE    1 ?     HE21 HE22 .   
         400  .   590  GLN  QG    1 ?     HG2  HG3  .   
         401  .   594  GLN  QB    1 ?     HB2  HB3  .   
         402  .   594  GLN  QE    1 ?     HE21 HE22 .   
         403  .   594  GLN  QG    1 ?     HG2  HG3  .   
         404  .   598  GLN  QB    1 ?     HB2  HB3  .   
         405  .   598  GLN  QE    1 ?     HE21 HE22 .   
         406  .   598  GLN  QG    1 ?     HG2  HG3  .   
         407  .   602  GLN  QB    1 ?     HB2  HB3  .   
         408  .   602  GLN  QE    1 ?     HE21 HE22 .   
         409  .   602  GLN  QG    1 ?     HG2  HG3  .   
         410  .   606  GLN  QB    1 ?     HB2  HB3  .   
         411  .   606  GLN  QE    1 ?     HE21 HE22 .   
         412  .   606  GLN  QG    1 ?     HG2  HG3  .   
         413  .   610  GLN  QB    1 ?     HB2  HB3  .   
         414  .   610  GLN  QE    1 ?     HE21 HE22 .   
         415  .   610  GLN  QG    1 ?     HG2  HG3  .   
         416  .   614  GLN  QB    1 ?     HB2  HB3  .   
         417  .   614  GLN  QE    1 ?     HE21 HE22 .   
         418  .   614  GLN  QG    1 ?     HG2  HG3  .   
         419  .   618  GLN  QB    1 ?     HB2  HB3  .   
         420  .   618  GLN  QE    1 ?     HE21 HE22 .   
         421  .   618  GLN  QG    1 ?     HG2  HG3  .   
         422  .   622  GLN  QB    1 ?     HB2  HB3  .   
         423  .   622  GLN  QE    1 ?     HE21 HE22 .   
         424  .   622  GLN  QG    1 ?     HG2  HG3  .   
         425  .   625  CYS  QB    1 ?     HB2  HB3  .   
         426  .   626  GLN  QB    1 ?     HB2  HB3  .   
         427  .   626  GLN  QE    1 ?     HE21 HE22 .   
         428  .   626  GLN  QG    1 ?     HG2  HG3  .   
         429  .   630  GLN  QB    1 ?     HB2  HB3  .   
         430  .   630  GLN  QE    1 ?     HE21 HE22 .   
         431  .   630  GLN  QG    1 ?     HG2  HG3  .   
         432  .   633  ASN  QB    1 ?     HB2  HB3  .   
         433  .   633  ASN  QD    1 ?     HD21 HD22 .   
         434  .   634  SER  QB    1 ?     HB2  HB3  .   
         435  .   638  SER  QB    1 ?     HB2  HB3  .   
         436  .   642  SER  QB    1 ?     HB2  HB3  .   
         437  .   646  SER  QB    1 ?     HB2  HB3  .   
         438  .   650  SER  QB    1 ?     HB2  HB3  .   
         439  .   654  SER  QB    1 ?     HB2  HB3  .   
         440  .   658  SER  QB    1 ?     HB2  HB3  .   
         441  .   662  SER  QB    1 ?     HB2  HB3  .   
         442  .   666  SER  QB    1 ?     HB2  HB3  .   
         443  .   669  CYS  QB    1 ?     HB2  HB3  .   
         444  .   670  SER  QB    1 ?     HB2  HB3  .   
         445  .   674  SER  QB    1 ?     HB2  HB3  .   
         446  .   677  ASN  QB    1 ?     HB2  HB3  .   
         447  .   677  ASN  QD    1 ?     HD21 HD22 .   
         448  .   678  CYS  QB    1 ?     HB2  HB3  .   
         449  .   682  CYS  QB    1 ?     HB2  HB3  .   
         450  .   686  CYS  QB    1 ?     HB2  HB3  .   
         451  .   690  CYS  QB    1 ?     HB2  HB3  .   
         452  .   694  CYS  QB    1 ?     HB2  HB3  .   
         453  .   698  CYS  QB    1 ?     HB2  HB3  .   
         454  .   702  CYS  QB    1 ?     HB2  HB3  .   
         455  .   706  CYS  QB    1 ?     HB2  HB3  .   
         456  .   710  CYS  QB    1 ?     HB2  HB3  .   
         457  .   713  CYS  QB    1 ?     HB2  HB3  .   
         458  .   714  CYS  QB    1 ?     HB2  HB3  .   
         459  .   718  CYS  QB    1 ?     HB2  HB3  .   
         460  .   721  ASN  QB    1 ?     HB2  HB3  .   
         461  .   721  ASN  QD    1 ?     HD21 HD22 .   
         462  .   722  VAL  QG    4 ?     MG1  MG2  .   
         463  .   726  VAL  QG    4 ?     MG1  MG2  .   
         464  .   730  VAL  QG    4 ?     MG1  MG2  .   
         465  .   734  VAL  QG    4 ?     MG1  MG2  .   
         466  .   738  VAL  QG    4 ?     MG1  MG2  .   
         467  .   742  VAL  QG    4 ?     MG1  MG2  .   
         468  .   746  VAL  QG    4 ?     MG1  MG2  .   
         469  .   750  VAL  QG    4 ?     MG1  MG2  .   
         470  .   754  VAL  QG    4 ?     MG1  MG2  .   
         471  .   758  VAL  QG    4 ?     MG1  MG2  .   
         472  .   762  VAL  QG    4 ?     MG1  MG2  .   
         473  .   766  VAL  QG    4 ?     MG1  MG2  .   
         474  .   770  VAL  QG    4 ?     MG1  MG2  .   
         475  .   774  VAL  QG    4 ?     MG1  MG2  .   
         476  .   777  CYS  QB    1 ?     HB2  HB3  .   
         477  .   778  VAL  QG    4 ?     MG1  MG2  .   
         478  .   782  VAL  QG    4 ?     MG1  MG2  .   
         479  .   785  ASN  QB    1 ?     HB2  HB3  .   
         480  .   785  ASN  QD    1 ?     HD21 HD22 .   
         481  .   786  ASN  QB    1 ?     HB2  HB3  .   
         482  .   786  ASN  QD    1 ?     HD21 HD22 .   
         483  .   790  ASN  QB    1 ?     HB2  HB3  .   
         484  .   790  ASN  QD    1 ?     HD21 HD22 .   
         485  .   794  ASN  QB    1 ?     HB2  HB3  .   
         486  .   794  ASN  QD    1 ?     HD21 HD22 .   
         487  .   798  ASN  QB    1 ?     HB2  HB3  .   
         488  .   798  ASN  QD    1 ?     HD21 HD22 .   
         489  .   802  ASN  QB    1 ?     HB2  HB3  .   
         490  .   802  ASN  QD    1 ?     HD21 HD22 .   
         491  .   806  ASN  QB    1 ?     HB2  HB3  .   
         492  .   806  ASN  QD    1 ?     HD21 HD22 .   
         493  .   810  ASN  QB    1 ?     HB2  HB3  .   
         494  .   810  ASN  QD    1 ?     HD21 HD22 .   
         495  .   814  ASN  QB    1 ?     HB2  HB3  .   
         496  .   814  ASN  QD    1 ?     HD21 HD22 .   
         497  .   818  ASN  QB    1 ?     HB2  HB3  .   
         498  .   818  ASN  QD    1 ?     HD21 HD22 .   
         499  .   822  ASN  QB    1 ?     HB2  HB3  .   
         500  .   822  ASN  QD    1 ?     HD21 HD22 .   
         501  .   826  ASN  QB    1 ?     HB2  HB3  .   
         502  .   826  ASN  QD    1 ?     HD21 HD22 .   
         503  .   830  ASN  QB    1 ?     HB2  HB3  .   
         504  .   830  ASN  QD    1 ?     HD21 HD22 .   
         505  .   833  CYS  QB    1 ?     HB2  HB3  .   
         506  .   834  ASN  QB    1 ?     HB2  HB3  .   
         507  .   834  ASN  QD    1 ?     HD21 HD22 .   
         508  .   838  ASN  QB    1 ?     HB2  HB3  .   
         509  .   838  ASN  QD    1 ?     HD21 HD22 .   
         510  .   841  ASN  QB    1 ?     HB2  HB3  .   
         511  .   841  ASN  QD    1 ?     HD21 HD22 .   
         512  .   842  CYS  QB    1 ?     HB2  HB3  .   
         513  .   846  CYS  QB    1 ?     HB2  HB3  .   
         514  .   850  CYS  QB    1 ?     HB2  HB3  .   
         515  .   854  CYS  QB    1 ?     HB2  HB3  .   
         516  .   858  CYS  QB    1 ?     HB2  HB3  .   
         517  .   862  CYS  QB    1 ?     HB2  HB3  .   
         518  .   866  CYS  QB    1 ?     HB2  HB3  .   
         519  .   870  CYS  QB    1 ?     HB2  HB3  .   
         520  .   874  CYS  QB    1 ?     HB2  HB3  .   
         521  .   877  CYS  QB    1 ?     HB2  HB3  .   
         522  .   878  CYS  QB    1 ?     HB2  HB3  .   
         523  .   882  CYS  QB    1 ?     HB2  HB3  .   
         524  .   885  ASN  QB    1 ?     HB2  HB3  .   
         525  .   885  ASN  QD    1 ?     HD21 HD22 .   
         526  .   886  GLY  QA    1 ?     HA2  HA3  .   
         527  .   890  GLY  QA    1 ?     HA2  HA3  .   
         528  .   894  GLY  QA    1 ?     HA2  HA3  .   
         529  .   898  GLY  QA    1 ?     HA2  HA3  .   
         530  .   902  GLY  QA    1 ?     HA2  HA3  .   
         531  .   905  CYS  QB    1 ?     HB2  HB3  .   
         532  .   906  GLY  QA    1 ?     HA2  HA3  .   
         533  .   910  GLY  QA    1 ?     HA2  HA3  .   
         534  .   913  ASN  QB    1 ?     HB2  HB3  .   
         535  .   913  ASN  QD    1 ?     HD21 HD22 .   
         536  .   914  ARG  QH2   1 ?     HH21 HH22 .   
         537  .   914  ARG  QB    1 ?     HB2  HB3  .   
         538  .   914  ARG  QH1   1 ?     HH11 HH12 .   
         539  .   914  ARG  QD    1 ?     HD2  HD3  .   
         540  .   914  ARG  QG    1 ?     HG2  HG3  .   
         541  .   914  ARG  QH    3 ?     QH1  QH2  .   
         542  .   918  ARG  QH2   1 ?     HH21 HH22 .   
         543  .   918  ARG  QB    1 ?     HB2  HB3  .   
         544  .   918  ARG  QH1   1 ?     HH11 HH12 .   
         545  .   918  ARG  QD    1 ?     HD2  HD3  .   
         546  .   918  ARG  QG    1 ?     HG2  HG3  .   
         547  .   918  ARG  QH    3 ?     QH1  QH2  .   
         548  .   922  ARG  QH2   1 ?     HH21 HH22 .   
         549  .   922  ARG  QB    1 ?     HB2  HB3  .   
         550  .   922  ARG  QH1   1 ?     HH11 HH12 .   
         551  .   922  ARG  QD    1 ?     HD2  HD3  .   
         552  .   922  ARG  QG    1 ?     HG2  HG3  .   
         553  .   922  ARG  QH    3 ?     QH1  QH2  .   
         554  .   926  ARG  QH2   1 ?     HH21 HH22 .   
         555  .   926  ARG  QB    1 ?     HB2  HB3  .   
         556  .   926  ARG  QH1   1 ?     HH11 HH12 .   
         557  .   926  ARG  QD    1 ?     HD2  HD3  .   
         558  .   926  ARG  QG    1 ?     HG2  HG3  .   
         559  .   926  ARG  QH    3 ?     QH1  QH2  .   
         560  .   930  ARG  QH2   1 ?     HH21 HH22 .   
         561  .   930  ARG  QB    1 ?     HB2  HB3  .   
         562  .   930  ARG  QH1   1 ?     HH11 HH12 .   
         563  .   930  ARG  QD    1 ?     HD2  HD3  .   
         564  .   930  ARG  QG    1 ?     HG2  HG3  .   
         565  .   930  ARG  QH    3 ?     QH1  QH2  .   
         566  .   934  ARG  QH2   1 ?     HH21 HH22 .   
         567  .   934  ARG  QB    1 ?     HB2  HB3  .   
         568  .   934  ARG  QH1   1 ?     HH11 HH12 .   
         569  .   934  ARG  QD    1 ?     HD2  HD3  .   
         570  .   934  ARG  QG    1 ?     HG2  HG3  .   
         571  .   934  ARG  QH    3 ?     QH1  QH2  .   
         572  .   938  ARG  QH2   1 ?     HH21 HH22 .   
         573  .   938  ARG  QB    1 ?     HB2  HB3  .   
         574  .   938  ARG  QH1   1 ?     HH11 HH12 .   
         575  .   938  ARG  QD    1 ?     HD2  HD3  .   
         576  .   938  ARG  QG    1 ?     HG2  HG3  .   
         577  .   938  ARG  QH    3 ?     QH1  QH2  .   
         578  .   942  ARG  QH2   1 ?     HH21 HH22 .   
         579  .   942  ARG  QB    1 ?     HB2  HB3  .   
         580  .   942  ARG  QH1   1 ?     HH11 HH12 .   
         581  .   942  ARG  QD    1 ?     HD2  HD3  .   
         582  .   942  ARG  QG    1 ?     HG2  HG3  .   
         583  .   942  ARG  QH    3 ?     QH1  QH2  .   
         584  .   946  ARG  QH2   1 ?     HH21 HH22 .   
         585  .   946  ARG  QB    1 ?     HB2  HB3  .   
         586  .   946  ARG  QH1   1 ?     HH11 HH12 .   
         587  .   946  ARG  QD    1 ?     HD2  HD3  .   
         588  .   946  ARG  QG    1 ?     HG2  HG3  .   
         589  .   946  ARG  QH    3 ?     QH1  QH2  .   
         590  .   950  ARG  QH2   1 ?     HH21 HH22 .   
         591  .   950  ARG  QB    1 ?     HB2  HB3  .   
         592  .   950  ARG  QH1   1 ?     HH11 HH12 .   
         593  .   950  ARG  QD    1 ?     HD2  HD3  .   
         594  .   950  ARG  QG    1 ?     HG2  HG3  .   
         595  .   950  ARG  QH    3 ?     QH1  QH2  .   
         596  .   954  ARG  QH2   1 ?     HH21 HH22 .   
         597  .   954  ARG  QB    1 ?     HB2  HB3  .   
         598  .   954  ARG  QH1   1 ?     HH11 HH12 .   
         599  .   954  ARG  QD    1 ?     HD2  HD3  .   
         600  .   954  ARG  QG    1 ?     HG2  HG3  .   
         601  .   954  ARG  QH    3 ?     QH1  QH2  .   
         602  .   958  ARG  QH2   1 ?     HH21 HH22 .   
         603  .   958  ARG  QB    1 ?     HB2  HB3  .   
         604  .   958  ARG  QH1   1 ?     HH11 HH12 .   
         605  .   958  ARG  QD    1 ?     HD2  HD3  .   
         606  .   958  ARG  QG    1 ?     HG2  HG3  .   
         607  .   958  ARG  QH    3 ?     QH1  QH2  .   
         608  .   962  ARG  QH2   1 ?     HH21 HH22 .   
         609  .   962  ARG  QB    1 ?     HB2  HB3  .   
         610  .   962  ARG  QH1   1 ?     HH11 HH12 .   
         611  .   962  ARG  QD    1 ?     HD2  HD3  .   
         612  .   962  ARG  QG    1 ?     HG2  HG3  .   
         613  .   962  ARG  QH    3 ?     QH1  QH2  .   
         614  .   966  ARG  QH2   1 ?     HH21 HH22 .   
         615  .   966  ARG  QB    1 ?     HB2  HB3  .   
         616  .   966  ARG  QH1   1 ?     HH11 HH12 .   
         617  .   966  ARG  QD    1 ?     HD2  HD3  .   
         618  .   966  ARG  QG    1 ?     HG2  HG3  .   
         619  .   966  ARG  QH    3 ?     QH1  QH2  .   
         620  .   970  ARG  QH2   1 ?     HH21 HH22 .   
         621  .   970  ARG  QB    1 ?     HB2  HB3  .   
         622  .   970  ARG  QH1   1 ?     HH11 HH12 .   
         623  .   970  ARG  QD    1 ?     HD2  HD3  .   
         624  .   970  ARG  QG    1 ?     HG2  HG3  .   
         625  .   970  ARG  QH    3 ?     QH1  QH2  .   
         626  .   974  ARG  QH2   1 ?     HH21 HH22 .   
         627  .   974  ARG  QB    1 ?     HB2  HB3  .   
         628  .   974  ARG  QH1   1 ?     HH11 HH12 .   
         629  .   974  ARG  QD    1 ?     HD2  HD3  .   
         630  .   974  ARG  QG    1 ?     HG2  HG3  .   
         631  .   974  ARG  QH    3 ?     QH1  QH2  .   
         632  .   978  ARG  QH2   1 ?     HH21 HH22 .   
         633  .   978  ARG  QB    1 ?     HB2  HB3  .   
         634  .   978  ARG  QH1   1 ?     HH11 HH12 .   
         635  .   978  ARG  QD    1 ?     HD2  HD3  .   
         636  .   978  ARG  QG    1 ?     HG2  HG3  .   
         637  .   978  ARG  QH    3 ?     QH1  QH2  .   
         638  .   982  ARG  QH2   1 ?     HH21 HH22 .   
         639  .   982  ARG  QB    1 ?     HB2  HB3  .   
         640  .   982  ARG  QH1   1 ?     HH11 HH12 .   
         641  .   982  ARG  QD    1 ?     HD2  HD3  .   
         642  .   982  ARG  QG    1 ?     HG2  HG3  .   
         643  .   982  ARG  QH    3 ?     QH1  QH2  .   
         644  .   986  ARG  QH2   1 ?     HH21 HH22 .   
         645  .   986  ARG  QB    1 ?     HB2  HB3  .   
         646  .   986  ARG  QH1   1 ?     HH11 HH12 .   
         647  .   986  ARG  QD    1 ?     HD2  HD3  .   
         648  .   986  ARG  QG    1 ?     HG2  HG3  .   
         649  .   986  ARG  QH    3 ?     QH1  QH2  .   
         650  .   990  ARG  QH2   1 ?     HH21 HH22 .   
         651  .   990  ARG  QB    1 ?     HB2  HB3  .   
         652  .   990  ARG  QH1   1 ?     HH11 HH12 .   
         653  .   990  ARG  QD    1 ?     HD2  HD3  .   
         654  .   990  ARG  QG    1 ?     HG2  HG3  .   
         655  .   990  ARG  QH    3 ?     QH1  QH2  .   
         656  .   994  ARG  QH2   1 ?     HH21 HH22 .   
         657  .   994  ARG  QB    1 ?     HB2  HB3  .   
         658  .   994  ARG  QH1   1 ?     HH11 HH12 .   
         659  .   994  ARG  QD    1 ?     HD2  HD3  .   
         660  .   994  ARG  QG    1 ?     HG2  HG3  .   
         661  .   994  ARG  QH    3 ?     QH1  QH2  .   
         662  .   998  ARG  QH2   1 ?     HH21 HH22 .   
         663  .   998  ARG  QB    1 ?     HB2  HB3  .   
         664  .   998  ARG  QH1   1 ?     HH11 HH12 .   
         665  .   998  ARG  QD    1 ?     HD2  HD3  .   
         666  .   998  ARG  QG    1 ?     HG2  HG3  .   
         667  .   998  ARG  QH    3 ?     QH1  QH2  .   
         668  .  1001  CYS  QB    1 ?     HB2  HB3  .   
         669  .  1002  ARG  QH2   1 ?     HH21 HH22 .   
         670  .  1002  ARG  QB    1 ?     HB2  HB3  .   
         671  .  1002  ARG  QH1   1 ?     HH11 HH12 .   
         672  .  1002  ARG  QD    1 ?     HD2  HD3  .   
         673  .  1002  ARG  QG    1 ?     HG2  HG3  .   
         674  .  1002  ARG  QH    3 ?     QH1  QH2  .   
         675  .  1006  ARG  QH2   1 ?     HH21 HH22 .   
         676  .  1006  ARG  QB    1 ?     HB2  HB3  .   
         677  .  1006  ARG  QH1   1 ?     HH11 HH12 .   
         678  .  1006  ARG  QD    1 ?     HD2  HD3  .   
         679  .  1006  ARG  QG    1 ?     HG2  HG3  .   
         680  .  1006  ARG  QH    3 ?     QH1  QH2  .   
         681  .  1009  ASN  QB    1 ?     HB2  HB3  .   
         682  .  1009  ASN  QD    1 ?     HD21 HD22 .   
         683  .  1010  GLU  QB    1 ?     HB2  HB3  .   
         684  .  1010  GLU  QG    1 ?     HG2  HG3  .   
         685  .  1014  GLU  QB    1 ?     HB2  HB3  .   
         686  .  1014  GLU  QG    1 ?     HG2  HG3  .   
         687  .  1018  GLU  QB    1 ?     HB2  HB3  .   
         688  .  1018  GLU  QG    1 ?     HG2  HG3  .   
         689  .  1022  GLU  QB    1 ?     HB2  HB3  .   
         690  .  1022  GLU  QG    1 ?     HG2  HG3  .   
         691  .  1026  GLU  QB    1 ?     HB2  HB3  .   
         692  .  1026  GLU  QG    1 ?     HG2  HG3  .   
         693  .  1030  GLU  QB    1 ?     HB2  HB3  .   
         694  .  1030  GLU  QG    1 ?     HG2  HG3  .   
         695  .  1034  GLU  QB    1 ?     HB2  HB3  .   
         696  .  1034  GLU  QG    1 ?     HG2  HG3  .   
         697  .  1038  GLU  QB    1 ?     HB2  HB3  .   
         698  .  1038  GLU  QG    1 ?     HG2  HG3  .   
         699  .  1042  GLU  QB    1 ?     HB2  HB3  .   
         700  .  1042  GLU  QG    1 ?     HG2  HG3  .   
         701  .  1046  GLU  QB    1 ?     HB2  HB3  .   
         702  .  1046  GLU  QG    1 ?     HG2  HG3  .   
         703  .  1050  GLU  QB    1 ?     HB2  HB3  .   
         704  .  1050  GLU  QG    1 ?     HG2  HG3  .   
         705  .  1054  GLU  QB    1 ?     HB2  HB3  .   
         706  .  1054  GLU  QG    1 ?     HG2  HG3  .   
         707  .  1058  GLU  QB    1 ?     HB2  HB3  .   
         708  .  1058  GLU  QG    1 ?     HG2  HG3  .   
         709  .  1061  CYS  QB    1 ?     HB2  HB3  .   
         710  .  1062  GLU  QB    1 ?     HB2  HB3  .   
         711  .  1062  GLU  QG    1 ?     HG2  HG3  .   
         712  .  1066  GLU  QB    1 ?     HB2  HB3  .   
         713  .  1066  GLU  QG    1 ?     HG2  HG3  .   
         714  .  1069  ASN  QB    1 ?     HB2  HB3  .   
         715  .  1069  ASN  QD    1 ?     HD21 HD22 .   
         716  .  1101  CYS  QB    1 ?     HB2  HB3  .   
         717  .  1109  ASN  QB    1 ?     HB2  HB3  .   
         718  .  1109  ASN  QD    1 ?     HD21 HD22 .   
         719  .  1110  MET  QB    1 ?     HB2  HB3  .   
         720  .  1110  MET  QG    1 ?     HG2  HG3  .   
         721  .  1114  MET  QB    1 ?     HB2  HB3  .   
         722  .  1114  MET  QG    1 ?     HG2  HG3  .   
         723  .  1118  MET  QB    1 ?     HB2  HB3  .   
         724  .  1118  MET  QG    1 ?     HG2  HG3  .   
         725  .  1122  MET  QB    1 ?     HB2  HB3  .   
         726  .  1122  MET  QG    1 ?     HG2  HG3  .   
         727  .  1126  MET  QB    1 ?     HB2  HB3  .   
         728  .  1126  MET  QG    1 ?     HG2  HG3  .   
         729  .  1130  MET  QB    1 ?     HB2  HB3  .   
         730  .  1130  MET  QG    1 ?     HG2  HG3  .   
         731  .  1134  MET  QB    1 ?     HB2  HB3  .   
         732  .  1134  MET  QG    1 ?     HG2  HG3  .   
         733  .  1138  MET  QB    1 ?     HB2  HB3  .   
         734  .  1138  MET  QG    1 ?     HG2  HG3  .   
         735  .  1142  MET  QB    1 ?     HB2  HB3  .   
         736  .  1142  MET  QG    1 ?     HG2  HG3  .   
         737  .  1146  MET  QB    1 ?     HB2  HB3  .   
         738  .  1146  MET  QG    1 ?     HG2  HG3  .   
         739  .  1150  MET  QB    1 ?     HB2  HB3  .   
         740  .  1150  MET  QG    1 ?     HG2  HG3  .   
         741  .  1154  MET  QB    1 ?     HB2  HB3  .   
         742  .  1154  MET  QG    1 ?     HG2  HG3  .   
         743  .  1158  MET  QB    1 ?     HB2  HB3  .   
         744  .  1158  MET  QG    1 ?     HG2  HG3  .   
         745  .  1162  MET  QB    1 ?     HB2  HB3  .   
         746  .  1162  MET  QG    1 ?     HG2  HG3  .   
         747  .  1166  MET  QB    1 ?     HB2  HB3  .   
         748  .  1166  MET  QG    1 ?     HG2  HG3  .   
         749  .  1169  CYS  QB    1 ?     HB2  HB3  .   
         750  .  1170  MET  QB    1 ?     HB2  HB3  .   
         751  .  1170  MET  QG    1 ?     HG2  HG3  .   
         752  .  1174  MET  QB    1 ?     HB2  HB3  .   
         753  .  1174  MET  QG    1 ?     HG2  HG3  .   
         754  .  1177  ASN  QB    1 ?     HB2  HB3  .   
         755  .  1177  ASN  QD    1 ?     HD21 HD22 .   
         756  .  1178  SER  QB    1 ?     HB2  HB3  .   
         757  .  1182  SER  QB    1 ?     HB2  HB3  .   
         758  .  1186  SER  QB    1 ?     HB2  HB3  .   
         759  .  1190  SER  QB    1 ?     HB2  HB3  .   
         760  .  1194  SER  QB    1 ?     HB2  HB3  .   
         761  .  1198  SER  QB    1 ?     HB2  HB3  .   
         762  .  1202  SER  QB    1 ?     HB2  HB3  .   
         763  .  1206  SER  QB    1 ?     HB2  HB3  .   
         764  .  1210  SER  QB    1 ?     HB2  HB3  .   
         765  .  1213  CYS  QB    1 ?     HB2  HB3  .   
         766  .  1214  SER  QB    1 ?     HB2  HB3  .   
         767  .  1218  SER  QB    1 ?     HB2  HB3  .   
         768  .  1221  ASN  QB    1 ?     HB2  HB3  .   
         769  .  1221  ASN  QD    1 ?     HD21 HD22 .   
         770  .  1222  GLU  QB    1 ?     HB2  HB3  .   
         771  .  1222  GLU  QG    1 ?     HG2  HG3  .   
         772  .  1226  GLU  QB    1 ?     HB2  HB3  .   
         773  .  1226  GLU  QG    1 ?     HG2  HG3  .   
         774  .  1230  GLU  QB    1 ?     HB2  HB3  .   
         775  .  1230  GLU  QG    1 ?     HG2  HG3  .   
         776  .  1234  GLU  QB    1 ?     HB2  HB3  .   
         777  .  1234  GLU  QG    1 ?     HG2  HG3  .   
         778  .  1238  GLU  QB    1 ?     HB2  HB3  .   
         779  .  1238  GLU  QG    1 ?     HG2  HG3  .   
         780  .  1242  GLU  QB    1 ?     HB2  HB3  .   
         781  .  1242  GLU  QG    1 ?     HG2  HG3  .   
         782  .  1246  GLU  QB    1 ?     HB2  HB3  .   
         783  .  1246  GLU  QG    1 ?     HG2  HG3  .   
         784  .  1250  GLU  QB    1 ?     HB2  HB3  .   
         785  .  1250  GLU  QG    1 ?     HG2  HG3  .   
         786  .  1254  GLU  QB    1 ?     HB2  HB3  .   
         787  .  1254  GLU  QG    1 ?     HG2  HG3  .   
         788  .  1258  GLU  QB    1 ?     HB2  HB3  .   
         789  .  1258  GLU  QG    1 ?     HG2  HG3  .   
         790  .  1262  GLU  QB    1 ?     HB2  HB3  .   
         791  .  1262  GLU  QG    1 ?     HG2  HG3  .   
         792  .  1266  GLU  QB    1 ?     HB2  HB3  .   
         793  .  1266  GLU  QG    1 ?     HG2  HG3  .   
         794  .  1270  GLU  QB    1 ?     HB2  HB3  .   
         795  .  1270  GLU  QG    1 ?     HG2  HG3  .   
         796  .  1273  CYS  QB    1 ?     HB2  HB3  .   
         797  .  1274  GLU  QB    1 ?     HB2  HB3  .   
         798  .  1274  GLU  QG    1 ?     HG2  HG3  .   
         799  .  1278  GLU  QB    1 ?     HB2  HB3  .   
         800  .  1278  GLU  QG    1 ?     HG2  HG3  .   
         801  .  1281  ASN  QB    1 ?     HB2  HB3  .   
         802  .  1281  ASN  QD    1 ?     HD21 HD22 .   
         803  .  1282  CYS  QB    1 ?     HB2  HB3  .   
         804  .  1286  CYS  QB    1 ?     HB2  HB3  .   
         805  .  1290  CYS  QB    1 ?     HB2  HB3  .   
         806  .  1294  CYS  QB    1 ?     HB2  HB3  .   
         807  .  1298  CYS  QB    1 ?     HB2  HB3  .   
         808  .  1302  CYS  QB    1 ?     HB2  HB3  .   
         809  .  1306  CYS  QB    1 ?     HB2  HB3  .   
         810  .  1310  CYS  QB    1 ?     HB2  HB3  .   
         811  .  1314  CYS  QB    1 ?     HB2  HB3  .   
         812  .  1317  CYS  QB    1 ?     HB2  HB3  .   
         813  .  1318  CYS  QB    1 ?     HB2  HB3  .   
         814  .  1322  CYS  QB    1 ?     HB2  HB3  .   
         815  .  1325  ASN  QB    1 ?     HB2  HB3  .   
         816  .  1325  ASN  QD    1 ?     HD21 HD22 .   
         817  .  1373  CYS  QB    1 ?     HB2  HB3  .   
         818  .  1381  ASN  QB    1 ?     HB2  HB3  .   
         819  .  1381  ASN  QD    1 ?     HD21 HD22 .   
         820  .  1382  GLY  QA    1 ?     HA2  HA3  .   
         821  .  1386  GLY  QA    1 ?     HA2  HA3  .   
         822  .  1390  GLY  QA    1 ?     HA2  HA3  .   
         823  .  1394  GLY  QA    1 ?     HA2  HA3  .   
         824  .  1398  GLY  QA    1 ?     HA2  HA3  .   
         825  .  1401  CYS  QB    1 ?     HB2  HB3  .   
         826  .  1402  GLY  QA    1 ?     HA2  HA3  .   
         827  .  1406  GLY  QA    1 ?     HA2  HA3  .   
         828  .  1409  ASN  QB    1 ?     HB2  HB3  .   
         829  .  1409  ASN  QD    1 ?     HD21 HD22 .   
         830  .  1410  CYS  QB    1 ?     HB2  HB3  .   
         831  .  1414  CYS  QB    1 ?     HB2  HB3  .   
         832  .  1418  CYS  QB    1 ?     HB2  HB3  .   
         833  .  1422  CYS  QB    1 ?     HB2  HB3  .   
         834  .  1426  CYS  QB    1 ?     HB2  HB3  .   
         835  .  1430  CYS  QB    1 ?     HB2  HB3  .   
         836  .  1434  CYS  QB    1 ?     HB2  HB3  .   
         837  .  1438  CYS  QB    1 ?     HB2  HB3  .   
         838  .  1442  CYS  QB    1 ?     HB2  HB3  .   
         839  .  1445  CYS  QB    1 ?     HB2  HB3  .   
         840  .  1446  CYS  QB    1 ?     HB2  HB3  .   
         841  .  1450  CYS  QB    1 ?     HB2  HB3  .   
         842  .  1453  ASN  QB    1 ?     HB2  HB3  .   
         843  .  1453  ASN  QD    1 ?     HD21 HD22 .   
         844  .  1454  HIS  QB    1 ?     HB2  HB3  .   
         845  .  1458  HIS  QB    1 ?     HB2  HB3  .   
         846  .  1462  HIS  QB    1 ?     HB2  HB3  .   
         847  .  1466  HIS  QB    1 ?     HB2  HB3  .   
         848  .  1470  HIS  QB    1 ?     HB2  HB3  .   
         849  .  1474  HIS  QB    1 ?     HB2  HB3  .   
         850  .  1478  HIS  QB    1 ?     HB2  HB3  .   
         851  .  1482  HIS  QB    1 ?     HB2  HB3  .   
         852  .  1486  HIS  QB    1 ?     HB2  HB3  .   
         853  .  1490  HIS  QB    1 ?     HB2  HB3  .   
         854  .  1494  HIS  QB    1 ?     HB2  HB3  .   
         855  .  1498  HIS  QB    1 ?     HB2  HB3  .   
         856  .  1502  HIS  QB    1 ?     HB2  HB3  .   
         857  .  1506  HIS  QB    1 ?     HB2  HB3  .   
         858  .  1510  HIS  QB    1 ?     HB2  HB3  .   
         859  .  1514  HIS  QB    1 ?     HB2  HB3  .   
         860  .  1517  CYS  QB    1 ?     HB2  HB3  .   
         861  .  1518  HIS  QB    1 ?     HB2  HB3  .   
         862  .  1522  HIS  QB    1 ?     HB2  HB3  .   
         863  .  1525  ASN  QB    1 ?     HB2  HB3  .   
         864  .  1525  ASN  QD    1 ?     HD21 HD22 .   
         865  .  1526  LYS  QB    1 ?     HB2  HB3  .   
         866  .  1526  LYS  QE    1 ?     HE2  HE3  .   
         867  .  1526  LYS  QD    1 ?     HD2  HD3  .   
         868  .  1526  LYS  QG    1 ?     HG2  HG3  .   
         869  .  1530  LYS  QB    1 ?     HB2  HB3  .   
         870  .  1530  LYS  QE    1 ?     HE2  HE3  .   
         871  .  1530  LYS  QD    1 ?     HD2  HD3  .   
         872  .  1530  LYS  QG    1 ?     HG2  HG3  .   
         873  .  1534  LYS  QB    1 ?     HB2  HB3  .   
         874  .  1534  LYS  QE    1 ?     HE2  HE3  .   
         875  .  1534  LYS  QD    1 ?     HD2  HD3  .   
         876  .  1534  LYS  QG    1 ?     HG2  HG3  .   
         877  .  1538  LYS  QB    1 ?     HB2  HB3  .   
         878  .  1538  LYS  QE    1 ?     HE2  HE3  .   
         879  .  1538  LYS  QD    1 ?     HD2  HD3  .   
         880  .  1538  LYS  QG    1 ?     HG2  HG3  .   
         881  .  1542  LYS  QB    1 ?     HB2  HB3  .   
         882  .  1542  LYS  QE    1 ?     HE2  HE3  .   
         883  .  1542  LYS  QD    1 ?     HD2  HD3  .   
         884  .  1542  LYS  QG    1 ?     HG2  HG3  .   
         885  .  1546  LYS  QB    1 ?     HB2  HB3  .   
         886  .  1546  LYS  QE    1 ?     HE2  HE3  .   
         887  .  1546  LYS  QD    1 ?     HD2  HD3  .   
         888  .  1546  LYS  QG    1 ?     HG2  HG3  .   
         889  .  1550  LYS  QB    1 ?     HB2  HB3  .   
         890  .  1550  LYS  QE    1 ?     HE2  HE3  .   
         891  .  1550  LYS  QD    1 ?     HD2  HD3  .   
         892  .  1550  LYS  QG    1 ?     HG2  HG3  .   
         893  .  1554  LYS  QB    1 ?     HB2  HB3  .   
         894  .  1554  LYS  QE    1 ?     HE2  HE3  .   
         895  .  1554  LYS  QD    1 ?     HD2  HD3  .   
         896  .  1554  LYS  QG    1 ?     HG2  HG3  .   
         897  .  1558  LYS  QB    1 ?     HB2  HB3  .   
         898  .  1558  LYS  QE    1 ?     HE2  HE3  .   
         899  .  1558  LYS  QD    1 ?     HD2  HD3  .   
         900  .  1558  LYS  QG    1 ?     HG2  HG3  .   
         901  .  1562  LYS  QB    1 ?     HB2  HB3  .   
         902  .  1562  LYS  QE    1 ?     HE2  HE3  .   
         903  .  1562  LYS  QD    1 ?     HD2  HD3  .   
         904  .  1562  LYS  QG    1 ?     HG2  HG3  .   
         905  .  1566  LYS  QB    1 ?     HB2  HB3  .   
         906  .  1566  LYS  QE    1 ?     HE2  HE3  .   
         907  .  1566  LYS  QD    1 ?     HD2  HD3  .   
         908  .  1566  LYS  QG    1 ?     HG2  HG3  .   
         909  .  1570  LYS  QB    1 ?     HB2  HB3  .   
         910  .  1570  LYS  QE    1 ?     HE2  HE3  .   
         911  .  1570  LYS  QD    1 ?     HD2  HD3  .   
         912  .  1570  LYS  QG    1 ?     HG2  HG3  .   
         913  .  1574  LYS  QB    1 ?     HB2  HB3  .   
         914  .  1574  LYS  QE    1 ?     HE2  HE3  .   
         915  .  1574  LYS  QD    1 ?     HD2  HD3  .   
         916  .  1574  LYS  QG    1 ?     HG2  HG3  .   
         917  .  1578  LYS  QB    1 ?     HB2  HB3  .   
         918  .  1578  LYS  QE    1 ?     HE2  HE3  .   
         919  .  1578  LYS  QD    1 ?     HD2  HD3  .   
         920  .  1578  LYS  QG    1 ?     HG2  HG3  .   
         921  .  1582  LYS  QB    1 ?     HB2  HB3  .   
         922  .  1582  LYS  QE    1 ?     HE2  HE3  .   
         923  .  1582  LYS  QD    1 ?     HD2  HD3  .   
         924  .  1582  LYS  QG    1 ?     HG2  HG3  .   
         925  .  1586  LYS  QB    1 ?     HB2  HB3  .   
         926  .  1586  LYS  QE    1 ?     HE2  HE3  .   
         927  .  1586  LYS  QD    1 ?     HD2  HD3  .   
         928  .  1586  LYS  QG    1 ?     HG2  HG3  .   
         929  .  1590  LYS  QB    1 ?     HB2  HB3  .   
         930  .  1590  LYS  QE    1 ?     HE2  HE3  .   
         931  .  1590  LYS  QD    1 ?     HD2  HD3  .   
         932  .  1590  LYS  QG    1 ?     HG2  HG3  .   
         933  .  1594  LYS  QB    1 ?     HB2  HB3  .   
         934  .  1594  LYS  QE    1 ?     HE2  HE3  .   
         935  .  1594  LYS  QD    1 ?     HD2  HD3  .   
         936  .  1594  LYS  QG    1 ?     HG2  HG3  .   
         937  .  1598  LYS  QB    1 ?     HB2  HB3  .   
         938  .  1598  LYS  QE    1 ?     HE2  HE3  .   
         939  .  1598  LYS  QD    1 ?     HD2  HD3  .   
         940  .  1598  LYS  QG    1 ?     HG2  HG3  .   
         941  .  1602  LYS  QB    1 ?     HB2  HB3  .   
         942  .  1602  LYS  QE    1 ?     HE2  HE3  .   
         943  .  1602  LYS  QD    1 ?     HD2  HD3  .   
         944  .  1602  LYS  QG    1 ?     HG2  HG3  .   
         945  .  1605  CYS  QB    1 ?     HB2  HB3  .   
         946  .  1606  LYS  QB    1 ?     HB2  HB3  .   
         947  .  1606  LYS  QE    1 ?     HE2  HE3  .   
         948  .  1606  LYS  QD    1 ?     HD2  HD3  .   
         949  .  1606  LYS  QG    1 ?     HG2  HG3  .   
         950  .  1610  LYS  QB    1 ?     HB2  HB3  .   
         951  .  1610  LYS  QE    1 ?     HE2  HE3  .   
         952  .  1610  LYS  QD    1 ?     HD2  HD3  .   
         953  .  1610  LYS  QG    1 ?     HG2  HG3  .   
         954  .  1613  ASN  QB    1 ?     HB2  HB3  .   
         955  .  1613  ASN  QD    1 ?     HD21 HD22 .   
         956  .  1614  VAL  QG    4 ?     MG1  MG2  .   
         957  .  1618  VAL  QG    4 ?     MG1  MG2  .   
         958  .  1622  VAL  QG    4 ?     MG1  MG2  .   
         959  .  1626  VAL  QG    4 ?     MG1  MG2  .   
         960  .  1630  VAL  QG    4 ?     MG1  MG2  .   
         961  .  1634  VAL  QG    4 ?     MG1  MG2  .   
         962  .  1638  VAL  QG    4 ?     MG1  MG2  .   
         963  .  1642  VAL  QG    4 ?     MG1  MG2  .   
         964  .  1646  VAL  QG    4 ?     MG1  MG2  .   
         965  .  1650  VAL  QG    4 ?     MG1  MG2  .   
         966  .  1654  VAL  QG    4 ?     MG1  MG2  .   
         967  .  1658  VAL  QG    4 ?     MG1  MG2  .   
         968  .  1662  VAL  QG    4 ?     MG1  MG2  .   
         969  .  1666  VAL  QG    4 ?     MG1  MG2  .   
         970  .  1669  CYS  QB    1 ?     HB2  HB3  .   
         971  .  1670  VAL  QG    4 ?     MG1  MG2  .   
         972  .  1674  VAL  QG    4 ?     MG1  MG2  .   
         973  .  1677  ASN  QB    1 ?     HB2  HB3  .   
         974  .  1677  ASN  QD    1 ?     HD21 HD22 .   
         975  .  1678  ASN  QB    1 ?     HB2  HB3  .   
         976  .  1678  ASN  QD    1 ?     HD21 HD22 .   
         977  .  1682  ASN  QB    1 ?     HB2  HB3  .   
         978  .  1682  ASN  QD    1 ?     HD21 HD22 .   
         979  .  1686  ASN  QB    1 ?     HB2  HB3  .   
         980  .  1686  ASN  QD    1 ?     HD21 HD22 .   
         981  .  1690  ASN  QB    1 ?     HB2  HB3  .   
         982  .  1690  ASN  QD    1 ?     HD21 HD22 .   
         983  .  1694  ASN  QB    1 ?     HB2  HB3  .   
         984  .  1694  ASN  QD    1 ?     HD21 HD22 .   
         985  .  1698  ASN  QB    1 ?     HB2  HB3  .   
         986  .  1698  ASN  QD    1 ?     HD21 HD22 .   
         987  .  1702  ASN  QB    1 ?     HB2  HB3  .   
         988  .  1702  ASN  QD    1 ?     HD21 HD22 .   
         989  .  1706  ASN  QB    1 ?     HB2  HB3  .   
         990  .  1706  ASN  QD    1 ?     HD21 HD22 .   
         991  .  1710  ASN  QB    1 ?     HB2  HB3  .   
         992  .  1710  ASN  QD    1 ?     HD21 HD22 .   
         993  .  1714  ASN  QB    1 ?     HB2  HB3  .   
         994  .  1714  ASN  QD    1 ?     HD21 HD22 .   
         995  .  1718  ASN  QB    1 ?     HB2  HB3  .   
         996  .  1718  ASN  QD    1 ?     HD21 HD22 .   
         997  .  1722  ASN  QB    1 ?     HB2  HB3  .   
         998  .  1722  ASN  QD    1 ?     HD21 HD22 .   
         999  .  1725  CYS  QB    1 ?     HB2  HB3  .   
        1000  .  1726  ASN  QB    1 ?     HB2  HB3  .   
        1001  .  1726  ASN  QD    1 ?     HD21 HD22 .   
        1002  .  1730  ASN  QB    1 ?     HB2  HB3  .   
        1003  .  1730  ASN  QD    1 ?     HD21 HD22 .   
        1004  .  1733  ASN  QB    1 ?     HB2  HB3  .   
        1005  .  1733  ASN  QD    1 ?     HD21 HD22 .   
        1006  .  1734  TYR  QB    1 ?     HB2  HB3  .   
        1007  .  1734  TYR  QE    5 ?     HE1  HE2  .   
        1008  .  1734  TYR  QD    5 ?     HD1  HD2  .   
        1009  .  1734  TYR  QR    6 ?     QD   QE   .   
        1010  .  1738  TYR  QB    1 ?     HB2  HB3  .   
        1011  .  1738  TYR  QE    5 ?     HE1  HE2  .   
        1012  .  1738  TYR  QD    5 ?     HD1  HD2  .   
        1013  .  1738  TYR  QR    6 ?     QD   QE   .   
        1014  .  1742  TYR  QB    1 ?     HB2  HB3  .   
        1015  .  1742  TYR  QE    5 ?     HE1  HE2  .   
        1016  .  1742  TYR  QD    5 ?     HD1  HD2  .   
        1017  .  1742  TYR  QR    6 ?     QD   QE   .   
        1018  .  1746  TYR  QB    1 ?     HB2  HB3  .   
        1019  .  1746  TYR  QE    5 ?     HE1  HE2  .   
        1020  .  1746  TYR  QD    5 ?     HD1  HD2  .   
        1021  .  1746  TYR  QR    6 ?     QD   QE   .   
        1022  .  1750  TYR  QB    1 ?     HB2  HB3  .   
        1023  .  1750  TYR  QE    5 ?     HE1  HE2  .   
        1024  .  1750  TYR  QD    5 ?     HD1  HD2  .   
        1025  .  1750  TYR  QR    6 ?     QD   QE   .   
        1026  .  1754  TYR  QB    1 ?     HB2  HB3  .   
        1027  .  1754  TYR  QE    5 ?     HE1  HE2  .   
        1028  .  1754  TYR  QD    5 ?     HD1  HD2  .   
        1029  .  1754  TYR  QR    6 ?     QD   QE   .   
        1030  .  1758  TYR  QB    1 ?     HB2  HB3  .   
        1031  .  1758  TYR  QE    5 ?     HE1  HE2  .   
        1032  .  1758  TYR  QD    5 ?     HD1  HD2  .   
        1033  .  1758  TYR  QR    6 ?     QD   QE   .   
        1034  .  1762  TYR  QB    1 ?     HB2  HB3  .   
        1035  .  1762  TYR  QE    5 ?     HE1  HE2  .   
        1036  .  1762  TYR  QD    5 ?     HD1  HD2  .   
        1037  .  1762  TYR  QR    6 ?     QD   QE   .   
        1038  .  1766  TYR  QB    1 ?     HB2  HB3  .   
        1039  .  1766  TYR  QE    5 ?     HE1  HE2  .   
        1040  .  1766  TYR  QD    5 ?     HD1  HD2  .   
        1041  .  1766  TYR  QR    6 ?     QD   QE   .   
        1042  .  1770  TYR  QB    1 ?     HB2  HB3  .   
        1043  .  1770  TYR  QE    5 ?     HE1  HE2  .   
        1044  .  1770  TYR  QD    5 ?     HD1  HD2  .   
        1045  .  1770  TYR  QR    6 ?     QD   QE   .   
        1046  .  1774  TYR  QB    1 ?     HB2  HB3  .   
        1047  .  1774  TYR  QE    5 ?     HE1  HE2  .   
        1048  .  1774  TYR  QD    5 ?     HD1  HD2  .   
        1049  .  1774  TYR  QR    6 ?     QD   QE   .   
        1050  .  1778  TYR  QB    1 ?     HB2  HB3  .   
        1051  .  1778  TYR  QE    5 ?     HE1  HE2  .   
        1052  .  1778  TYR  QD    5 ?     HD1  HD2  .   
        1053  .  1778  TYR  QR    6 ?     QD   QE   .   
        1054  .  1782  TYR  QB    1 ?     HB2  HB3  .   
        1055  .  1782  TYR  QE    5 ?     HE1  HE2  .   
        1056  .  1782  TYR  QD    5 ?     HD1  HD2  .   
        1057  .  1782  TYR  QR    6 ?     QD   QE   .   
        1058  .  1786  TYR  QB    1 ?     HB2  HB3  .   
        1059  .  1786  TYR  QE    5 ?     HE1  HE2  .   
        1060  .  1786  TYR  QD    5 ?     HD1  HD2  .   
        1061  .  1786  TYR  QR    6 ?     QD   QE   .   
        1062  .  1790  TYR  QB    1 ?     HB2  HB3  .   
        1063  .  1790  TYR  QE    5 ?     HE1  HE2  .   
        1064  .  1790  TYR  QD    5 ?     HD1  HD2  .   
        1065  .  1790  TYR  QR    6 ?     QD   QE   .   
        1066  .  1794  TYR  QB    1 ?     HB2  HB3  .   
        1067  .  1794  TYR  QE    5 ?     HE1  HE2  .   
        1068  .  1794  TYR  QD    5 ?     HD1  HD2  .   
        1069  .  1794  TYR  QR    6 ?     QD   QE   .   
        1070  .  1798  TYR  QB    1 ?     HB2  HB3  .   
        1071  .  1798  TYR  QE    5 ?     HE1  HE2  .   
        1072  .  1798  TYR  QD    5 ?     HD1  HD2  .   
        1073  .  1798  TYR  QR    6 ?     QD   QE   .   
        1074  .  1802  TYR  QB    1 ?     HB2  HB3  .   
        1075  .  1802  TYR  QE    5 ?     HE1  HE2  .   
        1076  .  1802  TYR  QD    5 ?     HD1  HD2  .   
        1077  .  1802  TYR  QR    6 ?     QD   QE   .   
        1078  .  1806  TYR  QB    1 ?     HB2  HB3  .   
        1079  .  1806  TYR  QE    5 ?     HE1  HE2  .   
        1080  .  1806  TYR  QD    5 ?     HD1  HD2  .   
        1081  .  1806  TYR  QR    6 ?     QD   QE   .   
        1082  .  1809  CYS  QB    1 ?     HB2  HB3  .   
        1083  .  1810  TYR  QB    1 ?     HB2  HB3  .   
        1084  .  1810  TYR  QE    5 ?     HE1  HE2  .   
        1085  .  1810  TYR  QD    5 ?     HD1  HD2  .   
        1086  .  1810  TYR  QR    6 ?     QD   QE   .   
        1087  .  1814  TYR  QB    1 ?     HB2  HB3  .   
        1088  .  1814  TYR  QE    5 ?     HE1  HE2  .   
        1089  .  1814  TYR  QD    5 ?     HD1  HD2  .   
        1090  .  1814  TYR  QR    6 ?     QD   QE   .   
        1091  .  1817  ASN  QB    1 ?     HB2  HB3  .   
        1092  .  1817  ASN  QD    1 ?     HD21 HD22 .   
        1093  .  1818  CYS  QB    1 ?     HB2  HB3  .   
        1094  .  1822  CYS  QB    1 ?     HB2  HB3  .   
        1095  .  1826  CYS  QB    1 ?     HB2  HB3  .   
        1096  .  1830  CYS  QB    1 ?     HB2  HB3  .   
        1097  .  1834  CYS  QB    1 ?     HB2  HB3  .   
        1098  .  1838  CYS  QB    1 ?     HB2  HB3  .   
        1099  .  1842  CYS  QB    1 ?     HB2  HB3  .   
        1100  .  1846  CYS  QB    1 ?     HB2  HB3  .   
        1101  .  1850  CYS  QB    1 ?     HB2  HB3  .   
        1102  .  1853  CYS  QB    1 ?     HB2  HB3  .   
        1103  .  1854  CYS  QB    1 ?     HB2  HB3  .   
        1104  .  1858  CYS  QB    1 ?     HB2  HB3  .   
        1105  .  1861  ASN  QB    1 ?     HB2  HB3  .   
        1106  .  1861  ASN  QD    1 ?     HD21 HD22 .   
        1107  .  1862  SER  QB    1 ?     HB2  HB3  .   
        1108  .  1866  SER  QB    1 ?     HB2  HB3  .   
        1109  .  1870  SER  QB    1 ?     HB2  HB3  .   
        1110  .  1874  SER  QB    1 ?     HB2  HB3  .   
        1111  .  1878  SER  QB    1 ?     HB2  HB3  .   
        1112  .  1882  SER  QB    1 ?     HB2  HB3  .   
        1113  .  1886  SER  QB    1 ?     HB2  HB3  .   
        1114  .  1890  SER  QB    1 ?     HB2  HB3  .   
        1115  .  1894  SER  QB    1 ?     HB2  HB3  .   
        1116  .  1897  CYS  QB    1 ?     HB2  HB3  .   
        1117  .  1898  SER  QB    1 ?     HB2  HB3  .   
        1118  .  1902  SER  QB    1 ?     HB2  HB3  .   
        1119  .  1905  ASN  QB    1 ?     HB2  HB3  .   
        1120  .  1905  ASN  QD    1 ?     HD21 HD22 .   
        1121  .  1953  CYS  QB    1 ?     HB2  HB3  .   
        1122  .  1961  ASN  QB    1 ?     HB2  HB3  .   
        1123  .  1961  ASN  QD    1 ?     HD21 HD22 .   
        1124  .  1962  PHE  QB    1 ?     HB2  HB3  .   
        1125  .  1962  PHE  QE    5 ?     HE1  HE2  .   
        1126  .  1962  PHE  QD    5 ?     HD1  HD2  .   
        1127  .  1962  PHE  QR    7 ?     QD   QE   HZ  
        1128  .  1966  PHE  QB    1 ?     HB2  HB3  .   
        1129  .  1966  PHE  QE    5 ?     HE1  HE2  .   
        1130  .  1966  PHE  QD    5 ?     HD1  HD2  .   
        1131  .  1966  PHE  QR    7 ?     QD   QE   HZ  
        1132  .  1970  PHE  QB    1 ?     HB2  HB3  .   
        1133  .  1970  PHE  QE    5 ?     HE1  HE2  .   
        1134  .  1970  PHE  QD    5 ?     HD1  HD2  .   
        1135  .  1970  PHE  QR    7 ?     QD   QE   HZ  
        1136  .  1974  PHE  QB    1 ?     HB2  HB3  .   
        1137  .  1974  PHE  QE    5 ?     HE1  HE2  .   
        1138  .  1974  PHE  QD    5 ?     HD1  HD2  .   
        1139  .  1974  PHE  QR    7 ?     QD   QE   HZ  
        1140  .  1978  PHE  QB    1 ?     HB2  HB3  .   
        1141  .  1978  PHE  QE    5 ?     HE1  HE2  .   
        1142  .  1978  PHE  QD    5 ?     HD1  HD2  .   
        1143  .  1978  PHE  QR    7 ?     QD   QE   HZ  
        1144  .  1982  PHE  QB    1 ?     HB2  HB3  .   
        1145  .  1982  PHE  QE    5 ?     HE1  HE2  .   
        1146  .  1982  PHE  QD    5 ?     HD1  HD2  .   
        1147  .  1982  PHE  QR    7 ?     QD   QE   HZ  
        1148  .  1986  PHE  QB    1 ?     HB2  HB3  .   
        1149  .  1986  PHE  QE    5 ?     HE1  HE2  .   
        1150  .  1986  PHE  QD    5 ?     HD1  HD2  .   
        1151  .  1986  PHE  QR    7 ?     QD   QE   HZ  
        1152  .  1990  PHE  QB    1 ?     HB2  HB3  .   
        1153  .  1990  PHE  QE    5 ?     HE1  HE2  .   
        1154  .  1990  PHE  QD    5 ?     HD1  HD2  .   
        1155  .  1990  PHE  QR    7 ?     QD   QE   HZ  
        1156  .  1994  PHE  QB    1 ?     HB2  HB3  .   
        1157  .  1994  PHE  QE    5 ?     HE1  HE2  .   
        1158  .  1994  PHE  QD    5 ?     HD1  HD2  .   
        1159  .  1994  PHE  QR    7 ?     QD   QE   HZ  
        1160  .  1998  PHE  QB    1 ?     HB2  HB3  .   
        1161  .  1998  PHE  QE    5 ?     HE1  HE2  .   
        1162  .  1998  PHE  QD    5 ?     HD1  HD2  .   
        1163  .  1998  PHE  QR    7 ?     QD   QE   HZ  
        1164  .  2002  PHE  QB    1 ?     HB2  HB3  .   
        1165  .  2002  PHE  QE    5 ?     HE1  HE2  .   
        1166  .  2002  PHE  QD    5 ?     HD1  HD2  .   
        1167  .  2002  PHE  QR    7 ?     QD   QE   HZ  
        1168  .  2006  PHE  QB    1 ?     HB2  HB3  .   
        1169  .  2006  PHE  QE    5 ?     HE1  HE2  .   
        1170  .  2006  PHE  QD    5 ?     HD1  HD2  .   
        1171  .  2006  PHE  QR    7 ?     QD   QE   HZ  
        1172  .  2010  PHE  QB    1 ?     HB2  HB3  .   
        1173  .  2010  PHE  QE    5 ?     HE1  HE2  .   
        1174  .  2010  PHE  QD    5 ?     HD1  HD2  .   
        1175  .  2010  PHE  QR    7 ?     QD   QE   HZ  
        1176  .  2014  PHE  QB    1 ?     HB2  HB3  .   
        1177  .  2014  PHE  QE    5 ?     HE1  HE2  .   
        1178  .  2014  PHE  QD    5 ?     HD1  HD2  .   
        1179  .  2014  PHE  QR    7 ?     QD   QE   HZ  
        1180  .  2018  PHE  QB    1 ?     HB2  HB3  .   
        1181  .  2018  PHE  QE    5 ?     HE1  HE2  .   
        1182  .  2018  PHE  QD    5 ?     HD1  HD2  .   
        1183  .  2018  PHE  QR    7 ?     QD   QE   HZ  
        1184  .  2022  PHE  QB    1 ?     HB2  HB3  .   
        1185  .  2022  PHE  QE    5 ?     HE1  HE2  .   
        1186  .  2022  PHE  QD    5 ?     HD1  HD2  .   
        1187  .  2022  PHE  QR    7 ?     QD   QE   HZ  
        1188  .  2026  PHE  QB    1 ?     HB2  HB3  .   
        1189  .  2026  PHE  QE    5 ?     HE1  HE2  .   
        1190  .  2026  PHE  QD    5 ?     HD1  HD2  .   
        1191  .  2026  PHE  QR    7 ?     QD   QE   HZ  
        1192  .  2030  PHE  QB    1 ?     HB2  HB3  .   
        1193  .  2030  PHE  QE    5 ?     HE1  HE2  .   
        1194  .  2030  PHE  QD    5 ?     HD1  HD2  .   
        1195  .  2030  PHE  QR    7 ?     QD   QE   HZ  
        1196  .  2033  CYS  QB    1 ?     HB2  HB3  .   
        1197  .  2034  PHE  QB    1 ?     HB2  HB3  .   
        1198  .  2034  PHE  QE    5 ?     HE1  HE2  .   
        1199  .  2034  PHE  QD    5 ?     HD1  HD2  .   
        1200  .  2034  PHE  QR    7 ?     QD   QE   HZ  
        1201  .  2038  PHE  QB    1 ?     HB2  HB3  .   
        1202  .  2038  PHE  QE    5 ?     HE1  HE2  .   
        1203  .  2038  PHE  QD    5 ?     HD1  HD2  .   
        1204  .  2038  PHE  QR    7 ?     QD   QE   HZ  
        1205  .  2041  ASN  QB    1 ?     HB2  HB3  .   
        1206  .  2041  ASN  QD    1 ?     HD21 HD22 .   
        1207  .  2042  CYS  QB    1 ?     HB2  HB3  .   
        1208  .  2046  CYS  QB    1 ?     HB2  HB3  .   
        1209  .  2050  CYS  QB    1 ?     HB2  HB3  .   
        1210  .  2054  CYS  QB    1 ?     HB2  HB3  .   
        1211  .  2058  CYS  QB    1 ?     HB2  HB3  .   
        1212  .  2062  CYS  QB    1 ?     HB2  HB3  .   
        1213  .  2066  CYS  QB    1 ?     HB2  HB3  .   
        1214  .  2070  CYS  QB    1 ?     HB2  HB3  .   
        1215  .  2074  CYS  QB    1 ?     HB2  HB3  .   
        1216  .  2077  CYS  QB    1 ?     HB2  HB3  .   
        1217  .  2078  CYS  QB    1 ?     HB2  HB3  .   
        1218  .  2082  CYS  QB    1 ?     HB2  HB3  .   
        1219  .  2085  ASN  QB    1 ?     HB2  HB3  .   
        1220  .  2085  ASN  QD    1 ?     HD21 HD22 .   
        1221  .  2086  GLN  QB    1 ?     HB2  HB3  .   
        1222  .  2086  GLN  QE    1 ?     HE21 HE22 .   
        1223  .  2086  GLN  QG    1 ?     HG2  HG3  .   
        1224  .  2090  GLN  QB    1 ?     HB2  HB3  .   
        1225  .  2090  GLN  QE    1 ?     HE21 HE22 .   
        1226  .  2090  GLN  QG    1 ?     HG2  HG3  .   
        1227  .  2094  GLN  QB    1 ?     HB2  HB3  .   
        1228  .  2094  GLN  QE    1 ?     HE21 HE22 .   
        1229  .  2094  GLN  QG    1 ?     HG2  HG3  .   
        1230  .  2098  GLN  QB    1 ?     HB2  HB3  .   
        1231  .  2098  GLN  QE    1 ?     HE21 HE22 .   
        1232  .  2098  GLN  QG    1 ?     HG2  HG3  .   
        1233  .  2102  GLN  QB    1 ?     HB2  HB3  .   
        1234  .  2102  GLN  QE    1 ?     HE21 HE22 .   
        1235  .  2102  GLN  QG    1 ?     HG2  HG3  .   
        1236  .  2106  GLN  QB    1 ?     HB2  HB3  .   
        1237  .  2106  GLN  QE    1 ?     HE21 HE22 .   
        1238  .  2106  GLN  QG    1 ?     HG2  HG3  .   
        1239  .  2110  GLN  QB    1 ?     HB2  HB3  .   
        1240  .  2110  GLN  QE    1 ?     HE21 HE22 .   
        1241  .  2110  GLN  QG    1 ?     HG2  HG3  .   
        1242  .  2114  GLN  QB    1 ?     HB2  HB3  .   
        1243  .  2114  GLN  QE    1 ?     HE21 HE22 .   
        1244  .  2114  GLN  QG    1 ?     HG2  HG3  .   
        1245  .  2118  GLN  QB    1 ?     HB2  HB3  .   
        1246  .  2118  GLN  QE    1 ?     HE21 HE22 .   
        1247  .  2118  GLN  QG    1 ?     HG2  HG3  .   
        1248  .  2122  GLN  QB    1 ?     HB2  HB3  .   
        1249  .  2122  GLN  QE    1 ?     HE21 HE22 .   
        1250  .  2122  GLN  QG    1 ?     HG2  HG3  .   
        1251  .  2126  GLN  QB    1 ?     HB2  HB3  .   
        1252  .  2126  GLN  QE    1 ?     HE21 HE22 .   
        1253  .  2126  GLN  QG    1 ?     HG2  HG3  .   
        1254  .  2130  GLN  QB    1 ?     HB2  HB3  .   
        1255  .  2130  GLN  QE    1 ?     HE21 HE22 .   
        1256  .  2130  GLN  QG    1 ?     HG2  HG3  .   
        1257  .  2134  GLN  QB    1 ?     HB2  HB3  .   
        1258  .  2134  GLN  QE    1 ?     HE21 HE22 .   
        1259  .  2134  GLN  QG    1 ?     HG2  HG3  .   
        1260  .  2138  GLN  QB    1 ?     HB2  HB3  .   
        1261  .  2138  GLN  QE    1 ?     HE21 HE22 .   
        1262  .  2138  GLN  QG    1 ?     HG2  HG3  .   
        1263  .  2142  GLN  QB    1 ?     HB2  HB3  .   
        1264  .  2142  GLN  QE    1 ?     HE21 HE22 .   
        1265  .  2142  GLN  QG    1 ?     HG2  HG3  .   
        1266  .  2145  CYS  QB    1 ?     HB2  HB3  .   
        1267  .  2146  GLN  QB    1 ?     HB2  HB3  .   
        1268  .  2146  GLN  QE    1 ?     HE21 HE22 .   
        1269  .  2146  GLN  QG    1 ?     HG2  HG3  .   
        1270  .  2150  GLN  QB    1 ?     HB2  HB3  .   
        1271  .  2150  GLN  QE    1 ?     HE21 HE22 .   
        1272  .  2150  GLN  QG    1 ?     HG2  HG3  .   
        1273  .  2153  ASN  QB    1 ?     HB2  HB3  .   
        1274  .  2153  ASN  QD    1 ?     HD21 HD22 .   
        1275  .  2154  ARG  QH2   1 ?     HH21 HH22 .   
        1276  .  2154  ARG  QB    1 ?     HB2  HB3  .   
        1277  .  2154  ARG  QH1   1 ?     HH11 HH12 .   
        1278  .  2154  ARG  QD    1 ?     HD2  HD3  .   
        1279  .  2154  ARG  QG    1 ?     HG2  HG3  .   
        1280  .  2154  ARG  QH    3 ?     QH1  QH2  .   
        1281  .  2158  ARG  QH2   1 ?     HH21 HH22 .   
        1282  .  2158  ARG  QB    1 ?     HB2  HB3  .   
        1283  .  2158  ARG  QH1   1 ?     HH11 HH12 .   
        1284  .  2158  ARG  QD    1 ?     HD2  HD3  .   
        1285  .  2158  ARG  QG    1 ?     HG2  HG3  .   
        1286  .  2158  ARG  QH    3 ?     QH1  QH2  .   
        1287  .  2162  ARG  QH2   1 ?     HH21 HH22 .   
        1288  .  2162  ARG  QB    1 ?     HB2  HB3  .   
        1289  .  2162  ARG  QH1   1 ?     HH11 HH12 .   
        1290  .  2162  ARG  QD    1 ?     HD2  HD3  .   
        1291  .  2162  ARG  QG    1 ?     HG2  HG3  .   
        1292  .  2162  ARG  QH    3 ?     QH1  QH2  .   
        1293  .  2166  ARG  QH2   1 ?     HH21 HH22 .   
        1294  .  2166  ARG  QB    1 ?     HB2  HB3  .   
        1295  .  2166  ARG  QH1   1 ?     HH11 HH12 .   
        1296  .  2166  ARG  QD    1 ?     HD2  HD3  .   
        1297  .  2166  ARG  QG    1 ?     HG2  HG3  .   
        1298  .  2166  ARG  QH    3 ?     QH1  QH2  .   
        1299  .  2170  ARG  QH2   1 ?     HH21 HH22 .   
        1300  .  2170  ARG  QB    1 ?     HB2  HB3  .   
        1301  .  2170  ARG  QH1   1 ?     HH11 HH12 .   
        1302  .  2170  ARG  QD    1 ?     HD2  HD3  .   
        1303  .  2170  ARG  QG    1 ?     HG2  HG3  .   
        1304  .  2170  ARG  QH    3 ?     QH1  QH2  .   
        1305  .  2174  ARG  QH2   1 ?     HH21 HH22 .   
        1306  .  2174  ARG  QB    1 ?     HB2  HB3  .   
        1307  .  2174  ARG  QH1   1 ?     HH11 HH12 .   
        1308  .  2174  ARG  QD    1 ?     HD2  HD3  .   
        1309  .  2174  ARG  QG    1 ?     HG2  HG3  .   
        1310  .  2174  ARG  QH    3 ?     QH1  QH2  .   
        1311  .  2178  ARG  QH2   1 ?     HH21 HH22 .   
        1312  .  2178  ARG  QB    1 ?     HB2  HB3  .   
        1313  .  2178  ARG  QH1   1 ?     HH11 HH12 .   
        1314  .  2178  ARG  QD    1 ?     HD2  HD3  .   
        1315  .  2178  ARG  QG    1 ?     HG2  HG3  .   
        1316  .  2178  ARG  QH    3 ?     QH1  QH2  .   
        1317  .  2182  ARG  QH2   1 ?     HH21 HH22 .   
        1318  .  2182  ARG  QB    1 ?     HB2  HB3  .   
        1319  .  2182  ARG  QH1   1 ?     HH11 HH12 .   
        1320  .  2182  ARG  QD    1 ?     HD2  HD3  .   
        1321  .  2182  ARG  QG    1 ?     HG2  HG3  .   
        1322  .  2182  ARG  QH    3 ?     QH1  QH2  .   
        1323  .  2186  ARG  QH2   1 ?     HH21 HH22 .   
        1324  .  2186  ARG  QB    1 ?     HB2  HB3  .   
        1325  .  2186  ARG  QH1   1 ?     HH11 HH12 .   
        1326  .  2186  ARG  QD    1 ?     HD2  HD3  .   
        1327  .  2186  ARG  QG    1 ?     HG2  HG3  .   
        1328  .  2186  ARG  QH    3 ?     QH1  QH2  .   
        1329  .  2190  ARG  QH2   1 ?     HH21 HH22 .   
        1330  .  2190  ARG  QB    1 ?     HB2  HB3  .   
        1331  .  2190  ARG  QH1   1 ?     HH11 HH12 .   
        1332  .  2190  ARG  QD    1 ?     HD2  HD3  .   
        1333  .  2190  ARG  QG    1 ?     HG2  HG3  .   
        1334  .  2190  ARG  QH    3 ?     QH1  QH2  .   
        1335  .  2194  ARG  QH2   1 ?     HH21 HH22 .   
        1336  .  2194  ARG  QB    1 ?     HB2  HB3  .   
        1337  .  2194  ARG  QH1   1 ?     HH11 HH12 .   
        1338  .  2194  ARG  QD    1 ?     HD2  HD3  .   
        1339  .  2194  ARG  QG    1 ?     HG2  HG3  .   
        1340  .  2194  ARG  QH    3 ?     QH1  QH2  .   
        1341  .  2198  ARG  QH2   1 ?     HH21 HH22 .   
        1342  .  2198  ARG  QB    1 ?     HB2  HB3  .   
        1343  .  2198  ARG  QH1   1 ?     HH11 HH12 .   
        1344  .  2198  ARG  QD    1 ?     HD2  HD3  .   
        1345  .  2198  ARG  QG    1 ?     HG2  HG3  .   
        1346  .  2198  ARG  QH    3 ?     QH1  QH2  .   
        1347  .  2202  ARG  QH2   1 ?     HH21 HH22 .   
        1348  .  2202  ARG  QB    1 ?     HB2  HB3  .   
        1349  .  2202  ARG  QH1   1 ?     HH11 HH12 .   
        1350  .  2202  ARG  QD    1 ?     HD2  HD3  .   
        1351  .  2202  ARG  QG    1 ?     HG2  HG3  .   
        1352  .  2202  ARG  QH    3 ?     QH1  QH2  .   
        1353  .  2206  ARG  QH2   1 ?     HH21 HH22 .   
        1354  .  2206  ARG  QB    1 ?     HB2  HB3  .   
        1355  .  2206  ARG  QH1   1 ?     HH11 HH12 .   
        1356  .  2206  ARG  QD    1 ?     HD2  HD3  .   
        1357  .  2206  ARG  QG    1 ?     HG2  HG3  .   
        1358  .  2206  ARG  QH    3 ?     QH1  QH2  .   
        1359  .  2210  ARG  QH2   1 ?     HH21 HH22 .   
        1360  .  2210  ARG  QB    1 ?     HB2  HB3  .   
        1361  .  2210  ARG  QH1   1 ?     HH11 HH12 .   
        1362  .  2210  ARG  QD    1 ?     HD2  HD3  .   
        1363  .  2210  ARG  QG    1 ?     HG2  HG3  .   
        1364  .  2210  ARG  QH    3 ?     QH1  QH2  .   
        1365  .  2214  ARG  QH2   1 ?     HH21 HH22 .   
        1366  .  2214  ARG  QB    1 ?     HB2  HB3  .   
        1367  .  2214  ARG  QH1   1 ?     HH11 HH12 .   
        1368  .  2214  ARG  QD    1 ?     HD2  HD3  .   
        1369  .  2214  ARG  QG    1 ?     HG2  HG3  .   
        1370  .  2214  ARG  QH    3 ?     QH1  QH2  .   
        1371  .  2218  ARG  QH2   1 ?     HH21 HH22 .   
        1372  .  2218  ARG  QB    1 ?     HB2  HB3  .   
        1373  .  2218  ARG  QH1   1 ?     HH11 HH12 .   
        1374  .  2218  ARG  QD    1 ?     HD2  HD3  .   
        1375  .  2218  ARG  QG    1 ?     HG2  HG3  .   
        1376  .  2218  ARG  QH    3 ?     QH1  QH2  .   
        1377  .  2222  ARG  QH2   1 ?     HH21 HH22 .   
        1378  .  2222  ARG  QB    1 ?     HB2  HB3  .   
        1379  .  2222  ARG  QH1   1 ?     HH11 HH12 .   
        1380  .  2222  ARG  QD    1 ?     HD2  HD3  .   
        1381  .  2222  ARG  QG    1 ?     HG2  HG3  .   
        1382  .  2222  ARG  QH    3 ?     QH1  QH2  .   
        1383  .  2226  ARG  QH2   1 ?     HH21 HH22 .   
        1384  .  2226  ARG  QB    1 ?     HB2  HB3  .   
        1385  .  2226  ARG  QH1   1 ?     HH11 HH12 .   
        1386  .  2226  ARG  QD    1 ?     HD2  HD3  .   
        1387  .  2226  ARG  QG    1 ?     HG2  HG3  .   
        1388  .  2226  ARG  QH    3 ?     QH1  QH2  .   
        1389  .  2230  ARG  QH2   1 ?     HH21 HH22 .   
        1390  .  2230  ARG  QB    1 ?     HB2  HB3  .   
        1391  .  2230  ARG  QH1   1 ?     HH11 HH12 .   
        1392  .  2230  ARG  QD    1 ?     HD2  HD3  .   
        1393  .  2230  ARG  QG    1 ?     HG2  HG3  .   
        1394  .  2230  ARG  QH    3 ?     QH1  QH2  .   
        1395  .  2234  ARG  QH2   1 ?     HH21 HH22 .   
        1396  .  2234  ARG  QB    1 ?     HB2  HB3  .   
        1397  .  2234  ARG  QH1   1 ?     HH11 HH12 .   
        1398  .  2234  ARG  QD    1 ?     HD2  HD3  .   
        1399  .  2234  ARG  QG    1 ?     HG2  HG3  .   
        1400  .  2234  ARG  QH    3 ?     QH1  QH2  .   
        1401  .  2238  ARG  QH2   1 ?     HH21 HH22 .   
        1402  .  2238  ARG  QB    1 ?     HB2  HB3  .   
        1403  .  2238  ARG  QH1   1 ?     HH11 HH12 .   
        1404  .  2238  ARG  QD    1 ?     HD2  HD3  .   
        1405  .  2238  ARG  QG    1 ?     HG2  HG3  .   
        1406  .  2238  ARG  QH    3 ?     QH1  QH2  .   
        1407  .  2241  CYS  QB    1 ?     HB2  HB3  .   
        1408  .  2242  ARG  QH2   1 ?     HH21 HH22 .   
        1409  .  2242  ARG  QB    1 ?     HB2  HB3  .   
        1410  .  2242  ARG  QH1   1 ?     HH11 HH12 .   
        1411  .  2242  ARG  QD    1 ?     HD2  HD3  .   
        1412  .  2242  ARG  QG    1 ?     HG2  HG3  .   
        1413  .  2242  ARG  QH    3 ?     QH1  QH2  .   
        1414  .  2246  ARG  QH2   1 ?     HH21 HH22 .   
        1415  .  2246  ARG  QB    1 ?     HB2  HB3  .   
        1416  .  2246  ARG  QH1   1 ?     HH11 HH12 .   
        1417  .  2246  ARG  QD    1 ?     HD2  HD3  .   
        1418  .  2246  ARG  QG    1 ?     HG2  HG3  .   
        1419  .  2246  ARG  QH    3 ?     QH1  QH2  .   
        1420  .  2249  ASN  QB    1 ?     HB2  HB3  .   
        1421  .  2249  ASN  QD    1 ?     HD21 HD22 .   
        1422  .  2250  LYS  QB    1 ?     HB2  HB3  .   
        1423  .  2250  LYS  QE    1 ?     HE2  HE3  .   
        1424  .  2250  LYS  QD    1 ?     HD2  HD3  .   
        1425  .  2250  LYS  QG    1 ?     HG2  HG3  .   
        1426  .  2254  LYS  QB    1 ?     HB2  HB3  .   
        1427  .  2254  LYS  QE    1 ?     HE2  HE3  .   
        1428  .  2254  LYS  QD    1 ?     HD2  HD3  .   
        1429  .  2254  LYS  QG    1 ?     HG2  HG3  .   
        1430  .  2258  LYS  QB    1 ?     HB2  HB3  .   
        1431  .  2258  LYS  QE    1 ?     HE2  HE3  .   
        1432  .  2258  LYS  QD    1 ?     HD2  HD3  .   
        1433  .  2258  LYS  QG    1 ?     HG2  HG3  .   
        1434  .  2262  LYS  QB    1 ?     HB2  HB3  .   
        1435  .  2262  LYS  QE    1 ?     HE2  HE3  .   
        1436  .  2262  LYS  QD    1 ?     HD2  HD3  .   
        1437  .  2262  LYS  QG    1 ?     HG2  HG3  .   
        1438  .  2266  LYS  QB    1 ?     HB2  HB3  .   
        1439  .  2266  LYS  QE    1 ?     HE2  HE3  .   
        1440  .  2266  LYS  QD    1 ?     HD2  HD3  .   
        1441  .  2266  LYS  QG    1 ?     HG2  HG3  .   
        1442  .  2270  LYS  QB    1 ?     HB2  HB3  .   
        1443  .  2270  LYS  QE    1 ?     HE2  HE3  .   
        1444  .  2270  LYS  QD    1 ?     HD2  HD3  .   
        1445  .  2270  LYS  QG    1 ?     HG2  HG3  .   
        1446  .  2274  LYS  QB    1 ?     HB2  HB3  .   
        1447  .  2274  LYS  QE    1 ?     HE2  HE3  .   
        1448  .  2274  LYS  QD    1 ?     HD2  HD3  .   
        1449  .  2274  LYS  QG    1 ?     HG2  HG3  .   
        1450  .  2278  LYS  QB    1 ?     HB2  HB3  .   
        1451  .  2278  LYS  QE    1 ?     HE2  HE3  .   
        1452  .  2278  LYS  QD    1 ?     HD2  HD3  .   
        1453  .  2278  LYS  QG    1 ?     HG2  HG3  .   
        1454  .  2282  LYS  QB    1 ?     HB2  HB3  .   
        1455  .  2282  LYS  QE    1 ?     HE2  HE3  .   
        1456  .  2282  LYS  QD    1 ?     HD2  HD3  .   
        1457  .  2282  LYS  QG    1 ?     HG2  HG3  .   
        1458  .  2286  LYS  QB    1 ?     HB2  HB3  .   
        1459  .  2286  LYS  QE    1 ?     HE2  HE3  .   
        1460  .  2286  LYS  QD    1 ?     HD2  HD3  .   
        1461  .  2286  LYS  QG    1 ?     HG2  HG3  .   
        1462  .  2290  LYS  QB    1 ?     HB2  HB3  .   
        1463  .  2290  LYS  QE    1 ?     HE2  HE3  .   
        1464  .  2290  LYS  QD    1 ?     HD2  HD3  .   
        1465  .  2290  LYS  QG    1 ?     HG2  HG3  .   
        1466  .  2294  LYS  QB    1 ?     HB2  HB3  .   
        1467  .  2294  LYS  QE    1 ?     HE2  HE3  .   
        1468  .  2294  LYS  QD    1 ?     HD2  HD3  .   
        1469  .  2294  LYS  QG    1 ?     HG2  HG3  .   
        1470  .  2298  LYS  QB    1 ?     HB2  HB3  .   
        1471  .  2298  LYS  QE    1 ?     HE2  HE3  .   
        1472  .  2298  LYS  QD    1 ?     HD2  HD3  .   
        1473  .  2298  LYS  QG    1 ?     HG2  HG3  .   
        1474  .  2302  LYS  QB    1 ?     HB2  HB3  .   
        1475  .  2302  LYS  QE    1 ?     HE2  HE3  .   
        1476  .  2302  LYS  QD    1 ?     HD2  HD3  .   
        1477  .  2302  LYS  QG    1 ?     HG2  HG3  .   
        1478  .  2306  LYS  QB    1 ?     HB2  HB3  .   
        1479  .  2306  LYS  QE    1 ?     HE2  HE3  .   
        1480  .  2306  LYS  QD    1 ?     HD2  HD3  .   
        1481  .  2306  LYS  QG    1 ?     HG2  HG3  .   
        1482  .  2310  LYS  QB    1 ?     HB2  HB3  .   
        1483  .  2310  LYS  QE    1 ?     HE2  HE3  .   
        1484  .  2310  LYS  QD    1 ?     HD2  HD3  .   
        1485  .  2310  LYS  QG    1 ?     HG2  HG3  .   
        1486  .  2314  LYS  QB    1 ?     HB2  HB3  .   
        1487  .  2314  LYS  QE    1 ?     HE2  HE3  .   
        1488  .  2314  LYS  QD    1 ?     HD2  HD3  .   
        1489  .  2314  LYS  QG    1 ?     HG2  HG3  .   
        1490  .  2318  LYS  QB    1 ?     HB2  HB3  .   
        1491  .  2318  LYS  QE    1 ?     HE2  HE3  .   
        1492  .  2318  LYS  QD    1 ?     HD2  HD3  .   
        1493  .  2318  LYS  QG    1 ?     HG2  HG3  .   
        1494  .  2322  LYS  QB    1 ?     HB2  HB3  .   
        1495  .  2322  LYS  QE    1 ?     HE2  HE3  .   
        1496  .  2322  LYS  QD    1 ?     HD2  HD3  .   
        1497  .  2322  LYS  QG    1 ?     HG2  HG3  .   
        1498  .  2326  LYS  QB    1 ?     HB2  HB3  .   
        1499  .  2326  LYS  QE    1 ?     HE2  HE3  .   
        1500  .  2326  LYS  QD    1 ?     HD2  HD3  .   
        1501  .  2326  LYS  QG    1 ?     HG2  HG3  .   
        1502  .  2329  CYS  QB    1 ?     HB2  HB3  .   
        1503  .  2330  LYS  QB    1 ?     HB2  HB3  .   
        1504  .  2330  LYS  QE    1 ?     HE2  HE3  .   
        1505  .  2330  LYS  QD    1 ?     HD2  HD3  .   
        1506  .  2330  LYS  QG    1 ?     HG2  HG3  .   
        1507  .  2334  LYS  QB    1 ?     HB2  HB3  .   
        1508  .  2334  LYS  QE    1 ?     HE2  HE3  .   
        1509  .  2334  LYS  QD    1 ?     HD2  HD3  .   
        1510  .  2334  LYS  QG    1 ?     HG2  HG3  .   
        1511  .  2337  ASN  QB    1 ?     HB2  HB3  .   
        1512  .  2337  ASN  QD    1 ?     HD21 HD22 .   
        1513  .  2338  ASP  QB    1 ?     HB2  HB3  .   
        1514  .  2342  ASP  QB    1 ?     HB2  HB3  .   
        1515  .  2346  ASP  QB    1 ?     HB2  HB3  .   
        1516  .  2350  ASP  QB    1 ?     HB2  HB3  .   
        1517  .  2354  ASP  QB    1 ?     HB2  HB3  .   
        1518  .  2358  ASP  QB    1 ?     HB2  HB3  .   
        1519  .  2362  ASP  QB    1 ?     HB2  HB3  .   
        1520  .  2366  ASP  QB    1 ?     HB2  HB3  .   
        1521  .  2370  ASP  QB    1 ?     HB2  HB3  .   
        1522  .  2374  ASP  QB    1 ?     HB2  HB3  .   
        1523  .  2377  CYS  QB    1 ?     HB2  HB3  .   
        1524  .  2378  ASP  QB    1 ?     HB2  HB3  .   
        1525  .  2382  ASP  QB    1 ?     HB2  HB3  .   
        1526  .  2385  ASN  QB    1 ?     HB2  HB3  .   
        1527  .  2385  ASN  QD    1 ?     HD21 HD22 .   
        1528  .  2386  TRP  QB    1 ?     HB2  HB3  .   
        1529  .  2390  TRP  QB    1 ?     HB2  HB3  .   
        1530  .  2394  TRP  QB    1 ?     HB2  HB3  .   
        1531  .  2398  TRP  QB    1 ?     HB2  HB3  .   
        1532  .  2402  TRP  QB    1 ?     HB2  HB3  .   
        1533  .  2406  TRP  QB    1 ?     HB2  HB3  .   
        1534  .  2410  TRP  QB    1 ?     HB2  HB3  .   
        1535  .  2414  TRP  QB    1 ?     HB2  HB3  .   
        1536  .  2418  TRP  QB    1 ?     HB2  HB3  .   
        1537  .  2422  TRP  QB    1 ?     HB2  HB3  .   
        1538  .  2426  TRP  QB    1 ?     HB2  HB3  .   
        1539  .  2430  TRP  QB    1 ?     HB2  HB3  .   
        1540  .  2434  TRP  QB    1 ?     HB2  HB3  .   
        1541  .  2438  TRP  QB    1 ?     HB2  HB3  .   
        1542  .  2442  TRP  QB    1 ?     HB2  HB3  .   
        1543  .  2446  TRP  QB    1 ?     HB2  HB3  .   
        1544  .  2450  TRP  QB    1 ?     HB2  HB3  .   
        1545  .  2454  TRP  QB    1 ?     HB2  HB3  .   
        1546  .  2458  TRP  QB    1 ?     HB2  HB3  .   
        1547  .  2462  TRP  QB    1 ?     HB2  HB3  .   
        1548  .  2466  TRP  QB    1 ?     HB2  HB3  .   
        1549  .  2470  TRP  QB    1 ?     HB2  HB3  .   
        1550  .  2473  CYS  QB    1 ?     HB2  HB3  .   
        1551  .  2474  TRP  QB    1 ?     HB2  HB3  .   
        1552  .  2478  TRP  QB    1 ?     HB2  HB3  .   
        1553  .  2481  ASN  QB    1 ?     HB2  HB3  .   
        1554  .  2481  ASN  QD    1 ?     HD21 HD22 .   
        1555  .  2482  LYS  QB    1 ?     HB2  HB3  .   
        1556  .  2482  LYS  QE    1 ?     HE2  HE3  .   
        1557  .  2482  LYS  QD    1 ?     HD2  HD3  .   
        1558  .  2482  LYS  QG    1 ?     HG2  HG3  .   
        1559  .  2486  LYS  QB    1 ?     HB2  HB3  .   
        1560  .  2486  LYS  QE    1 ?     HE2  HE3  .   
        1561  .  2486  LYS  QD    1 ?     HD2  HD3  .   
        1562  .  2486  LYS  QG    1 ?     HG2  HG3  .   
        1563  .  2490  LYS  QB    1 ?     HB2  HB3  .   
        1564  .  2490  LYS  QE    1 ?     HE2  HE3  .   
        1565  .  2490  LYS  QD    1 ?     HD2  HD3  .   
        1566  .  2490  LYS  QG    1 ?     HG2  HG3  .   
        1567  .  2494  LYS  QB    1 ?     HB2  HB3  .   
        1568  .  2494  LYS  QE    1 ?     HE2  HE3  .   
        1569  .  2494  LYS  QD    1 ?     HD2  HD3  .   
        1570  .  2494  LYS  QG    1 ?     HG2  HG3  .   
        1571  .  2498  LYS  QB    1 ?     HB2  HB3  .   
        1572  .  2498  LYS  QE    1 ?     HE2  HE3  .   
        1573  .  2498  LYS  QD    1 ?     HD2  HD3  .   
        1574  .  2498  LYS  QG    1 ?     HG2  HG3  .   
        1575  .  2502  LYS  QB    1 ?     HB2  HB3  .   
        1576  .  2502  LYS  QE    1 ?     HE2  HE3  .   
        1577  .  2502  LYS  QD    1 ?     HD2  HD3  .   
        1578  .  2502  LYS  QG    1 ?     HG2  HG3  .   
        1579  .  2506  LYS  QB    1 ?     HB2  HB3  .   
        1580  .  2506  LYS  QE    1 ?     HE2  HE3  .   
        1581  .  2506  LYS  QD    1 ?     HD2  HD3  .   
        1582  .  2506  LYS  QG    1 ?     HG2  HG3  .   
        1583  .  2510  LYS  QB    1 ?     HB2  HB3  .   
        1584  .  2510  LYS  QE    1 ?     HE2  HE3  .   
        1585  .  2510  LYS  QD    1 ?     HD2  HD3  .   
        1586  .  2510  LYS  QG    1 ?     HG2  HG3  .   
        1587  .  2514  LYS  QB    1 ?     HB2  HB3  .   
        1588  .  2514  LYS  QE    1 ?     HE2  HE3  .   
        1589  .  2514  LYS  QD    1 ?     HD2  HD3  .   
        1590  .  2514  LYS  QG    1 ?     HG2  HG3  .   
        1591  .  2518  LYS  QB    1 ?     HB2  HB3  .   
        1592  .  2518  LYS  QE    1 ?     HE2  HE3  .   
        1593  .  2518  LYS  QD    1 ?     HD2  HD3  .   
        1594  .  2518  LYS  QG    1 ?     HG2  HG3  .   
        1595  .  2522  LYS  QB    1 ?     HB2  HB3  .   
        1596  .  2522  LYS  QE    1 ?     HE2  HE3  .   
        1597  .  2522  LYS  QD    1 ?     HD2  HD3  .   
        1598  .  2522  LYS  QG    1 ?     HG2  HG3  .   
        1599  .  2526  LYS  QB    1 ?     HB2  HB3  .   
        1600  .  2526  LYS  QE    1 ?     HE2  HE3  .   
        1601  .  2526  LYS  QD    1 ?     HD2  HD3  .   
        1602  .  2526  LYS  QG    1 ?     HG2  HG3  .   
        1603  .  2530  LYS  QB    1 ?     HB2  HB3  .   
        1604  .  2530  LYS  QE    1 ?     HE2  HE3  .   
        1605  .  2530  LYS  QD    1 ?     HD2  HD3  .   
        1606  .  2530  LYS  QG    1 ?     HG2  HG3  .   
        1607  .  2534  LYS  QB    1 ?     HB2  HB3  .   
        1608  .  2534  LYS  QE    1 ?     HE2  HE3  .   
        1609  .  2534  LYS  QD    1 ?     HD2  HD3  .   
        1610  .  2534  LYS  QG    1 ?     HG2  HG3  .   
        1611  .  2538  LYS  QB    1 ?     HB2  HB3  .   
        1612  .  2538  LYS  QE    1 ?     HE2  HE3  .   
        1613  .  2538  LYS  QD    1 ?     HD2  HD3  .   
        1614  .  2538  LYS  QG    1 ?     HG2  HG3  .   
        1615  .  2542  LYS  QB    1 ?     HB2  HB3  .   
        1616  .  2542  LYS  QE    1 ?     HE2  HE3  .   
        1617  .  2542  LYS  QD    1 ?     HD2  HD3  .   
        1618  .  2542  LYS  QG    1 ?     HG2  HG3  .   
        1619  .  2546  LYS  QB    1 ?     HB2  HB3  .   
        1620  .  2546  LYS  QE    1 ?     HE2  HE3  .   
        1621  .  2546  LYS  QD    1 ?     HD2  HD3  .   
        1622  .  2546  LYS  QG    1 ?     HG2  HG3  .   
        1623  .  2550  LYS  QB    1 ?     HB2  HB3  .   
        1624  .  2550  LYS  QE    1 ?     HE2  HE3  .   
        1625  .  2550  LYS  QD    1 ?     HD2  HD3  .   
        1626  .  2550  LYS  QG    1 ?     HG2  HG3  .   
        1627  .  2554  LYS  QB    1 ?     HB2  HB3  .   
        1628  .  2554  LYS  QE    1 ?     HE2  HE3  .   
        1629  .  2554  LYS  QD    1 ?     HD2  HD3  .   
        1630  .  2554  LYS  QG    1 ?     HG2  HG3  .   
        1631  .  2558  LYS  QB    1 ?     HB2  HB3  .   
        1632  .  2558  LYS  QE    1 ?     HE2  HE3  .   
        1633  .  2558  LYS  QD    1 ?     HD2  HD3  .   
        1634  .  2558  LYS  QG    1 ?     HG2  HG3  .   
        1635  .  2561  CYS  QB    1 ?     HB2  HB3  .   
        1636  .  2562  LYS  QB    1 ?     HB2  HB3  .   
        1637  .  2562  LYS  QE    1 ?     HE2  HE3  .   
        1638  .  2562  LYS  QD    1 ?     HD2  HD3  .   
        1639  .  2562  LYS  QG    1 ?     HG2  HG3  .   
        1640  .  2566  LYS  QB    1 ?     HB2  HB3  .   
        1641  .  2566  LYS  QE    1 ?     HE2  HE3  .   
        1642  .  2566  LYS  QD    1 ?     HD2  HD3  .   
        1643  .  2566  LYS  QG    1 ?     HG2  HG3  .   
        1644  .  2569  ASN  QB    1 ?     HB2  HB3  .   
        1645  .  2569  ASN  QD    1 ?     HD21 HD22 .   
        1646  .  2570  ASP  QB    1 ?     HB2  HB3  .   
        1647  .  2574  ASP  QB    1 ?     HB2  HB3  .   
        1648  .  2578  ASP  QB    1 ?     HB2  HB3  .   
        1649  .  2582  ASP  QB    1 ?     HB2  HB3  .   
        1650  .  2586  ASP  QB    1 ?     HB2  HB3  .   
        1651  .  2590  ASP  QB    1 ?     HB2  HB3  .   
        1652  .  2594  ASP  QB    1 ?     HB2  HB3  .   
        1653  .  2598  ASP  QB    1 ?     HB2  HB3  .   
        1654  .  2602  ASP  QB    1 ?     HB2  HB3  .   
        1655  .  2606  ASP  QB    1 ?     HB2  HB3  .   
        1656  .  2609  CYS  QB    1 ?     HB2  HB3  .   
        1657  .  2610  ASP  QB    1 ?     HB2  HB3  .   
        1658  .  2614  ASP  QB    1 ?     HB2  HB3  .   
        1659  .  2617  ASN  QB    1 ?     HB2  HB3  .   
        1660  .  2617  ASN  QD    1 ?     HD21 HD22 .   
        1661  .  2618  HIS  QB    1 ?     HB2  HB3  .   
        1662  .  2622  HIS  QB    1 ?     HB2  HB3  .   
        1663  .  2626  HIS  QB    1 ?     HB2  HB3  .   
        1664  .  2630  HIS  QB    1 ?     HB2  HB3  .   
        1665  .  2634  HIS  QB    1 ?     HB2  HB3  .   
        1666  .  2638  HIS  QB    1 ?     HB2  HB3  .   
        1667  .  2642  HIS  QB    1 ?     HB2  HB3  .   
        1668  .  2646  HIS  QB    1 ?     HB2  HB3  .   
        1669  .  2650  HIS  QB    1 ?     HB2  HB3  .   
        1670  .  2654  HIS  QB    1 ?     HB2  HB3  .   
        1671  .  2658  HIS  QB    1 ?     HB2  HB3  .   
        1672  .  2662  HIS  QB    1 ?     HB2  HB3  .   
        1673  .  2666  HIS  QB    1 ?     HB2  HB3  .   
        1674  .  2670  HIS  QB    1 ?     HB2  HB3  .   
        1675  .  2674  HIS  QB    1 ?     HB2  HB3  .   
        1676  .  2678  HIS  QB    1 ?     HB2  HB3  .   
        1677  .  2681  CYS  QB    1 ?     HB2  HB3  .   
        1678  .  2682  HIS  QB    1 ?     HB2  HB3  .   
        1679  .  2686  HIS  QB    1 ?     HB2  HB3  .   
        1680  .  2689  ASN  QB    1 ?     HB2  HB3  .   
        1681  .  2689  ASN  QD    1 ?     HD21 HD22 .   
        1682  .  2690  GLN  QB    1 ?     HB2  HB3  .   
        1683  .  2690  GLN  QE    1 ?     HE21 HE22 .   
        1684  .  2690  GLN  QG    1 ?     HG2  HG3  .   
        1685  .  2694  GLN  QB    1 ?     HB2  HB3  .   
        1686  .  2694  GLN  QE    1 ?     HE21 HE22 .   
        1687  .  2694  GLN  QG    1 ?     HG2  HG3  .   
        1688  .  2698  GLN  QB    1 ?     HB2  HB3  .   
        1689  .  2698  GLN  QE    1 ?     HE21 HE22 .   
        1690  .  2698  GLN  QG    1 ?     HG2  HG3  .   
        1691  .  2702  GLN  QB    1 ?     HB2  HB3  .   
        1692  .  2702  GLN  QE    1 ?     HE21 HE22 .   
        1693  .  2702  GLN  QG    1 ?     HG2  HG3  .   
        1694  .  2706  GLN  QB    1 ?     HB2  HB3  .   
        1695  .  2706  GLN  QE    1 ?     HE21 HE22 .   
        1696  .  2706  GLN  QG    1 ?     HG2  HG3  .   
        1697  .  2710  GLN  QB    1 ?     HB2  HB3  .   
        1698  .  2710  GLN  QE    1 ?     HE21 HE22 .   
        1699  .  2710  GLN  QG    1 ?     HG2  HG3  .   
        1700  .  2714  GLN  QB    1 ?     HB2  HB3  .   
        1701  .  2714  GLN  QE    1 ?     HE21 HE22 .   
        1702  .  2714  GLN  QG    1 ?     HG2  HG3  .   
        1703  .  2718  GLN  QB    1 ?     HB2  HB3  .   
        1704  .  2718  GLN  QE    1 ?     HE21 HE22 .   
        1705  .  2718  GLN  QG    1 ?     HG2  HG3  .   
        1706  .  2722  GLN  QB    1 ?     HB2  HB3  .   
        1707  .  2722  GLN  QE    1 ?     HE21 HE22 .   
        1708  .  2722  GLN  QG    1 ?     HG2  HG3  .   
        1709  .  2726  GLN  QB    1 ?     HB2  HB3  .   
        1710  .  2726  GLN  QE    1 ?     HE21 HE22 .   
        1711  .  2726  GLN  QG    1 ?     HG2  HG3  .   
        1712  .  2730  GLN  QB    1 ?     HB2  HB3  .   
        1713  .  2730  GLN  QE    1 ?     HE21 HE22 .   
        1714  .  2730  GLN  QG    1 ?     HG2  HG3  .   
        1715  .  2734  GLN  QB    1 ?     HB2  HB3  .   
        1716  .  2734  GLN  QE    1 ?     HE21 HE22 .   
        1717  .  2734  GLN  QG    1 ?     HG2  HG3  .   
        1718  .  2738  GLN  QB    1 ?     HB2  HB3  .   
        1719  .  2738  GLN  QE    1 ?     HE21 HE22 .   
        1720  .  2738  GLN  QG    1 ?     HG2  HG3  .   
        1721  .  2742  GLN  QB    1 ?     HB2  HB3  .   
        1722  .  2742  GLN  QE    1 ?     HE21 HE22 .   
        1723  .  2742  GLN  QG    1 ?     HG2  HG3  .   
        1724  .  2746  GLN  QB    1 ?     HB2  HB3  .   
        1725  .  2746  GLN  QE    1 ?     HE21 HE22 .   
        1726  .  2746  GLN  QG    1 ?     HG2  HG3  .   
        1727  .  2749  CYS  QB    1 ?     HB2  HB3  .   
        1728  .  2750  GLN  QB    1 ?     HB2  HB3  .   
        1729  .  2750  GLN  QE    1 ?     HE21 HE22 .   
        1730  .  2750  GLN  QG    1 ?     HG2  HG3  .   
        1731  .  2754  GLN  QB    1 ?     HB2  HB3  .   
        1732  .  2754  GLN  QE    1 ?     HE21 HE22 .   
        1733  .  2754  GLN  QG    1 ?     HG2  HG3  .   
        1734  .  2757  ASN  QB    1 ?     HB2  HB3  .   
        1735  .  2757  ASN  QD    1 ?     HD21 HD22 .   
        1736  .  2758  HIS  QB    1 ?     HB2  HB3  .   
        1737  .  2762  HIS  QB    1 ?     HB2  HB3  .   
        1738  .  2766  HIS  QB    1 ?     HB2  HB3  .   
        1739  .  2770  HIS  QB    1 ?     HB2  HB3  .   
        1740  .  2774  HIS  QB    1 ?     HB2  HB3  .   
        1741  .  2778  HIS  QB    1 ?     HB2  HB3  .   
        1742  .  2782  HIS  QB    1 ?     HB2  HB3  .   
        1743  .  2786  HIS  QB    1 ?     HB2  HB3  .   
        1744  .  2790  HIS  QB    1 ?     HB2  HB3  .   
        1745  .  2794  HIS  QB    1 ?     HB2  HB3  .   
        1746  .  2798  HIS  QB    1 ?     HB2  HB3  .   
        1747  .  2802  HIS  QB    1 ?     HB2  HB3  .   
        1748  .  2806  HIS  QB    1 ?     HB2  HB3  .   
        1749  .  2810  HIS  QB    1 ?     HB2  HB3  .   
        1750  .  2814  HIS  QB    1 ?     HB2  HB3  .   
        1751  .  2818  HIS  QB    1 ?     HB2  HB3  .   
        1752  .  2821  CYS  QB    1 ?     HB2  HB3  .   
        1753  .  2822  HIS  QB    1 ?     HB2  HB3  .   
        1754  .  2826  HIS  QB    1 ?     HB2  HB3  .   
        1755  .  2829  ASN  QB    1 ?     HB2  HB3  .   
        1756  .  2829  ASN  QD    1 ?     HD21 HD22 .   
        1757  .  2830  ILE  QG    1 ?     HG12 HG13 .   
        1758  .  2834  ILE  QG    1 ?     HG12 HG13 .   
        1759  .  2838  ILE  QG    1 ?     HG12 HG13 .   
        1760  .  2842  ILE  QG    1 ?     HG12 HG13 .   
        1761  .  2846  ILE  QG    1 ?     HG12 HG13 .   
        1762  .  2850  ILE  QG    1 ?     HG12 HG13 .   
        1763  .  2854  ILE  QG    1 ?     HG12 HG13 .   
        1764  .  2858  ILE  QG    1 ?     HG12 HG13 .   
        1765  .  2862  ILE  QG    1 ?     HG12 HG13 .   
        1766  .  2866  ILE  QG    1 ?     HG12 HG13 .   
        1767  .  2870  ILE  QG    1 ?     HG12 HG13 .   
        1768  .  2874  ILE  QG    1 ?     HG12 HG13 .   
        1769  .  2878  ILE  QG    1 ?     HG12 HG13 .   
        1770  .  2882  ILE  QG    1 ?     HG12 HG13 .   
        1771  .  2886  ILE  QG    1 ?     HG12 HG13 .   
        1772  .  2890  ILE  QG    1 ?     HG12 HG13 .   
        1773  .  2894  ILE  QG    1 ?     HG12 HG13 .   
        1774  .  2897  CYS  QB    1 ?     HB2  HB3  .   
        1775  .  2898  ILE  QG    1 ?     HG12 HG13 .   
        1776  .  2902  ILE  QG    1 ?     HG12 HG13 .   
        1777  .  2905  ASN  QB    1 ?     HB2  HB3  .   
        1778  .  2905  ASN  QD    1 ?     HD21 HD22 .   
        1779  .  2906  CYS  QB    1 ?     HB2  HB3  .   
        1780  .  2910  CYS  QB    1 ?     HB2  HB3  .   
        1781  .  2914  CYS  QB    1 ?     HB2  HB3  .   
        1782  .  2918  CYS  QB    1 ?     HB2  HB3  .   
        1783  .  2922  CYS  QB    1 ?     HB2  HB3  .   
        1784  .  2926  CYS  QB    1 ?     HB2  HB3  .   
        1785  .  2930  CYS  QB    1 ?     HB2  HB3  .   
        1786  .  2934  CYS  QB    1 ?     HB2  HB3  .   
        1787  .  2938  CYS  QB    1 ?     HB2  HB3  .   
        1788  .  2941  CYS  QB    1 ?     HB2  HB3  .   
        1789  .  2942  CYS  QB    1 ?     HB2  HB3  .   
        1790  .  2946  CYS  QB    1 ?     HB2  HB3  .   
        1791  .  2949  ASN  QB    1 ?     HB2  HB3  .   
        1792  .  2949  ASN  QD    1 ?     HD21 HD22 .   
        1793  .  2950  GLY  QA    1 ?     HA2  HA3  .   
        1794  .  2954  GLY  QA    1 ?     HA2  HA3  .   
        1795  .  2958  GLY  QA    1 ?     HA2  HA3  .   
        1796  .  2962  GLY  QA    1 ?     HA2  HA3  .   
        1797  .  2966  GLY  QA    1 ?     HA2  HA3  .   
        1798  .  2969  CYS  QB    1 ?     HB2  HB3  .   
        1799  .  2970  GLY  QA    1 ?     HA2  HA3  .   
        1800  .  2974  GLY  QA    1 ?     HA2  HA3  .   
        1801  .  2977  ASN  QB    1 ?     HB2  HB3  .   
        1802  .  2977  ASN  QD    1 ?     HD21 HD22 .   
        1803  .  2978  GLN  QB    1 ?     HB2  HB3  .   
        1804  .  2978  GLN  QE    1 ?     HE21 HE22 .   
        1805  .  2978  GLN  QG    1 ?     HG2  HG3  .   
        1806  .  2982  GLN  QB    1 ?     HB2  HB3  .   
        1807  .  2982  GLN  QE    1 ?     HE21 HE22 .   
        1808  .  2982  GLN  QG    1 ?     HG2  HG3  .   
        1809  .  2986  GLN  QB    1 ?     HB2  HB3  .   
        1810  .  2986  GLN  QE    1 ?     HE21 HE22 .   
        1811  .  2986  GLN  QG    1 ?     HG2  HG3  .   
        1812  .  2990  GLN  QB    1 ?     HB2  HB3  .   
        1813  .  2990  GLN  QE    1 ?     HE21 HE22 .   
        1814  .  2990  GLN  QG    1 ?     HG2  HG3  .   
        1815  .  2994  GLN  QB    1 ?     HB2  HB3  .   
        1816  .  2994  GLN  QE    1 ?     HE21 HE22 .   
        1817  .  2994  GLN  QG    1 ?     HG2  HG3  .   
        1818  .  2998  GLN  QB    1 ?     HB2  HB3  .   
        1819  .  2998  GLN  QE    1 ?     HE21 HE22 .   
        1820  .  2998  GLN  QG    1 ?     HG2  HG3  .   
        1821  .  3002  GLN  QB    1 ?     HB2  HB3  .   
        1822  .  3002  GLN  QE    1 ?     HE21 HE22 .   
        1823  .  3002  GLN  QG    1 ?     HG2  HG3  .   
        1824  .  3006  GLN  QB    1 ?     HB2  HB3  .   
        1825  .  3006  GLN  QE    1 ?     HE21 HE22 .   
        1826  .  3006  GLN  QG    1 ?     HG2  HG3  .   
        1827  .  3010  GLN  QB    1 ?     HB2  HB3  .   
        1828  .  3010  GLN  QE    1 ?     HE21 HE22 .   
        1829  .  3010  GLN  QG    1 ?     HG2  HG3  .   
        1830  .  3014  GLN  QB    1 ?     HB2  HB3  .   
        1831  .  3014  GLN  QE    1 ?     HE21 HE22 .   
        1832  .  3014  GLN  QG    1 ?     HG2  HG3  .   
        1833  .  3018  GLN  QB    1 ?     HB2  HB3  .   
        1834  .  3018  GLN  QE    1 ?     HE21 HE22 .   
        1835  .  3018  GLN  QG    1 ?     HG2  HG3  .   
        1836  .  3022  GLN  QB    1 ?     HB2  HB3  .   
        1837  .  3022  GLN  QE    1 ?     HE21 HE22 .   
        1838  .  3022  GLN  QG    1 ?     HG2  HG3  .   
        1839  .  3026  GLN  QB    1 ?     HB2  HB3  .   
        1840  .  3026  GLN  QE    1 ?     HE21 HE22 .   
        1841  .  3026  GLN  QG    1 ?     HG2  HG3  .   
        1842  .  3030  GLN  QB    1 ?     HB2  HB3  .   
        1843  .  3030  GLN  QE    1 ?     HE21 HE22 .   
        1844  .  3030  GLN  QG    1 ?     HG2  HG3  .   
        1845  .  3034  GLN  QB    1 ?     HB2  HB3  .   
        1846  .  3034  GLN  QE    1 ?     HE21 HE22 .   
        1847  .  3034  GLN  QG    1 ?     HG2  HG3  .   
        1848  .  3037  CYS  QB    1 ?     HB2  HB3  .   
        1849  .  3038  GLN  QB    1 ?     HB2  HB3  .   
        1850  .  3038  GLN  QE    1 ?     HE21 HE22 .   
        1851  .  3038  GLN  QG    1 ?     HG2  HG3  .   
        1852  .  3042  GLN  QB    1 ?     HB2  HB3  .   
        1853  .  3042  GLN  QE    1 ?     HE21 HE22 .   
        1854  .  3042  GLN  QG    1 ?     HG2  HG3  .   
        1855  .  3045  ASN  QB    1 ?     HB2  HB3  .   
        1856  .  3045  ASN  QD    1 ?     HD21 HD22 .   
        1857  .  3046  SER  QB    1 ?     HB2  HB3  .   
        1858  .  3050  SER  QB    1 ?     HB2  HB3  .   
        1859  .  3054  SER  QB    1 ?     HB2  HB3  .   
        1860  .  3058  SER  QB    1 ?     HB2  HB3  .   
        1861  .  3062  SER  QB    1 ?     HB2  HB3  .   
        1862  .  3066  SER  QB    1 ?     HB2  HB3  .   
        1863  .  3070  SER  QB    1 ?     HB2  HB3  .   
        1864  .  3074  SER  QB    1 ?     HB2  HB3  .   
        1865  .  3078  SER  QB    1 ?     HB2  HB3  .   
        1866  .  3081  CYS  QB    1 ?     HB2  HB3  .   
        1867  .  3082  SER  QB    1 ?     HB2  HB3  .   
        1868  .  3086  SER  QB    1 ?     HB2  HB3  .   
        1869  .  3089  ASN  QB    1 ?     HB2  HB3  .   
        1870  .  3089  ASN  QD    1 ?     HD21 HD22 .   
        1871  .  3121  CYS  QB    1 ?     HB2  HB3  .   

   stop_

save_


#######################################
#  Cited references within the entry  #
#######################################
save_reference_1
   _Saveframe_category   citation

   _Citation_class       citation
   _Citation_full       
;
M. Nilges and S.I. O'Donoghue. Ambiguous NOEs and automated NOE 
assignment. Prog.NMR spectr. 32:107-139, 1998.
;

save_


save_reference_2
   _Saveframe_category   citation

   _Citation_class       citation
   _Citation_full       
;
Linge,J.P., O'Donoghue,S.I. and Nilges,M. in Methods Enzymol., Nuclear Magnetic
Resonance of Biological Macromolecules Part B.:71-90, Academic Press, 2001.
;

save_

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    SER 503           HN       SER 503  -7.153  -0.259  -1.832
    2    HA   SER 503           HA       SER 503  -7.391  -1.478   0.776
    3    HG   SER 503           HG       SER 503  -9.641  -1.462  -0.251
    4    HB2  SER 503           HB2      SER 503  -8.102  -3.020  -1.742
    5    HB3  SER 503           HB1      SER 503  -8.068  -3.659  -0.102
    6    H    CYS 504           HN       CYS 504  -6.013  -3.902   0.088
    7    HA   CYS 504           HA       CYS 504  -3.423  -3.115  -0.304
    8    HB2  CYS 504           HB2      CYS 504  -3.979  -5.477   0.211
    9    HB3  CYS 504           HB1      CYS 504  -4.566  -5.682  -1.446
   10    H    VAL 505           HN       VAL 505  -2.456  -2.053  -1.821
   11    HA   VAL 505           HA       VAL 505  -3.698  -1.595  -4.366
   12    HB   VAL 505           HB       VAL 505  -0.924  -0.737  -3.462
   13   HG11  VAL 505          HG11      VAL 505  -1.180   1.060  -5.090
   14   HG12  VAL 505          HG12      VAL 505  -2.772   0.453  -5.540
   15   HG13  VAL 505          HG13      VAL 505  -1.334  -0.508  -5.886
   16   HG21  VAL 505          HG21      VAL 505  -1.948   1.344  -2.743
   17   HG22  VAL 505          HG22      VAL 505  -2.628  -0.024  -1.859
   18   HG23  VAL 505          HG23      VAL 505  -3.543   0.724  -3.171
   19    H    ASN 506           HN       ASN 506  -2.742  -4.300  -3.493
   20    HA   ASN 506           HA       ASN 506  -1.340  -4.975  -5.976
   21    HB2  ASN 506           HB2      ASN 506   0.387  -4.808  -4.215
   22    HB3  ASN 506           HB1      ASN 506  -0.469  -6.032  -3.280
   23   HD21  ASN 506          HD21      ASN 506  -0.112  -6.071  -6.778
   24   HD22  ASN 506          HD22      ASN 506   0.895  -7.478  -6.842
   25    H    CYS 507           HN       CYS 507  -3.296  -6.196  -3.207
   26    HA   CYS 507           HA       CYS 507  -4.144  -8.349  -5.006
   27    HB2  CYS 507           HB2      CYS 507  -3.892  -9.328  -2.274
   28    HB3  CYS 507           HB1      CYS 507  -3.443 -10.085  -3.796
   29    H    GLY 508           HN       GLY 508  -4.797  -7.930  -1.522
   30    HA2  GLY 508           HA2      GLY 508  -7.577  -8.528  -2.288
   31    HA3  GLY 508           HA1      GLY 508  -6.768  -9.199  -0.887
   32    H    ARG 509           HN       ARG 509  -7.162  -8.331   0.993
   33    HA   ARG 509           HA       ARG 509  -9.311  -6.523   1.198
   34    HE   ARG 509           HE       ARG 509  -7.512  -9.160   4.777
   35    HB2  ARG 509           HB2      ARG 509  -7.481  -7.567   3.364
   36    HB3  ARG 509           HB1      ARG 509  -9.031  -6.775   3.625
   37    HG2  ARG 509           HG2      ARG 509 -10.076  -8.610   2.258
   38    HG3  ARG 509           HG1      ARG 509  -8.517  -9.433   2.325
   39    HD2  ARG 509           HD2      ARG 509 -10.147  -8.594   4.718
   40    HD3  ARG 509           HD1      ARG 509 -10.104 -10.221   4.043
   41   HH11  ARG 509          HH11      ARG 509 -10.302 -11.033   5.748
   42   HH12  ARG 509          HH12      ARG 509  -9.512 -11.772   7.111
   43   HH21  ARG 509          HH21      ARG 509  -6.451 -10.123   6.590
   44   HH22  ARG 509          HH22      ARG 509  -7.330 -11.249   7.585
   45    H    GLU 510           HN       GLU 510  -8.939  -4.835   3.250
   46    HA   GLU 510           HA       GLU 510  -8.024  -2.693   1.749
   47    HB2  GLU 510           HB2      GLU 510  -8.340  -1.325   3.803
   48    HB3  GLU 510           HB1      GLU 510  -9.729  -2.291   3.337
   49    HG2  GLU 510           HG2      GLU 510  -9.217  -3.909   5.059
   50    HG3  GLU 510           HG1      GLU 510  -7.760  -3.015   5.493
   51    H    ALA 511           HN       ALA 511  -6.480  -4.267   4.490
   52    HA   ALA 511           HA       ALA 511  -3.858  -3.980   3.832
   53    HB1  ALA 511           HB1      ALA 511  -3.055  -1.948   4.912
   54    HB2  ALA 511           HB2      ALA 511  -4.707  -1.504   5.340
   55    HB3  ALA 511           HB3      ALA 511  -4.222  -1.550   3.645
   56    H    MET 512           HN       MET 512  -2.408  -4.471   5.518
   57    HA   MET 512           HA       MET 512  -3.624  -5.005   8.138
   58    HB2  MET 512           HB2      MET 512  -2.313  -6.854   7.171
   59    HB3  MET 512           HB1      MET 512  -0.913  -5.799   7.035
   60    HG2  MET 512           HG2      MET 512  -0.837  -5.580   9.467
   61    HG3  MET 512           HG1      MET 512  -2.245  -6.628   9.605
   62    HE1  MET 512           HE1      MET 512  -0.971  -8.226  11.293
   63    HE2  MET 512           HE2      MET 512   0.427  -7.152  11.206
   64    HE3  MET 512           HE3      MET 512   0.635  -8.890  10.980
   65    H    SER 513           HN       SER 513  -0.495  -3.796   6.939
   66    HA   SER 513           HA       SER 513  -0.811  -1.486   8.734
   67    HG   SER 513           HG       SER 513   2.467  -2.528   7.058
   68    HB2  SER 513           HB2      SER 513   1.689  -1.294   8.602
   69    HB3  SER 513           HB1      SER 513   1.106  -2.724   9.466
   70    H    GLU 514           HN       GLU 514   0.427   0.443   7.932
   71    HA   GLU 514           HA       GLU 514   0.198   0.724   5.020
   72    HB2  GLU 514           HB2      GLU 514   0.486   2.796   7.196
   73    HB3  GLU 514           HB1      GLU 514   0.353   3.149   5.478
   74    HG2  GLU 514           HG2      GLU 514  -1.862   2.327   5.390
   75    HG3  GLU 514           HG1      GLU 514  -1.742   1.650   7.012
   76    H    CYS 515           HN       CYS 515   1.958   1.747   3.889
   77    HA   CYS 515           HA       CYS 515   4.384   0.641   4.002
   78    HB2  CYS 515           HB2      CYS 515   3.716   2.203   2.250
   79    HB3  CYS 515           HB1      CYS 515   3.850   3.551   3.370
   80    H    THR 516           HN       THR 516   5.767   0.347   5.643
   81    HA   THR 516           HA       THR 516   5.578   1.947   7.997
   82    HB   THR 516           HB       THR 516   7.459   0.409   8.781
   83    HG1  THR 516           HG1      THR 516   7.975  -1.287   7.453
   84   HG21  THR 516          HG21      THR 516   5.120   0.041   9.355
   85   HG22  THR 516          HG22      THR 516   5.915  -1.497   9.021
   86   HG23  THR 516          HG23      THR 516   4.851  -0.771   7.815
   87    H    GLY 517           HN       GLY 517   6.611   3.354   5.665
   88    HA2  GLY 517           HA2      GLY 517   8.954   4.476   7.058
   89    HA3  GLY 517           HA1      GLY 517   8.928   4.323   5.305
   90    H    CYS 518           HN       CYS 518   5.833   4.908   6.086
   91    HA   CYS 518           HA       CYS 518   5.873   7.753   6.462
   92    HB2  CYS 518           HB2      CYS 518   5.156   8.413   4.276
   93    HB3  CYS 518           HB1      CYS 518   6.650   7.498   4.098
   94    H    HIS 519           HN       HIS 519   4.215   4.900   5.361
   95    HA   HIS 519           HA       HIS 519   2.168   4.034   5.558
   96    HD1  HIS 519           HD1      HIS 519   0.992   3.763   9.746
   97    HD2  HIS 519           HD2      HIS 519   4.495   4.258   7.594
   98    HE1  HIS 519           HE1      HIS 519   2.780   2.595  11.078
   99    HE2  HIS 519           HE2      HIS 519   4.929   3.193   9.915
  100    HB2  HIS 519           HB2      HIS 519   1.617   6.112   7.697
  101    HB3  HIS 519           HB1      HIS 519   0.665   4.676   7.363
  102    H    LYS 520           HN       LYS 520   2.744   5.929   3.584
  103    HA   LYS 520           HA       LYS 520   0.240   7.404   3.242
  104    HB2  LYS 520           HB2      LYS 520   2.862   7.399   1.778
  105    HB3  LYS 520           HB1      LYS 520   1.433   8.154   1.087
  106    HG2  LYS 520           HG2      LYS 520   1.280   9.629   3.035
  107    HG3  LYS 520           HG1      LYS 520   2.727   8.877   3.707
  108    HD2  LYS 520           HD2      LYS 520   3.107  11.057   2.495
  109    HD3  LYS 520           HD1      LYS 520   4.084   9.696   1.944
  110    HE2  LYS 520           HE2      LYS 520   3.216  10.983   0.057
  111    HE3  LYS 520           HE1      LYS 520   2.575   9.343   0.067
  112    HZ1  LYS 520           HZ1      LYS 520   0.814  10.838  -0.435
  113    HZ2  LYS 520           HZ2      LYS 520   1.162  11.820   0.897
  114    HZ3  LYS 520           HZ3      LYS 520   0.543  10.262   1.132
  115    H    VAL 521           HN       VAL 521   1.371   4.344   2.541
  116    HA   VAL 521           HA       VAL 521  -0.699   3.929   0.539
  117    HB   VAL 521           HB       VAL 521   0.773   2.435  -0.801
  118   HG11  VAL 521          HG11      VAL 521   1.636   5.320  -0.710
  119   HG12  VAL 521          HG12      VAL 521   0.291   4.651  -1.636
  120   HG13  VAL 521          HG13      VAL 521   1.950   4.204  -2.039
  121   HG21  VAL 521          HG21      VAL 521   3.206   2.664  -0.641
  122   HG22  VAL 521          HG22      VAL 521   2.509   2.008   0.842
  123   HG23  VAL 521          HG23      VAL 521   3.009   3.699   0.774
  124    H    ASN 522           HN       ASN 522  -1.057   1.473   0.357
  125    HA   ASN 522           HA       ASN 522  -0.366   0.122   2.830
  126    HB2  ASN 522           HB2      ASN 522  -2.759  -0.207   3.444
  127    HB3  ASN 522           HB1      ASN 522  -2.246   1.476   3.541
  128   HD21  ASN 522          HD21      ASN 522  -4.298  -0.801   1.967
  129   HD22  ASN 522          HD22      ASN 522  -5.162   0.334   0.995
  130    H    TYR 523           HN       TYR 523  -0.706  -2.048   2.819
  131    HA   TYR 523           HA       TYR 523  -1.842  -3.253   0.424
  132    HD1  TYR 523           HD1      TYR 523   1.711  -1.523   0.844
  133    HD2  TYR 523           HD2      TYR 523  -0.160  -4.057  -2.015
  134    HE1  TYR 523           HE1      TYR 523   2.513  -0.069  -0.965
  135    HE2  TYR 523           HE2      TYR 523   0.644  -2.608  -3.828
  136    HH   TYR 523           HH       TYR 523   1.394  -0.365  -4.193
  137    HB2  TYR 523           HB2      TYR 523   0.951  -3.784   1.450
  138    HB3  TYR 523           HB1      TYR 523   0.126  -4.795   0.267
  139    H    CYS 524           HN       CYS 524  -2.214  -5.607   0.718
  140    HA   CYS 524           HA       CYS 524  -3.548  -5.949   3.187
  141    HB2  CYS 524           HB2      CYS 524  -4.303  -8.035   2.359
  142    HB3  CYS 524           HB1      CYS 524  -4.318  -6.905   1.020
  143    H    SER 525           HN       SER 525  -0.635  -7.342   1.842
  144    HA   SER 525           HA       SER 525   0.106  -8.243   4.542
  145    HG   SER 525           HG       SER 525   0.774 -11.095   4.317
  146    HB2  SER 525           HB2      SER 525  -0.492 -10.125   2.970
  147    HB3  SER 525           HB1      SER 525   0.910  -9.670   2.007
  148    H    THR 526           HN       THR 526   2.696  -8.780   4.439
  149    HA   THR 526           HA       THR 526   3.889  -6.242   4.068
  150    HB   THR 526           HB       THR 526   5.258  -8.898   4.519
  151    HG1  THR 526           HG1      THR 526   3.505  -7.931   6.069
  152   HG21  THR 526          HG21      THR 526   7.027  -7.542   5.549
  153   HG22  THR 526          HG22      THR 526   6.142  -6.073   5.130
  154   HG23  THR 526          HG23      THR 526   6.789  -7.107   3.854
  155    H    PHE 527           HN       PHE 527   4.015  -9.251   2.176
  156    HA   PHE 527           HA       PHE 527   6.275  -8.615   0.661
  157    HD1  PHE 527           HD2      PHE 527   3.432  -9.797  -2.183
  158    HD2  PHE 527           HD1      PHE 527   3.392 -11.505   1.710
  159    HE1  PHE 527           HE2      PHE 527   1.089 -10.480  -2.517
  160    HE2  PHE 527           HE1      PHE 527   1.060 -12.202   1.384
  161    HZ   PHE 527           HZ       PHE 527  -0.094 -11.692  -0.730
  162    HB2  PHE 527           HB2      PHE 527   5.512 -10.316  -0.952
  163    HB3  PHE 527           HB1      PHE 527   5.440 -10.882   0.712
  164    H    CYS 528           HN       CYS 528   2.896  -7.803   0.129
  165    HA   CYS 528           HA       CYS 528   3.022  -6.891  -2.488
  166    HB2  CYS 528           HB2      CYS 528   1.389  -5.358  -0.559
  167    HB3  CYS 528           HB1      CYS 528   0.932  -6.092  -2.095
  168    H    GLN 529           HN       GLN 529   3.717  -5.249   0.541
  169    HA   GLN 529           HA       GLN 529   3.918  -2.625  -0.523
  170    HB2  GLN 529           HB2      GLN 529   3.445  -3.093   1.849
  171    HB3  GLN 529           HB1      GLN 529   5.024  -3.839   2.034
  172    HG2  GLN 529           HG2      GLN 529   4.994  -1.610   2.977
  173    HG3  GLN 529           HG1      GLN 529   6.093  -1.690   1.600
  174   HE21  GLN 529          HE21      GLN 529   5.600  -0.576  -0.265
  175   HE22  GLN 529          HE22      GLN 529   4.353   0.618  -0.331
  176    H    ARG 530           HN       ARG 530   6.214  -5.194   0.188
  177    HA   ARG 530           HA       ARG 530   8.538  -3.663  -0.386
  178    HE   ARG 530           HE       ARG 530  11.867  -6.101   0.457
  179    HB2  ARG 530           HB2      ARG 530   9.213  -5.415   0.876
  180    HB3  ARG 530           HB1      ARG 530   7.897  -6.443   0.332
  181    HG2  ARG 530           HG2      ARG 530   9.078  -7.068  -1.622
  182    HG3  ARG 530           HG1      ARG 530  10.327  -5.854  -1.339
  183    HD2  ARG 530           HD2      ARG 530   9.761  -8.134   0.547
  184    HD3  ARG 530           HD1      ARG 530  10.956  -8.217  -0.748
  185   HH11  ARG 530          HH11      ARG 530  10.489  -8.937   2.003
  186   HH12  ARG 530          HH12      ARG 530  11.449  -8.765   3.440
  187   HH21  ARG 530          HH21      ARG 530  13.135  -5.901   2.349
  188   HH22  ARG 530          HH22      ARG 530  12.961  -7.070   3.626
  189    H    LYS 531           HN       LYS 531   6.442  -5.786  -2.240
  190    HA   LYS 531           HA       LYS 531   8.095  -5.966  -4.542
  191    HB2  LYS 531           HB2      LYS 531   5.147  -6.374  -4.090
  192    HB3  LYS 531           HB1      LYS 531   5.892  -6.595  -5.663
  193    HG2  LYS 531           HG2      LYS 531   7.189  -8.416  -4.886
  194    HG3  LYS 531           HG1      LYS 531   6.765  -8.083  -3.206
  195    HD2  LYS 531           HD2      LYS 531   5.527 -10.005  -4.166
  196    HD3  LYS 531           HD1      LYS 531   4.473  -8.709  -3.604
  197    HE2  LYS 531           HE2      LYS 531   5.325  -8.823  -6.471
  198    HE3  LYS 531           HE1      LYS 531   4.020  -9.857  -5.901
  199    HZ1  LYS 531           HZ1      LYS 531   4.074  -6.884  -5.715
  200    HZ2  LYS 531           HZ2      LYS 531   2.820  -7.880  -5.177
  201    HZ3  LYS 531           HZ3      LYS 531   3.177  -7.793  -6.828
  202    H    ASP 532           HN       ASP 532   5.160  -4.048  -3.894
  203    HA   ASP 532           HA       ASP 532   5.246  -2.994  -6.569
  204    HB2  ASP 532           HB2      ASP 532   3.342  -3.037  -4.290
  205    HB3  ASP 532           HB1      ASP 532   3.101  -1.836  -5.550
  206    H    TRP 533           HN       TRP 533   6.335  -1.940  -3.528
  207    HA   TRP 533           HA       TRP 533   5.937   0.864  -3.937
  208    HD1  TRP 533           HD1      TRP 533   9.152  -1.619  -3.099
  209    HE1  TRP 533           HE1      TRP 533  11.473  -1.039  -2.120
  210    HE3  TRP 533           HE3      TRP 533   7.820   2.343  -0.164
  211    HZ2  TRP 533           HZ2      TRP 533  12.555   0.850  -0.331
  212    HZ3  TRP 533           HZ3      TRP 533   9.555   3.473   1.167
  213    HH2  TRP 533           HH2      TRP 533  11.878   2.731   1.093
  214    HB2  TRP 533           HB2      TRP 533   6.669   1.085  -1.820
  215    HB3  TRP 533           HB1      TRP 533   6.541  -0.671  -1.766
  216    H    LYS 534           HN       LYS 534   7.794  -1.088  -5.729
  217    HA   LYS 534           HA       LYS 534  10.298   0.054  -5.957
  218    HB2  LYS 534           HB2      LYS 534   8.466  -0.943  -8.148
  219    HB3  LYS 534           HB1      LYS 534  10.140  -0.493  -8.422
  220    HG2  LYS 534           HG2      LYS 534   9.191  -2.693  -6.600
  221    HG3  LYS 534           HG1      LYS 534   9.860  -2.901  -8.219
  222    HD2  LYS 534           HD2      LYS 534  11.837  -3.117  -7.197
  223    HD3  LYS 534           HD1      LYS 534  11.765  -1.370  -6.958
  224    HE2  LYS 534           HE2      LYS 534  12.266  -2.499  -4.870
  225    HE3  LYS 534           HE1      LYS 534  10.682  -1.722  -4.789
  226    HZ1  LYS 534           HZ1      LYS 534  10.558  -3.922  -3.861
  227    HZ2  LYS 534           HZ2      LYS 534  11.213  -4.604  -5.267
  228    HZ3  LYS 534           HZ3      LYS 534   9.678  -3.888  -5.308
  229    H    ASP 535           HN       ASP 535   7.213   1.301  -7.051
  230    HA   ASP 535           HA       ASP 535   8.395   3.588  -8.395
  231    HB2  ASP 535           HB2      ASP 535   6.359   2.618  -9.305
  232    HB3  ASP 535           HB1      ASP 535   5.529   2.838  -7.771
  233    H    HIS 536           HN       HIS 536   6.953   2.785  -5.365
  234    HA   HIS 536           HA       HIS 536   6.459   5.475  -4.519
  235    HD1  HIS 536           HD1      HIS 536   4.004   5.653  -2.272
  236    HD2  HIS 536           HD2      HIS 536   7.434   3.853  -0.740
  237    HE1  HIS 536           HE1      HIS 536   4.350   6.588   0.079
  238    HB2  HIS 536           HB2      HIS 536   4.967   3.763  -3.748
  239    HB3  HIS 536           HB1      HIS 536   6.303   2.822  -3.083
  240    H    GLN 537           HN       GLN 537   9.042   3.150  -3.973
  241    HA   GLN 537           HA       GLN 537  10.267   4.097  -1.703
  242    HB2  GLN 537           HB2      GLN 537  12.369   3.185  -2.597
  243    HB3  GLN 537           HB1      GLN 537  11.011   2.087  -2.806
  244    HG2  GLN 537           HG2      GLN 537  10.828   2.827  -5.155
  245    HG3  GLN 537           HG1      GLN 537  12.265   3.820  -4.919
  246   HE21  GLN 537          HE21      GLN 537  14.269   2.831  -4.730
  247   HE22  GLN 537          HE22      GLN 537  14.523   1.162  -5.113
  248    H    HIS 538           HN       HIS 538  10.112   5.596  -4.779
  249    HA   HIS 538           HA       HIS 538  12.398   7.286  -4.510
  250    HD2  HIS 538           HD2      HIS 538  10.012   4.733  -6.635
  251    HE1  HIS 538           HE1      HIS 538  13.424   4.927  -9.147
  252    HE2  HIS 538           HE2      HIS 538  11.423   3.532  -8.457
  253    HB2  HIS 538           HB2      HIS 538  10.003   7.630  -6.324
  254    HB3  HIS 538           HB1      HIS 538  11.593   8.356  -6.525
  255    H    ILE 539           HN       ILE 539   9.251   7.370  -3.146
  256    HA   ILE 539           HA       ILE 539   9.471  10.298  -2.806
  257    HB   ILE 539           HB       ILE 539   7.074  10.526  -2.829
  258   HG12  ILE 539          HG12      ILE 539   6.949   7.541  -3.320
  259   HG13  ILE 539          HG11      ILE 539   6.513   8.345  -1.815
  260   HG21  ILE 539          HG21      ILE 539   8.028   8.903  -5.183
  261   HG22  ILE 539          HG22      ILE 539   8.189  10.649  -4.976
  262   HG23  ILE 539          HG23      ILE 539   6.590   9.922  -5.161
  263   HD11  ILE 539          HD11      ILE 539   4.540   7.780  -3.102
  264   HD12  ILE 539          HD12      ILE 539   5.142   8.712  -4.471
  265   HD13  ILE 539          HD13      ILE 539   4.715   9.527  -2.968
  266    H    CYS 540           HN       CYS 540   9.432   7.310  -1.293
  267    HA   CYS 540           HA       CYS 540   7.952   7.907   1.025
  268    HB2  CYS 540           HB2      CYS 540   8.844   5.600   0.197
  269    HB3  CYS 540           HB1      CYS 540  10.295   6.039   1.090
  270    H    GLY 541           HN       GLY 541   8.512   8.726   2.907
  271    HA2  GLY 541           HA2      GLY 541  10.169   9.413   4.556
  272    HA3  GLY 541           HA1      GLY 541  11.227   9.843   3.215
  273    H    GLN 542           HN       GLN 542   8.622  10.839   1.918
  274    HA   GLN 542           HA       GLN 542   8.649  13.495   3.186
  275    HB2  GLN 542           HB2      GLN 542   7.933  12.716   0.349
  276    HB3  GLN 542           HB1      GLN 542   7.963  14.352   0.990
  277    HG2  GLN 542           HG2      GLN 542  10.293  14.369   1.163
  278    HG3  GLN 542           HG1      GLN 542  10.402  12.615   1.012
  279   HE21  GLN 542          HE21      GLN 542  10.209  11.667  -0.998
  280   HE22  GLN 542          HE22      GLN 542  10.356  12.569  -2.471
  281    H    SER 543           HN       SER 543   6.866  13.988   4.292
  282    HA   SER 543           HA       SER 543   4.498  12.357   4.007
  283    HG   SER 543           HG       SER 543   2.904  14.195   6.310
  284    HB2  SER 543           HB2      SER 543   5.431  13.177   6.225
  285    HB3  SER 543           HB1      SER 543   4.849  14.782   5.782
  286    H    ALA 544           HN       ALA 544   4.247  13.097   1.732
  287    HA   ALA 544           HA       ALA 544   2.491  15.453   1.675
  288    HB1  ALA 544           HB1      ALA 544   3.326  16.033  -0.552
  289    HB2  ALA 544           HB2      ALA 544   4.490  14.713  -0.470
  290    HB3  ALA 544           HB3      ALA 544   4.625  16.075   0.643
  Start of MODEL    2
    1    H    SER 503           HN       SER 503  -7.293  -0.558  -2.497
    2    HA   SER 503           HA       SER 503  -7.613  -1.450   0.274
    3    HG   SER 503           HG       SER 503  -9.704  -1.762  -0.811
    4    HB2  SER 503           HB2      SER 503  -7.837  -3.208  -2.192
    5    HB3  SER 503           HB1      SER 503  -8.020  -3.727  -0.520
    6    H    CYS 504           HN       CYS 504  -5.986  -3.868  -0.260
    7    HA   CYS 504           HA       CYS 504  -3.398  -2.949  -0.305
    8    HB2  CYS 504           HB2      CYS 504  -3.822  -5.322   0.095
    9    HB3  CYS 504           HB1      CYS 504  -4.402  -5.525  -1.563
   10    H    VAL 505           HN       VAL 505  -2.318  -1.787  -1.714
   11    HA   VAL 505           HA       VAL 505  -3.320  -1.325  -4.360
   12    HB   VAL 505           HB       VAL 505  -0.658  -0.414  -3.220
   13   HG11  VAL 505          HG11      VAL 505  -2.415   0.764  -5.369
   14   HG12  VAL 505          HG12      VAL 505  -0.915  -0.119  -5.643
   15   HG13  VAL 505          HG13      VAL 505  -0.887   1.431  -4.799
   16   HG21  VAL 505          HG21      VAL 505  -2.493   0.190  -1.712
   17   HG22  VAL 505          HG22      VAL 505  -3.326   0.971  -3.056
   18   HG23  VAL 505          HG23      VAL 505  -1.779   1.601  -2.489
   19    H    ASN 506           HN       ASN 506  -2.340  -4.037  -3.486
   20    HA   ASN 506           HA       ASN 506  -0.585  -4.530  -5.778
   21    HB2  ASN 506           HB2      ASN 506   0.797  -4.290  -3.690
   22    HB3  ASN 506           HB1      ASN 506  -0.018  -5.725  -3.060
   23   HD21  ASN 506          HD21      ASN 506   0.462  -7.738  -3.926
   24   HD22  ASN 506          HD22      ASN 506   1.820  -7.991  -4.972
   25    H    CYS 507           HN       CYS 507  -2.709  -6.000  -3.273
   26    HA   CYS 507           HA       CYS 507  -3.515  -7.937  -5.280
   27    HB2  CYS 507           HB2      CYS 507  -3.165  -9.558  -3.008
   28    HB3  CYS 507           HB1      CYS 507  -2.342  -9.664  -4.556
   29    H    GLY 508           HN       GLY 508  -3.899  -8.201  -1.747
   30    HA2  GLY 508           HA2      GLY 508  -6.549  -9.175  -2.344
   31    HA3  GLY 508           HA1      GLY 508  -5.715  -9.288  -0.811
   32    H    ARG 509           HN       ARG 509  -6.866  -8.404   0.715
   33    HA   ARG 509           HA       ARG 509  -9.027  -6.673   0.038
   34    HE   ARG 509           HE       ARG 509 -12.342 -10.116   2.505
   35    HB2  ARG 509           HB2      ARG 509  -8.137  -8.052   2.512
   36    HB3  ARG 509           HB1      ARG 509  -9.245  -6.695   2.665
   37    HG2  ARG 509           HG2      ARG 509 -10.599  -7.955   0.835
   38    HG3  ARG 509           HG1      ARG 509  -9.665  -9.348   1.382
   39    HD2  ARG 509           HD2      ARG 509 -10.514  -9.178   3.577
   40    HD3  ARG 509           HD1      ARG 509 -11.165  -7.569   3.279
   41   HH11  ARG 509          HH11      ARG 509 -12.363  -6.623   2.125
   42   HH12  ARG 509          HH12      ARG 509 -14.034  -6.555   1.656
   43   HH21  ARG 509          HH21      ARG 509 -14.550 -10.026   1.896
   44   HH22  ARG 509          HH22      ARG 509 -15.277  -8.500   1.515
   45    H    GLU 510           HN       GLU 510  -9.161  -5.221   2.503
   46    HA   GLU 510           HA       GLU 510  -8.520  -2.827   1.273
   47    HB2  GLU 510           HB2      GLU 510  -8.774  -2.579   4.172
   48    HB3  GLU 510           HB1      GLU 510  -9.748  -1.875   2.895
   49    HG2  GLU 510           HG2      GLU 510 -10.029  -4.672   3.971
   50    HG3  GLU 510           HG1      GLU 510 -11.061  -3.303   4.371
   51    H    ALA 511           HN       ALA 511  -6.893  -4.348   4.015
   52    HA   ALA 511           HA       ALA 511  -4.325  -3.531   3.500
   53    HB1  ALA 511           HB1      ALA 511  -5.141  -1.226   3.592
   54    HB2  ALA 511           HB2      ALA 511  -3.989  -1.550   4.886
   55    HB3  ALA 511           HB3      ALA 511  -5.718  -1.491   5.238
   56    H    MET 512           HN       MET 512  -2.874  -4.055   5.115
   57    HA   MET 512           HA       MET 512  -4.023  -5.014   7.654
   58    HB2  MET 512           HB2      MET 512  -2.747  -6.719   6.350
   59    HB3  MET 512           HB1      MET 512  -1.331  -5.679   6.428
   60    HG2  MET 512           HG2      MET 512  -1.155  -7.416   8.081
   61    HG3  MET 512           HG1      MET 512  -1.362  -5.858   8.882
   62    HE1  MET 512           HE1      MET 512  -3.244  -8.187  11.350
   63    HE2  MET 512           HE2      MET 512  -2.090  -6.864  11.192
   64    HE3  MET 512           HE3      MET 512  -1.712  -8.449  10.514
   65    H    SER 513           HN       SER 513  -0.787  -3.921   6.670
   66    HA   SER 513           HA       SER 513  -1.088  -1.650   8.509
   67    HG   SER 513           HG       SER 513   2.169  -2.886   7.014
   68    HB2  SER 513           HB2      SER 513   1.430  -1.609   8.577
   69    HB3  SER 513           HB1      SER 513   0.683  -3.002   9.384
   70    H    GLU 514           HN       GLU 514   0.356   0.187   7.889
   71    HA   GLU 514           HA       GLU 514   0.247   0.670   5.014
   72    HB2  GLU 514           HB2      GLU 514   0.964   2.539   7.256
   73    HB3  GLU 514           HB1      GLU 514   0.613   2.977   5.588
   74    HG2  GLU 514           HG2      GLU 514  -1.607   2.799   5.863
   75    HG3  GLU 514           HG1      GLU 514  -1.460   1.468   7.004
   76    H    CYS 515           HN       CYS 515   2.136   1.369   3.886
   77    HA   CYS 515           HA       CYS 515   4.477   0.090   4.099
   78    HB2  CYS 515           HB2      CYS 515   4.119   1.499   2.224
   79    HB3  CYS 515           HB1      CYS 515   3.990   2.935   3.231
   80    H    THR 516           HN       THR 516   5.803  -0.225   5.750
   81    HA   THR 516           HA       THR 516   5.765   1.446   8.043
   82    HB   THR 516           HB       THR 516   7.509  -0.110   8.913
   83    HG1  THR 516           HG1      THR 516   8.477  -1.449   7.578
   84   HG21  THR 516          HG21      THR 516   5.120  -0.572   9.208
   85   HG22  THR 516          HG22      THR 516   6.042  -2.061   9.004
   86   HG23  THR 516          HG23      THR 516   5.093  -1.422   7.663
   87    H    GLY 517           HN       GLY 517   6.951   2.491   5.417
   88    HA2  GLY 517           HA2      GLY 517   9.367   3.623   6.679
   89    HA3  GLY 517           HA1      GLY 517   9.101   3.542   4.942
   90    H    CYS 518           HN       CYS 518   6.154   4.254   5.839
   91    HA   CYS 518           HA       CYS 518   6.405   7.067   6.413
   92    HB2  CYS 518           HB2      CYS 518   5.580   7.888   4.311
   93    HB3  CYS 518           HB1      CYS 518   7.023   6.928   4.007
   94    H    HIS 519           HN       HIS 519   4.453   4.426   5.267
   95    HA   HIS 519           HA       HIS 519   2.373   3.688   5.621
   96    HD1  HIS 519           HD1      HIS 519   1.084   3.400   9.639
   97    HD2  HIS 519           HD2      HIS 519   4.752   3.763   7.748
   98    HE1  HIS 519           HE1      HIS 519   2.682   1.983  10.979
   99    HE2  HIS 519           HE2      HIS 519   4.937   2.373   9.925
  100    HB2  HIS 519           HB2      HIS 519   2.109   5.824   7.752
  101    HB3  HIS 519           HB1      HIS 519   0.951   4.542   7.431
  102    H    LYS 520           HN       LYS 520   3.120   5.899   3.782
  103    HA   LYS 520           HA       LYS 520   0.739   7.498   3.491
  104    HB2  LYS 520           HB2      LYS 520   3.184   7.099   1.777
  105    HB3  LYS 520           HB1      LYS 520   1.831   8.094   1.265
  106    HG2  LYS 520           HG2      LYS 520   2.150   9.557   3.175
  107    HG3  LYS 520           HG1      LYS 520   3.475   8.541   3.746
  108    HD2  LYS 520           HD2      LYS 520   4.261  10.561   2.552
  109    HD3  LYS 520           HD1      LYS 520   4.780   9.063   1.774
  110    HE2  LYS 520           HE2      LYS 520   3.036   9.276   0.114
  111    HE3  LYS 520           HE1      LYS 520   2.383  10.691   0.935
  112    HZ1  LYS 520           HZ1      LYS 520   5.124  10.580  -0.202
  113    HZ2  LYS 520           HZ2      LYS 520   4.307  11.947   0.388
  114    HZ3  LYS 520           HZ3      LYS 520   3.783  11.191  -1.036
  115    H    VAL 521           HN       VAL 521   1.392   4.311   2.810
  116    HA   VAL 521           HA       VAL 521  -0.770   4.133   0.871
  117    HB   VAL 521           HB       VAL 521   0.552   2.428  -0.439
  118   HG11  VAL 521          HG11      VAL 521   1.725   4.072  -1.815
  119   HG12  VAL 521          HG12      VAL 521   1.594   5.260  -0.517
  120   HG13  VAL 521          HG13      VAL 521   0.141   4.667  -1.322
  121   HG21  VAL 521          HG21      VAL 521   2.874   3.667   1.036
  122   HG22  VAL 521          HG22      VAL 521   3.006   2.571  -0.341
  123   HG23  VAL 521          HG23      VAL 521   2.311   2.002   1.177
  124    H    ASN 522           HN       ASN 522  -1.386   1.740   0.654
  125    HA   ASN 522           HA       ASN 522  -0.853   0.346   3.161
  126    HB2  ASN 522           HB2      ASN 522  -3.295  -0.012   3.530
  127    HB3  ASN 522           HB1      ASN 522  -2.819   1.676   3.676
  128   HD21  ASN 522          HD21      ASN 522  -4.681  -0.629   1.911
  129   HD22  ASN 522          HD22      ASN 522  -5.456   0.494   0.855
  130    H    TYR 523           HN       TYR 523  -1.163  -1.828   3.127
  131    HA   TYR 523           HA       TYR 523  -1.813  -3.058   0.551
  132    HD1  TYR 523           HD2      TYR 523   0.321  -3.223  -1.542
  133    HD2  TYR 523           HD1      TYR 523   1.690  -1.390   2.044
  134    HE1  TYR 523           HE2      TYR 523   1.509  -1.527  -2.868
  135    HE2  TYR 523           HE1      TYR 523   2.884   0.305   0.728
  136    HH   TYR 523           HH       TYR 523   2.602   0.461  -2.794
  137    HB2  TYR 523           HB2      TYR 523   0.737  -3.592   2.093
  138    HB3  TYR 523           HB1      TYR 523   0.233  -4.404   0.616
  139    H    CYS 524           HN       CYS 524  -2.094  -5.415   0.748
  140    HA   CYS 524           HA       CYS 524  -3.588  -5.977   3.119
  141    HB2  CYS 524           HB2      CYS 524  -4.374  -7.911   2.028
  142    HB3  CYS 524           HB1      CYS 524  -4.186  -6.701   0.778
  143    H    SER 525           HN       SER 525  -0.548  -7.048   1.785
  144    HA   SER 525           HA       SER 525   0.104  -8.120   4.446
  145    HG   SER 525           HG       SER 525   1.377 -10.943   3.877
  146    HB2  SER 525           HB2      SER 525  -0.193  -9.989   2.857
  147    HB3  SER 525           HB1      SER 525   1.067  -9.299   1.832
  148    H    THR 526           HN       THR 526   2.671  -8.443   4.529
  149    HA   THR 526           HA       THR 526   3.832  -5.862   4.268
  150    HB   THR 526           HB       THR 526   5.226  -8.479   4.828
  151    HG1  THR 526           HG1      THR 526   3.516  -6.890   6.375
  152   HG21  THR 526          HG21      THR 526   5.884  -5.646   5.650
  153   HG22  THR 526          HG22      THR 526   6.705  -6.560   4.386
  154   HG23  THR 526          HG23      THR 526   6.810  -7.089   6.066
  155    H    PHE 527           HN       PHE 527   4.008  -8.845   2.358
  156    HA   PHE 527           HA       PHE 527   6.330  -8.131   0.931
  157    HD1  PHE 527           HD2      PHE 527   3.366  -9.215  -1.708
  158    HD2  PHE 527           HD1      PHE 527   3.833 -11.495   1.853
  159    HE1  PHE 527           HE2      PHE 527   1.061 -10.037  -1.932
  160    HE2  PHE 527           HE1      PHE 527   1.525 -12.316   1.638
  161    HZ   PHE 527           HZ       PHE 527   0.181 -11.704  -0.282
  162    HB2  PHE 527           HB2      PHE 527   5.623  -9.837  -0.753
  163    HB3  PHE 527           HB1      PHE 527   5.692 -10.433   0.902
  164    H    CYS 528           HN       CYS 528   2.947  -7.406   0.414
  165    HA   CYS 528           HA       CYS 528   3.030  -6.353  -2.152
  166    HB2  CYS 528           HB2      CYS 528   1.462  -4.963  -0.049
  167    HB3  CYS 528           HB1      CYS 528   0.959  -5.521  -1.644
  168    H    GLN 529           HN       GLN 529   3.828  -4.964   0.947
  169    HA   GLN 529           HA       GLN 529   3.904  -2.246   0.294
  170    HB2  GLN 529           HB2      GLN 529   3.846  -3.151   2.585
  171    HB3  GLN 529           HB1      GLN 529   5.456  -3.816   2.371
  172    HG2  GLN 529           HG2      GLN 529   6.244  -1.447   2.008
  173    HG3  GLN 529           HG1      GLN 529   4.651  -0.937   2.570
  174   HE21  GLN 529          HE21      GLN 529   7.720  -2.214   3.465
  175   HE22  GLN 529          HE22      GLN 529   7.457  -2.198   5.176
  176    H    ARG 530           HN       ARG 530   6.342  -4.738   0.439
  177    HA   ARG 530           HA       ARG 530   8.447  -2.915  -0.324
  178    HE   ARG 530           HE       ARG 530  10.694  -3.046   3.328
  179    HB2  ARG 530           HB2      ARG 530   8.461  -5.843   0.362
  180    HB3  ARG 530           HB1      ARG 530   9.908  -4.974  -0.162
  181    HG2  ARG 530           HG2      ARG 530   9.214  -3.285   1.697
  182    HG3  ARG 530           HG1      ARG 530   8.299  -4.652   2.324
  183    HD2  ARG 530           HD2      ARG 530  10.208  -5.884   2.779
  184    HD3  ARG 530           HD1      ARG 530  11.196  -4.958   1.645
  185   HH11  ARG 530          HH11      ARG 530  11.356  -6.400   4.131
  186   HH12  ARG 530          HH12      ARG 530  11.995  -6.017   5.702
  187   HH21  ARG 530          HH21      ARG 530  11.557  -2.549   5.363
  188   HH22  ARG 530          HH22      ARG 530  12.129  -3.821   6.404
  189    H    LYS 531           HN       LYS 531   6.456  -5.268  -1.952
  190    HA   LYS 531           HA       LYS 531   8.101  -5.466  -4.277
  191    HB2  LYS 531           HB2      LYS 531   5.204  -6.116  -3.766
  192    HB3  LYS 531           HB1      LYS 531   5.919  -6.259  -5.366
  193    HG2  LYS 531           HG2      LYS 531   7.604  -7.819  -4.408
  194    HG3  LYS 531           HG1      LYS 531   6.717  -7.757  -2.881
  195    HD2  LYS 531           HD2      LYS 531   4.761  -8.691  -3.909
  196    HD3  LYS 531           HD1      LYS 531   5.493  -8.574  -5.511
  197    HE2  LYS 531           HE2      LYS 531   5.614 -10.859  -4.748
  198    HE3  LYS 531           HE1      LYS 531   7.237 -10.173  -4.793
  199    HZ1  LYS 531           HZ1      LYS 531   6.930 -11.427  -2.783
  200    HZ2  LYS 531           HZ2      LYS 531   5.549 -10.540  -2.386
  201    HZ3  LYS 531           HZ3      LYS 531   7.068  -9.784  -2.386
  202    H    ASP 532           HN       ASP 532   5.020  -3.768  -3.711
  203    HA   ASP 532           HA       ASP 532   4.851  -2.431  -6.159
  204    HB2  ASP 532           HB2      ASP 532   3.064  -2.630  -4.421
  205    HB3  ASP 532           HB1      ASP 532   3.952  -1.434  -3.471
  206    H    TRP 533           HN       TRP 533   6.754  -1.821  -3.371
  207    HA   TRP 533           HA       TRP 533   6.883   0.961  -3.527
  208    HD1  TRP 533           HD1      TRP 533  10.290  -1.491  -3.261
  209    HE1  TRP 533           HE1      TRP 533  12.589  -0.461  -2.676
  210    HE3  TRP 533           HE3      TRP 533   8.698   2.242  -0.208
  211    HZ2  TRP 533           HZ2      TRP 533  13.554   1.693  -1.068
  212    HZ3  TRP 533           HZ3      TRP 533  10.351   3.730   0.833
  213    HH2  TRP 533           HH2      TRP 533  12.730   3.452   0.418
  214    HB2  TRP 533           HB2      TRP 533   7.587   0.535  -1.449
  215    HB3  TRP 533           HB1      TRP 533   7.869  -1.159  -1.850
  216    H    LYS 534           HN       LYS 534   8.372  -1.311  -5.571
  217    HA   LYS 534           HA       LYS 534  10.787   0.082  -6.087
  218    HB2  LYS 534           HB2      LYS 534   9.142  -1.718  -7.867
  219    HB3  LYS 534           HB1      LYS 534  10.746  -1.119  -8.280
  220    HG2  LYS 534           HG2      LYS 534  11.772  -2.329  -6.569
  221    HG3  LYS 534           HG1      LYS 534  10.241  -2.614  -5.738
  222    HD2  LYS 534           HD2      LYS 534  11.190  -3.834  -8.321
  223    HD3  LYS 534           HD1      LYS 534  10.889  -4.645  -6.780
  224    HE2  LYS 534           HE2      LYS 534   8.482  -3.785  -7.023
  225    HE3  LYS 534           HE1      LYS 534   8.906  -3.469  -8.705
  226    HZ1  LYS 534           HZ1      LYS 534   9.475  -5.816  -8.954
  227    HZ2  LYS 534           HZ2      LYS 534   7.862  -5.613  -8.482
  228    HZ3  LYS 534           HZ3      LYS 534   9.019  -6.107  -7.345
  229    H    ASP 535           HN       ASP 535   7.531   0.740  -6.813
  230    HA   ASP 535           HA       ASP 535   8.292   3.032  -8.486
  231    HB2  ASP 535           HB2      ASP 535   5.668   1.693  -7.844
  232    HB3  ASP 535           HB1      ASP 535   5.709   3.333  -8.494
  233    H    HIS 536           HN       HIS 536   6.659   2.130  -5.533
  234    HA   HIS 536           HA       HIS 536   5.994   4.672  -4.600
  235    HD1  HIS 536           HD1      HIS 536   3.848   4.658  -2.206
  236    HD2  HIS 536           HD2      HIS 536   7.451   3.128  -0.797
  237    HE1  HIS 536           HE1      HIS 536   4.221   5.668   0.104
  238    HB2  HIS 536           HB2      HIS 536   4.898   2.760  -3.685
  239    HB3  HIS 536           HB1      HIS 536   6.426   2.070  -3.133
  240    H    GLN 537           HN       GLN 537   9.082   3.000  -4.324
  241    HA   GLN 537           HA       GLN 537  10.270   4.196  -2.165
  242    HB2  GLN 537           HB2      GLN 537  12.429   3.941  -3.319
  243    HB3  GLN 537           HB1      GLN 537  11.420   2.504  -3.434
  244    HG2  GLN 537           HG2      GLN 537  10.894   2.964  -5.707
  245    HG3  GLN 537           HG1      GLN 537  11.637   4.561  -5.615
  246   HE21  GLN 537          HE21      GLN 537  13.907   3.619  -4.066
  247   HE22  GLN 537          HE22      GLN 537  14.916   2.740  -5.162
  248    H    HIS 538           HN       HIS 538   9.567   5.624  -5.256
  249    HA   HIS 538           HA       HIS 538  11.279   7.885  -4.991
  250    HD2  HIS 538           HD2      HIS 538   9.734   4.844  -7.231
  251    HE1  HIS 538           HE1      HIS 538  12.966   6.152  -9.631
  252    HE2  HIS 538           HE2      HIS 538  11.400   4.226  -9.116
  253    HB2  HIS 538           HB2      HIS 538   8.847   7.537  -6.762
  254    HB3  HIS 538           HB1      HIS 538  10.106   8.749  -6.956
  255    H    ILE 539           HN       ILE 539   8.325   7.085  -3.494
  256    HA   ILE 539           HA       ILE 539   7.791   9.946  -3.026
  257    HB   ILE 539           HB       ILE 539   5.418   9.538  -2.868
  258   HG12  ILE 539          HG12      ILE 539   6.027   6.658  -3.576
  259   HG13  ILE 539          HG11      ILE 539   5.508   7.232  -1.994
  260   HG21  ILE 539          HG21      ILE 539   6.321  10.054  -5.064
  261   HG22  ILE 539          HG22      ILE 539   4.918   8.991  -5.190
  262   HG23  ILE 539          HG23      ILE 539   6.543   8.334  -5.389
  263   HD11  ILE 539          HD11      ILE 539   3.904   7.402  -4.538
  264   HD12  ILE 539          HD12      ILE 539   3.386   7.955  -2.948
  265   HD13  ILE 539          HD13      ILE 539   3.665   6.238  -3.234
  266    H    CYS 540           HN       CYS 540   8.899   7.180  -1.715
  267    HA   CYS 540           HA       CYS 540   7.692   7.477   0.892
  268    HB2  CYS 540           HB2      CYS 540   8.713   5.283  -0.226
  269    HB3  CYS 540           HB1      CYS 540  10.198   5.895   0.495
  270    H    GLY 541           HN       GLY 541   8.761   8.194   2.680
  271    HA2  GLY 541           HA2      GLY 541  10.456   9.167   3.964
  272    HA3  GLY 541           HA1      GLY 541  11.459   9.252   2.522
  273    H    GLN 542           HN       GLN 542   9.904  10.620   0.808
  274    HA   GLN 542           HA       GLN 542  10.095  13.307   1.783
  275    HB2  GLN 542           HB2      GLN 542  10.631  12.732  -0.547
  276    HB3  GLN 542           HB1      GLN 542   8.968  12.237  -0.813
  277    HG2  GLN 542           HG2      GLN 542   8.194  14.490  -0.520
  278    HG3  GLN 542           HG1      GLN 542   9.810  15.023  -0.060
  279   HE21  GLN 542          HE21      GLN 542  11.116  13.354  -2.065
  280   HE22  GLN 542          HE22      GLN 542  10.844  14.148  -3.581
  281    H    SER 543           HN       SER 543   8.658  13.555   3.432
  282    HA   SER 543           HA       SER 543   5.847  13.717   2.695
  283    HG   SER 543           HG       SER 543   6.641  11.383   2.599
  284    HB2  SER 543           HB2      SER 543   6.754  12.161   5.137
  285    HB3  SER 543           HB1      SER 543   5.097  12.371   4.567
  286    H    ALA 544           HN       ALA 544   4.591  14.717   4.586
  287    HA   ALA 544           HA       ALA 544   6.292  16.743   5.863
  288    HB1  ALA 544           HB1      ALA 544   3.332  16.807   5.287
  289    HB2  ALA 544           HB2      ALA 544   4.587  17.638   4.365
  290    HB3  ALA 544           HB3      ALA 544   4.267  18.104   6.036
  Start of MODEL    3
    1    H    SER 503           HN       SER 503  -7.078  -0.758  -2.191
    2    HA   SER 503           HA       SER 503  -7.218  -1.275   0.675
    3    HG   SER 503           HG       SER 503  -9.414  -1.619  -0.057
    4    HB2  SER 503           HB2      SER 503  -7.874  -3.321  -1.470
    5    HB3  SER 503           HB1      SER 503  -7.736  -3.664   0.254
    6    H    CYS 504           HN       CYS 504  -5.999  -4.027  -0.485
    7    HA   CYS 504           HA       CYS 504  -3.289  -3.247  -0.421
    8    HB2  CYS 504           HB2      CYS 504  -3.926  -5.572   0.020
    9    HB3  CYS 504           HB1      CYS 504  -4.563  -5.728  -1.615
   10    H    VAL 505           HN       VAL 505  -2.570  -1.803  -1.802
   11    HA   VAL 505           HA       VAL 505  -3.646  -1.397  -4.398
   12    HB   VAL 505           HB       VAL 505  -1.021  -0.353  -3.285
   13   HG11  VAL 505          HG11      VAL 505  -1.256  -0.038  -5.704
   14   HG12  VAL 505          HG12      VAL 505  -1.343   1.499  -4.842
   15   HG13  VAL 505          HG13      VAL 505  -2.818   0.746  -5.450
   16   HG21  VAL 505          HG21      VAL 505  -2.871   0.144  -1.775
   17   HG22  VAL 505          HG22      VAL 505  -3.780   0.848  -3.114
   18   HG23  VAL 505          HG23      VAL 505  -2.284   1.606  -2.570
   19    H    ASN 506           HN       ASN 506  -2.069  -3.967  -3.428
   20    HA   ASN 506           HA       ASN 506  -0.556  -4.261  -5.930
   21    HB2  ASN 506           HB2      ASN 506   1.030  -4.221  -4.132
   22    HB3  ASN 506           HB1      ASN 506   0.086  -5.389  -3.206
   23   HD21  ASN 506          HD21      ASN 506   2.116  -4.935  -6.028
   24   HD22  ASN 506          HD22      ASN 506   2.557  -6.604  -6.200
   25    H    CYS 507           HN       CYS 507  -2.638  -5.995  -3.545
   26    HA   CYS 507           HA       CYS 507  -3.198  -7.899  -5.651
   27    HB2  CYS 507           HB2      CYS 507  -2.135  -9.729  -4.859
   28    HB3  CYS 507           HB1      CYS 507  -1.023  -8.487  -4.312
   29    H    GLY 508           HN       GLY 508  -3.864  -7.126  -2.187
   30    HA2  GLY 508           HA2      GLY 508  -6.330  -8.722  -2.521
   31    HA3  GLY 508           HA1      GLY 508  -5.265  -9.004  -1.164
   32    H    ARG 509           HN       ARG 509  -5.901  -8.133   0.686
   33    HA   ARG 509           HA       ARG 509  -8.290  -6.488   0.570
   34    HE   ARG 509           HE       ARG 509 -10.896 -10.089   1.217
   35    HB2  ARG 509           HB2      ARG 509  -6.993  -8.050   2.788
   36    HB3  ARG 509           HB1      ARG 509  -8.384  -7.004   3.054
   37    HG2  ARG 509           HG2      ARG 509  -8.242  -9.424   1.271
   38    HG3  ARG 509           HG1      ARG 509  -9.155  -9.249   2.772
   39    HD2  ARG 509           HD2      ARG 509 -10.522  -7.500   1.727
   40    HD3  ARG 509           HD1      ARG 509  -9.608  -7.683   0.232
   41   HH11  ARG 509          HH11      ARG 509 -11.092  -7.317  -0.932
   42   HH12  ARG 509          HH12      ARG 509 -12.317  -8.023  -1.928
   43   HH21  ARG 509          HH21      ARG 509 -12.521 -11.008  -0.100
   44   HH22  ARG 509          HH22      ARG 509 -13.131 -10.115  -1.464
   45    H    GLU 510           HN       GLU 510  -8.310  -5.249   3.017
   46    HA   GLU 510           HA       GLU 510  -7.266  -2.828   1.934
   47    HB2  GLU 510           HB2      GLU 510  -8.510  -1.791   3.846
   48    HB3  GLU 510           HB1      GLU 510  -9.467  -2.787   2.758
   49    HG2  GLU 510           HG2      GLU 510  -9.214  -4.663   4.399
   50    HG3  GLU 510           HG1      GLU 510  -8.484  -3.502   5.508
   51    H    ALA 511           HN       ALA 511  -5.407  -4.819   3.469
   52    HA   ALA 511           HA       ALA 511  -3.356  -4.545   4.426
   53    HB1  ALA 511           HB1      ALA 511  -3.919  -1.595   4.351
   54    HB2  ALA 511           HB2      ALA 511  -3.209  -2.528   3.033
   55    HB3  ALA 511           HB3      ALA 511  -2.348  -2.366   4.566
   56    H    MET 512           HN       MET 512  -2.613  -4.809   6.402
   57    HA   MET 512           HA       MET 512  -4.406  -4.270   8.618
   58    HB2  MET 512           HB2      MET 512  -1.709  -5.640   8.564
   59    HB3  MET 512           HB1      MET 512  -2.807  -5.592   9.938
   60    HG2  MET 512           HG2      MET 512  -4.451  -6.867   8.704
   61    HG3  MET 512           HG1      MET 512  -3.413  -6.859   7.279
   62    HE1  MET 512           HE1      MET 512  -4.652  -9.522   8.470
   63    HE2  MET 512           HE2      MET 512  -3.254 -10.592   8.377
   64    HE3  MET 512           HE3      MET 512  -3.591  -9.468   7.062
   65    H    SER 513           HN       SER 513  -1.086  -3.531   7.653
   66    HA   SER 513           HA       SER 513  -1.267  -1.088   9.282
   67    HG   SER 513           HG       SER 513   0.722  -3.520   7.928
   68    HB2  SER 513           HB2      SER 513   1.250  -1.091   9.207
   69    HB3  SER 513           HB1      SER 513   0.530  -2.381  10.177
   70    H    GLU 514           HN       GLU 514   0.179   0.646   8.418
   71    HA   GLU 514           HA       GLU 514  -0.049   0.794   5.496
   72    HB2  GLU 514           HB2      GLU 514   0.245   2.996   7.551
   73    HB3  GLU 514           HB1      GLU 514   0.046   3.226   5.816
   74    HG2  GLU 514           HG2      GLU 514  -2.141   2.380   5.856
   75    HG3  GLU 514           HG1      GLU 514  -1.952   1.757   7.488
   76    H    CYS 515           HN       CYS 515   1.772   1.553   4.316
   77    HA   CYS 515           HA       CYS 515   4.101   0.281   4.659
   78    HB2  CYS 515           HB2      CYS 515   3.751   1.423   2.629
   79    HB3  CYS 515           HB1      CYS 515   3.566   2.975   3.436
   80    H    THR 516           HN       THR 516   5.584   0.210   6.230
   81    HA   THR 516           HA       THR 516   5.385   1.899   8.467
   82    HB   THR 516           HB       THR 516   7.403   0.698   9.293
   83    HG1  THR 516           HG1      THR 516   8.520  -0.598   7.976
   84   HG21  THR 516          HG21      THR 516   5.173  -0.214   9.674
   85   HG22  THR 516          HG22      THR 516   6.336  -1.512   9.401
   86   HG23  THR 516          HG23      THR 516   5.227  -1.035   8.114
   87    H    GLY 517           HN       GLY 517   6.853   2.599   5.572
   88    HA2  GLY 517           HA2      GLY 517   9.024   4.159   6.757
   89    HA3  GLY 517           HA1      GLY 517   8.736   3.916   5.040
   90    H    CYS 518           HN       CYS 518   5.761   4.616   6.061
   91    HA   CYS 518           HA       CYS 518   5.944   7.470   6.375
   92    HB2  CYS 518           HB2      CYS 518   5.083   8.076   4.211
   93    HB3  CYS 518           HB1      CYS 518   6.548   7.122   3.985
   94    H    HIS 519           HN       HIS 519   4.045   4.679   5.515
   95    HA   HIS 519           HA       HIS 519   1.932   3.996   5.782
   96    HD1  HIS 519           HD1      HIS 519   0.776   3.913   9.935
   97    HD2  HIS 519           HD2      HIS 519   4.357   4.239   7.877
   98    HE1  HIS 519           HE1      HIS 519   2.476   2.673  11.323
   99    HE2  HIS 519           HE2      HIS 519   4.672   3.135  10.200
  100    HB2  HIS 519           HB2      HIS 519   1.580   6.194   7.838
  101    HB3  HIS 519           HB1      HIS 519   0.530   4.821   7.583
  102    H    LYS 520           HN       LYS 520   2.708   6.005   3.838
  103    HA   LYS 520           HA       LYS 520   0.303   7.620   3.491
  104    HB2  LYS 520           HB2      LYS 520   2.859   7.394   1.904
  105    HB3  LYS 520           HB1      LYS 520   1.517   8.436   1.448
  106    HG2  LYS 520           HG2      LYS 520   1.769   9.728   3.454
  107    HG3  LYS 520           HG1      LYS 520   2.998   8.618   4.063
  108    HD2  LYS 520           HD2      LYS 520   4.486   9.223   2.233
  109    HD3  LYS 520           HD1      LYS 520   3.253  10.288   1.558
  110    HE2  LYS 520           HE2      LYS 520   3.382  11.732   3.479
  111    HE3  LYS 520           HE1      LYS 520   4.474  10.615   4.295
  112    HZ1  LYS 520           HZ1      LYS 520   6.164  11.059   2.692
  113    HZ2  LYS 520           HZ2      LYS 520   5.598  12.550   3.262
  114    HZ3  LYS 520           HZ3      LYS 520   5.117  11.990   1.740
  115    H    VAL 521           HN       VAL 521   1.280   4.515   2.746
  116    HA   VAL 521           HA       VAL 521  -0.804   4.209   0.732
  117    HB   VAL 521           HB       VAL 521   0.607   2.719  -0.639
  118   HG11  VAL 521          HG11      VAL 521   0.331   5.025  -1.357
  119   HG12  VAL 521          HG12      VAL 521   1.941   4.435  -1.772
  120   HG13  VAL 521          HG13      VAL 521   1.725   5.511  -0.389
  121   HG21  VAL 521          HG21      VAL 521   2.238   2.103   1.075
  122   HG22  VAL 521          HG22      VAL 521   2.901   3.739   1.030
  123   HG23  VAL 521          HG23      VAL 521   3.026   2.696  -0.388
  124    H    ASN 522           HN       ASN 522  -1.088   1.702   0.398
  125    HA   ASN 522           HA       ASN 522  -0.407   0.239   2.797
  126    HB2  ASN 522           HB2      ASN 522  -2.722  -0.283   3.391
  127    HB3  ASN 522           HB1      ASN 522  -2.427   1.446   3.489
  128   HD21  ASN 522          HD21      ASN 522  -4.908  -0.099   3.163
  129   HD22  ASN 522          HD22      ASN 522  -5.655   0.518   1.733
  130    H    TYR 523           HN       TYR 523  -0.350  -1.889   2.558
  131    HA   TYR 523           HA       TYR 523  -1.607  -3.129   0.230
  132    HD1  TYR 523           HD1      TYR 523   2.039  -1.302   0.783
  133    HD2  TYR 523           HD2      TYR 523   0.030  -3.279  -2.401
  134    HE1  TYR 523           HE1      TYR 523   2.821   0.429  -0.776
  135    HE2  TYR 523           HE2      TYR 523   0.804  -1.552  -3.969
  136    HH   TYR 523           HH       TYR 523   1.587   0.742  -3.950
  137    HB2  TYR 523           HB2      TYR 523   1.274  -3.619   1.020
  138    HB3  TYR 523           HB1      TYR 523   0.402  -4.411  -0.283
  139    H    CYS 524           HN       CYS 524  -2.108  -5.378   0.605
  140    HA   CYS 524           HA       CYS 524  -3.115  -5.563   3.197
  141    HB2  CYS 524           HB2      CYS 524  -4.218  -7.501   2.543
  142    HB3  CYS 524           HB1      CYS 524  -4.025  -6.578   1.064
  143    H    SER 525           HN       SER 525  -0.371  -7.140   1.733
  144    HA   SER 525           HA       SER 525   0.421  -8.056   4.416
  145    HG   SER 525           HG       SER 525   1.090 -10.636   4.439
  146    HB2  SER 525           HB2      SER 525  -0.326  -9.943   2.959
  147    HB3  SER 525           HB1      SER 525   0.986  -9.550   1.848
  148    H    THR 526           HN       THR 526   2.953  -8.683   4.326
  149    HA   THR 526           HA       THR 526   4.260  -6.231   3.930
  150    HB   THR 526           HB       THR 526   5.582  -8.931   4.261
  151    HG1  THR 526           HG1      THR 526   5.312  -7.684   6.594
  152   HG21  THR 526          HG21      THR 526   7.094  -7.072   3.781
  153   HG22  THR 526          HG22      THR 526   7.289  -7.620   5.446
  154   HG23  THR 526          HG23      THR 526   6.387  -6.143   5.105
  155    H    PHE 527           HN       PHE 527   4.225  -9.235   2.031
  156    HA   PHE 527           HA       PHE 527   6.368  -8.529   0.355
  157    HD1  PHE 527           HD1      PHE 527   3.486 -11.307   1.641
  158    HD2  PHE 527           HD2      PHE 527   3.627 -10.084  -2.432
  159    HE1  PHE 527           HE1      PHE 527   1.171 -12.073   1.335
  160    HE2  PHE 527           HE2      PHE 527   1.306 -10.842  -2.746
  161    HZ   PHE 527           HZ       PHE 527   0.077 -11.841  -0.861
  162    HB2  PHE 527           HB2      PHE 527   5.639 -10.317  -1.134
  163    HB3  PHE 527           HB1      PHE 527   5.595 -10.846   0.545
  164    H    CYS 528           HN       CYS 528   2.912  -7.950   0.099
  165    HA   CYS 528           HA       CYS 528   2.742  -6.958  -2.474
  166    HB2  CYS 528           HB2      CYS 528   1.276  -5.763  -0.142
  167    HB3  CYS 528           HB1      CYS 528   0.693  -6.058  -1.779
  168    H    GLN 529           HN       GLN 529   3.719  -5.380   0.519
  169    HA   GLN 529           HA       GLN 529   3.779  -2.727  -0.500
  170    HB2  GLN 529           HB2      GLN 529   5.192  -3.966   1.883
  171    HB3  GLN 529           HB1      GLN 529   5.119  -2.243   1.550
  172    HG2  GLN 529           HG2      GLN 529   2.762  -2.201   1.881
  173    HG3  GLN 529           HG1      GLN 529   2.689  -3.959   1.985
  174   HE21  GLN 529          HE21      GLN 529   3.327  -4.976   3.863
  175   HE22  GLN 529          HE22      GLN 529   3.612  -4.121   5.342
  176    H    ARG 530           HN       ARG 530   6.198  -5.213   0.043
  177    HA   ARG 530           HA       ARG 530   8.391  -3.513  -0.682
  178    HE   ARG 530           HE       ARG 530  11.088  -4.600   1.841
  179    HB2  ARG 530           HB2      ARG 530   8.383  -6.507  -0.299
  180    HB3  ARG 530           HB1      ARG 530   9.799  -5.464  -0.340
  181    HG2  ARG 530           HG2      ARG 530   8.803  -4.263   1.651
  182    HG3  ARG 530           HG1      ARG 530   7.657  -5.598   1.757
  183    HD2  ARG 530           HD2      ARG 530   9.382  -6.154   3.241
  184    HD3  ARG 530           HD1      ARG 530   9.686  -7.127   1.804
  185   HH11  ARG 530          HH11      ARG 530  11.205  -7.993   2.731
  186   HH12  ARG 530          HH12      ARG 530  12.928  -8.007   2.925
  187   HH21  ARG 530          HH21      ARG 530  13.367  -4.646   2.059
  188   HH22  ARG 530          HH22      ARG 530  14.154  -6.127   2.520
  189    H    LYS 531           HN       LYS 531   6.360  -5.775  -2.364
  190    HA   LYS 531           HA       LYS 531   8.088  -6.058  -4.639
  191    HB2  LYS 531           HB2      LYS 531   5.169  -6.677  -4.202
  192    HB3  LYS 531           HB1      LYS 531   5.963  -6.919  -5.749
  193    HG2  LYS 531           HG2      LYS 531   6.766  -8.238  -3.166
  194    HG3  LYS 531           HG1      LYS 531   5.785  -8.979  -4.431
  195    HD2  LYS 531           HD2      LYS 531   7.704  -8.563  -6.007
  196    HD3  LYS 531           HD1      LYS 531   8.664  -8.108  -4.599
  197    HE2  LYS 531           HE2      LYS 531   9.118 -10.400  -5.082
  198    HE3  LYS 531           HE1      LYS 531   8.145 -10.341  -3.614
  199    HZ1  LYS 531           HZ1      LYS 531   7.135 -10.946  -6.343
  200    HZ2  LYS 531           HZ2      LYS 531   6.184 -10.880  -4.945
  201    HZ3  LYS 531           HZ3      LYS 531   7.379 -12.078  -5.103
  202    H    ASP 532           HN       ASP 532   5.138  -4.177  -3.961
  203    HA   ASP 532           HA       ASP 532   4.972  -3.176  -6.637
  204    HB2  ASP 532           HB2      ASP 532   3.224  -3.483  -4.572
  205    HB3  ASP 532           HB1      ASP 532   3.510  -1.748  -4.541
  206    H    TRP 533           HN       TRP 533   6.284  -2.015  -3.636
  207    HA   TRP 533           HA       TRP 533   5.962   0.735  -4.160
  208    HD1  TRP 533           HD1      TRP 533   9.059  -1.804  -3.129
  209    HE1  TRP 533           HE1      TRP 533  11.384  -1.244  -2.129
  210    HE3  TRP 533           HE3      TRP 533   7.836   2.388  -0.503
  211    HZ2  TRP 533           HZ2      TRP 533  12.500   0.713  -0.435
  212    HZ3  TRP 533           HZ3      TRP 533   9.572   3.528   0.801
  213    HH2  TRP 533           HH2      TRP 533  11.865   2.703   0.838
  214    HB2  TRP 533           HB2      TRP 533   6.661   1.030  -2.042
  215    HB3  TRP 533           HB1      TRP 533   6.494  -0.722  -1.942
  216    H    LYS 534           HN       LYS 534   7.827  -1.181  -5.917
  217    HA   LYS 534           HA       LYS 534  10.326   0.008  -6.093
  218    HB2  LYS 534           HB2      LYS 534   8.670  -0.934  -8.447
  219    HB3  LYS 534           HB1      LYS 534  10.423  -0.808  -8.371
  220    HG2  LYS 534           HG2      LYS 534   8.752  -2.656  -6.689
  221    HG3  LYS 534           HG1      LYS 534   9.614  -3.112  -8.159
  222    HD2  LYS 534           HD2      LYS 534  11.710  -2.796  -7.163
  223    HD3  LYS 534           HD1      LYS 534  11.030  -1.847  -5.836
  224    HE2  LYS 534           HE2      LYS 534   9.976  -3.785  -4.911
  225    HE3  LYS 534           HE1      LYS 534  10.445  -4.764  -6.304
  226    HZ1  LYS 534           HZ1      LYS 534  12.696  -4.669  -5.682
  227    HZ2  LYS 534           HZ2      LYS 534  11.853  -5.018  -4.253
  228    HZ3  LYS 534           HZ3      LYS 534  12.424  -3.448  -4.539
  229    H    ASP 535           HN       ASP 535   7.234   1.301  -7.015
  230    HA   ASP 535           HA       ASP 535   8.502   3.635  -8.267
  231    HB2  ASP 535           HB2      ASP 535   5.733   2.524  -8.225
  232    HB3  ASP 535           HB1      ASP 535   5.917   4.270  -8.394
  233    H    HIS 536           HN       HIS 536   6.990   2.552  -5.400
  234    HA   HIS 536           HA       HIS 536   6.328   5.129  -4.346
  235    HD1  HIS 536           HD1      HIS 536   4.875   5.839  -2.471
  236    HD2  HIS 536           HD2      HIS 536   6.194   2.466  -0.405
  237    HE1  HIS 536           HE1      HIS 536   4.646   6.369   0.004
  238    HB2  HIS 536           HB2      HIS 536   5.019   3.173  -3.742
  239    HB3  HIS 536           HB1      HIS 536   6.451   2.399  -3.060
  240    H    GLN 537           HN       GLN 537   9.064   2.965  -4.128
  241    HA   GLN 537           HA       GLN 537  10.411   3.948  -1.927
  242    HB2  GLN 537           HB2      GLN 537  12.471   3.158  -3.040
  243    HB3  GLN 537           HB1      GLN 537  11.165   1.983  -3.125
  244    HG2  GLN 537           HG2      GLN 537  10.690   2.736  -5.427
  245    HG3  GLN 537           HG1      GLN 537  12.078   3.817  -5.329
  246   HE21  GLN 537          HE21      GLN 537  12.047   0.668  -3.850
  247   HE22  GLN 537          HE22      GLN 537  13.193  -0.065  -4.916
  248    H    HIS 538           HN       HIS 538   9.819   5.436  -4.951
  249    HA   HIS 538           HA       HIS 538  11.958   7.337  -4.866
  250    HD2  HIS 538           HD2      HIS 538   9.753   4.593  -7.053
  251    HE1  HIS 538           HE1      HIS 538  13.106   5.332  -9.535
  252    HE2  HIS 538           HE2      HIS 538  11.251   3.696  -8.976
  253    HB2  HIS 538           HB2      HIS 538   9.407   7.384  -6.493
  254    HB3  HIS 538           HB1      HIS 538  10.837   8.370  -6.779
  255    H    ILE 539           HN       ILE 539   8.902   7.112  -3.320
  256    HA   ILE 539           HA       ILE 539   8.868  10.033  -2.939
  257    HB   ILE 539           HB       ILE 539   7.015   9.486  -4.390
  258   HG12  ILE 539          HG12      ILE 539   5.994   9.944  -1.577
  259   HG13  ILE 539          HG11      ILE 539   6.634  11.196  -2.640
  260   HG21  ILE 539          HG21      ILE 539   6.784   7.130  -3.893
  261   HG22  ILE 539          HG22      ILE 539   5.231   7.947  -3.703
  262   HG23  ILE 539          HG23      ILE 539   6.178   7.507  -2.280
  263   HD11  ILE 539          HD11      ILE 539   4.214  11.230  -2.619
  264   HD12  ILE 539          HD12      ILE 539   4.169   9.540  -3.125
  265   HD13  ILE 539          HD13      ILE 539   4.809  10.770  -4.215
  266    H    CYS 540           HN       CYS 540   8.798   6.908  -1.556
  267    HA   CYS 540           HA       CYS 540   7.846   7.631   1.010
  268    HB2  CYS 540           HB2      CYS 540   8.296   5.232  -0.056
  269    HB3  CYS 540           HB1      CYS 540   9.880   5.473   0.668
  270    H    GLY 541           HN       GLY 541   9.003   8.029   2.844
  271    HA2  GLY 541           HA2      GLY 541  11.447   9.547   2.451
  272    HA3  GLY 541           HA1      GLY 541  10.498   9.467   3.927
  273    H    GLN 542           HN       GLN 542  10.397   6.666   4.227
  274    HA   GLN 542           HA       GLN 542  13.154   6.233   5.112
  275    HB2  GLN 542           HB2      GLN 542  10.528   5.018   5.936
  276    HB3  GLN 542           HB1      GLN 542  12.064   4.309   6.409
  277    HG2  GLN 542           HG2      GLN 542  11.161   7.107   7.050
  278    HG3  GLN 542           HG1      GLN 542  11.116   5.732   8.152
  279   HE21  GLN 542          HE21      GLN 542  13.091   8.112   6.614
  280   HE22  GLN 542          HE22      GLN 542  14.542   7.786   7.503
  281    H    SER 543           HN       SER 543  13.568   5.828   2.732
  282    HA   SER 543           HA       SER 543  12.751   3.297   1.677
  283    HG   SER 543           HG       SER 543  12.971   5.370  -0.799
  284    HB2  SER 543           HB2      SER 543  15.034   5.065   0.771
  285    HB3  SER 543           HB1      SER 543  14.229   3.809  -0.169
  286    H    ALA 544           HN       ALA 544  13.349   2.014   3.542
  287    HA   ALA 544           HA       ALA 544  16.088   1.025   3.325
  288    HB1  ALA 544           HB1      ALA 544  16.371   1.000   5.765
  289    HB2  ALA 544           HB2      ALA 544  14.840   1.857   5.945
  290    HB3  ALA 544           HB3      ALA 544  16.201   2.638   5.142
  Start of MODEL    4
    1    H    SER 503           HN       SER 503  -8.377  -1.377  -1.572
    2    HA   SER 503           HA       SER 503  -8.123  -2.574   1.046
    3    HG   SER 503           HG       SER 503  -7.587  -4.201  -2.158
    4    HB2  SER 503           HB2      SER 503  -7.909  -4.856   0.015
    5    HB3  SER 503           HB1      SER 503  -9.533  -4.183  -0.086
    6    H    CYS 504           HN       CYS 504  -6.134  -4.466   0.185
    7    HA   CYS 504           HA       CYS 504  -3.787  -3.106  -0.074
    8    HB2  CYS 504           HB2      CYS 504  -3.984  -5.576   0.207
    9    HB3  CYS 504           HB1      CYS 504  -4.442  -5.708  -1.483
   10    H    VAL 505           HN       VAL 505  -2.805  -1.941  -1.613
   11    HA   VAL 505           HA       VAL 505  -4.193  -1.322  -4.046
   12    HB   VAL 505           HB       VAL 505  -1.367  -0.506  -3.316
   13   HG11  VAL 505          HG11      VAL 505  -1.844   1.451  -4.706
   14   HG12  VAL 505          HG12      VAL 505  -3.448   0.812  -5.063
   15   HG13  VAL 505          HG13      VAL 505  -2.013  -0.044  -5.627
   16   HG21  VAL 505          HG21      VAL 505  -2.815   0.044  -1.454
   17   HG22  VAL 505          HG22      VAL 505  -3.959   0.826  -2.545
   18   HG23  VAL 505          HG23      VAL 505  -2.349   1.511  -2.318
   19    H    ASN 506           HN       ASN 506  -3.190  -4.075  -3.492
   20    HA   ASN 506           HA       ASN 506  -1.955  -4.545  -6.088
   21    HB2  ASN 506           HB2      ASN 506  -0.044  -4.307  -4.578
   22    HB3  ASN 506           HB1      ASN 506  -0.714  -5.538  -3.510
   23   HD21  ASN 506          HD21      ASN 506   1.050  -6.873  -3.703
   24   HD22  ASN 506          HD22      ASN 506   1.430  -7.732  -5.156
   25    H    CYS 507           HN       CYS 507  -3.680  -5.788  -3.271
   26    HA   CYS 507           HA       CYS 507  -4.571  -8.036  -4.905
   27    HB2  CYS 507           HB2      CYS 507  -3.994  -8.779  -2.112
   28    HB3  CYS 507           HB1      CYS 507  -3.833  -9.717  -3.591
   29    H    GLY 508           HN       GLY 508  -4.983  -7.856  -1.425
   30    HA2  GLY 508           HA2      GLY 508  -7.772  -7.001  -1.678
   31    HA3  GLY 508           HA1      GLY 508  -7.468  -8.639  -1.125
   32    H    ARG 509           HN       ARG 509  -8.748  -7.711   0.755
   33    HA   ARG 509           HA       ARG 509  -8.715  -7.304   3.011
   34    HE   ARG 509           HE       ARG 509  -9.010  -7.063   5.710
   35    HB2  ARG 509           HB2      ARG 509  -6.694  -8.777   2.904
   36    HB3  ARG 509           HB1      ARG 509  -5.699  -7.341   2.725
   37    HG2  ARG 509           HG2      ARG 509  -5.512  -7.925   4.970
   38    HG3  ARG 509           HG1      ARG 509  -6.669  -6.596   4.961
   39    HD2  ARG 509           HD2      ARG 509  -7.512  -9.482   4.917
   40    HD3  ARG 509           HD1      ARG 509  -7.234  -8.599   6.416
   41   HH11  ARG 509          HH11      ARG 509  -8.896 -10.289   4.332
   42   HH12  ARG 509          HH12      ARG 509 -10.563 -10.265   3.846
   43   HH21  ARG 509          HH21      ARG 509 -11.177  -7.027   5.067
   44   HH22  ARG 509          HH22      ARG 509 -11.861  -8.402   4.241
   45    H    GLU 510           HN       GLU 510  -8.885  -5.449   4.287
   46    HA   GLU 510           HA       GLU 510  -8.262  -2.980   2.962
   47    HB2  GLU 510           HB2      GLU 510  -9.355  -1.857   4.822
   48    HB3  GLU 510           HB1      GLU 510 -10.340  -3.177   4.220
   49    HG2  GLU 510           HG2      GLU 510  -8.600  -3.355   6.666
   50    HG3  GLU 510           HG1      GLU 510 -10.311  -2.934   6.691
   51    H    ALA 511           HN       ALA 511  -6.131  -4.820   4.059
   52    HA   ALA 511           HA       ALA 511  -3.939  -4.503   4.516
   53    HB1  ALA 511           HB1      ALA 511  -4.174  -2.302   3.431
   54    HB2  ALA 511           HB2      ALA 511  -2.991  -2.306   4.740
   55    HB3  ALA 511           HB3      ALA 511  -4.589  -1.601   4.998
   56    H    MET 512           HN       MET 512  -2.593  -4.581   6.283
   57    HA   MET 512           HA       MET 512  -3.966  -4.475   8.876
   58    HB2  MET 512           HB2      MET 512  -1.352  -5.806   8.115
   59    HB3  MET 512           HB1      MET 512  -2.121  -5.890   9.695
   60    HG2  MET 512           HG2      MET 512  -4.025  -7.050   8.720
   61    HG3  MET 512           HG1      MET 512  -3.280  -6.951   7.127
   62    HE1  MET 512           HE1      MET 512  -3.008 -10.755   7.909
   63    HE2  MET 512           HE2      MET 512  -3.580  -9.527   6.782
   64    HE3  MET 512           HE3      MET 512  -4.330  -9.684   8.369
   65    H    SER 513           HN       SER 513  -0.712  -3.836   7.574
   66    HA   SER 513           HA       SER 513  -0.710  -1.347   9.140
   67    HG   SER 513           HG       SER 513   1.174  -4.044   9.809
   68    HB2  SER 513           HB2      SER 513   1.709  -2.846   8.121
   69    HB3  SER 513           HB1      SER 513   1.703  -1.380   9.114
   70    H    GLU 514           HN       GLU 514   0.766   0.303   8.125
   71    HA   GLU 514           HA       GLU 514   0.184   0.514   5.265
   72    HB2  GLU 514           HB2      GLU 514   0.965   2.683   7.170
   73    HB3  GLU 514           HB1      GLU 514   0.273   2.859   5.558
   74    HG2  GLU 514           HG2      GLU 514  -1.790   2.636   6.307
   75    HG3  GLU 514           HG1      GLU 514  -1.370   1.238   7.287
   76    H    CYS 515           HN       CYS 515   1.867   1.496   3.916
   77    HA   CYS 515           HA       CYS 515   4.375   0.438   3.952
   78    HB2  CYS 515           HB2      CYS 515   3.518   1.787   2.098
   79    HB3  CYS 515           HB1      CYS 515   3.625   3.241   3.084
   80    H    THR 516           HN       THR 516   5.855   0.403   5.571
   81    HA   THR 516           HA       THR 516   5.342   1.925   7.888
   82    HB   THR 516           HB       THR 516   7.957   0.635   7.824
   83    HG1  THR 516           HG1      THR 516   5.670  -1.018   7.493
   84   HG21  THR 516          HG21      THR 516   6.799   1.250   9.883
   85   HG22  THR 516          HG22      THR 516   7.033  -0.495   9.790
   86   HG23  THR 516          HG23      THR 516   5.451   0.200   9.442
   87    H    GLY 517           HN       GLY 517   6.954   2.946   5.177
   88    HA2  GLY 517           HA2      GLY 517   8.865   4.595   6.655
   89    HA3  GLY 517           HA1      GLY 517   8.754   4.456   4.908
   90    H    CYS 518           HN       CYS 518   5.661   4.814   5.617
   91    HA   CYS 518           HA       CYS 518   5.616   7.692   5.990
   92    HB2  CYS 518           HB2      CYS 518   4.653   8.188   3.836
   93    HB3  CYS 518           HB1      CYS 518   6.213   7.408   3.607
   94    H    HIS 519           HN       HIS 519   3.895   4.817   5.013
   95    HA   HIS 519           HA       HIS 519   1.898   3.919   5.465
   96    HD1  HIS 519           HD1      HIS 519   1.194   3.259   9.506
   97    HD2  HIS 519           HD2      HIS 519   4.501   4.534   7.375
   98    HE1  HIS 519           HE1      HIS 519   3.197   2.197  10.632
   99    HE2  HIS 519           HE2      HIS 519   5.177   3.285   9.539
  100    HB2  HIS 519           HB2      HIS 519   1.588   6.002   7.650
  101    HB3  HIS 519           HB1      HIS 519   0.615   4.547   7.441
  102    H    LYS 520           HN       LYS 520   2.389   6.182   3.651
  103    HA   LYS 520           HA       LYS 520  -0.202   7.491   3.461
  104    HB2  LYS 520           HB2      LYS 520   2.231   7.571   1.671
  105    HB3  LYS 520           HB1      LYS 520   0.764   8.500   1.382
  106    HG2  LYS 520           HG2      LYS 520   1.081   9.659   3.505
  107    HG3  LYS 520           HG1      LYS 520   2.551   8.727   3.793
  108    HD2  LYS 520           HD2      LYS 520   3.294  10.790   2.948
  109    HD3  LYS 520           HD1      LYS 520   3.396   9.676   1.588
  110    HE2  LYS 520           HE2      LYS 520   1.066  11.523   2.065
  111    HE3  LYS 520           HE1      LYS 520   2.449  11.947   1.064
  112    HZ1  LYS 520           HZ1      LYS 520   0.782  11.165  -0.384
  113    HZ2  LYS 520           HZ2      LYS 520   0.441   9.820   0.581
  114    HZ3  LYS 520           HZ3      LYS 520   1.902   9.898  -0.267
  115    H    VAL 521           HN       VAL 521   0.871   4.481   2.733
  116    HA   VAL 521           HA       VAL 521  -1.241   3.988   0.817
  117    HB   VAL 521           HB       VAL 521   0.272   2.555  -0.591
  118   HG11  VAL 521          HG11      VAL 521   1.175   4.397  -1.953
  119   HG12  VAL 521          HG12      VAL 521   0.836   5.516  -0.633
  120   HG13  VAL 521          HG13      VAL 521  -0.490   4.689  -1.449
  121   HG21  VAL 521          HG21      VAL 521   2.679   3.067  -0.601
  122   HG22  VAL 521          HG22      VAL 521   2.148   2.354   0.923
  123   HG23  VAL 521          HG23      VAL 521   2.448   4.090   0.819
  124    H    ASN 522           HN       ASN 522  -1.373   1.464   0.569
  125    HA   ASN 522           HA       ASN 522  -0.387   0.114   2.914
  126    HB2  ASN 522           HB2      ASN 522  -2.628  -0.436   3.792
  127    HB3  ASN 522           HB1      ASN 522  -2.288   1.288   3.873
  128   HD21  ASN 522          HD21      ASN 522  -3.441   2.703   2.567
  129   HD22  ASN 522          HD22      ASN 522  -4.875   2.229   1.731
  130    H    TYR 523           HN       TYR 523  -0.744  -2.098   2.938
  131    HA   TYR 523           HA       TYR 523  -1.794  -3.289   0.484
  132    HD1  TYR 523           HD2      TYR 523   0.009  -3.411  -1.926
  133    HD2  TYR 523           HD1      TYR 523   1.888  -1.654   1.463
  134    HE1  TYR 523           HE2      TYR 523   0.975  -1.670  -3.370
  135    HE2  TYR 523           HE1      TYR 523   2.855   0.091   0.031
  136    HH   TYR 523           HH       TYR 523   1.871   0.574  -3.214
  137    HB2  TYR 523           HB2      TYR 523   0.962  -3.878   1.590
  138    HB3  TYR 523           HB1      TYR 523   0.224  -4.643   0.187
  139    H    CYS 524           HN       CYS 524  -2.269  -5.566   0.705
  140    HA   CYS 524           HA       CYS 524  -3.522  -6.187   3.112
  141    HB2  CYS 524           HB2      CYS 524  -3.952  -8.355   2.218
  142    HB3  CYS 524           HB1      CYS 524  -4.097  -7.175   0.927
  143    H    SER 525           HN       SER 525  -0.489  -7.418   1.800
  144    HA   SER 525           HA       SER 525   0.354  -8.106   4.524
  145    HG   SER 525           HG       SER 525   1.654 -11.280   3.749
  146    HB2  SER 525           HB2      SER 525  -0.265 -10.166   3.255
  147    HB3  SER 525           HB1      SER 525   0.994  -9.778   2.085
  148    H    THR 526           HN       THR 526   2.938  -8.758   4.202
  149    HA   THR 526           HA       THR 526   4.154  -6.250   3.793
  150    HB   THR 526           HB       THR 526   5.551  -8.910   4.007
  151    HG1  THR 526           HG1      THR 526   5.043  -8.966   6.080
  152   HG21  THR 526          HG21      THR 526   6.341  -6.124   4.881
  153   HG22  THR 526          HG22      THR 526   7.003  -7.006   3.503
  154   HG23  THR 526          HG23      THR 526   7.287  -7.590   5.143
  155    H    PHE 527           HN       PHE 527   3.968  -9.152   1.748
  156    HA   PHE 527           HA       PHE 527   6.251  -8.643   0.227
  157    HD1  PHE 527           HD1      PHE 527   3.156 -11.080   1.359
  158    HD2  PHE 527           HD2      PHE 527   3.294  -9.796  -2.699
  159    HE1  PHE 527           HE1      PHE 527   0.778 -11.621   1.112
  160    HE2  PHE 527           HE2      PHE 527   0.894 -10.328  -2.952
  161    HZ   PHE 527           HZ       PHE 527  -0.360 -11.249  -1.043
  162    HB2  PHE 527           HB2      PHE 527   5.312 -10.193  -1.466
  163    HB3  PHE 527           HB1      PHE 527   5.281 -10.839   0.171
  164    H    CYS 528           HN       CYS 528   2.907  -7.636  -0.358
  165    HA   CYS 528           HA       CYS 528   3.265  -6.528  -2.902
  166    HB2  CYS 528           HB2      CYS 528   1.408  -5.155  -1.081
  167    HB3  CYS 528           HB1      CYS 528   1.099  -5.948  -2.630
  168    H    GLN 529           HN       GLN 529   3.872  -5.290   0.294
  169    HA   GLN 529           HA       GLN 529   4.031  -2.539  -0.371
  170    HB2  GLN 529           HB2      GLN 529   3.668  -3.575   1.926
  171    HB3  GLN 529           HB1      GLN 529   5.380  -3.964   1.933
  172    HG2  GLN 529           HG2      GLN 529   5.881  -1.552   1.700
  173    HG3  GLN 529           HG1      GLN 529   4.153  -1.221   1.846
  174   HE21  GLN 529          HE21      GLN 529   3.101  -1.725   3.825
  175   HE22  GLN 529          HE22      GLN 529   4.000  -1.813   5.298
  176    H    ARG 530           HN       ARG 530   6.382  -5.133   0.082
  177    HA   ARG 530           HA       ARG 530   8.623  -3.466  -0.520
  178    HE   ARG 530           HE       ARG 530   9.799  -5.332   3.826
  179    HB2  ARG 530           HB2      ARG 530   8.355  -6.452  -0.232
  180    HB3  ARG 530           HB1      ARG 530   9.882  -5.649  -0.581
  181    HG2  ARG 530           HG2      ARG 530   9.571  -4.312   1.496
  182    HG3  ARG 530           HG1      ARG 530   8.170  -5.318   1.870
  183    HD2  ARG 530           HD2      ARG 530   9.552  -7.288   1.960
  184    HD3  ARG 530           HD1      ARG 530  10.956  -6.368   1.414
  185   HH11  ARG 530          HH11      ARG 530  12.010  -7.734   2.537
  186   HH12  ARG 530          HH12      ARG 530  12.941  -7.836   3.997
  187   HH21  ARG 530          HH21      ARG 530  11.047  -5.461   5.740
  188   HH22  ARG 530          HH22      ARG 530  12.404  -6.555   5.806
  189    H    LYS 531           HN       LYS 531   6.712  -5.797  -2.360
  190    HA   LYS 531           HA       LYS 531   8.521  -5.922  -4.555
  191    HB2  LYS 531           HB2      LYS 531   5.646  -6.742  -4.230
  192    HB3  LYS 531           HB1      LYS 531   6.524  -6.963  -5.734
  193    HG2  LYS 531           HG2      LYS 531   8.097  -8.433  -4.657
  194    HG3  LYS 531           HG1      LYS 531   7.361  -8.115  -3.085
  195    HD2  LYS 531           HD2      LYS 531   5.292  -9.160  -3.813
  196    HD3  LYS 531           HD1      LYS 531   5.962  -9.418  -5.424
  197    HE2  LYS 531           HE2      LYS 531   7.155 -10.573  -2.911
  198    HE3  LYS 531           HE1      LYS 531   5.991 -11.429  -3.920
  199    HZ1  LYS 531           HZ1      LYS 531   7.501 -11.492  -5.701
  200    HZ2  LYS 531           HZ2      LYS 531   8.411 -11.917  -4.336
  201    HZ3  LYS 531           HZ3      LYS 531   8.539 -10.358  -4.990
  202    H    ASP 532           HN       ASP 532   5.559  -4.064  -3.969
  203    HA   ASP 532           HA       ASP 532   5.543  -3.087  -6.692
  204    HB2  ASP 532           HB2      ASP 532   3.709  -3.184  -4.417
  205    HB3  ASP 532           HB1      ASP 532   3.566  -1.723  -5.386
  206    H    TRP 533           HN       TRP 533   6.687  -1.994  -3.641
  207    HA   TRP 533           HA       TRP 533   6.348   0.788  -4.149
  208    HD1  TRP 533           HD1      TRP 533   9.475  -1.642  -3.016
  209    HE1  TRP 533           HE1      TRP 533  11.707  -1.055  -1.855
  210    HE3  TRP 533           HE3      TRP 533   7.915   2.341  -0.238
  211    HZ2  TRP 533           HZ2      TRP 533  12.646   0.851   0.012
  212    HZ3  TRP 533           HZ3      TRP 533   9.528   3.481   1.229
  213    HH2  TRP 533           HH2      TRP 533  11.849   2.738   1.356
  214    HB2  TRP 533           HB2      TRP 533   6.902   1.079  -1.990
  215    HB3  TRP 533           HB1      TRP 533   6.761  -0.673  -1.892
  216    H    LYS 534           HN       LYS 534   8.270  -1.167  -5.789
  217    HA   LYS 534           HA       LYS 534  10.823  -0.067  -5.732
  218    HB2  LYS 534           HB2      LYS 534   9.354  -1.050  -8.189
  219    HB3  LYS 534           HB1      LYS 534  11.098  -0.928  -7.993
  220    HG2  LYS 534           HG2      LYS 534   9.252  -2.749  -6.467
  221    HG3  LYS 534           HG1      LYS 534  10.384  -3.218  -7.739
  222    HD2  LYS 534           HD2      LYS 534  12.259  -2.665  -6.386
  223    HD3  LYS 534           HD1      LYS 534  11.237  -1.872  -5.184
  224    HE2  LYS 534           HE2      LYS 534  10.239  -3.969  -4.571
  225    HE3  LYS 534           HE1      LYS 534  11.106  -4.807  -5.867
  226    HZ1  LYS 534           HZ1      LYS 534  12.350  -5.252  -3.967
  227    HZ2  LYS 534           HZ2      LYS 534  12.181  -3.685  -3.352
  228    HZ3  LYS 534           HZ3      LYS 534  13.197  -3.966  -4.679
  229    H    ASP 535           HN       ASP 535   7.881   1.232  -7.055
  230    HA   ASP 535           HA       ASP 535   9.305   3.470  -8.289
  231    HB2  ASP 535           HB2      ASP 535   7.424   2.511  -9.534
  232    HB3  ASP 535           HB1      ASP 535   6.345   2.829  -8.178
  233    H    HIS 536           HN       HIS 536   7.389   2.653  -5.527
  234    HA   HIS 536           HA       HIS 536   6.814   5.346  -4.744
  235    HD1  HIS 536           HD1      HIS 536   4.023   5.385  -2.673
  236    HD2  HIS 536           HD2      HIS 536   7.419   3.742  -0.927
  237    HE1  HIS 536           HE1      HIS 536   4.136   6.279  -0.290
  238    HB2  HIS 536           HB2      HIS 536   5.218   3.670  -4.161
  239    HB3  HIS 536           HB1      HIS 536   6.450   2.675  -3.385
  240    H    GLN 537           HN       GLN 537   9.332   3.029  -3.986
  241    HA   GLN 537           HA       GLN 537  10.412   3.960  -1.645
  242    HB2  GLN 537           HB2      GLN 537  12.594   3.135  -2.469
  243    HB3  GLN 537           HB1      GLN 537  11.280   1.998  -2.762
  244    HG2  GLN 537           HG2      GLN 537  11.155   2.822  -5.092
  245    HG3  GLN 537           HG1      GLN 537  12.559   3.835  -4.773
  246   HE21  GLN 537          HE21      GLN 537  12.182   0.651  -3.414
  247   HE22  GLN 537          HE22      GLN 537  13.433  -0.104  -4.338
  248    H    HIS 538           HN       HIS 538  10.355   5.524  -4.693
  249    HA   HIS 538           HA       HIS 538  12.566   7.290  -4.235
  250    HD2  HIS 538           HD2      HIS 538  10.557   4.619  -6.576
  251    HE1  HIS 538           HE1      HIS 538  14.201   5.015  -8.702
  252    HE2  HIS 538           HE2      HIS 538  12.363   3.419  -8.002
  253    HB2  HIS 538           HB2      HIS 538  10.337   7.501  -6.274
  254    HB3  HIS 538           HB1      HIS 538  11.888   8.330  -6.329
  255    H    ILE 539           HN       ILE 539   9.299   7.214  -3.197
  256    HA   ILE 539           HA       ILE 539   9.316  10.145  -2.849
  257    HB   ILE 539           HB       ILE 539   6.898  10.201  -3.103
  258   HG12  ILE 539          HG12      ILE 539   7.102   7.245  -3.737
  259   HG13  ILE 539          HG11      ILE 539   6.395   7.933  -2.278
  260   HG21  ILE 539          HG21      ILE 539   8.251   8.800  -5.406
  261   HG22  ILE 539          HG22      ILE 539   8.262  10.536  -5.085
  262   HG23  ILE 539          HG23      ILE 539   6.752   9.724  -5.502
  263   HD11  ILE 539          HD11      ILE 539   4.680   7.259  -3.846
  264   HD12  ILE 539          HD12      ILE 539   5.373   8.304  -5.083
  265   HD13  ILE 539          HD13      ILE 539   4.667   9.008  -3.628
  266    H    CYS 540           HN       CYS 540   9.419   7.223  -1.326
  267    HA   CYS 540           HA       CYS 540   7.650   7.717   0.844
  268    HB2  CYS 540           HB2      CYS 540   8.673   5.441   0.088
  269    HB3  CYS 540           HB1      CYS 540  10.043   5.925   1.078
  270    H    GLY 541           HN       GLY 541   8.041   8.537   2.782
  271    HA2  GLY 541           HA2      GLY 541  10.484  10.083   3.160
  272    HA3  GLY 541           HA1      GLY 541   9.033  10.182   4.148
  273    H    GLN 542           HN       GLN 542  10.876   7.310   3.236
  274    HA   GLN 542           HA       GLN 542  10.846   6.393   5.956
  275    HB2  GLN 542           HB2      GLN 542  10.545   4.904   3.957
  276    HB3  GLN 542           HB1      GLN 542  12.248   5.144   3.591
  277    HG2  GLN 542           HG2      GLN 542  12.836   4.178   5.769
  278    HG3  GLN 542           HG1      GLN 542  11.126   3.899   6.091
  279   HE21  GLN 542          HE21      GLN 542  10.035   2.312   4.934
  280   HE22  GLN 542          HE22      GLN 542  10.876   1.060   4.080
  281    H    SER 543           HN       SER 543  12.106   8.408   6.548
  282    HA   SER 543           HA       SER 543  14.988   7.934   6.364
  283    HG   SER 543           HG       SER 543  12.977  11.038   7.831
  284    HB2  SER 543           HB2      SER 543  14.903  10.232   7.674
  285    HB3  SER 543           HB1      SER 543  14.651  10.181   5.925
  286    H    ALA 544           HN       ALA 544  12.378   7.221   8.281
  287    HA   ALA 544           HA       ALA 544  14.054   6.233  10.403
  288    HB1  ALA 544           HB1      ALA 544  13.640   8.539  11.143
  289    HB2  ALA 544           HB2      ALA 544  12.875   7.363  12.212
  290    HB3  ALA 544           HB3      ALA 544  11.901   8.254  11.040
  Start of MODEL    5
    1    H    SER 503           HN       SER 503  -7.897  -0.542  -1.127
    2    HA   SER 503           HA       SER 503  -7.649  -1.907   1.440
    3    HG   SER 503           HG       SER 503  -8.800  -3.860  -1.926
    4    HB2  SER 503           HB2      SER 503  -7.914  -4.055   0.008
    5    HB3  SER 503           HB1      SER 503  -9.367  -3.149   0.405
    6    H    CYS 504           HN       CYS 504  -6.230  -4.136   0.007
    7    HA   CYS 504           HA       CYS 504  -3.656  -3.023  -0.150
    8    HB2  CYS 504           HB2      CYS 504  -4.085  -5.498   0.094
    9    HB3  CYS 504           HB1      CYS 504  -4.564  -5.529  -1.605
   10    H    VAL 505           HN       VAL 505  -2.860  -1.702  -1.615
   11    HA   VAL 505           HA       VAL 505  -4.223  -1.147  -4.072
   12    HB   VAL 505           HB       VAL 505  -1.424  -0.264  -3.309
   13   HG11  VAL 505          HG11      VAL 505  -2.035   0.177  -5.628
   14   HG12  VAL 505          HG12      VAL 505  -1.927   1.680  -4.711
   15   HG13  VAL 505          HG13      VAL 505  -3.506   0.993  -5.094
   16   HG21  VAL 505          HG21      VAL 505  -2.921   0.257  -1.470
   17   HG22  VAL 505          HG22      VAL 505  -4.052   1.028  -2.582
   18   HG23  VAL 505          HG23      VAL 505  -2.454   1.731  -2.322
   19    H    ASN 506           HN       ASN 506  -3.182  -3.884  -3.508
   20    HA   ASN 506           HA       ASN 506  -1.654  -4.273  -5.972
   21    HB2  ASN 506           HB2      ASN 506  -0.119  -3.968  -3.927
   22    HB3  ASN 506           HB1      ASN 506  -0.675  -5.571  -3.444
   23   HD21  ASN 506          HD21      ASN 506   1.981  -4.688  -4.136
   24   HD22  ASN 506          HD22      ASN 506   2.494  -5.647  -5.478
   25    H    CYS 507           HN       CYS 507  -3.501  -5.778  -3.306
   26    HA   CYS 507           HA       CYS 507  -4.091  -7.963  -5.163
   27    HB2  CYS 507           HB2      CYS 507  -3.778  -8.842  -2.369
   28    HB3  CYS 507           HB1      CYS 507  -3.408  -9.681  -3.871
   29    H    GLY 508           HN       GLY 508  -4.871  -7.421  -1.702
   30    HA2  GLY 508           HA2      GLY 508  -7.710  -7.632  -2.427
   31    HA3  GLY 508           HA1      GLY 508  -6.988  -8.882  -1.431
   32    H    ARG 509           HN       ARG 509  -6.442  -8.489   0.649
   33    HA   ARG 509           HA       ARG 509  -8.474  -7.328   2.063
   34    HE   ARG 509           HE       ARG 509  -7.526  -9.819   5.672
   35    HB2  ARG 509           HB2      ARG 509  -5.705  -8.058   2.955
   36    HB3  ARG 509           HB1      ARG 509  -7.025  -7.669   4.051
   37    HG2  ARG 509           HG2      ARG 509  -8.286  -9.552   3.318
   38    HG3  ARG 509           HG1      ARG 509  -7.139  -9.878   2.015
   39    HD2  ARG 509           HD2      ARG 509  -6.745 -11.403   3.845
   40    HD3  ARG 509           HD1      ARG 509  -5.401 -10.273   3.686
   41   HH11  ARG 509          HH11      ARG 509  -4.139 -10.171   4.820
   42   HH12  ARG 509          HH12      ARG 509  -3.579  -9.865   6.435
   43   HH21  ARG 509          HH21      ARG 509  -6.801  -9.438   7.785
   44   HH22  ARG 509          HH22      ARG 509  -5.096  -9.456   8.140
   45    H    GLU 510           HN       GLU 510  -8.387  -5.720   3.762
   46    HA   GLU 510           HA       GLU 510  -7.754  -3.203   2.599
   47    HB2  GLU 510           HB2      GLU 510  -8.800  -3.797   5.361
   48    HB3  GLU 510           HB1      GLU 510  -8.906  -2.263   4.505
   49    HG2  GLU 510           HG2      GLU 510 -10.374  -3.224   2.865
   50    HG3  GLU 510           HG1      GLU 510 -10.183  -4.823   3.585
   51    H    ALA 511           HN       ALA 511  -5.604  -5.075   3.670
   52    HA   ALA 511           HA       ALA 511  -3.441  -4.785   4.307
   53    HB1  ALA 511           HB1      ALA 511  -3.509  -2.604   3.221
   54    HB2  ALA 511           HB2      ALA 511  -2.534  -2.560   4.687
   55    HB3  ALA 511           HB3      ALA 511  -4.162  -1.887   4.693
   56    H    MET 512           HN       MET 512  -2.174  -4.673   6.199
   57    HA   MET 512           HA       MET 512  -3.739  -4.784   8.666
   58    HB2  MET 512           HB2      MET 512  -0.828  -5.444   8.132
   59    HB3  MET 512           HB1      MET 512  -1.671  -5.714   9.650
   60    HG2  MET 512           HG2      MET 512  -3.114  -7.344   8.605
   61    HG3  MET 512           HG1      MET 512  -2.389  -7.016   7.032
   62    HE1  MET 512           HE1      MET 512  -0.556  -7.270  10.507
   63    HE2  MET 512           HE2      MET 512  -0.102  -8.975  10.537
   64    HE3  MET 512           HE3      MET 512  -1.801  -8.514  10.628
   65    H    SER 513           HN       SER 513  -0.570  -3.526   7.736
   66    HA   SER 513           HA       SER 513  -1.237  -1.009   9.088
   67    HG   SER 513           HG       SER 513   1.968  -2.250   7.766
   68    HB2  SER 513           HB2      SER 513   1.273  -0.712   9.231
   69    HB3  SER 513           HB1      SER 513   0.609  -1.995  10.244
   70    H    GLU 514           HN       GLU 514   0.025   0.857   8.137
   71    HA   GLU 514           HA       GLU 514  -0.163   0.802   5.236
   72    HB2  GLU 514           HB2      GLU 514   0.436   3.010   7.204
   73    HB3  GLU 514           HB1      GLU 514   0.404   3.237   5.461
   74    HG2  GLU 514           HG2      GLU 514  -1.915   2.682   5.373
   75    HG3  GLU 514           HG1      GLU 514  -1.925   2.246   7.080
   76    H    CYS 515           HN       CYS 515   1.613   1.594   3.940
   77    HA   CYS 515           HA       CYS 515   3.946   0.268   4.020
   78    HB2  CYS 515           HB2      CYS 515   3.347   1.688   2.145
   79    HB3  CYS 515           HB1      CYS 515   3.578   3.132   3.119
   80    H    THR 516           HN       THR 516   5.374   0.001   5.620
   81    HA   THR 516           HA       THR 516   5.263   1.536   7.951
   82    HB   THR 516           HB       THR 516   7.294   0.261   8.658
   83    HG1  THR 516           HG1      THR 516   8.272  -1.088   7.256
   84   HG21  THR 516          HG21      THR 516   5.027  -1.327   7.453
   85   HG22  THR 516          HG22      THR 516   5.061  -0.612   9.065
   86   HG23  THR 516          HG23      THR 516   6.166  -1.926   8.659
   87    H    GLY 517           HN       GLY 517   7.016   2.185   5.099
   88    HA2  GLY 517           HA2      GLY 517   9.108   3.691   6.405
   89    HA3  GLY 517           HA1      GLY 517   8.831   3.574   4.675
   90    H    CYS 518           HN       CYS 518   5.863   4.368   5.726
   91    HA   CYS 518           HA       CYS 518   6.241   7.205   6.087
   92    HB2  CYS 518           HB2      CYS 518   5.353   7.909   3.966
   93    HB3  CYS 518           HB1      CYS 518   6.771   6.896   3.691
   94    H    HIS 519           HN       HIS 519   4.104   4.616   5.132
   95    HA   HIS 519           HA       HIS 519   1.975   4.060   5.540
   96    HD1  HIS 519           HD1      HIS 519   0.970   3.988   9.691
   97    HD2  HIS 519           HD2      HIS 519   4.469   4.038   7.457
   98    HE1  HIS 519           HE1      HIS 519   2.599   2.513  10.928
   99    HE2  HIS 519           HE2      HIS 519   4.777   2.784   9.703
  100    HB2  HIS 519           HB2      HIS 519   1.944   6.273   7.600
  101    HB3  HIS 519           HB1      HIS 519   0.709   5.050   7.390
  102    H    LYS 520           HN       LYS 520   2.819   5.975   3.562
  103    HA   LYS 520           HA       LYS 520   0.493   7.693   3.213
  104    HB2  LYS 520           HB2      LYS 520   2.862   7.195   1.399
  105    HB3  LYS 520           HB1      LYS 520   1.593   8.373   1.099
  106    HG2  LYS 520           HG2      LYS 520   2.214   9.544   3.163
  107    HG3  LYS 520           HG1      LYS 520   3.518   8.385   3.414
  108    HD2  LYS 520           HD2      LYS 520   4.508   9.072   1.259
  109    HD3  LYS 520           HD1      LYS 520   3.225  10.269   1.072
  110    HE2  LYS 520           HE2      LYS 520   3.962  11.376   3.130
  111    HE3  LYS 520           HE1      LYS 520   5.247  10.183   3.313
  112    HZ1  LYS 520           HZ1      LYS 520   6.147  10.945   1.156
  113    HZ2  LYS 520           HZ2      LYS 520   6.131  12.165   2.329
  114    HZ3  LYS 520           HZ3      LYS 520   4.964  12.157   1.109
  115    H    VAL 521           HN       VAL 521   1.169   4.483   2.665
  116    HA   VAL 521           HA       VAL 521  -1.058   4.160   0.836
  117    HB   VAL 521           HB       VAL 521   0.177   2.599  -0.644
  118   HG11  VAL 521          HG11      VAL 521  -0.197   4.848  -1.434
  119   HG12  VAL 521          HG12      VAL 521   1.387   4.284  -1.968
  120   HG13  VAL 521          HG13      VAL 521   1.259   5.409  -0.617
  121   HG21  VAL 521          HG21      VAL 521   2.646   2.702  -0.697
  122   HG22  VAL 521          HG22      VAL 521   2.008   1.985   0.782
  123   HG23  VAL 521          HG23      VAL 521   2.606   3.644   0.795
  124    H    ASN 522           HN       ASN 522  -1.169   1.518   0.502
  125    HA   ASN 522           HA       ASN 522  -0.301   0.133   2.866
  126    HB2  ASN 522           HB2      ASN 522  -2.547  -0.438   3.695
  127    HB3  ASN 522           HB1      ASN 522  -2.251   1.293   3.789
  128   HD21  ASN 522          HD21      ASN 522  -4.731  -0.368   3.628
  129   HD22  ASN 522          HD22      ASN 522  -5.630   0.297   2.312
  130    H    TYR 523           HN       TYR 523  -0.573  -2.070   2.792
  131    HA   TYR 523           HA       TYR 523  -1.688  -3.215   0.345
  132    HD1  TYR 523           HD2      TYR 523   0.035  -3.509  -2.108
  133    HD2  TYR 523           HD1      TYR 523   2.010  -1.589   1.130
  134    HE1  TYR 523           HE2      TYR 523   0.954  -1.839  -3.666
  135    HE2  TYR 523           HE1      TYR 523   2.935   0.081  -0.413
  136    HH   TYR 523           HH       TYR 523   1.853   0.411  -3.642
  137    HB2  TYR 523           HB2      TYR 523   1.093  -3.808   1.392
  138    HB3  TYR 523           HB1      TYR 523   0.309  -4.633   0.050
  139    H    CYS 524           HN       CYS 524  -2.364  -5.390   0.583
  140    HA   CYS 524           HA       CYS 524  -3.639  -5.913   2.961
  141    HB2  CYS 524           HB2      CYS 524  -4.187  -8.082   2.123
  142    HB3  CYS 524           HB1      CYS 524  -4.247  -6.924   0.807
  143    H    SER 525           HN       SER 525  -0.639  -7.299   1.804
  144    HA   SER 525           HA       SER 525   0.092  -7.929   4.580
  145    HG   SER 525           HG       SER 525  -1.435  -9.631   3.393
  146    HB2  SER 525           HB2      SER 525   0.737  -9.631   2.168
  147    HB3  SER 525           HB1      SER 525   1.317  -9.920   3.811
  148    H    THR 526           HN       THR 526   2.666  -8.478   4.529
  149    HA   THR 526           HA       THR 526   3.884  -6.005   3.983
  150    HB   THR 526           HB       THR 526   5.222  -8.654   4.556
  151    HG1  THR 526           HG1      THR 526   3.939  -8.337   6.284
  152   HG21  THR 526          HG21      THR 526   6.173  -5.816   4.990
  153   HG22  THR 526          HG22      THR 526   6.793  -6.942   3.786
  154   HG23  THR 526          HG23      THR 526   7.024  -7.271   5.501
  155    H    PHE 527           HN       PHE 527   3.839  -9.039   2.138
  156    HA   PHE 527           HA       PHE 527   6.194  -8.606   0.702
  157    HD1  PHE 527           HD2      PHE 527   3.299  -9.770  -2.191
  158    HD2  PHE 527           HD1      PHE 527   3.163 -11.209   1.809
  159    HE1  PHE 527           HE2      PHE 527   0.921 -10.351  -2.487
  160    HE2  PHE 527           HE1      PHE 527   0.801 -11.804   1.520
  161    HZ   PHE 527           HZ       PHE 527  -0.325 -11.379  -0.628
  162    HB2  PHE 527           HB2      PHE 527   5.333 -10.265  -0.940
  163    HB3  PHE 527           HB1      PHE 527   5.257 -10.809   0.733
  164    H    CYS 528           HN       CYS 528   2.892  -7.567  -0.045
  165    HA   CYS 528           HA       CYS 528   3.381  -6.749  -2.687
  166    HB2  CYS 528           HB2      CYS 528   1.434  -5.114  -1.290
  167    HB3  CYS 528           HB1      CYS 528   1.202  -6.249  -2.620
  168    H    GLN 529           HN       GLN 529   4.010  -5.240   0.379
  169    HA   GLN 529           HA       GLN 529   4.040  -2.545  -0.520
  170    HB2  GLN 529           HB2      GLN 529   3.740  -3.191   1.846
  171    HB3  GLN 529           HB1      GLN 529   5.377  -3.826   1.881
  172    HG2  GLN 529           HG2      GLN 529   6.116  -1.464   1.251
  173    HG3  GLN 529           HG1      GLN 529   4.480  -0.977   1.701
  174   HE21  GLN 529          HE21      GLN 529   7.554  -2.072   2.823
  175   HE22  GLN 529          HE22      GLN 529   7.245  -1.863   4.514
  176    H    ARG 530           HN       ARG 530   6.544  -4.881   0.283
  177    HA   ARG 530           HA       ARG 530   8.650  -3.088  -0.472
  178    HE   ARG 530           HE       ARG 530   8.553  -8.976   0.860
  179    HB2  ARG 530           HB2      ARG 530  10.172  -4.911   0.090
  180    HB3  ARG 530           HB1      ARG 530   8.991  -4.619   1.355
  181    HG2  ARG 530           HG2      ARG 530   7.712  -6.566   0.618
  182    HG3  ARG 530           HG1      ARG 530   8.918  -6.871  -0.640
  183    HD2  ARG 530           HD2      ARG 530  10.642  -7.126   1.050
  184    HD3  ARG 530           HD1      ARG 530   9.479  -6.762   2.319
  185   HH11  ARG 530          HH11      ARG 530  11.184  -8.085   3.000
  186   HH12  ARG 530          HH12      ARG 530  11.332  -9.673   3.693
  187   HH21  ARG 530          HH21      ARG 530   8.753 -11.087   1.775
  188   HH22  ARG 530          HH22      ARG 530   9.993 -11.382   2.967
  189    H    LYS 531           HN       LYS 531   6.838  -5.555  -2.064
  190    HA   LYS 531           HA       LYS 531   8.751  -6.045  -4.157
  191    HB2  LYS 531           HB2      LYS 531   6.901  -7.597  -3.310
  192    HB3  LYS 531           HB1      LYS 531   5.798  -6.615  -4.251
  193    HG2  LYS 531           HG2      LYS 531   6.401  -8.559  -5.516
  194    HG3  LYS 531           HG1      LYS 531   7.107  -7.131  -6.275
  195    HD2  LYS 531           HD2      LYS 531   9.263  -7.635  -5.282
  196    HD3  LYS 531           HD1      LYS 531   8.568  -9.010  -4.419
  197    HE2  LYS 531           HE2      LYS 531   8.009 -10.053  -6.570
  198    HE3  LYS 531           HE1      LYS 531   8.749  -8.695  -7.410
  199    HZ1  LYS 531           HZ1      LYS 531  10.870  -9.272  -6.475
  200    HZ2  LYS 531           HZ2      LYS 531  10.212 -10.628  -7.246
  201    HZ3  LYS 531           HZ3      LYS 531  10.180 -10.518  -5.556
  202    H    ASP 532           HN       ASP 532   5.841  -4.121  -3.751
  203    HA   ASP 532           HA       ASP 532   5.705  -3.373  -6.540
  204    HB2  ASP 532           HB2      ASP 532   3.873  -3.609  -4.577
  205    HB3  ASP 532           HB1      ASP 532   4.157  -1.881  -4.520
  206    H    TRP 533           HN       TRP 533   6.971  -2.046  -3.629
  207    HA   TRP 533           HA       TRP 533   6.494   0.658  -4.208
  208    HD1  TRP 533           HD1      TRP 533   9.659  -1.688  -3.189
  209    HE1  TRP 533           HE1      TRP 533  11.960  -1.068  -2.169
  210    HE3  TRP 533           HE3      TRP 533   8.252   2.321  -0.383
  211    HZ2  TRP 533           HZ2      TRP 533  12.993   0.880  -0.372
  212    HZ3  TRP 533           HZ3      TRP 533   9.931   3.494   0.970
  213    HH2  TRP 533           HH2      TRP 533  12.257   2.774   0.984
  214    HB2  TRP 533           HB2      TRP 533   7.175   1.056  -2.095
  215    HB3  TRP 533           HB1      TRP 533   7.031  -0.696  -1.954
  216    H    LYS 534           HN       LYS 534   8.608  -1.145  -5.903
  217    HA   LYS 534           HA       LYS 534  10.943   0.386  -5.966
  218    HB2  LYS 534           HB2      LYS 534   9.572  -1.303  -8.030
  219    HB3  LYS 534           HB1      LYS 534  11.038  -0.410  -8.423
  220    HG2  LYS 534           HG2      LYS 534  11.709  -2.593  -7.794
  221    HG3  LYS 534           HG1      LYS 534  12.117  -1.498  -6.474
  222    HD2  LYS 534           HD2      LYS 534   9.701  -2.219  -5.640
  223    HD3  LYS 534           HD1      LYS 534  10.102  -3.658  -6.577
  224    HE2  LYS 534           HE2      LYS 534  11.872  -2.481  -4.447
  225    HE3  LYS 534           HE1      LYS 534  10.712  -3.777  -4.162
  226    HZ1  LYS 534           HZ1      LYS 534  12.917  -4.665  -4.526
  227    HZ2  LYS 534           HZ2      LYS 534  13.031  -3.874  -6.020
  228    HZ3  LYS 534           HZ3      LYS 534  11.900  -5.120  -5.805
  229    H    ASP 535           HN       ASP 535   7.813   1.096  -7.113
  230    HA   ASP 535           HA       ASP 535   8.736   3.498  -8.518
  231    HB2  ASP 535           HB2      ASP 535   6.977   2.171  -9.577
  232    HB3  ASP 535           HB1      ASP 535   5.963   2.337  -8.147
  233    H    HIS 536           HN       HIS 536   7.423   2.442  -5.561
  234    HA   HIS 536           HA       HIS 536   6.463   5.025  -4.703
  235    HD1  HIS 536           HD1      HIS 536   3.817   4.623  -2.501
  236    HD2  HIS 536           HD2      HIS 536   7.560   3.626  -0.991
  237    HE1  HIS 536           HE1      HIS 536   3.961   5.587  -0.142
  238    HB2  HIS 536           HB2      HIS 536   5.179   3.114  -4.044
  239    HB3  HIS 536           HB1      HIS 536   6.596   2.336  -3.342
  240    H    GLN 537           HN       GLN 537   9.292   3.033  -4.093
  241    HA   GLN 537           HA       GLN 537  10.455   4.035  -1.856
  242    HB2  GLN 537           HB2      GLN 537  12.618   3.522  -2.833
  243    HB3  GLN 537           HB1      GLN 537  11.438   2.286  -3.259
  244    HG2  GLN 537           HG2      GLN 537  11.197   3.268  -5.475
  245    HG3  GLN 537           HG1      GLN 537  12.351   4.529  -5.046
  246   HE21  GLN 537          HE21      GLN 537  14.526   3.997  -4.812
  247   HE22  GLN 537          HE22      GLN 537  15.186   2.548  -5.498
  248    H    HIS 538           HN       HIS 538   9.931   5.755  -4.794
  249    HA   HIS 538           HA       HIS 538  11.856   7.839  -4.359
  250    HD2  HIS 538           HD2      HIS 538   9.780   5.095  -6.745
  251    HE1  HIS 538           HE1      HIS 538  13.225   5.809  -9.093
  252    HE2  HIS 538           HE2      HIS 538  11.546   4.068  -8.346
  253    HB2  HIS 538           HB2      HIS 538   9.453   7.907  -6.191
  254    HB3  HIS 538           HB1      HIS 538  10.938   8.838  -6.337
  255    H    ILE 539           HN       ILE 539   8.667   7.167  -3.254
  256    HA   ILE 539           HA       ILE 539   8.281  10.006  -2.534
  257    HB   ILE 539           HB       ILE 539   5.889   9.753  -2.768
  258   HG12  ILE 539          HG12      ILE 539   6.443   6.930  -3.710
  259   HG13  ILE 539          HG11      ILE 539   5.751   7.355  -2.149
  260   HG21  ILE 539          HG21      ILE 539   7.343   8.742  -5.204
  261   HG22  ILE 539          HG22      ILE 539   7.134  10.431  -4.740
  262   HG23  ILE 539          HG23      ILE 539   5.733   9.460  -5.194
  263   HD11  ILE 539          HD11      ILE 539   4.041   6.628  -3.726
  264   HD12  ILE 539          HD12      ILE 539   4.502   7.923  -4.831
  265   HD13  ILE 539          HD13      ILE 539   3.807   8.312  -3.257
  266    H    CYS 540           HN       CYS 540   9.217   7.290  -1.202
  267    HA   CYS 540           HA       CYS 540   7.359   7.155   1.007
  268    HB2  CYS 540           HB2      CYS 540   8.786   5.207  -0.005
  269    HB3  CYS 540           HB1      CYS 540  10.054   5.852   1.017
  270    H    GLY 541           HN       GLY 541   7.428   8.481   2.623
  271    HA2  GLY 541           HA2      GLY 541   8.277   9.723   4.399
  272    HA3  GLY 541           HA1      GLY 541   9.901   9.369   3.829
  273    H    GLN 542           HN       GLN 542   9.842  10.265   1.302
  274    HA   GLN 542           HA       GLN 542   9.846  13.142   1.640
  275    HB2  GLN 542           HB2      GLN 542  11.702  11.853   0.525
  276    HB3  GLN 542           HB1      GLN 542  10.584  11.477  -0.777
  277    HG2  GLN 542           HG2      GLN 542  10.366  13.855  -1.277
  278    HG3  GLN 542           HG1      GLN 542  11.483  14.231   0.034
  279   HE21  GLN 542          HE21      GLN 542  11.724  14.815  -2.794
  280   HE22  GLN 542          HE22      GLN 542  13.183  14.042  -3.323
  281    H    SER 543           HN       SER 543   8.634  14.560   0.304
  282    HA   SER 543           HA       SER 543   6.315  13.279  -0.986
  283    HG   SER 543           HG       SER 543   4.704  14.716   1.682
  284    HB2  SER 543           HB2      SER 543   6.443  15.911   0.497
  285    HB3  SER 543           HB1      SER 543   5.036  15.342  -0.404
  286    H    ALA 544           HN       ALA 544   8.566  15.998  -1.100
  287    HA   ALA 544           HA       ALA 544   8.647  15.906  -3.955
  288    HB1  ALA 544           HB1      ALA 544   7.813  18.145  -4.410
  289    HB2  ALA 544           HB2      ALA 544   7.428  18.369  -2.705
  290    HB3  ALA 544           HB3      ALA 544   6.552  17.168  -3.653
  Start of MODEL    6
    1    H    SER 503           HN       SER 503  -8.601  -2.959  -1.698
    2    HA   SER 503           HA       SER 503  -8.731  -2.940   1.214
    3    HG   SER 503           HG       SER 503 -10.012  -5.205  -1.265
    4    HB2  SER 503           HB2      SER 503  -8.143  -5.506   0.774
    5    HB3  SER 503           HB1      SER 503  -9.806  -4.943   0.839
    6    H    CYS 504           HN       CYS 504  -6.777  -5.140  -0.592
    7    HA   CYS 504           HA       CYS 504  -4.372  -3.610  -0.043
    8    HB2  CYS 504           HB2      CYS 504  -4.230  -6.064   0.145
    9    HB3  CYS 504           HB1      CYS 504  -4.723  -6.232  -1.539
   10    H    VAL 505           HN       VAL 505  -3.085  -2.678  -1.652
   11    HA   VAL 505           HA       VAL 505  -4.556  -1.925  -4.035
   12    HB   VAL 505           HB       VAL 505  -1.805  -0.991  -3.117
   13   HG11  VAL 505          HG11      VAL 505  -2.136   0.869  -4.658
   14   HG12  VAL 505          HG12      VAL 505  -3.682   0.198  -5.171
   15   HG13  VAL 505          HG13      VAL 505  -2.187  -0.663  -5.537
   16   HG21  VAL 505          HG21      VAL 505  -4.518   0.285  -2.800
   17   HG22  VAL 505          HG22      VAL 505  -2.976   1.019  -2.360
   18   HG23  VAL 505          HG23      VAL 505  -3.540  -0.421  -1.511
   19    H    ASN 506           HN       ASN 506  -3.044  -4.616  -3.304
   20    HA   ASN 506           HA       ASN 506  -2.284  -5.051  -6.092
   21    HB2  ASN 506           HB2      ASN 506  -0.187  -4.565  -4.929
   22    HB3  ASN 506           HB1      ASN 506  -0.506  -5.865  -3.784
   23   HD21  ASN 506          HD21      ASN 506   1.417  -6.893  -4.367
   24   HD22  ASN 506          HD22      ASN 506   1.592  -7.736  -5.862
   25    H    CYS 507           HN       CYS 507  -3.459  -6.453  -3.044
   26    HA   CYS 507           HA       CYS 507  -4.183  -8.819  -4.597
   27    HB2  CYS 507           HB2      CYS 507  -3.331  -9.694  -1.983
   28    HB3  CYS 507           HB1      CYS 507  -2.904 -10.316  -3.574
   29    H    GLY 508           HN       GLY 508  -4.301  -8.806  -1.084
   30    HA2  GLY 508           HA2      GLY 508  -7.194  -9.279  -1.444
   31    HA3  GLY 508           HA1      GLY 508  -6.170 -10.207  -0.364
   32    H    ARG 509           HN       ARG 509  -5.785  -9.524   1.628
   33    HA   ARG 509           HA       ARG 509  -7.658  -8.420   3.153
   34    HE   ARG 509           HE       ARG 509  -3.982  -9.827   2.720
   35    HB2  ARG 509           HB2      ARG 509  -4.680  -8.369   3.546
   36    HB3  ARG 509           HB1      ARG 509  -5.762  -7.723   4.764
   37    HG2  ARG 509           HG2      ARG 509  -5.122  -9.956   5.356
   38    HG3  ARG 509           HG1      ARG 509  -6.833  -9.940   4.939
   39    HD2  ARG 509           HD2      ARG 509  -5.548 -11.880   4.034
   40    HD3  ARG 509           HD1      ARG 509  -6.413 -10.936   2.827
   41   HH11  ARG 509          HH11      ARG 509  -4.930 -13.197   2.816
   42   HH12  ARG 509          HH12      ARG 509  -3.635 -13.716   1.778
   43   HH21  ARG 509          HH21      ARG 509  -2.307 -10.503   1.312
   44   HH22  ARG 509          HH22      ARG 509  -2.154 -12.197   0.922
   45    H    GLU 510           HN       GLU 510  -8.034  -6.530   4.271
   46    HA   GLU 510           HA       GLU 510  -8.108  -4.218   2.642
   47    HB2  GLU 510           HB2      GLU 510  -9.228  -3.202   4.598
   48    HB3  GLU 510           HB1      GLU 510  -9.910  -4.759   4.145
   49    HG2  GLU 510           HG2      GLU 510  -8.471  -5.789   5.933
   50    HG3  GLU 510           HG1      GLU 510  -8.095  -4.151   6.462
   51    H    ALA 511           HN       ALA 511  -5.401  -5.135   3.536
   52    HA   ALA 511           HA       ALA 511  -3.392  -4.286   4.135
   53    HB1  ALA 511           HB1      ALA 511  -4.809  -1.630   4.297
   54    HB2  ALA 511           HB2      ALA 511  -4.035  -2.302   2.861
   55    HB3  ALA 511           HB3      ALA 511  -3.063  -1.881   4.273
   56    H    MET 512           HN       MET 512  -2.465  -4.723   6.002
   57    HA   MET 512           HA       MET 512  -4.022  -4.429   8.441
   58    HB2  MET 512           HB2      MET 512  -1.315  -5.696   7.952
   59    HB3  MET 512           HB1      MET 512  -2.171  -5.711   9.488
   60    HG2  MET 512           HG2      MET 512  -3.989  -6.983   8.459
   61    HG3  MET 512           HG1      MET 512  -3.123  -6.976   6.925
   62    HE1  MET 512           HE1      MET 512  -1.678  -9.161  10.728
   63    HE2  MET 512           HE2      MET 512  -3.262  -8.398  10.587
   64    HE3  MET 512           HE3      MET 512  -1.804  -7.407  10.594
   65    H    SER 513           HN       SER 513  -0.665  -3.747   7.507
   66    HA   SER 513           HA       SER 513  -0.917  -1.201   8.937
   67    HG   SER 513           HG       SER 513   1.949  -3.094   7.624
   68    HB2  SER 513           HB2      SER 513   1.640  -1.318   8.977
   69    HB3  SER 513           HB1      SER 513   0.754  -2.353  10.102
   70    H    GLU 514           HN       GLU 514   0.113   0.599   8.036
   71    HA   GLU 514           HA       GLU 514   0.233   0.557   5.138
   72    HB2  GLU 514           HB2      GLU 514   0.381   2.825   7.122
   73    HB3  GLU 514           HB1      GLU 514   0.331   3.010   5.372
   74    HG2  GLU 514           HG2      GLU 514  -1.862   2.194   5.249
   75    HG3  GLU 514           HG1      GLU 514  -1.817   1.585   6.899
   76    H    CYS 515           HN       CYS 515   2.002   1.370   3.985
   77    HA   CYS 515           HA       CYS 515   4.399   0.247   4.298
   78    HB2  CYS 515           HB2      CYS 515   3.710   1.461   2.317
   79    HB3  CYS 515           HB1      CYS 515   3.823   2.989   3.172
   80    H    THR 516           HN       THR 516   5.708   0.180   5.988
   81    HA   THR 516           HA       THR 516   5.506   1.679   8.255
   82    HB   THR 516           HB       THR 516   7.841   0.843   8.795
   83    HG1  THR 516           HG1      THR 516   8.855  -0.407   7.293
   84   HG21  THR 516          HG21      THR 516   5.840  -0.372   9.462
   85   HG22  THR 516          HG22      THR 516   7.086  -1.504   8.939
   86   HG23  THR 516          HG23      THR 516   5.736  -1.124   7.870
   87    H    GLY 517           HN       GLY 517   7.477   2.519   5.476
   88    HA2  GLY 517           HA2      GLY 517   9.110   4.391   6.921
   89    HA3  GLY 517           HA1      GLY 517   9.059   4.180   5.179
   90    H    CYS 518           HN       CYS 518   5.911   4.591   5.939
   91    HA   CYS 518           HA       CYS 518   5.907   7.477   6.155
   92    HB2  CYS 518           HB2      CYS 518   4.986   7.899   3.962
   93    HB3  CYS 518           HB1      CYS 518   6.541   7.088   3.795
   94    H    HIS 519           HN       HIS 519   4.099   4.647   5.150
   95    HA   HIS 519           HA       HIS 519   2.036   3.849   5.477
   96    HD1  HIS 519           HD1      HIS 519   0.981   3.466   9.586
   97    HD2  HIS 519           HD2      HIS 519   4.502   4.263   7.553
   98    HE1  HIS 519           HE1      HIS 519   2.806   2.358  10.919
   99    HE2  HIS 519           HE2      HIS 519   4.946   3.086   9.823
  100    HB2  HIS 519           HB2      HIS 519   1.622   5.979   7.595
  101    HB3  HIS 519           HB1      HIS 519   0.633   4.554   7.326
  102    H    LYS 520           HN       LYS 520   2.714   5.812   3.541
  103    HA   LYS 520           HA       LYS 520   0.206   7.291   3.178
  104    HB2  LYS 520           HB2      LYS 520   2.886   7.433   1.825
  105    HB3  LYS 520           HB1      LYS 520   1.467   8.206   1.131
  106    HG2  LYS 520           HG2      LYS 520   1.191   9.545   3.138
  107    HG3  LYS 520           HG1      LYS 520   2.582   8.748   3.874
  108    HD2  LYS 520           HD2      LYS 520   4.063   9.683   2.243
  109    HD3  LYS 520           HD1      LYS 520   2.708  10.308   1.300
  110    HE2  LYS 520           HE2      LYS 520   3.773  12.083   2.588
  111    HE3  LYS 520           HE1      LYS 520   2.121  11.810   3.134
  112    HZ1  LYS 520           HZ1      LYS 520   3.046  10.450   4.959
  113    HZ2  LYS 520           HZ2      LYS 520   3.528  12.073   5.025
  114    HZ3  LYS 520           HZ3      LYS 520   4.606  10.893   4.465
  115    H    VAL 521           HN       VAL 521   1.306   4.285   2.485
  116    HA   VAL 521           HA       VAL 521  -0.732   3.949   0.414
  117    HB   VAL 521           HB       VAL 521   0.669   2.293  -0.789
  118   HG11  VAL 521          HG11      VAL 521   2.074   3.885  -2.009
  119   HG12  VAL 521          HG12      VAL 521   1.867   5.061  -0.713
  120   HG13  VAL 521          HG13      VAL 521   0.478   4.557  -1.674
  121   HG21  VAL 521          HG21      VAL 521   2.231   1.753   0.993
  122   HG22  VAL 521          HG22      VAL 521   2.917   3.374   0.901
  123   HG23  VAL 521          HG23      VAL 521   3.092   2.265  -0.460
  124    H    ASN 522           HN       ASN 522  -1.247   1.505   0.284
  125    HA   ASN 522           HA       ASN 522  -0.691   0.122   2.743
  126    HB2  ASN 522           HB2      ASN 522  -3.194  -0.109   3.250
  127    HB3  ASN 522           HB1      ASN 522  -2.399   1.393   3.689
  128   HD21  ASN 522          HD21      ASN 522  -4.335   2.498   3.726
  129   HD22  ASN 522          HD22      ASN 522  -5.189   2.932   2.289
  130    H    TYR 523           HN       TYR 523  -0.390  -1.859   2.290
  131    HA   TYR 523           HA       TYR 523  -2.051  -3.142   0.233
  132    HD1  TYR 523           HD1      TYR 523   0.753  -0.997   0.162
  133    HD2  TYR 523           HD2      TYR 523   0.052  -4.241  -2.503
  134    HE1  TYR 523           HE1      TYR 523   1.252   0.468  -1.752
  135    HE2  TYR 523           HE2      TYR 523   0.555  -2.786  -4.414
  136    HH   TYR 523           HH       TYR 523   1.900   0.380  -4.022
  137    HB2  TYR 523           HB2      TYR 523   0.886  -3.585   0.827
  138    HB3  TYR 523           HB1      TYR 523  -0.073  -4.625  -0.215
  139    H    CYS 524           HN       CYS 524  -2.402  -5.466   0.615
  140    HA   CYS 524           HA       CYS 524  -3.462  -5.909   3.112
  141    HB2  CYS 524           HB2      CYS 524  -3.763  -8.207   2.513
  142    HB3  CYS 524           HB1      CYS 524  -4.054  -7.209   1.099
  143    H    SER 525           HN       SER 525  -0.363  -7.014   1.885
  144    HA   SER 525           HA       SER 525   0.480  -7.549   4.648
  145    HG   SER 525           HG       SER 525  -0.949  -9.346   2.785
  146    HB2  SER 525           HB2      SER 525   1.356  -9.211   2.288
  147    HB3  SER 525           HB1      SER 525   1.604  -9.548   4.001
  148    H    THR 526           HN       THR 526   3.052  -7.977   4.510
  149    HA   THR 526           HA       THR 526   4.172  -5.473   3.797
  150    HB   THR 526           HB       THR 526   5.653  -8.012   4.502
  151    HG1  THR 526           HG1      THR 526   4.926  -5.987   6.346
  152   HG21  THR 526          HG21      THR 526   6.398  -5.102   4.859
  153   HG22  THR 526          HG22      THR 526   7.047  -6.177   3.621
  154   HG23  THR 526          HG23      THR 526   7.378  -6.494   5.323
  155    H    PHE 527           HN       PHE 527   4.192  -8.664   2.254
  156    HA   PHE 527           HA       PHE 527   6.452  -8.266   0.679
  157    HD1  PHE 527           HD2      PHE 527   3.321  -9.671  -1.741
  158    HD2  PHE 527           HD1      PHE 527   3.840 -11.215   2.192
  159    HE1  PHE 527           HE2      PHE 527   0.981 -10.419  -1.727
  160    HE2  PHE 527           HE1      PHE 527   1.490 -11.964   2.214
  161    HZ   PHE 527           HZ       PHE 527   0.101 -11.683   0.259
  162    HB2  PHE 527           HB2      PHE 527   5.576 -10.116  -0.772
  163    HB3  PHE 527           HB1      PHE 527   5.727 -10.495   0.940
  164    H    CYS 528           HN       CYS 528   3.039  -7.660  -0.218
  165    HA   CYS 528           HA       CYS 528   3.687  -7.008  -2.883
  166    HB2  CYS 528           HB2      CYS 528   1.310  -5.931  -2.568
  167    HB3  CYS 528           HB1      CYS 528   1.513  -7.671  -2.661
  168    H    GLN 529           HN       GLN 529   3.345  -5.227   0.083
  169    HA   GLN 529           HA       GLN 529   3.174  -2.633  -1.045
  170    HB2  GLN 529           HB2      GLN 529   2.530  -3.417   1.308
  171    HB3  GLN 529           HB1      GLN 529   4.243  -3.324   1.692
  172    HG2  GLN 529           HG2      GLN 529   4.270  -1.049   1.647
  173    HG3  GLN 529           HG1      GLN 529   2.944  -0.940   0.490
  174   HE21  GLN 529          HE21      GLN 529   2.794  -2.941   3.336
  175   HE22  GLN 529          HE22      GLN 529   1.629  -1.993   4.190
  176    H    ARG 530           HN       ARG 530   5.771  -4.691   0.077
  177    HA   ARG 530           HA       ARG 530   7.809  -2.743  -0.458
  178    HE   ARG 530           HE       ARG 530   8.956  -2.149   3.714
  179    HB2  ARG 530           HB2      ARG 530   7.898  -5.624   0.375
  180    HB3  ARG 530           HB1      ARG 530   9.357  -4.736  -0.059
  181    HG2  ARG 530           HG2      ARG 530   7.415  -4.050   2.141
  182    HG3  ARG 530           HG1      ARG 530   9.070  -4.643   2.324
  183    HD2  ARG 530           HD2      ARG 530  10.001  -2.647   1.568
  184    HD3  ARG 530           HD1      ARG 530   8.506  -2.131   0.793
  185   HH11  ARG 530          HH11      ARG 530   7.383  -0.868   0.854
  186   HH12  ARG 530          HH12      ARG 530   6.691   0.492   1.688
  187   HH21  ARG 530          HH21      ARG 530   8.056  -0.324   4.800
  188   HH22  ARG 530          HH22      ARG 530   7.071   0.794   3.899
  189    H    LYS 531           HN       LYS 531   6.419  -5.446  -2.243
  190    HA   LYS 531           HA       LYS 531   8.501  -5.542  -4.194
  191    HB2  LYS 531           HB2      LYS 531   5.687  -6.607  -4.138
  192    HB3  LYS 531           HB1      LYS 531   6.713  -6.777  -5.554
  193    HG2  LYS 531           HG2      LYS 531   7.430  -7.790  -2.813
  194    HG3  LYS 531           HG1      LYS 531   6.677  -8.766  -4.075
  195    HD2  LYS 531           HD2      LYS 531   8.622  -8.211  -5.549
  196    HD3  LYS 531           HD1      LYS 531   9.384  -7.445  -4.156
  197    HE2  LYS 531           HE2      LYS 531   8.473 -10.314  -4.206
  198    HE3  LYS 531           HE1      LYS 531  10.111  -9.799  -4.602
  199    HZ1  LYS 531           HZ1      LYS 531   8.826  -9.145  -2.013
  200    HZ2  LYS 531           HZ2      LYS 531  10.467  -9.051  -2.422
  201    HZ3  LYS 531           HZ3      LYS 531   9.721 -10.563  -2.255
  202    H    ASP 532           HN       ASP 532   5.320  -4.014  -4.098
  203    HA   ASP 532           HA       ASP 532   5.560  -3.002  -6.788
  204    HB2  ASP 532           HB2      ASP 532   3.532  -2.843  -4.606
  205    HB3  ASP 532           HB1      ASP 532   3.378  -1.795  -6.010
  206    H    TRP 533           HN       TRP 533   6.739  -1.976  -3.843
  207    HA   TRP 533           HA       TRP 533   6.266   0.830  -4.105
  208    HD1  TRP 533           HD1      TRP 533   9.521  -1.591  -3.566
  209    HE1  TRP 533           HE1      TRP 533  11.867  -1.120  -2.561
  210    HE3  TRP 533           HE3      TRP 533   8.234   1.980  -0.165
  211    HZ2  TRP 533           HZ2      TRP 533  12.968   0.566  -0.591
  212    HZ3  TRP 533           HZ3      TRP 533   9.980   2.961   1.255
  213    HH2  TRP 533           HH2      TRP 533  12.307   2.252   1.053
  214    HB2  TRP 533           HB2      TRP 533   7.064   0.954  -1.996
  215    HB3  TRP 533           HB1      TRP 533   6.934  -0.802  -2.033
  216    H    LYS 534           HN       LYS 534   8.033  -0.998  -6.061
  217    HA   LYS 534           HA       LYS 534  10.596   0.037  -6.194
  218    HB2  LYS 534           HB2      LYS 534   8.835  -0.692  -8.549
  219    HB3  LYS 534           HB1      LYS 534  10.589  -0.586  -8.564
  220    HG2  LYS 534           HG2      LYS 534   9.165  -2.484  -6.735
  221    HG3  LYS 534           HG1      LYS 534   9.493  -2.897  -8.415
  222    HD2  LYS 534           HD2      LYS 534  11.263  -3.806  -7.125
  223    HD3  LYS 534           HD1      LYS 534  11.912  -2.401  -7.966
  224    HE2  LYS 534           HE2      LYS 534  11.751  -1.071  -5.955
  225    HE3  LYS 534           HE1      LYS 534  10.958  -2.398  -5.103
  226    HZ1  LYS 534           HZ1      LYS 534  12.973  -3.708  -5.333
  227    HZ2  LYS 534           HZ2      LYS 534  13.305  -2.247  -4.540
  228    HZ3  LYS 534           HZ3      LYS 534  13.735  -2.445  -6.169
  229    H    ASP 535           HN       ASP 535   7.585   1.503  -7.247
  230    HA   ASP 535           HA       ASP 535   8.992   3.809  -8.362
  231    HB2  ASP 535           HB2      ASP 535   7.050   3.054  -9.603
  232    HB3  ASP 535           HB1      ASP 535   6.043   3.143  -8.163
  233    H    HIS 536           HN       HIS 536   7.576   2.747  -5.460
  234    HA   HIS 536           HA       HIS 536   6.856   5.382  -4.502
  235    HD1  HIS 536           HD1      HIS 536   4.363   5.525  -2.438
  236    HD2  HIS 536           HD2      HIS 536   7.440   3.240  -0.798
  237    HE1  HIS 536           HE1      HIS 536   4.586   6.229   0.004
  238    HB2  HIS 536           HB2      HIS 536   5.290   3.646  -3.996
  239    HB3  HIS 536           HB1      HIS 536   6.558   2.605  -3.345
  240    H    GLN 537           HN       GLN 537   9.455   3.111  -4.133
  241    HA   GLN 537           HA       GLN 537  10.589   3.872  -1.703
  242    HB2  GLN 537           HB2      GLN 537  12.798   3.218  -2.765
  243    HB3  GLN 537           HB1      GLN 537  11.533   1.993  -2.759
  244    HG2  GLN 537           HG2      GLN 537  11.015   2.601  -5.103
  245    HG3  GLN 537           HG1      GLN 537  12.394   3.698  -5.079
  246   HE21  GLN 537          HE21      GLN 537  13.989   1.933  -3.403
  247   HE22  GLN 537          HE22      GLN 537  14.509   0.641  -4.424
  248    H    HIS 538           HN       HIS 538  10.364   5.552  -4.642
  249    HA   HIS 538           HA       HIS 538  12.511   7.396  -4.261
  250    HD2  HIS 538           HD2      HIS 538  10.416   4.738  -6.509
  251    HE1  HIS 538           HE1      HIS 538  13.790   5.432  -8.985
  252    HE2  HIS 538           HE2      HIS 538  12.124   3.701  -8.174
  253    HB2  HIS 538           HB2      HIS 538  10.092   7.618  -6.062
  254    HB3  HIS 538           HB1      HIS 538  11.602   8.507  -6.215
  255    H    ILE 539           HN       ILE 539   9.382   7.130  -2.902
  256    HA   ILE 539           HA       ILE 539   9.339  10.019  -2.333
  257    HB   ILE 539           HB       ILE 539   7.567   9.569  -3.918
  258   HG12  ILE 539          HG12      ILE 539   6.297   9.839  -1.190
  259   HG13  ILE 539          HG11      ILE 539   7.144  11.153  -2.005
  260   HG21  ILE 539          HG21      ILE 539   5.736   8.029  -3.443
  261   HG22  ILE 539          HG22      ILE 539   6.553   7.510  -1.969
  262   HG23  ILE 539          HG23      ILE 539   7.283   7.188  -3.542
  263   HD11  ILE 539          HD11      ILE 539   5.528  11.079  -3.821
  264   HD12  ILE 539          HD12      ILE 539   4.726  11.320  -2.269
  265   HD13  ILE 539          HD13      ILE 539   4.696   9.734  -3.040
  266    H    CYS 540           HN       CYS 540   9.516   6.906  -1.067
  267    HA   CYS 540           HA       CYS 540   8.085   7.362   1.345
  268    HB2  CYS 540           HB2      CYS 540   8.991   5.086   0.306
  269    HB3  CYS 540           HB1      CYS 540  10.378   5.456   1.327
  270    H    GLY 541           HN       GLY 541   8.749   8.064   3.241
  271    HA2  GLY 541           HA2      GLY 541  10.260   8.831   4.891
  272    HA3  GLY 541           HA1      GLY 541  11.521   8.880   3.667
  273    H    GLN 542           HN       GLN 542   9.076  10.239   2.124
  274    HA   GLN 542           HA       GLN 542   9.967  12.929   2.852
  275    HB2  GLN 542           HB2      GLN 542   8.376  12.148   0.413
  276    HB3  GLN 542           HB1      GLN 542   9.307  13.618   0.669
  277    HG2  GLN 542           HG2      GLN 542  11.368  12.241   0.703
  278    HG3  GLN 542           HG1      GLN 542  10.384  10.835   0.298
  279   HE21  GLN 542          HE21      GLN 542  12.550  11.978  -1.199
  280   HE22  GLN 542          HE22      GLN 542  11.908  12.447  -2.736
  281    H    SER 543           HN       SER 543   8.446  14.627   3.041
  282    HA   SER 543           HA       SER 543   6.593  15.631   3.856
  283    HG   SER 543           HG       SER 543   6.543  15.461   1.483
  284    HB2  SER 543           HB2      SER 543   5.080  13.371   2.525
  285    HB3  SER 543           HB1      SER 543   4.453  14.968   2.937
  286    H    ALA 544           HN       ALA 544   7.934  13.915   5.610
  287    HA   ALA 544           HA       ALA 544   5.698  12.909   7.243
  288    HB1  ALA 544           HB1      ALA 544   7.181  11.191   8.132
  289    HB2  ALA 544           HB2      ALA 544   8.490  11.771   7.103
  290    HB3  ALA 544           HB3      ALA 544   7.048  11.055   6.381
  Start of MODEL    7
    1    H    SER 503           HN       SER 503  -7.754  -1.243  -1.368
    2    HA   SER 503           HA       SER 503  -7.749  -1.549   1.533
    3    HG   SER 503           HG       SER 503  -9.954  -1.983   0.619
    4    HB2  SER 503           HB2      SER 503  -8.342  -3.783  -0.415
    5    HB3  SER 503           HB1      SER 503  -8.215  -3.945   1.339
    6    H    CYS 504           HN       CYS 504  -6.473  -4.236  -0.132
    7    HA   CYS 504           HA       CYS 504  -3.807  -3.146   0.007
    8    HB2  CYS 504           HB2      CYS 504  -4.146  -5.605   0.319
    9    HB3  CYS 504           HB1      CYS 504  -4.660  -5.713  -1.369
   10    H    VAL 505           HN       VAL 505  -2.995  -1.842  -1.466
   11    HA   VAL 505           HA       VAL 505  -4.318  -1.256  -3.911
   12    HB   VAL 505           HB       VAL 505  -1.464  -0.595  -3.117
   13   HG11  VAL 505          HG11      VAL 505  -3.297   0.682  -5.144
   14   HG12  VAL 505          HG12      VAL 505  -1.831  -0.241  -5.484
   15   HG13  VAL 505          HG13      VAL 505  -1.724   1.313  -4.653
   16   HG21  VAL 505          HG21      VAL 505  -2.328   1.525  -2.316
   17   HG22  VAL 505          HG22      VAL 505  -3.047   0.176  -1.438
   18   HG23  VAL 505          HG23      VAL 505  -3.974   1.009  -2.685
   19    H    ASN 506           HN       ASN 506  -2.587  -3.914  -3.013
   20    HA   ASN 506           HA       ASN 506  -1.601  -4.402  -5.742
   21    HB2  ASN 506           HB2      ASN 506   0.124  -4.378  -3.934
   22    HB3  ASN 506           HB1      ASN 506  -0.685  -5.767  -3.209
   23   HD21  ASN 506          HD21      ASN 506  -0.536  -7.780  -4.210
   24   HD22  ASN 506          HD22      ASN 506   0.616  -8.100  -5.466
   25    H    CYS 507           HN       CYS 507  -3.391  -5.906  -3.014
   26    HA   CYS 507           HA       CYS 507  -4.297  -7.946  -4.930
   27    HB2  CYS 507           HB2      CYS 507  -3.909  -9.018  -2.230
   28    HB3  CYS 507           HB1      CYS 507  -3.560  -9.738  -3.795
   29    H    GLY 508           HN       GLY 508  -4.816  -7.615  -1.406
   30    HA2  GLY 508           HA2      GLY 508  -7.707  -7.586  -1.948
   31    HA3  GLY 508           HA1      GLY 508  -6.999  -8.921  -1.059
   32    H    ARG 509           HN       ARG 509  -6.620  -8.802   0.996
   33    HA   ARG 509           HA       ARG 509  -8.236  -7.540   2.682
   34    HE   ARG 509           HE       ARG 509  -8.184 -10.154   4.674
   35    HB2  ARG 509           HB2      ARG 509  -6.663  -9.353   3.253
   36    HB3  ARG 509           HB1      ARG 509  -5.347  -8.193   3.279
   37    HG2  ARG 509           HG2      ARG 509  -6.146  -8.823   5.515
   38    HG3  ARG 509           HG1      ARG 509  -6.284  -7.094   5.195
   39    HD2  ARG 509           HD2      ARG 509  -8.257  -8.008   6.339
   40    HD3  ARG 509           HD1      ARG 509  -8.640  -7.319   4.766
   41   HH11  ARG 509          HH11      ARG 509 -10.518  -7.621   5.276
   42   HH12  ARG 509          HH12      ARG 509 -11.902  -8.630   4.973
   43   HH21  ARG 509          HH21      ARG 509  -9.985 -11.494   4.250
   44   HH22  ARG 509          HH22      ARG 509 -11.598 -10.852   4.387
   45    H    GLU 510           HN       GLU 510  -8.317  -5.735   4.016
   46    HA   GLU 510           HA       GLU 510  -7.530  -3.375   2.667
   47    HB2  GLU 510           HB2      GLU 510  -8.800  -2.165   4.290
   48    HB3  GLU 510           HB1      GLU 510  -9.678  -3.619   3.859
   49    HG2  GLU 510           HG2      GLU 510  -8.028  -3.309   6.357
   50    HG3  GLU 510           HG1      GLU 510  -9.763  -3.036   6.265
   51    H    ALA 511           HN       ALA 511  -5.379  -5.035   3.986
   52    HA   ALA 511           HA       ALA 511  -3.269  -4.622   4.700
   53    HB1  ALA 511           HB1      ALA 511  -3.359  -2.525   3.460
   54    HB2  ALA 511           HB2      ALA 511  -2.451  -2.351   4.962
   55    HB3  ALA 511           HB3      ALA 511  -4.099  -1.733   4.851
   56    H    MET 512           HN       MET 512  -2.305  -4.868   6.604
   57    HA   MET 512           HA       MET 512  -3.914  -4.479   9.001
   58    HB2  MET 512           HB2      MET 512  -1.217  -5.800   8.610
   59    HB3  MET 512           HB1      MET 512  -2.124  -5.774  10.118
   60    HG2  MET 512           HG2      MET 512  -3.897  -7.067   9.125
   61    HG3  MET 512           HG1      MET 512  -3.099  -7.011   7.555
   62    HE1  MET 512           HE1      MET 512  -3.230  -9.613   7.260
   63    HE2  MET 512           HE2      MET 512  -4.114  -9.704   8.785
   64    HE3  MET 512           HE3      MET 512  -2.736 -10.767   8.496
   65    H    SER 513           HN       SER 513  -0.662  -3.693   7.813
   66    HA   SER 513           HA       SER 513  -0.902  -1.137   9.243
   67    HG   SER 513           HG       SER 513   1.073  -3.420  10.420
   68    HB2  SER 513           HB2      SER 513   1.595  -2.666   8.484
   69    HB3  SER 513           HB1      SER 513   1.595  -1.008   9.097
   70    H    GLU 514           HN       GLU 514  -0.044   0.716   8.124
   71    HA   GLU 514           HA       GLU 514  -0.235   0.575   5.229
   72    HB2  GLU 514           HB2      GLU 514   0.268   2.883   7.113
   73    HB3  GLU 514           HB1      GLU 514   0.095   3.036   5.369
   74    HG2  GLU 514           HG2      GLU 514  -2.161   2.353   5.454
   75    HG3  GLU 514           HG1      GLU 514  -2.027   1.873   7.141
   76    H    CYS 515           HN       CYS 515   1.531   1.525   3.902
   77    HA   CYS 515           HA       CYS 515   3.852   0.148   4.022
   78    HB2  CYS 515           HB2      CYS 515   3.293   1.492   2.094
   79    HB3  CYS 515           HB1      CYS 515   3.481   2.974   3.020
   80    H    THR 516           HN       THR 516   5.401  -0.041   5.474
   81    HA   THR 516           HA       THR 516   5.257   1.436   7.856
   82    HB   THR 516           HB       THR 516   7.301   0.095   8.494
   83    HG1  THR 516           HG1      THR 516   8.258  -0.348   6.528
   84   HG21  THR 516          HG21      THR 516   5.037  -0.662   8.997
   85   HG22  THR 516          HG22      THR 516   6.056  -2.029   8.552
   86   HG23  THR 516          HG23      THR 516   4.902  -1.374   7.391
   87    H    GLY 517           HN       GLY 517   6.696   2.482   5.069
   88    HA2  GLY 517           HA2      GLY 517   8.837   3.885   6.519
   89    HA3  GLY 517           HA1      GLY 517   8.716   3.738   4.774
   90    H    CYS 518           HN       CYS 518   5.671   4.394   5.458
   91    HA   CYS 518           HA       CYS 518   5.910   7.276   5.796
   92    HB2  CYS 518           HB2      CYS 518   4.978   7.803   3.641
   93    HB3  CYS 518           HB1      CYS 518   6.458   6.878   3.429
   94    H    HIS 519           HN       HIS 519   3.923   4.494   5.083
   95    HA   HIS 519           HA       HIS 519   1.770   3.944   5.373
   96    HD1  HIS 519           HD1      HIS 519   0.881   3.693   9.571
   97    HD2  HIS 519           HD2      HIS 519   4.348   4.034   7.335
   98    HE1  HIS 519           HE1      HIS 519   2.609   2.316  10.779
   99    HE2  HIS 519           HE2      HIS 519   4.761   2.804   9.576
  100    HB2  HIS 519           HB2      HIS 519   1.668   6.071   7.532
  101    HB3  HIS 519           HB1      HIS 519   0.531   4.762   7.296
  102    H    LYS 520           HN       LYS 520   2.510   5.844   3.408
  103    HA   LYS 520           HA       LYS 520   0.206   7.621   3.213
  104    HB2  LYS 520           HB2      LYS 520   2.721   7.234   1.651
  105    HB3  LYS 520           HB1      LYS 520   1.332   7.908   0.817
  106    HG2  LYS 520           HG2      LYS 520   2.590   9.748   1.532
  107    HG3  LYS 520           HG1      LYS 520   1.243   9.641   2.661
  108    HD2  LYS 520           HD2      LYS 520   2.593   8.779   4.368
  109    HD3  LYS 520           HD1      LYS 520   3.902   8.397   3.250
  110    HE2  LYS 520           HE2      LYS 520   4.442  10.370   4.577
  111    HE3  LYS 520           HE1      LYS 520   4.284  10.782   2.871
  112    HZ1  LYS 520           HZ1      LYS 520   2.305  11.283   5.027
  113    HZ2  LYS 520           HZ2      LYS 520   1.985  11.529   3.377
  114    HZ3  LYS 520           HZ3      LYS 520   3.181  12.438   4.154
  115    H    VAL 521           HN       VAL 521   0.906   4.397   2.536
  116    HA   VAL 521           HA       VAL 521  -1.382   4.075   0.803
  117    HB   VAL 521           HB       VAL 521  -0.098   2.572  -0.743
  118   HG11  VAL 521          HG11      VAL 521   0.766   5.460  -0.767
  119   HG12  VAL 521          HG12      VAL 521  -0.719   4.812  -1.467
  120   HG13  VAL 521          HG13      VAL 521   0.847   4.351  -2.138
  121   HG21  VAL 521          HG21      VAL 521   1.853   2.192   0.679
  122   HG22  VAL 521          HG22      VAL 521   2.319   3.885   0.501
  123   HG23  VAL 521          HG23      VAL 521   2.330   2.815  -0.901
  124    H    ASN 522           HN       ASN 522  -1.803   1.608   0.657
  125    HA   ASN 522           HA       ASN 522  -0.639   0.232   2.948
  126    HB2  ASN 522           HB2      ASN 522  -2.868  -0.400   3.819
  127    HB3  ASN 522           HB1      ASN 522  -2.580   1.328   3.911
  128   HD21  ASN 522          HD21      ASN 522  -5.068  -0.214   3.893
  129   HD22  ASN 522          HD22      ASN 522  -5.996   0.408   2.577
  130    H    TYR 523           HN       TYR 523  -0.813  -1.992   2.937
  131    HA   TYR 523           HA       TYR 523  -1.890  -3.238   0.529
  132    HD1  TYR 523           HD2      TYR 523  -0.511  -3.349  -1.934
  133    HD2  TYR 523           HD1      TYR 523   1.771  -1.294   1.009
  134    HE1  TYR 523           HE2      TYR 523   0.028  -1.604  -3.577
  135    HE2  TYR 523           HE1      TYR 523   2.302   0.466  -0.626
  136    HH   TYR 523           HH       TYR 523   2.424   0.615  -3.233
  137    HB2  TYR 523           HB2      TYR 523   0.986  -3.514   1.435
  138    HB3  TYR 523           HB1      TYR 523   0.232  -4.467   0.158
  139    H    CYS 524           HN       CYS 524  -2.461  -5.397   0.788
  140    HA   CYS 524           HA       CYS 524  -3.463  -6.068   3.265
  141    HB2  CYS 524           HB2      CYS 524  -4.091  -8.153   2.361
  142    HB3  CYS 524           HB1      CYS 524  -4.143  -6.993   1.049
  143    H    SER 525           HN       SER 525  -0.473  -7.123   1.746
  144    HA   SER 525           HA       SER 525   0.430  -8.199   4.330
  145    HG   SER 525           HG       SER 525  -1.105  -9.589   2.124
  146    HB2  SER 525           HB2      SER 525   1.165  -9.364   1.641
  147    HB3  SER 525           HB1      SER 525   1.473 -10.054   3.235
  148    H    THR 526           HN       THR 526   2.996  -8.653   4.034
  149    HA   THR 526           HA       THR 526   4.140  -6.060   3.779
  150    HB   THR 526           HB       THR 526   5.458  -8.744   4.197
  151    HG1  THR 526           HG1      THR 526   4.819  -6.670   6.055
  152   HG21  THR 526          HG21      THR 526   7.054  -7.084   3.339
  153   HG22  THR 526          HG22      THR 526   7.378  -7.461   5.032
  154   HG23  THR 526          HG23      THR 526   6.563  -5.956   4.604
  155    H    PHE 527           HN       PHE 527   4.271  -8.994   1.766
  156    HA   PHE 527           HA       PHE 527   6.407  -8.208   0.153
  157    HD1  PHE 527           HD2      PHE 527   3.529  -9.342  -2.645
  158    HD2  PHE 527           HD1      PHE 527   3.556 -11.168   1.200
  159    HE1  PHE 527           HE2      PHE 527   1.184 -10.004  -2.945
  160    HE2  PHE 527           HE1      PHE 527   1.199 -11.830   0.905
  161    HZ   PHE 527           HZ       PHE 527   0.033 -11.310  -1.167
  162    HB2  PHE 527           HB2      PHE 527   5.622  -9.860  -1.489
  163    HB3  PHE 527           HB1      PHE 527   5.609 -10.505   0.148
  164    H    CYS 528           HN       CYS 528   2.975  -7.439  -0.140
  165    HA   CYS 528           HA       CYS 528   2.988  -6.335  -2.709
  166    HB2  CYS 528           HB2      CYS 528   1.327  -5.021  -0.653
  167    HB3  CYS 528           HB1      CYS 528   0.866  -5.712  -2.209
  168    H    GLN 529           HN       GLN 529   3.732  -4.958   0.436
  169    HA   GLN 529           HA       GLN 529   3.878  -2.244  -0.332
  170    HB2  GLN 529           HB2      GLN 529   3.682  -2.986   2.018
  171    HB3  GLN 529           HB1      GLN 529   5.288  -3.694   1.928
  172    HG2  GLN 529           HG2      GLN 529   6.104  -1.349   1.355
  173    HG3  GLN 529           HG1      GLN 529   4.520  -0.799   1.897
  174   HE21  GLN 529          HE21      GLN 529   7.131  -0.236   3.009
  175   HE22  GLN 529          HE22      GLN 529   7.117  -0.809   4.643
  176    H    ARG 530           HN       ARG 530   6.180  -4.881  -0.172
  177    HA   ARG 530           HA       ARG 530   8.481  -3.261  -0.724
  178    HE   ARG 530           HE       ARG 530  11.100  -4.474   0.119
  179    HB2  ARG 530           HB2      ARG 530   8.117  -6.257  -0.756
  180    HB3  ARG 530           HB1      ARG 530   9.663  -5.439  -0.942
  181    HG2  ARG 530           HG2      ARG 530   7.872  -5.401   1.479
  182    HG3  ARG 530           HG1      ARG 530   9.435  -6.204   1.321
  183    HD2  ARG 530           HD2      ARG 530   8.934  -3.230   1.227
  184    HD3  ARG 530           HD1      ARG 530   9.646  -4.121   2.569
  185   HH11  ARG 530          HH11      ARG 530  10.666  -2.397   2.915
  186   HH12  ARG 530          HH12      ARG 530  12.214  -1.616   2.737
  187   HH21  ARG 530          HH21      ARG 530  13.150  -3.473  -0.097
  188   HH22  ARG 530          HH22      ARG 530  13.633  -2.238   1.028
  189    H    LYS 531           HN       LYS 531   6.522  -5.526  -2.641
  190    HA   LYS 531           HA       LYS 531   8.036  -5.534  -4.981
  191    HB2  LYS 531           HB2      LYS 531   5.066  -5.826  -4.550
  192    HB3  LYS 531           HB1      LYS 531   5.818  -6.032  -6.123
  193    HG2  LYS 531           HG2      LYS 531   7.097  -7.898  -5.327
  194    HG3  LYS 531           HG1      LYS 531   6.527  -7.638  -3.680
  195    HD2  LYS 531           HD2      LYS 531   5.341  -9.488  -4.758
  196    HD3  LYS 531           HD1      LYS 531   4.248  -8.161  -4.370
  197    HE2  LYS 531           HE2      LYS 531   5.475  -8.203  -7.075
  198    HE3  LYS 531           HE1      LYS 531   4.224  -9.393  -6.726
  199    HZ1  LYS 531           HZ1      LYS 531   3.954  -6.437  -6.532
  200    HZ2  LYS 531           HZ2      LYS 531   2.768  -7.546  -6.055
  201    HZ3  LYS 531           HZ3      LYS 531   3.224  -7.454  -7.677
  202    H    ASP 532           HN       ASP 532   5.288  -3.475  -4.136
  203    HA   ASP 532           HA       ASP 532   5.260  -1.901  -6.473
  204    HB2  ASP 532           HB2      ASP 532   3.403  -2.014  -4.867
  205    HB3  ASP 532           HB1      ASP 532   4.428  -1.214  -3.666
  206    H    TRP 533           HN       TRP 533   7.159  -1.742  -3.545
  207    HA   TRP 533           HA       TRP 533   7.455   1.056  -3.572
  208    HD1  TRP 533           HD1      TRP 533  10.676  -1.580  -2.840
  209    HE1  TRP 533           HE1      TRP 533  12.891  -0.598  -1.914
  210    HE3  TRP 533           HE3      TRP 533   8.738   2.220  -0.064
  211    HZ2  TRP 533           HZ2      TRP 533  13.649   1.514  -0.217
  212    HZ3  TRP 533           HZ3      TRP 533  10.269   3.659   1.209
  213    HH2  TRP 533           HH2      TRP 533  12.684   3.306   1.143
  214    HB2  TRP 533           HB2      TRP 533   7.778   0.483  -1.435
  215    HB3  TRP 533           HB1      TRP 533   8.097  -1.196  -1.863
  216    H    LYS 534           HN       LYS 534   8.934  -1.328  -5.454
  217    HA   LYS 534           HA       LYS 534  11.531  -0.254  -5.679
  218    HB2  LYS 534           HB2      LYS 534   9.916  -1.510  -7.918
  219    HB3  LYS 534           HB1      LYS 534  11.670  -1.408  -7.806
  220    HG2  LYS 534           HG2      LYS 534   9.840  -3.029  -6.052
  221    HG3  LYS 534           HG1      LYS 534  10.972  -3.636  -7.262
  222    HD2  LYS 534           HD2      LYS 534  12.846  -2.995  -5.975
  223    HD3  LYS 534           HD1      LYS 534  11.864  -1.998  -4.899
  224    HE2  LYS 534           HE2      LYS 534  12.496  -4.071  -3.802
  225    HE3  LYS 534           HE1      LYS 534  10.751  -4.014  -4.062
  226    HZ1  LYS 534           HZ1      LYS 534  12.733  -5.515  -5.694
  227    HZ2  LYS 534           HZ2      LYS 534  11.079  -5.406  -6.049
  228    HZ3  LYS 534           HZ3      LYS 534  11.590  -6.180  -4.632
  229    H    ASP 535           HN       ASP 535   8.447   0.719  -6.891
  230    HA   ASP 535           HA       ASP 535   9.601   3.025  -8.282
  231    HB2  ASP 535           HB2      ASP 535   6.781   1.923  -8.108
  232    HB3  ASP 535           HB1      ASP 535   7.178   3.457  -8.886
  233    H    HIS 536           HN       HIS 536   7.465   2.109  -5.666
  234    HA   HIS 536           HA       HIS 536   6.691   4.658  -4.829
  235    HD1  HIS 536           HD1      HIS 536   4.080   4.499  -2.790
  236    HD2  HIS 536           HD2      HIS 536   7.535   3.142  -0.906
  237    HE1  HIS 536           HE1      HIS 536   4.081   5.485  -0.439
  238    HB2  HIS 536           HB2      HIS 536   5.428   2.749  -4.153
  239    HB3  HIS 536           HB1      HIS 536   6.832   2.026  -3.364
  240    H    GLN 537           HN       GLN 537   9.623   2.858  -4.031
  241    HA   GLN 537           HA       GLN 537  10.562   4.044  -1.768
  242    HB2  GLN 537           HB2      GLN 537  12.829   3.673  -2.608
  243    HB3  GLN 537           HB1      GLN 537  11.775   2.299  -2.923
  244    HG2  GLN 537           HG2      GLN 537  11.503   3.110  -5.247
  245    HG3  GLN 537           HG1      GLN 537  12.686   4.374  -4.904
  246   HE21  GLN 537          HE21      GLN 537  12.875   1.170  -3.560
  247   HE22  GLN 537          HE22      GLN 537  14.267   0.654  -4.452
  248    H    HIS 538           HN       HIS 538  10.241   5.523  -4.891
  249    HA   HIS 538           HA       HIS 538  11.997   7.711  -4.385
  250    HD2  HIS 538           HD2      HIS 538  10.759   4.796  -7.043
  251    HE1  HIS 538           HE1      HIS 538  14.400   6.241  -8.651
  252    HE2  HIS 538           HE2      HIS 538  12.799   4.278  -8.574
  253    HB2  HIS 538           HB2      HIS 538   9.804   7.401  -6.448
  254    HB3  HIS 538           HB1      HIS 538  11.034   8.662  -6.446
  255    H    ILE 539           HN       ILE 539   8.827   6.977  -3.336
  256    HA   ILE 539           HA       ILE 539   8.362   9.831  -2.756
  257    HB   ILE 539           HB       ILE 539   5.978   9.532  -2.923
  258   HG12  ILE 539          HG12      ILE 539   6.542   6.666  -3.717
  259   HG13  ILE 539          HG11      ILE 539   5.884   7.173  -2.163
  260   HG21  ILE 539          HG21      ILE 539   7.177  10.105  -4.959
  261   HG22  ILE 539          HG22      ILE 539   5.767   9.112  -5.321
  262   HG23  ILE 539          HG23      ILE 539   7.376   8.394  -5.336
  263   HD11  ILE 539          HD11      ILE 539   3.910   8.058  -3.278
  264   HD12  ILE 539          HD12      ILE 539   4.142   6.350  -3.648
  265   HD13  ILE 539          HD13      ILE 539   4.570   7.578  -4.841
  266    H    CYS 540           HN       CYS 540   9.012   6.854  -1.401
  267    HA   CYS 540           HA       CYS 540   7.416   7.112   0.960
  268    HB2  CYS 540           HB2      CYS 540   8.705   4.998  -0.010
  269    HB3  CYS 540           HB1      CYS 540   9.996   5.613   1.007
  270    H    GLY 541           HN       GLY 541   7.736   8.517   2.514
  271    HA2  GLY 541           HA2      GLY 541   8.837   9.863   4.050
  272    HA3  GLY 541           HA1      GLY 541  10.365   9.242   3.436
  273    H    GLN 542           HN       GLN 542   8.125  10.439   1.166
  274    HA   GLN 542           HA       GLN 542   9.769  12.301  -0.027
  275    HB2  GLN 542           HB2      GLN 542   7.782  11.389  -1.087
  276    HB3  GLN 542           HB1      GLN 542   6.748  12.186   0.087
  277    HG2  GLN 542           HG2      GLN 542   7.379  14.352  -0.786
  278    HG3  GLN 542           HG1      GLN 542   8.498  13.589  -1.917
  279   HE21  GLN 542          HE21      GLN 542   5.431  12.155  -1.149
  280   HE22  GLN 542          HE22      GLN 542   4.679  12.439  -2.683
  281    H    SER 543           HN       SER 543  10.692  13.974   0.935
  282    HA   SER 543           HA       SER 543   9.045  15.921   2.334
  283    HG   SER 543           HG       SER 543  11.201  13.286   3.263
  284    HB2  SER 543           HB2      SER 543  10.848  15.955   4.186
  285    HB3  SER 543           HB1      SER 543   9.667  14.642   4.211
  286    H    ALA 544           HN       ALA 544   9.906  18.002   2.334
  287    HA   ALA 544           HA       ALA 544  12.297  18.350   0.655
  288    HB1  ALA 544           HB1      ALA 544  10.020  20.266   1.156
  289    HB2  ALA 544           HB2      ALA 544  10.266  19.305  -0.302
  290    HB3  ALA 544           HB3      ALA 544  11.417  20.572   0.124
  Start of MODEL    8
    1    H    SER 503           HN       SER 503  -8.519  -1.232  -1.297
    2    HA   SER 503           HA       SER 503  -7.913  -2.076   1.432
    3    HG   SER 503           HG       SER 503  -8.613  -4.886  -1.417
    4    HB2  SER 503           HB2      SER 503  -7.749  -4.438   0.519
    5    HB3  SER 503           HB1      SER 503  -9.382  -3.786   0.627
    6    H    CYS 504           HN       CYS 504  -6.155  -4.198   0.107
    7    HA   CYS 504           HA       CYS 504  -3.741  -2.859  -0.051
    8    HB2  CYS 504           HB2      CYS 504  -4.026  -5.368   0.028
    9    HB3  CYS 504           HB1      CYS 504  -4.451  -5.316  -1.681
   10    H    VAL 505           HN       VAL 505  -2.772  -1.643  -1.553
   11    HA   VAL 505           HA       VAL 505  -4.280  -0.790  -3.851
   12    HB   VAL 505           HB       VAL 505  -1.413  -0.067  -3.182
   13   HG11  VAL 505          HG11      VAL 505  -2.127   0.587  -5.414
   14   HG12  VAL 505          HG12      VAL 505  -1.936   2.009  -4.388
   15   HG13  VAL 505          HG13      VAL 505  -3.548   1.387  -4.744
   16   HG21  VAL 505          HG21      VAL 505  -2.320   1.873  -1.985
   17   HG22  VAL 505          HG22      VAL 505  -2.788   0.350  -1.226
   18   HG23  VAL 505          HG23      VAL 505  -3.950   1.237  -2.209
   19    H    ASN 506           HN       ASN 506  -3.270  -3.598  -3.558
   20    HA   ASN 506           HA       ASN 506  -2.131  -3.847  -6.209
   21    HB2  ASN 506           HB2      ASN 506  -0.131  -3.563  -4.879
   22    HB3  ASN 506           HB1      ASN 506  -0.622  -4.853  -3.787
   23   HD21  ASN 506          HD21      ASN 506   1.242  -6.030  -4.207
   24   HD22  ASN 506          HD22      ASN 506   1.504  -6.858  -5.704
   25    H    CYS 507           HN       CYS 507  -3.494  -5.514  -3.346
   26    HA   CYS 507           HA       CYS 507  -4.273  -7.636  -5.211
   27    HB2  CYS 507           HB2      CYS 507  -3.618  -8.718  -2.581
   28    HB3  CYS 507           HB1      CYS 507  -3.261  -9.341  -4.187
   29    H    GLY 508           HN       GLY 508  -4.663  -7.847  -1.697
   30    HA2  GLY 508           HA2      GLY 508  -7.546  -8.113  -2.289
   31    HA3  GLY 508           HA1      GLY 508  -6.648  -9.286  -1.350
   32    H    ARG 509           HN       ARG 509  -5.926  -8.750   0.707
   33    HA   ARG 509           HA       ARG 509  -7.933  -7.979   2.380
   34    HE   ARG 509           HE       ARG 509  -4.715 -12.156   4.293
   35    HB2  ARG 509           HB2      ARG 509  -5.019  -7.673   3.061
   36    HB3  ARG 509           HB1      ARG 509  -6.343  -8.003   4.164
   37    HG2  ARG 509           HG2      ARG 509  -6.602 -10.210   3.328
   38    HG3  ARG 509           HG1      ARG 509  -5.498  -9.892   1.987
   39    HD2  ARG 509           HD2      ARG 509  -3.682  -9.514   3.606
   40    HD3  ARG 509           HD1      ARG 509  -4.793  -9.911   4.912
   41   HH11  ARG 509          HH11      ARG 509  -2.852 -10.180   2.052
   42   HH12  ARG 509          HH12      ARG 509  -1.995 -11.538   1.390
   43   HH21  ARG 509          HH21      ARG 509  -3.536 -13.911   3.448
   44   HH22  ARG 509          HH22      ARG 509  -2.354 -13.640   2.203
   45    H    GLU 510           HN       GLU 510  -8.194  -6.252   3.858
   46    HA   GLU 510           HA       GLU 510  -7.894  -3.685   2.605
   47    HB2  GLU 510           HB2      GLU 510  -9.087  -2.868   4.691
   48    HB3  GLU 510           HB1      GLU 510  -9.966  -4.001   3.679
   49    HG2  GLU 510           HG2      GLU 510  -8.433  -4.878   6.108
   50    HG3  GLU 510           HG1      GLU 510 -10.104  -4.326   6.191
   51    H    ALA 511           HN       ALA 511  -5.584  -5.267   3.741
   52    HA   ALA 511           HA       ALA 511  -3.467  -4.666   4.279
   53    HB1  ALA 511           HB1      ALA 511  -4.550  -1.921   4.866
   54    HB2  ALA 511           HB2      ALA 511  -3.930  -2.464   3.308
   55    HB3  ALA 511           HB3      ALA 511  -2.851  -2.372   4.700
   56    H    MET 512           HN       MET 512  -2.207  -4.723   6.062
   57    HA   MET 512           HA       MET 512  -3.597  -5.004   8.618
   58    HB2  MET 512           HB2      MET 512  -0.683  -5.522   7.977
   59    HB3  MET 512           HB1      MET 512  -1.561  -6.053   9.404
   60    HG2  MET 512           HG2      MET 512  -2.877  -7.578   8.090
   61    HG3  MET 512           HG1      MET 512  -2.157  -6.969   6.600
   62    HE1  MET 512           HE1      MET 512  -1.428  -9.295   5.720
   63    HE2  MET 512           HE2      MET 512  -2.256 -10.020   7.096
   64    HE3  MET 512           HE3      MET 512  -0.610 -10.511   6.700
   65    H    SER 513           HN       SER 513  -0.502  -3.650   7.554
   66    HA   SER 513           HA       SER 513  -1.088  -1.235   9.115
   67    HG   SER 513           HG       SER 513   1.647  -3.702   8.877
   68    HB2  SER 513           HB2      SER 513   1.451  -0.917   9.030
   69    HB3  SER 513           HB1      SER 513   0.833  -2.165  10.124
   70    H    GLU 514           HN       GLU 514   0.112   0.679   8.254
   71    HA   GLU 514           HA       GLU 514  -0.155   0.891   5.370
   72    HB2  GLU 514           HB2      GLU 514   0.729   2.937   7.404
   73    HB3  GLU 514           HB1      GLU 514   0.242   3.250   5.741
   74    HG2  GLU 514           HG2      GLU 514  -1.993   2.706   6.183
   75    HG3  GLU 514           HG1      GLU 514  -1.589   1.982   7.733
   76    H    CYS 515           HN       CYS 515   1.675   1.549   4.030
   77    HA   CYS 515           HA       CYS 515   4.014   0.197   4.204
   78    HB2  CYS 515           HB2      CYS 515   3.526   1.464   2.225
   79    HB3  CYS 515           HB1      CYS 515   3.559   2.980   3.113
   80    H    THR 516           HN       THR 516   5.516   0.054   5.762
   81    HA   THR 516           HA       THR 516   5.371   1.765   7.998
   82    HB   THR 516           HB       THR 516   7.295   0.484   8.872
   83    HG1  THR 516           HG1      THR 516   8.469   0.038   7.012
   84   HG21  THR 516          HG21      THR 516   5.003  -0.351   9.120
   85   HG22  THR 516          HG22      THR 516   6.152  -1.679   8.940
   86   HG23  THR 516          HG23      THR 516   5.143  -1.195   7.577
   87    H    GLY 517           HN       GLY 517   6.860   2.343   5.093
   88    HA2  GLY 517           HA2      GLY 517   9.095   3.837   6.208
   89    HA3  GLY 517           HA1      GLY 517   8.717   3.643   4.501
   90    H    CYS 518           HN       CYS 518   5.809   4.427   5.505
   91    HA   CYS 518           HA       CYS 518   6.175   7.278   5.884
   92    HB2  CYS 518           HB2      CYS 518   5.108   7.918   3.805
   93    HB3  CYS 518           HB1      CYS 518   6.576   6.998   3.486
   94    H    HIS 519           HN       HIS 519   4.090   4.587   5.219
   95    HA   HIS 519           HA       HIS 519   1.982   4.011   5.702
   96    HD1  HIS 519           HD1      HIS 519   0.970   4.034   9.772
   97    HD2  HIS 519           HD2      HIS 519   4.518   4.053   7.635
   98    HE1  HIS 519           HE1      HIS 519   2.553   2.580  11.084
   99    HE2  HIS 519           HE2      HIS 519   4.753   2.761   9.873
  100    HB2  HIS 519           HB2      HIS 519   2.038   6.296   7.691
  101    HB3  HIS 519           HB1      HIS 519   0.760   5.101   7.543
  102    H    LYS 520           HN       LYS 520   2.740   6.018   3.673
  103    HA   LYS 520           HA       LYS 520   0.415   7.738   3.445
  104    HB2  LYS 520           HB2      LYS 520   2.688   7.210   1.524
  105    HB3  LYS 520           HB1      LYS 520   1.430   8.416   1.291
  106    HG2  LYS 520           HG2      LYS 520   2.159   9.610   3.254
  107    HG3  LYS 520           HG1      LYS 520   3.375   8.377   3.584
  108    HD2  LYS 520           HD2      LYS 520   4.668   9.932   2.511
  109    HD3  LYS 520           HD1      LYS 520   4.160   8.950   1.139
  110    HE2  LYS 520           HE2      LYS 520   2.902  11.544   2.027
  111    HE3  LYS 520           HE1      LYS 520   3.986  11.339   0.657
  112    HZ1  LYS 520           HZ1      LYS 520   2.289   9.788  -0.282
  113    HZ2  LYS 520           HZ2      LYS 520   1.798  11.404  -0.172
  114    HZ3  LYS 520           HZ3      LYS 520   1.236  10.275   0.958
  115    H    VAL 521           HN       VAL 521   1.047   4.517   2.803
  116    HA   VAL 521           HA       VAL 521  -1.239   4.233   1.069
  117    HB   VAL 521           HB       VAL 521  -0.063   2.748  -0.522
  118   HG11  VAL 521          HG11      VAL 521   1.053   5.546  -0.436
  119   HG12  VAL 521          HG12      VAL 521  -0.447   5.034  -1.210
  120   HG13  VAL 521          HG13      VAL 521   1.103   4.472  -1.834
  121   HG21  VAL 521          HG21      VAL 521   1.818   2.095   0.857
  122   HG22  VAL 521          HG22      VAL 521   2.445   3.744   0.824
  123   HG23  VAL 521          HG23      VAL 521   2.390   2.791  -0.660
  124    H    ASN 522           HN       ASN 522  -1.458   1.670   0.740
  125    HA   ASN 522           HA       ASN 522  -0.440   0.266   3.079
  126    HB2  ASN 522           HB2      ASN 522  -2.693  -0.422   3.820
  127    HB3  ASN 522           HB1      ASN 522  -2.485   1.324   3.921
  128   HD21  ASN 522          HD21      ASN 522  -4.091  -1.277   2.273
  129   HD22  ASN 522          HD22      ASN 522  -5.239  -0.304   1.423
  130    H    TYR 523           HN       TYR 523  -0.611  -1.981   2.968
  131    HA   TYR 523           HA       TYR 523  -1.591  -3.085   0.443
  132    HD1  TYR 523           HD1      TYR 523   1.939  -1.330   1.375
  133    HD2  TYR 523           HD2      TYR 523   0.268  -3.414  -1.933
  134    HE1  TYR 523           HE1      TYR 523   2.854   0.367  -0.147
  135    HE2  TYR 523           HE2      TYR 523   1.178  -1.722  -3.468
  136    HH   TYR 523           HH       TYR 523   2.018   0.442  -3.537
  137    HB2  TYR 523           HB2      TYR 523   1.152  -3.623   1.610
  138    HB3  TYR 523           HB1      TYR 523   0.452  -4.479   0.241
  139    H    CYS 524           HN       CYS 524  -2.197  -5.283   0.547
  140    HA   CYS 524           HA       CYS 524  -3.488  -5.996   2.901
  141    HB2  CYS 524           HB2      CYS 524  -4.028  -8.067   1.866
  142    HB3  CYS 524           HB1      CYS 524  -4.095  -6.804   0.651
  143    H    SER 525           HN       SER 525  -0.468  -7.197   1.573
  144    HA   SER 525           HA       SER 525   0.234  -8.214   4.238
  145    HG   SER 525           HG       SER 525   1.139 -11.199   3.670
  146    HB2  SER 525           HB2      SER 525  -0.338 -10.080   2.697
  147    HB3  SER 525           HB1      SER 525   0.961  -9.556   1.627
  148    H    THR 526           HN       THR 526   2.808  -8.789   4.083
  149    HA   THR 526           HA       THR 526   4.067  -6.273   3.834
  150    HB   THR 526           HB       THR 526   5.379  -8.980   4.099
  151    HG1  THR 526           HG1      THR 526   3.942  -7.386   5.911
  152   HG21  THR 526          HG21      THR 526   6.912  -7.117   3.604
  153   HG22  THR 526          HG22      THR 526   7.150  -7.742   5.234
  154   HG23  THR 526          HG23      THR 526   6.273  -6.232   4.986
  155    H    PHE 527           HN       PHE 527   3.939  -9.116   1.724
  156    HA   PHE 527           HA       PHE 527   6.282  -8.597   0.300
  157    HD1  PHE 527           HD2      PHE 527   3.156  -9.330  -2.437
  158    HD2  PHE 527           HD1      PHE 527   3.445 -11.546   1.182
  159    HE1  PHE 527           HE2      PHE 527   0.784  -9.959  -2.644
  160    HE2  PHE 527           HE1      PHE 527   1.082 -12.189   0.981
  161    HZ   PHE 527           HZ       PHE 527  -0.250 -11.397  -0.932
  162    HB2  PHE 527           HB2      PHE 527   5.340 -10.079  -1.489
  163    HB3  PHE 527           HB1      PHE 527   5.393 -10.781   0.122
  164    H    CYS 528           HN       CYS 528   2.962  -7.489  -0.396
  165    HA   CYS 528           HA       CYS 528   3.579  -6.361  -2.906
  166    HB2  CYS 528           HB2      CYS 528   1.522  -4.899  -1.600
  167    HB3  CYS 528           HB1      CYS 528   1.365  -6.099  -2.882
  168    H    GLN 529           HN       GLN 529   3.842  -5.229   0.378
  169    HA   GLN 529           HA       GLN 529   3.974  -2.460  -0.130
  170    HB2  GLN 529           HB2      GLN 529   3.512  -3.449   2.089
  171    HB3  GLN 529           HB1      GLN 529   5.164  -4.043   2.159
  172    HG2  GLN 529           HG2      GLN 529   5.969  -1.715   2.070
  173    HG3  GLN 529           HG1      GLN 529   4.294  -1.163   2.088
  174   HE21  GLN 529          HE21      GLN 529   3.472  -3.294   3.914
  175   HE22  GLN 529          HE22      GLN 529   4.063  -2.842   5.478
  176    H    ARG 530           HN       ARG 530   6.387  -4.997   0.201
  177    HA   ARG 530           HA       ARG 530   8.586  -3.205  -0.262
  178    HE   ARG 530           HE       ARG 530   9.701  -3.727   3.931
  179    HB2  ARG 530           HB2      ARG 530   8.432  -6.203  -0.050
  180    HB3  ARG 530           HB1      ARG 530   9.935  -5.340  -0.369
  181    HG2  ARG 530           HG2      ARG 530   8.175  -5.083   2.062
  182    HG3  ARG 530           HG1      ARG 530   9.797  -5.784   1.981
  183    HD2  ARG 530           HD2      ARG 530  10.815  -3.723   1.706
  184    HD3  ARG 530           HD1      ARG 530   9.345  -2.964   1.099
  185   HH11  ARG 530          HH11      ARG 530   8.681  -1.459   1.458
  186   HH12  ARG 530          HH12      ARG 530   8.067  -0.301   2.590
  187   HH21  ARG 530          HH21      ARG 530   8.918  -2.220   5.419
  188   HH22  ARG 530          HH22      ARG 530   8.198  -0.740   4.869
  189    H    LYS 531           HN       LYS 531   6.938  -5.678  -2.222
  190    HA   LYS 531           HA       LYS 531   8.609  -5.599  -4.457
  191    HB2  LYS 531           HB2      LYS 531   5.666  -6.163  -4.173
  192    HB3  LYS 531           HB1      LYS 531   6.481  -6.259  -5.724
  193    HG2  LYS 531           HG2      LYS 531   7.914  -8.017  -4.915
  194    HG3  LYS 531           HG1      LYS 531   7.232  -7.865  -3.291
  195    HD2  LYS 531           HD2      LYS 531   6.273  -9.760  -4.557
  196    HD3  LYS 531           HD1      LYS 531   5.062  -8.564  -4.097
  197    HE2  LYS 531           HE2      LYS 531   5.342  -7.560  -6.390
  198    HE3  LYS 531           HE1      LYS 531   6.320  -8.966  -6.807
  199    HZ1  LYS 531           HZ1      LYS 531   3.500  -9.058  -5.879
  200    HZ2  LYS 531           HZ2      LYS 531   4.435 -10.391  -6.356
  201    HZ3  LYS 531           HZ3      LYS 531   4.000  -9.208  -7.491
  202    H    ASP 532           HN       ASP 532   5.551  -3.862  -3.955
  203    HA   ASP 532           HA       ASP 532   5.604  -2.411  -6.357
  204    HB2  ASP 532           HB2      ASP 532   4.187  -2.261  -3.754
  205    HB3  ASP 532           HB1      ASP 532   3.958  -0.963  -4.921
  206    H    TRP 533           HN       TRP 533   7.154  -1.897  -3.317
  207    HA   TRP 533           HA       TRP 533   7.290   0.929  -3.544
  208    HD1  TRP 533           HD1      TRP 533  10.445  -1.643  -2.452
  209    HE1  TRP 533           HE1      TRP 533  12.687  -0.616  -1.631
  210    HE3  TRP 533           HE3      TRP 533   8.620   2.498  -0.129
  211    HZ2  TRP 533           HZ2      TRP 533  13.510   1.669  -0.163
  212    HZ3  TRP 533           HZ3      TRP 533  10.175   4.041   0.978
  213    HH2  TRP 533           HH2      TRP 533  12.578   3.624   0.970
  214    HB2  TRP 533           HB2      TRP 533   7.603   0.657  -1.337
  215    HB3  TRP 533           HB1      TRP 533   7.875  -1.073  -1.553
  216    H    LYS 534           HN       LYS 534   8.887  -1.503  -5.189
  217    HA   LYS 534           HA       LYS 534  11.393  -0.203  -5.383
  218    HB2  LYS 534           HB2      LYS 534  10.105  -2.023  -7.421
  219    HB3  LYS 534           HB1      LYS 534  11.801  -1.568  -7.377
  220    HG2  LYS 534           HG2      LYS 534  10.294  -3.393  -5.544
  221    HG3  LYS 534           HG1      LYS 534  11.758  -3.708  -6.470
  222    HD2  LYS 534           HD2      LYS 534  11.474  -2.035  -3.979
  223    HD3  LYS 534           HD1      LYS 534  12.367  -3.542  -4.166
  224    HE2  LYS 534           HE2      LYS 534  13.025  -0.874  -5.397
  225    HE3  LYS 534           HE1      LYS 534  13.899  -1.684  -4.105
  226    HZ1  LYS 534           HZ1      LYS 534  13.604  -2.814  -6.837
  227    HZ2  LYS 534           HZ2      LYS 534  14.604  -3.378  -5.592
  228    HZ3  LYS 534           HZ3      LYS 534  14.935  -1.896  -6.334
  229    H    ASP 535           HN       ASP 535   8.335   0.414  -6.648
  230    HA   ASP 535           HA       ASP 535   9.386   2.657  -8.225
  231    HB2  ASP 535           HB2      ASP 535   7.747   1.456  -9.455
  232    HB3  ASP 535           HB1      ASP 535   6.682   1.327  -8.059
  233    H    HIS 536           HN       HIS 536   7.265   1.824  -5.540
  234    HA   HIS 536           HA       HIS 536   6.440   4.400  -4.844
  235    HD1  HIS 536           HD1      HIS 536   3.799   4.152  -2.601
  236    HD2  HIS 536           HD2      HIS 536   7.505   3.316  -0.920
  237    HE1  HIS 536           HE1      HIS 536   3.838   5.257  -0.305
  238    HB2  HIS 536           HB2      HIS 536   5.233   2.534  -3.998
  239    HB3  HIS 536           HB1      HIS 536   6.666   1.875  -3.217
  240    H    GLN 537           HN       GLN 537   9.478   2.795  -4.033
  241    HA   GLN 537           HA       GLN 537  10.483   4.169  -1.922
  242    HB2  GLN 537           HB2      GLN 537  12.702   3.925  -2.891
  243    HB3  GLN 537           HB1      GLN 537  11.742   2.475  -3.164
  244    HG2  GLN 537           HG2      GLN 537  11.382   3.070  -5.452
  245    HG3  GLN 537           HG1      GLN 537  12.143   4.641  -5.210
  246   HE21  GLN 537          HE21      GLN 537  12.662   1.237  -5.567
  247   HE22  GLN 537          HE22      GLN 537  14.373   1.304  -5.827
  248    H    HIS 538           HN       HIS 538   9.823   5.463  -5.086
  249    HA   HIS 538           HA       HIS 538  11.342   7.853  -4.889
  250    HD2  HIS 538           HD2      HIS 538  10.676   4.718  -6.817
  251    HE1  HIS 538           HE1      HIS 538  12.749   6.677  -9.938
  252    HE2  HIS 538           HE2      HIS 538  12.407   4.474  -8.742
  253    HB2  HIS 538           HB2      HIS 538   8.923   7.194  -6.580
  254    HB3  HIS 538           HB1      HIS 538   9.931   8.618  -6.782
  255    H    ILE 539           HN       ILE 539   8.301   6.883  -3.541
  256    HA   ILE 539           HA       ILE 539   7.580   9.722  -3.142
  257    HB   ILE 539           HB       ILE 539   5.221   9.131  -3.263
  258   HG12  ILE 539          HG12      ILE 539   6.194   6.347  -3.945
  259   HG13  ILE 539          HG11      ILE 539   5.366   6.816  -2.463
  260   HG21  ILE 539          HG21      ILE 539   5.089   8.615  -5.664
  261   HG22  ILE 539          HG22      ILE 539   6.795   8.170  -5.648
  262   HG23  ILE 539          HG23      ILE 539   6.313   9.833  -5.307
  263   HD11  ILE 539          HD11      ILE 539   4.205   6.888  -5.241
  264   HD12  ILE 539          HD12      ILE 539   3.374   7.385  -3.767
  265   HD13  ILE 539          HD13      ILE 539   3.851   5.701  -3.987
  266    H    CYS 540           HN       CYS 540   8.745   7.162  -1.583
  267    HA   CYS 540           HA       CYS 540   7.009   7.125   0.704
  268    HB2  CYS 540           HB2      CYS 540   8.650   5.253  -0.159
  269    HB3  CYS 540           HB1      CYS 540   9.828   6.130   0.796
  270    H    GLY 541           HN       GLY 541   7.015   8.492   2.280
  271    HA2  GLY 541           HA2      GLY 541   8.610  10.790   2.415
  272    HA3  GLY 541           HA1      GLY 541   7.579  10.199   3.705
  273    H    GLN 542           HN       GLN 542   9.274   7.616   3.535
  274    HA   GLN 542           HA       GLN 542  11.044   6.685   4.597
  275    HB2  GLN 542           HB2      GLN 542  12.259   8.093   2.890
  276    HB3  GLN 542           HB1      GLN 542  12.462   9.314   4.139
  277    HG2  GLN 542           HG2      GLN 542  14.463   7.967   3.898
  278    HG3  GLN 542           HG1      GLN 542  13.734   7.740   5.486
  279   HE21  GLN 542          HE21      GLN 542  12.836   5.768   6.017
  280   HE22  GLN 542          HE22      GLN 542  13.096   4.341   5.075
  281    H    SER 543           HN       SER 543   9.136   7.590   6.237
  282    HA   SER 543           HA       SER 543   8.669   7.995   8.411
  283    HG   SER 543           HG       SER 543   9.795   5.862   7.879
  284    HB2  SER 543           HB2      SER 543  11.618   7.429   8.756
  285    HB3  SER 543           HB1      SER 543  10.425   7.448  10.057
  286    H    ALA 544           HN       ALA 544   8.370  10.241   7.529
  287    HA   ALA 544           HA       ALA 544  10.207  12.134   8.831
  288    HB1  ALA 544           HB1      ALA 544   9.189  13.847   7.401
  289    HB2  ALA 544           HB2      ALA 544   8.121  12.628   6.704
  290    HB3  ALA 544           HB3      ALA 544   9.862  12.527   6.444
  Start of MODEL    9
    1    H    SER 503           HN       SER 503  -7.905  -1.626  -1.593
    2    HA   SER 503           HA       SER 503  -8.136  -2.401   1.175
    3    HG   SER 503           HG       SER 503  -8.898  -4.026  -1.953
    4    HB2  SER 503           HB2      SER 503  -7.922  -4.839   0.574
    5    HB3  SER 503           HB1      SER 503  -9.473  -4.103   0.175
    6    H    CYS 504           HN       CYS 504  -6.351  -4.339  -1.028
    7    HA   CYS 504           HA       CYS 504  -3.839  -3.096  -0.211
    8    HB2  CYS 504           HB2      CYS 504  -4.033  -5.595  -0.216
    9    HB3  CYS 504           HB1      CYS 504  -4.296  -5.543  -1.955
   10    H    VAL 505           HN       VAL 505  -2.708  -1.763  -1.532
   11    HA   VAL 505           HA       VAL 505  -3.884  -1.007  -4.060
   12    HB   VAL 505           HB       VAL 505  -1.187  -0.035  -3.133
   13   HG11  VAL 505          HG11      VAL 505  -1.908   0.681  -5.324
   14   HG12  VAL 505          HG12      VAL 505  -1.924   2.051  -4.213
   15   HG13  VAL 505          HG13      VAL 505  -3.438   1.265  -4.662
   16   HG21  VAL 505          HG21      VAL 505  -2.212   1.699  -1.810
   17   HG22  VAL 505          HG22      VAL 505  -2.651   0.111  -1.181
   18   HG23  VAL 505          HG23      VAL 505  -3.815   1.038  -2.129
   19    H    ASN 506           HN       ASN 506  -2.418  -3.677  -3.387
   20    HA   ASN 506           HA       ASN 506  -0.855  -3.733  -5.882
   21    HB2  ASN 506           HB2      ASN 506   0.615  -3.613  -3.809
   22    HB3  ASN 506           HB1      ASN 506   0.015  -5.224  -3.405
   23   HD21  ASN 506          HD21      ASN 506   1.946  -3.340  -5.601
   24   HD22  ASN 506          HD22      ASN 506   2.755  -4.675  -6.353
   25    H    CYS 507           HN       CYS 507  -2.674  -5.595  -3.466
   26    HA   CYS 507           HA       CYS 507  -3.285  -7.516  -5.623
   27    HB2  CYS 507           HB2      CYS 507  -3.603  -8.438  -2.821
   28    HB3  CYS 507           HB1      CYS 507  -3.116  -9.339  -4.253
   29    H    GLY 508           HN       GLY 508  -4.785  -7.795  -2.522
   30    HA2  GLY 508           HA2      GLY 508  -6.611  -5.807  -2.437
   31    HA3  GLY 508           HA1      GLY 508  -7.335  -6.955  -3.559
   32    H    ARG 509           HN       ARG 509  -5.510  -7.462  -0.529
   33    HA   ARG 509           HA       ARG 509  -8.028  -8.378   0.676
   34    HE   ARG 509           HE       ARG 509  -9.002  -9.447   4.304
   35    HB2  ARG 509           HB2      ARG 509  -6.011  -9.887   0.894
   36    HB3  ARG 509           HB1      ARG 509  -5.239  -8.620   1.838
   37    HG2  ARG 509           HG2      ARG 509  -6.196 -10.343   3.266
   38    HG3  ARG 509           HG1      ARG 509  -6.983  -8.783   3.523
   39    HD2  ARG 509           HD2      ARG 509  -8.446 -10.033   1.494
   40    HD3  ARG 509           HD1      ARG 509  -8.115 -11.299   2.677
   41   HH11  ARG 509          HH11      ARG 509 -10.236 -10.333   1.139
   42   HH12  ARG 509          HH12      ARG 509 -11.857  -9.804   1.492
   43   HH21  ARG 509          HH21      ARG 509 -11.148  -8.737   4.752
   44   HH22  ARG 509          HH22      ARG 509 -12.372  -8.916   3.521
   45    H    GLU 510           HN       GLU 510  -8.259  -7.487   3.037
   46    HA   GLU 510           HA       GLU 510  -8.853  -4.803   2.452
   47    HB2  GLU 510           HB2      GLU 510  -9.806  -4.749   4.722
   48    HB3  GLU 510           HB1      GLU 510 -10.324  -6.141   3.777
   49    HG2  GLU 510           HG2      GLU 510  -8.649  -7.521   4.935
   50    HG3  GLU 510           HG1      GLU 510  -8.208  -6.128   5.921
   51    H    ALA 511           HN       ALA 511  -5.849  -5.618   3.100
   52    HA   ALA 511           HA       ALA 511  -3.999  -4.515   3.825
   53    HB1  ALA 511           HB1      ALA 511  -4.075  -2.129   4.198
   54    HB2  ALA 511           HB2      ALA 511  -5.834  -2.174   4.308
   55    HB3  ALA 511           HB3      ALA 511  -5.038  -2.548   2.779
   56    H    MET 512           HN       MET 512  -2.834  -4.310   5.692
   57    HA   MET 512           HA       MET 512  -4.394  -4.513   8.177
   58    HB2  MET 512           HB2      MET 512  -1.672  -5.678   7.562
   59    HB3  MET 512           HB1      MET 512  -2.483  -5.768   9.121
   60    HG2  MET 512           HG2      MET 512  -4.317  -7.028   8.060
   61    HG3  MET 512           HG1      MET 512  -3.430  -6.987   6.539
   62    HE1  MET 512           HE1      MET 512  -3.442  -8.267  10.242
   63    HE2  MET 512           HE2      MET 512  -1.915  -7.393  10.137
   64    HE3  MET 512           HE3      MET 512  -1.916  -9.146  10.320
   65    H    SER 513           HN       SER 513  -1.023  -3.722   7.289
   66    HA   SER 513           HA       SER 513  -1.377  -1.226   8.803
   67    HG   SER 513           HG       SER 513   0.917  -4.085   8.865
   68    HB2  SER 513           HB2      SER 513   1.172  -1.295   9.023
   69    HB3  SER 513           HB1      SER 513   0.234  -2.416  10.026
   70    H    GLU 514           HN       GLU 514   0.305   0.413   8.140
   71    HA   GLU 514           HA       GLU 514   0.130   0.762   5.250
   72    HB2  GLU 514           HB2      GLU 514   0.853   2.722   7.415
   73    HB3  GLU 514           HB1      GLU 514   0.542   3.103   5.724
   74    HG2  GLU 514           HG2      GLU 514  -1.733   2.584   5.922
   75    HG3  GLU 514           HG1      GLU 514  -1.497   1.800   7.480
   76    H    CYS 515           HN       CYS 515   1.973   1.432   4.042
   77    HA   CYS 515           HA       CYS 515   4.322   0.119   4.254
   78    HB2  CYS 515           HB2      CYS 515   3.879   1.381   2.284
   79    HB3  CYS 515           HB1      CYS 515   3.796   2.891   3.183
   80    H    THR 516           HN       THR 516   5.772  -0.029   5.835
   81    HA   THR 516           HA       THR 516   5.700   1.686   8.070
   82    HB   THR 516           HB       THR 516   7.753   0.364   8.780
   83    HG1  THR 516           HG1      THR 516   7.526  -1.695   7.212
   84   HG21  THR 516          HG21      THR 516   5.241  -1.122   8.005
   85   HG22  THR 516          HG22      THR 516   5.494  -0.216   9.497
   86   HG23  THR 516          HG23      THR 516   6.437  -1.673   9.179
   87    H    GLY 517           HN       GLY 517   6.979   2.465   5.178
   88    HA2  GLY 517           HA2      GLY 517   9.295   3.869   6.302
   89    HA3  GLY 517           HA1      GLY 517   8.907   3.724   4.594
   90    H    CYS 518           HN       CYS 518   6.009   4.428   5.640
   91    HA   CYS 518           HA       CYS 518   6.295   7.281   6.066
   92    HB2  CYS 518           HB2      CYS 518   5.223   7.912   3.987
   93    HB3  CYS 518           HB1      CYS 518   6.715   7.038   3.664
   94    H    HIS 519           HN       HIS 519   4.319   4.508   5.444
   95    HA   HIS 519           HA       HIS 519   2.188   3.917   5.778
   96    HD1  HIS 519           HD1      HIS 519   1.222   3.560   9.875
   97    HD2  HIS 519           HD2      HIS 519   4.742   3.899   7.729
   98    HE1  HIS 519           HE1      HIS 519   2.871   2.070  11.048
   99    HE2  HIS 519           HE2      HIS 519   5.065   2.563   9.923
  100    HB2  HIS 519           HB2      HIS 519   2.192   6.023   7.962
  101    HB3  HIS 519           HB1      HIS 519   0.953   4.801   7.714
  102    H    LYS 520           HN       LYS 520   2.855   5.900   3.824
  103    HA   LYS 520           HA       LYS 520   0.537   7.661   3.728
  104    HB2  LYS 520           HB2      LYS 520   2.864   7.260   1.843
  105    HB3  LYS 520           HB1      LYS 520   1.555   8.399   1.558
  106    HG2  LYS 520           HG2      LYS 520   2.141   9.645   3.523
  107    HG3  LYS 520           HG1      LYS 520   3.364   8.454   3.961
  108    HD2  LYS 520           HD2      LYS 520   4.428  10.378   2.949
  109    HD3  LYS 520           HD1      LYS 520   4.591   8.981   1.884
  110    HE2  LYS 520           HE2      LYS 520   2.717   9.803   0.535
  111    HE3  LYS 520           HE1      LYS 520   2.567  11.202   1.597
  112    HZ1  LYS 520           HZ1      LYS 520   4.881  10.539  -0.147
  113    HZ2  LYS 520           HZ2      LYS 520   4.864  11.811   0.971
  114    HZ3  LYS 520           HZ3      LYS 520   3.796  11.825  -0.342
  115    H    VAL 521           HN       VAL 521   1.237   4.488   2.947
  116    HA   VAL 521           HA       VAL 521  -1.085   4.224   1.242
  117    HB   VAL 521           HB       VAL 521   0.081   2.750  -0.354
  118   HG11  VAL 521          HG11      VAL 521   1.294   5.508  -0.255
  119   HG12  VAL 521          HG12      VAL 521  -0.253   5.079  -0.983
  120   HG13  VAL 521          HG13      VAL 521   1.245   4.450  -1.666
  121   HG21  VAL 521          HG21      VAL 521   2.531   2.723  -0.478
  122   HG22  VAL 521          HG22      VAL 521   1.944   2.056   1.045
  123   HG23  VAL 521          HG23      VAL 521   2.610   3.689   0.996
  124    H    ASN 522           HN       ASN 522  -1.494   1.742   1.035
  125    HA   ASN 522           HA       ASN 522  -0.349   0.271   3.260
  126    HB2  ASN 522           HB2      ASN 522  -2.735  -0.381   3.987
  127    HB3  ASN 522           HB1      ASN 522  -2.132   1.193   4.481
  128   HD21  ASN 522          HD21      ASN 522  -4.186   2.027   4.741
  129   HD22  ASN 522          HD22      ASN 522  -5.219   2.401   3.404
  130    H    TYR 523           HN       TYR 523  -0.729  -1.977   3.175
  131    HA   TYR 523           HA       TYR 523  -1.820  -2.942   0.646
  132    HD1  TYR 523           HD2      TYR 523  -0.646  -2.888  -1.666
  133    HD2  TYR 523           HD1      TYR 523   2.163  -1.578   1.250
  134    HE1  TYR 523           HE2      TYR 523   0.184  -1.177  -3.232
  135    HE2  TYR 523           HE1      TYR 523   2.992   0.126  -0.306
  136    HH   TYR 523           HH       TYR 523   1.538   1.274  -2.772
  137    HB2  TYR 523           HB2      TYR 523   0.975  -3.522   1.650
  138    HB3  TYR 523           HB1      TYR 523   0.201  -4.371   0.309
  139    H    CYS 524           HN       CYS 524  -2.167  -5.287   0.621
  140    HA   CYS 524           HA       CYS 524  -3.551  -5.998   2.961
  141    HB2  CYS 524           HB2      CYS 524  -4.214  -7.951   1.849
  142    HB3  CYS 524           HB1      CYS 524  -4.045  -6.729   0.603
  143    H    SER 525           HN       SER 525  -0.479  -7.000   1.635
  144    HA   SER 525           HA       SER 525   0.201  -8.251   4.210
  145    HG   SER 525           HG       SER 525  -1.115  -9.709   1.828
  146    HB2  SER 525           HB2      SER 525   1.074  -9.266   1.501
  147    HB3  SER 525           HB1      SER 525   1.427  -9.998   3.066
  148    H    THR 526           HN       THR 526   2.747  -8.617   4.268
  149    HA   THR 526           HA       THR 526   3.975  -6.081   4.091
  150    HB   THR 526           HB       THR 526   5.324  -8.756   4.438
  151    HG1  THR 526           HG1      THR 526   4.776  -7.439   6.753
  152   HG21  THR 526          HG21      THR 526   6.938  -7.469   5.765
  153   HG22  THR 526          HG22      THR 526   6.036  -5.989   5.441
  154   HG23  THR 526          HG23      THR 526   6.834  -6.841   4.120
  155    H    PHE 527           HN       PHE 527   4.192  -9.018   2.089
  156    HA   PHE 527           HA       PHE 527   6.477  -8.264   0.669
  157    HD1  PHE 527           HD2      PHE 527   3.798  -9.354  -2.333
  158    HD2  PHE 527           HD1      PHE 527   3.614 -11.299   1.444
  159    HE1  PHE 527           HE2      PHE 527   1.498 -10.085  -2.827
  160    HE2  PHE 527           HE1      PHE 527   1.322 -12.035   0.962
  161    HZ   PHE 527           HZ       PHE 527   0.258 -11.433  -1.179
  162    HB2  PHE 527           HB2      PHE 527   5.835  -9.915  -1.032
  163    HB3  PHE 527           HB1      PHE 527   5.693 -10.556   0.600
  164    H    CYS 528           HN       CYS 528   3.103  -7.424   0.133
  165    HA   CYS 528           HA       CYS 528   3.311  -6.308  -2.415
  166    HB2  CYS 528           HB2      CYS 528   1.605  -4.951  -0.414
  167    HB3  CYS 528           HB1      CYS 528   1.207  -5.544  -2.026
  168    H    GLN 529           HN       GLN 529   3.964  -4.965   0.780
  169    HA   GLN 529           HA       GLN 529   4.186  -2.258   0.038
  170    HB2  GLN 529           HB2      GLN 529   3.983  -2.998   2.390
  171    HB3  GLN 529           HB1      GLN 529   5.577  -3.737   2.290
  172    HG2  GLN 529           HG2      GLN 529   6.445  -1.423   1.707
  173    HG3  GLN 529           HG1      GLN 529   4.872  -0.824   2.230
  174   HE21  GLN 529          HE21      GLN 529   7.495  -0.304   3.332
  175   HE22  GLN 529          HE22      GLN 529   7.454  -0.828   4.982
  176    H    ARG 530           HN       ARG 530   6.454  -4.912   0.268
  177    HA   ARG 530           HA       ARG 530   8.767  -3.365  -0.421
  178    HE   ARG 530           HE       ARG 530  11.379  -6.236   0.373
  179    HB2  ARG 530           HB2      ARG 530   8.256  -6.322  -0.194
  180    HB3  ARG 530           HB1      ARG 530   9.827  -5.662  -0.633
  181    HG2  ARG 530           HG2      ARG 530   9.867  -4.431   1.504
  182    HG3  ARG 530           HG1      ARG 530   8.327  -5.177   1.934
  183    HD2  ARG 530           HD2      ARG 530  10.221  -6.341   2.964
  184    HD3  ARG 530           HD1      ARG 530   9.344  -7.379   1.839
  185   HH11  ARG 530          HH11      ARG 530  11.178  -8.241   3.245
  186   HH12  ARG 530          HH12      ARG 530  12.679  -9.060   2.919
  187   HH21  ARG 530          HH21      ARG 530  13.338  -7.294  -0.040
  188   HH22  ARG 530          HH22      ARG 530  13.911  -8.524   1.052
  189    H    LYS 531           HN       LYS 531   6.736  -5.694  -2.142
  190    HA   LYS 531           HA       LYS 531   8.162  -5.843  -4.545
  191    HB2  LYS 531           HB2      LYS 531   6.324  -7.355  -3.825
  192    HB3  LYS 531           HB1      LYS 531   5.176  -6.068  -4.127
  193    HG2  LYS 531           HG2      LYS 531   5.738  -6.097  -6.495
  194    HG3  LYS 531           HG1      LYS 531   6.926  -7.371  -6.204
  195    HD2  LYS 531           HD2      LYS 531   5.114  -8.820  -5.355
  196    HD3  LYS 531           HD1      LYS 531   3.950  -7.553  -5.735
  197    HE2  LYS 531           HE2      LYS 531   5.744  -8.909  -7.743
  198    HE3  LYS 531           HE1      LYS 531   4.060  -9.336  -7.450
  199    HZ1  LYS 531           HZ1      LYS 531   3.459  -7.041  -8.081
  200    HZ2  LYS 531           HZ2      LYS 531   4.186  -7.909  -9.337
  201    HZ3  LYS 531           HZ3      LYS 531   5.084  -6.748  -8.492
  202    H    ASP 532           HN       ASP 532   5.300  -3.914  -3.759
  203    HA   ASP 532           HA       ASP 532   5.068  -2.524  -6.190
  204    HB2  ASP 532           HB2      ASP 532   3.365  -2.748  -4.333
  205    HB3  ASP 532           HB1      ASP 532   4.322  -1.551  -3.449
  206    H    TRP 533           HN       TRP 533   7.014  -1.978  -3.355
  207    HA   TRP 533           HA       TRP 533   7.152   0.815  -3.520
  208    HD1  TRP 533           HD1      TRP 533  10.636  -1.537  -3.066
  209    HE1  TRP 533           HE1      TRP 533  12.851  -0.372  -2.383
  210    HE3  TRP 533           HE3      TRP 533   8.707   2.208  -0.213
  211    HZ2  TRP 533           HZ2      TRP 533  13.622   1.845  -0.821
  212    HZ3  TRP 533           HZ3      TRP 533  10.239   3.806   0.858
  213    HH2  TRP 533           HH2      TRP 533  12.654   3.618   0.564
  214    HB2  TRP 533           HB2      TRP 533   7.753   0.364  -1.419
  215    HB3  TRP 533           HB1      TRP 533   8.146  -1.307  -1.824
  216    H    LYS 534           HN       LYS 534   8.679  -1.495  -5.470
  217    HA   LYS 534           HA       LYS 534  11.083  -0.105  -6.003
  218    HB2  LYS 534           HB2      LYS 534   9.442  -1.847  -7.860
  219    HB3  LYS 534           HB1      LYS 534  11.112  -1.354  -8.132
  220    HG2  LYS 534           HG2      LYS 534  10.106  -3.051  -5.858
  221    HG3  LYS 534           HG1      LYS 534  11.021  -3.610  -7.260
  222    HD2  LYS 534           HD2      LYS 534  12.979  -2.552  -6.556
  223    HD3  LYS 534           HD1      LYS 534  12.108  -1.462  -5.476
  224    HE2  LYS 534           HE2      LYS 534  11.615  -3.279  -3.970
  225    HE3  LYS 534           HE1      LYS 534  12.362  -4.440  -5.072
  226    HZ1  LYS 534           HZ1      LYS 534  13.791  -2.191  -3.751
  227    HZ2  LYS 534           HZ2      LYS 534  14.486  -3.393  -4.724
  228    HZ3  LYS 534           HZ3      LYS 534  13.822  -3.802  -3.217
  229    H    ASP 535           HN       ASP 535   7.806   0.470  -6.809
  230    HA   ASP 535           HA       ASP 535   8.493   2.769  -8.502
  231    HB2  ASP 535           HB2      ASP 535   6.679   1.592  -9.441
  232    HB3  ASP 535           HB1      ASP 535   5.953   1.279  -7.871
  233    H    HIS 536           HN       HIS 536   6.806   1.883  -5.559
  234    HA   HIS 536           HA       HIS 536   6.059   4.412  -4.687
  235    HD1  HIS 536           HD1      HIS 536   3.788   4.254  -2.366
  236    HD2  HIS 536           HD2      HIS 536   7.509   3.192  -0.835
  237    HE1  HIS 536           HE1      HIS 536   3.991   5.365  -0.083
  238    HB2  HIS 536           HB2      HIS 536   5.059   2.444  -3.749
  239    HB3  HIS 536           HB1      HIS 536   6.612   1.896  -3.118
  240    H    GLN 537           HN       GLN 537   9.185   2.818  -4.225
  241    HA   GLN 537           HA       GLN 537  10.312   4.116  -2.127
  242    HB2  GLN 537           HB2      GLN 537  12.484   3.817  -3.184
  243    HB3  GLN 537           HB1      GLN 537  11.466   2.402  -3.427
  244    HG2  GLN 537           HG2      GLN 537  10.966   3.167  -5.700
  245    HG3  GLN 537           HG1      GLN 537  12.017   4.559  -5.451
  246   HE21  GLN 537          HE21      GLN 537  13.415   4.017  -7.085
  247   HE22  GLN 537          HE22      GLN 537  14.492   2.666  -6.996
  248    H    HIS 538           HN       HIS 538   9.621   5.482  -5.246
  249    HA   HIS 538           HA       HIS 538  11.302   7.763  -5.009
  250    HD2  HIS 538           HD2      HIS 538  10.022   4.663  -7.244
  251    HE1  HIS 538           HE1      HIS 538  13.165   6.234  -9.609
  252    HE2  HIS 538           HE2      HIS 538  11.808   4.164  -9.074
  253    HB2  HIS 538           HB2      HIS 538   8.906   7.296  -6.799
  254    HB3  HIS 538           HB1      HIS 538  10.075   8.598  -6.977
  255    H    ILE 539           HN       ILE 539   8.299   6.958  -3.580
  256    HA   ILE 539           HA       ILE 539   7.758   9.829  -3.121
  257    HB   ILE 539           HB       ILE 539   5.393   9.433  -3.051
  258   HG12  ILE 539          HG12      ILE 539   5.982   6.523  -3.643
  259   HG13  ILE 539          HG11      ILE 539   5.463   7.147  -2.081
  260   HG21  ILE 539          HG21      ILE 539   4.976   8.739  -5.374
  261   HG22  ILE 539          HG22      ILE 539   6.633   8.145  -5.476
  262   HG23  ILE 539          HG23      ILE 539   6.325   9.866  -5.238
  263   HD11  ILE 539          HD11      ILE 539   3.357   7.871  -3.070
  264   HD12  ILE 539          HD12      ILE 539   3.623   6.142  -3.297
  265   HD13  ILE 539          HD13      ILE 539   3.882   7.257  -4.638
  266    H    CYS 540           HN       CYS 540   8.858   7.140  -1.642
  267    HA   CYS 540           HA       CYS 540   7.317   7.290   0.782
  268    HB2  CYS 540           HB2      CYS 540   8.643   5.236  -0.177
  269    HB3  CYS 540           HB1      CYS 540  10.005   5.977   0.647
  270    H    GLY 541           HN       GLY 541   7.553   8.791   2.229
  271    HA2  GLY 541           HA2      GLY 541   8.685  10.025   3.870
  272    HA3  GLY 541           HA1      GLY 541  10.199   9.677   3.048
  273    H    GLN 542           HN       GLN 542   9.675  10.541   0.520
  274    HA   GLN 542           HA       GLN 542  10.081  13.334   0.744
  275    HB2  GLN 542           HB2      GLN 542  11.059  11.960  -1.057
  276    HB3  GLN 542           HB1      GLN 542   9.451  11.678  -1.710
  277    HG2  GLN 542           HG2      GLN 542   9.210  14.062  -2.168
  278    HG3  GLN 542           HG1      GLN 542  10.813  14.356  -1.496
  279   HE21  GLN 542          HE21      GLN 542   9.014  13.037  -4.156
  280   HE22  GLN 542          HE22      GLN 542  10.346  12.870  -5.246
  281    H    SER 543           HN       SER 543   8.449  14.553   1.495
  282    HA   SER 543           HA       SER 543   5.950  14.562  -0.034
  283    HG   SER 543           HG       SER 543   6.471  12.555   2.615
  284    HB2  SER 543           HB2      SER 543   6.001  14.627   2.990
  285    HB3  SER 543           HB1      SER 543   4.586  14.523   1.942
  286    H    ALA 544           HN       ALA 544   5.111  16.563  -0.344
  287    HA   ALA 544           HA       ALA 544   5.942  18.790   1.317
  288    HB1  ALA 544           HB1      ALA 544   6.556  18.756  -1.639
  289    HB2  ALA 544           HB2      ALA 544   7.738  18.694  -0.331
  290    HB3  ALA 544           HB3      ALA 544   6.750  20.138  -0.560
  Start of MODEL   10
    1    H    SER 503           HN       SER 503  -7.062  -0.174  -1.622
    2    HA   SER 503           HA       SER 503  -7.371  -1.339   0.979
    3    HG   SER 503           HG       SER 503  -9.605  -1.519   0.152
    4    HB2  SER 503           HB2      SER 503  -8.118  -2.886  -1.533
    5    HB3  SER 503           HB1      SER 503  -7.878  -3.615   0.054
    6    H    CYS 504           HN       CYS 504  -5.927  -3.785   0.174
    7    HA   CYS 504           HA       CYS 504  -3.360  -2.891  -0.308
    8    HB2  CYS 504           HB2      CYS 504  -3.896  -5.288   0.206
    9    HB3  CYS 504           HB1      CYS 504  -4.444  -5.471  -1.466
   10    H    VAL 505           HN       VAL 505  -2.760  -1.559  -1.823
   11    HA   VAL 505           HA       VAL 505  -4.079  -1.250  -4.312
   12    HB   VAL 505           HB       VAL 505  -1.294  -0.309  -3.549
   13   HG11  VAL 505          HG11      VAL 505  -3.223   0.734  -5.627
   14   HG12  VAL 505          HG12      VAL 505  -1.739  -0.164  -5.951
   15   HG13  VAL 505          HG13      VAL 505  -1.657   1.438  -5.219
   16   HG21  VAL 505          HG21      VAL 505  -2.920   0.442  -1.912
   17   HG22  VAL 505          HG22      VAL 505  -3.953   1.069  -3.196
   18   HG23  VAL 505          HG23      VAL 505  -2.371   1.793  -2.903
   19    H    ASN 506           HN       ASN 506  -2.237  -3.694  -3.192
   20    HA   ASN 506           HA       ASN 506  -0.965  -4.259  -5.785
   21    HB2  ASN 506           HB2      ASN 506   0.488  -4.137  -3.729
   22    HB3  ASN 506           HB1      ASN 506  -0.339  -5.584  -3.148
   23   HD21  ASN 506          HD21      ASN 506   0.044  -7.559  -4.147
   24   HD22  ASN 506          HD22      ASN 506   1.382  -7.795  -5.228
   25    H    CYS 507           HN       CYS 507  -3.036  -5.772  -3.260
   26    HA   CYS 507           HA       CYS 507  -3.812  -7.710  -5.318
   27    HB2  CYS 507           HB2      CYS 507  -3.677  -8.993  -2.717
   28    HB3  CYS 507           HB1      CYS 507  -3.111  -9.552  -4.286
   29    H    GLY 508           HN       GLY 508  -4.606  -7.484  -1.809
   30    HA2  GLY 508           HA2      GLY 508  -7.347  -8.083  -2.720
   31    HA3  GLY 508           HA1      GLY 508  -6.573  -8.887  -1.370
   32    H    ARG 509           HN       ARG 509  -6.954  -8.209   0.574
   33    HA   ARG 509           HA       ARG 509  -9.162  -6.487   0.958
   34    HE   ARG 509           HE       ARG 509  -7.568 -10.810   1.355
   35    HB2  ARG 509           HB2      ARG 509  -7.309  -7.855   2.905
   36    HB3  ARG 509           HB1      ARG 509  -8.763  -6.987   3.385
   37    HG2  ARG 509           HG2      ARG 509 -10.131  -8.629   2.698
   38    HG3  ARG 509           HG1      ARG 509  -9.155  -8.988   1.273
   39    HD2  ARG 509           HD2      ARG 509  -7.670  -9.709   3.585
   40    HD3  ARG 509           HD1      ARG 509  -9.286 -10.402   3.725
   41   HH11  ARG 509          HH11      ARG 509  -9.763 -12.011   3.795
   42   HH12  ARG 509          HH12      ARG 509  -9.795 -13.632   3.155
   43   HH21  ARG 509          HH21      ARG 509  -7.627 -12.917   0.479
   44   HH22  ARG 509          HH22      ARG 509  -8.611 -14.133   1.245
   45    H    GLU 510           HN       GLU 510  -8.851  -5.022   3.197
   46    HA   GLU 510           HA       GLU 510  -7.994  -2.684   1.966
   47    HB2  GLU 510           HB2      GLU 510  -8.312  -1.567   4.156
   48    HB3  GLU 510           HB1      GLU 510  -9.674  -2.561   3.666
   49    HG2  GLU 510           HG2      GLU 510  -9.095  -4.262   5.229
   50    HG3  GLU 510           HG1      GLU 510  -7.554  -3.485   5.588
   51    H    ALA 511           HN       ALA 511  -6.396  -4.489   4.528
   52    HA   ALA 511           HA       ALA 511  -3.804  -4.282   3.841
   53    HB1  ALA 511           HB1      ALA 511  -4.034  -1.824   3.726
   54    HB2  ALA 511           HB2      ALA 511  -2.855  -2.331   4.936
   55    HB3  ALA 511           HB3      ALA 511  -4.460  -1.801   5.439
   56    H    MET 512           HN       MET 512  -2.282  -4.627   5.586
   57    HA   MET 512           HA       MET 512  -3.518  -5.188   8.195
   58    HB2  MET 512           HB2      MET 512  -0.855  -6.022   7.022
   59    HB3  MET 512           HB1      MET 512  -1.279  -6.259   8.712
   60    HG2  MET 512           HG2      MET 512  -3.160  -7.661   8.041
   61    HG3  MET 512           HG1      MET 512  -2.723  -7.432   6.348
   62    HE1  MET 512           HE1      MET 512  -2.656 -10.049   5.956
   63    HE2  MET 512           HE2      MET 512  -3.135 -10.292   7.636
   64    HE3  MET 512           HE3      MET 512  -1.753 -11.167   6.977
   65    H    SER 513           HN       SER 513  -0.444  -3.934   6.932
   66    HA   SER 513           HA       SER 513  -0.724  -1.633   8.744
   67    HG   SER 513           HG       SER 513   1.410  -2.852  10.365
   68    HB2  SER 513           HB2      SER 513   1.848  -2.794   7.648
   69    HB3  SER 513           HB1      SER 513   1.694  -1.458   8.797
   70    H    GLU 514           HN       GLU 514   0.439   0.314   7.911
   71    HA   GLU 514           HA       GLU 514   0.147   0.587   5.007
   72    HB2  GLU 514           HB2      GLU 514   0.414   2.664   7.188
   73    HB3  GLU 514           HB1      GLU 514   0.276   3.025   5.472
   74    HG2  GLU 514           HG2      GLU 514  -1.921   2.143   5.380
   75    HG3  GLU 514           HG1      GLU 514  -1.791   1.487   7.006
   76    H    CYS 515           HN       CYS 515   1.877   1.680   3.836
   77    HA   CYS 515           HA       CYS 515   4.271   0.485   3.876
   78    HB2  CYS 515           HB2      CYS 515   3.686   2.002   2.097
   79    HB3  CYS 515           HB1      CYS 515   3.740   3.380   3.191
   80    H    THR 516           HN       THR 516   5.682   0.157   5.483
   81    HA   THR 516           HA       THR 516   5.533   1.598   7.885
   82    HB   THR 516           HB       THR 516   7.572   0.276   8.538
   83    HG1  THR 516           HG1      THR 516   8.690  -0.482   6.908
   84   HG21  THR 516          HG21      THR 516   5.302  -0.530   8.950
   85   HG22  THR 516          HG22      THR 516   6.380  -1.865   8.543
   86   HG23  THR 516          HG23      THR 516   5.254  -1.242   7.336
   87    H    GLY 517           HN       GLY 517   6.930   2.700   5.118
   88    HA2  GLY 517           HA2      GLY 517   9.084   4.118   6.518
   89    HA3  GLY 517           HA1      GLY 517   8.852   4.060   4.779
   90    H    CYS 518           HN       CYS 518   5.837   4.612   5.721
   91    HA   CYS 518           HA       CYS 518   5.960   7.430   6.315
   92    HB2  CYS 518           HB2      CYS 518   5.141   8.244   4.208
   93    HB3  CYS 518           HB1      CYS 518   6.628   7.350   3.921
   94    H    HIS 519           HN       HIS 519   4.194   4.673   5.213
   95    HA   HIS 519           HA       HIS 519   2.140   3.845   5.473
   96    HD1  HIS 519           HD1      HIS 519   1.170   3.631   9.749
   97    HD2  HIS 519           HD2      HIS 519   4.570   4.094   7.436
   98    HE1  HIS 519           HE1      HIS 519   3.015   2.492  11.027
   99    HE2  HIS 519           HE2      HIS 519   5.109   3.109   9.770
  100    HB2  HIS 519           HB2      HIS 519   1.664   5.916   7.632
  101    HB3  HIS 519           HB1      HIS 519   0.735   4.458   7.350
  102    H    LYS 520           HN       LYS 520   2.722   5.949   3.570
  103    HA   LYS 520           HA       LYS 520   0.271   7.489   3.360
  104    HB2  LYS 520           HB2      LYS 520   2.730   7.226   1.655
  105    HB3  LYS 520           HB1      LYS 520   1.304   8.058   1.060
  106    HG2  LYS 520           HG2      LYS 520   1.448   9.600   2.989
  107    HG3  LYS 520           HG1      LYS 520   2.943   8.795   3.475
  108    HD2  LYS 520           HD2      LYS 520   4.098   9.535   1.586
  109    HD3  LYS 520           HD1      LYS 520   2.612   9.920   0.714
  110    HE2  LYS 520           HE2      LYS 520   3.637  11.969   1.395
  111    HE3  LYS 520           HE1      LYS 520   2.183  11.727   2.360
  112    HZ1  LYS 520           HZ1      LYS 520   5.004  11.522   3.184
  113    HZ2  LYS 520           HZ2      LYS 520   3.802  10.702   4.056
  114    HZ3  LYS 520           HZ3      LYS 520   3.737  12.388   3.902
  115    H    VAL 521           HN       VAL 521   1.141   4.332   2.630
  116    HA   VAL 521           HA       VAL 521  -1.064   4.011   0.776
  117    HB   VAL 521           HB       VAL 521   0.345   2.460  -0.642
  118   HG11  VAL 521          HG11      VAL 521   1.075   5.388  -0.692
  119   HG12  VAL 521          HG12      VAL 521  -0.321   4.645  -1.473
  120   HG13  VAL 521          HG13      VAL 521   1.308   4.249  -2.021
  121   HG21  VAL 521          HG21      VAL 521   2.774   2.843  -0.675
  122   HG22  VAL 521          HG22      VAL 521   2.230   2.181   0.866
  123   HG23  VAL 521          HG23      VAL 521   2.616   3.894   0.732
  124    H    ASN 522           HN       ASN 522  -1.572   1.594   0.630
  125    HA   ASN 522           HA       ASN 522  -0.701   0.249   3.057
  126    HB2  ASN 522           HB2      ASN 522  -3.132  -0.256   3.609
  127    HB3  ASN 522           HB1      ASN 522  -2.588   1.389   3.911
  128   HD21  ASN 522          HD21      ASN 522  -4.697  -0.634   2.108
  129   HD22  ASN 522          HD22      ASN 522  -5.537   0.627   1.276
  130    H    TYR 523           HN       TYR 523  -1.009  -1.946   3.118
  131    HA   TYR 523           HA       TYR 523  -1.702  -3.229   0.580
  132    HD1  TYR 523           HD2      TYR 523   0.366  -3.396  -1.588
  133    HD2  TYR 523           HD1      TYR 523   1.706  -1.299   1.865
  134    HE1  TYR 523           HE2      TYR 523   1.380  -1.680  -3.027
  135    HE2  TYR 523           HE1      TYR 523   2.722   0.420   0.434
  136    HH   TYR 523           HH       TYR 523   2.343   0.349  -3.086
  137    HB2  TYR 523           HB2      TYR 523   0.929  -3.590   2.032
  138    HB3  TYR 523           HB1      TYR 523   0.413  -4.479   0.604
  139    H    CYS 524           HN       CYS 524  -2.197  -5.410   0.757
  140    HA   CYS 524           HA       CYS 524  -3.545  -6.056   3.157
  141    HB2  CYS 524           HB2      CYS 524  -4.439  -7.890   2.015
  142    HB3  CYS 524           HB1      CYS 524  -4.209  -6.656   0.792
  143    H    SER 525           HN       SER 525  -0.576  -7.180   1.681
  144    HA   SER 525           HA       SER 525   0.106  -8.447   4.245
  145    HG   SER 525           HG       SER 525  -1.279  -9.951   2.039
  146    HB2  SER 525           HB2      SER 525   0.874  -9.460   1.501
  147    HB3  SER 525           HB1      SER 525   1.373 -10.163   3.040
  148    H    THR 526           HN       THR 526   2.673  -8.841   4.266
  149    HA   THR 526           HA       THR 526   3.874  -6.290   4.109
  150    HB   THR 526           HB       THR 526   5.134  -9.004   4.532
  151    HG1  THR 526           HG1      THR 526   4.122  -7.055   6.359
  152   HG21  THR 526          HG21      THR 526   6.793  -7.298   3.938
  153   HG22  THR 526          HG22      THR 526   6.944  -7.756   5.633
  154   HG23  THR 526          HG23      THR 526   6.163  -6.236   5.196
  155    H    PHE 527           HN       PHE 527   4.115  -9.198   2.054
  156    HA   PHE 527           HA       PHE 527   6.350  -8.368   0.586
  157    HD1  PHE 527           HD2      PHE 527   3.557  -9.377  -2.341
  158    HD2  PHE 527           HD1      PHE 527   3.557 -11.491   1.354
  159    HE1  PHE 527           HE2      PHE 527   1.241 -10.107  -2.765
  160    HE2  PHE 527           HE1      PHE 527   1.251 -12.231   0.934
  161    HZ   PHE 527           HZ       PHE 527   0.091 -11.540  -1.126
  162    HB2  PHE 527           HB2      PHE 527   5.663  -9.976  -1.149
  163    HB3  PHE 527           HB1      PHE 527   5.588 -10.671   0.466
  164    H    CYS 528           HN       CYS 528   2.953  -7.610   0.195
  165    HA   CYS 528           HA       CYS 528   2.944  -6.445  -2.312
  166    HB2  CYS 528           HB2      CYS 528   1.460  -5.199  -0.042
  167    HB3  CYS 528           HB1      CYS 528   0.909  -5.560  -1.677
  168    H    GLN 529           HN       GLN 529   3.727  -5.069   0.837
  169    HA   GLN 529           HA       GLN 529   3.903  -2.373   0.042
  170    HB2  GLN 529           HB2      GLN 529   3.663  -3.186   2.393
  171    HB3  GLN 529           HB1      GLN 529   5.327  -3.750   2.332
  172    HG2  GLN 529           HG2      GLN 529   5.938  -1.338   1.771
  173    HG3  GLN 529           HG1      GLN 529   4.302  -0.934   2.293
  174   HE21  GLN 529          HE21      GLN 529   7.453  -1.952   3.278
  175   HE22  GLN 529          HE22      GLN 529   7.195  -1.805   4.984
  176    H    ARG 530           HN       ARG 530   6.218  -4.977   0.379
  177    HA   ARG 530           HA       ARG 530   8.493  -3.338  -0.176
  178    HE   ARG 530           HE       ARG 530  11.205  -4.774   1.477
  179    HB2  ARG 530           HB2      ARG 530   8.237  -6.343  -0.098
  180    HB3  ARG 530           HB1      ARG 530   9.756  -5.452  -0.155
  181    HG2  ARG 530           HG2      ARG 530   8.856  -4.311   2.001
  182    HG3  ARG 530           HG1      ARG 530   7.788  -5.715   2.078
  183    HD2  ARG 530           HD2      ARG 530   9.682  -6.264   3.376
  184    HD3  ARG 530           HD1      ARG 530   9.863  -7.141   1.858
  185   HH11  ARG 530          HH11      ARG 530  11.441  -7.483   3.697
  186   HH12  ARG 530          HH12      ARG 530  13.132  -7.224   4.030
  187   HH21  ARG 530          HH21      ARG 530  13.429  -4.447   1.904
  188   HH22  ARG 530          HH22      ARG 530  14.252  -5.491   3.023
  189    H    LYS 531           HN       LYS 531   6.398  -5.404  -2.087
  190    HA   LYS 531           HA       LYS 531   8.178  -5.517  -4.338
  191    HB2  LYS 531           HB2      LYS 531   5.306  -6.324  -3.955
  192    HB3  LYS 531           HB1      LYS 531   6.125  -6.464  -5.504
  193    HG2  LYS 531           HG2      LYS 531   7.773  -7.954  -4.512
  194    HG3  LYS 531           HG1      LYS 531   6.972  -7.803  -2.945
  195    HD2  LYS 531           HD2      LYS 531   4.974  -8.838  -3.822
  196    HD3  LYS 531           HD1      LYS 531   5.665  -8.870  -5.446
  197    HE2  LYS 531           HE2      LYS 531   6.672 -10.377  -3.037
  198    HE3  LYS 531           HE1      LYS 531   5.821 -11.063  -4.420
  199    HZ1  LYS 531           HZ1      LYS 531   8.108 -11.465  -4.752
  200    HZ2  LYS 531           HZ2      LYS 531   8.534  -9.871  -4.379
  201    HZ3  LYS 531           HZ3      LYS 531   7.697 -10.208  -5.814
  202    H    ASP 532           HN       ASP 532   5.063  -3.849  -3.741
  203    HA   ASP 532           HA       ASP 532   4.983  -2.604  -6.290
  204    HB2  ASP 532           HB2      ASP 532   3.008  -2.923  -4.848
  205    HB3  ASP 532           HB1      ASP 532   3.681  -1.763  -3.706
  206    H    TRP 533           HN       TRP 533   6.601  -1.851  -3.339
  207    HA   TRP 533           HA       TRP 533   6.614   0.962  -3.690
  208    HD1  TRP 533           HD1      TRP 533   9.794  -1.646  -2.754
  209    HE1  TRP 533           HE1      TRP 533  12.088  -0.848  -1.875
  210    HE3  TRP 533           HE3      TRP 533   8.272   2.468  -0.165
  211    HZ2  TRP 533           HZ2      TRP 533  13.088   1.259  -0.275
  212    HZ3  TRP 533           HZ3      TRP 533   9.949   3.814   1.029
  213    HH2  TRP 533           HH2      TRP 533  12.311   3.212   0.984
  214    HB2  TRP 533           HB2      TRP 533   7.146   0.902  -1.532
  215    HB3  TRP 533           HB1      TRP 533   7.204  -0.855  -1.628
  216    H    LYS 534           HN       LYS 534   8.262  -1.289  -5.483
  217    HA   LYS 534           HA       LYS 534  10.798  -0.079  -5.740
  218    HB2  LYS 534           HB2      LYS 534   9.245  -1.257  -8.049
  219    HB3  LYS 534           HB1      LYS 534  10.989  -1.182  -7.852
  220    HG2  LYS 534           HG2      LYS 534   9.079  -2.881  -6.271
  221    HG3  LYS 534           HG1      LYS 534  10.189  -3.431  -7.524
  222    HD2  LYS 534           HD2      LYS 534  12.083  -2.955  -6.170
  223    HD3  LYS 534           HD1      LYS 534  11.101  -2.066  -4.999
  224    HE2  LYS 534           HE2      LYS 534   9.961  -4.074  -4.352
  225    HE3  LYS 534           HE1      LYS 534  10.783  -4.999  -5.609
  226    HZ1  LYS 534           HZ1      LYS 534  12.867  -4.659  -4.472
  227    HZ2  LYS 534           HZ2      LYS 534  11.748  -5.355  -3.412
  228    HZ3  LYS 534           HZ3      LYS 534  12.117  -3.703  -3.290
  229    H    ASP 535           HN       ASP 535   7.636   0.706  -6.883
  230    HA   ASP 535           HA       ASP 535   8.455   2.994  -8.462
  231    HB2  ASP 535           HB2      ASP 535   6.495   1.827  -9.201
  232    HB3  ASP 535           HB1      ASP 535   5.792   1.828  -7.582
  233    H    HIS 536           HN       HIS 536   6.865   2.317  -5.421
  234    HA   HIS 536           HA       HIS 536   6.383   4.969  -4.649
  235    HD1  HIS 536           HD1      HIS 536   3.889   4.990  -2.387
  236    HD2  HIS 536           HD2      HIS 536   7.546   3.794  -0.822
  237    HE1  HIS 536           HE1      HIS 536   4.143   6.143  -0.131
  238    HB2  HIS 536           HB2      HIS 536   5.080   3.163  -3.760
  239    HB3  HIS 536           HB1      HIS 536   6.510   2.428  -3.035
  240    H    GLN 537           HN       GLN 537   9.234   2.961  -4.064
  241    HA   GLN 537           HA       GLN 537  10.388   4.124  -1.874
  242    HB2  GLN 537           HB2      GLN 537  12.545   3.408  -2.737
  243    HB3  GLN 537           HB1      GLN 537  11.320   2.174  -3.008
  244    HG2  GLN 537           HG2      GLN 537  11.139   2.871  -5.340
  245    HG3  GLN 537           HG1      GLN 537  12.366   4.106  -5.066
  246   HE21  GLN 537          HE21      GLN 537  13.891   2.350  -3.269
  247   HE22  GLN 537          HE22      GLN 537  14.691   1.207  -4.296
  248    H    HIS 538           HN       HIS 538  10.026   5.510  -5.012
  249    HA   HIS 538           HA       HIS 538  12.101   7.457  -4.782
  250    HD2  HIS 538           HD2      HIS 538  10.220   4.602  -6.978
  251    HE1  HIS 538           HE1      HIS 538  13.603   5.440  -9.386
  252    HE2  HIS 538           HE2      HIS 538  11.779   3.754  -8.872
  253    HB2  HIS 538           HB2      HIS 538   9.690   7.427  -6.616
  254    HB3  HIS 538           HB1      HIS 538  11.117   8.437  -6.802
  255    H    ILE 539           HN       ILE 539   8.994   7.191  -3.378
  256    HA   ILE 539           HA       ILE 539   8.851  10.129  -3.117
  257    HB   ILE 539           HB       ILE 539   6.443  10.075  -3.142
  258   HG12  ILE 539          HG12      ILE 539   6.672   7.093  -3.613
  259   HG13  ILE 539          HG11      ILE 539   6.133   7.847  -2.115
  260   HG21  ILE 539          HG21      ILE 539   7.576   8.541  -5.477
  261   HG22  ILE 539          HG22      ILE 539   7.558  10.295  -5.293
  262   HG23  ILE 539          HG23      ILE 539   6.042   9.410  -5.468
  263   HD11  ILE 539          HD11      ILE 539   4.208   8.791  -3.287
  264   HD12  ILE 539          HD12      ILE 539   4.257   7.032  -3.418
  265   HD13  ILE 539          HD13      ILE 539   4.756   8.032  -4.784
  266    H    CYS 540           HN       CYS 540   9.264   7.241  -1.528
  267    HA   CYS 540           HA       CYS 540   7.666   7.716   0.775
  268    HB2  CYS 540           HB2      CYS 540   8.760   5.471   0.002
  269    HB3  CYS 540           HB1      CYS 540  10.162   6.062   0.880
  270    H    GLY 541           HN       GLY 541   8.286   8.393   2.749
  271    HA2  GLY 541           HA2      GLY 541   9.714   9.296   4.390
  272    HA3  GLY 541           HA1      GLY 541  10.934   9.550   3.151
  273    H    GLN 542           HN       GLN 542   9.077  10.846   1.325
  274    HA   GLN 542           HA       GLN 542   9.430  13.512   2.244
  275    HB2  GLN 542           HB2      GLN 542   9.477  12.777  -0.169
  276    HB3  GLN 542           HB1      GLN 542   7.733  12.582  -0.081
  277    HG2  GLN 542           HG2      GLN 542   7.575  14.989   0.565
  278    HG3  GLN 542           HG1      GLN 542   9.300  15.128   0.231
  279   HE21  GLN 542          HE21      GLN 542   7.105  16.509  -1.046
  280   HE22  GLN 542          HE22      GLN 542   7.157  16.086  -2.731
  281    H    SER 543           HN       SER 543   8.219  14.387   3.781
  282    HA   SER 543           HA       SER 543   5.312  13.918   3.677
  283    HG   SER 543           HG       SER 543   7.315  12.679   5.651
  284    HB2  SER 543           HB2      SER 543   7.003  14.875   6.005
  285    HB3  SER 543           HB1      SER 543   5.263  14.597   6.040
  286    H    ALA 544           HN       ALA 544   7.528  15.941   2.585
  287    HA   ALA 544           HA       ALA 544   5.673  18.159   2.427
  288    HB1  ALA 544           HB1      ALA 544   6.977  18.681   4.441
  289    HB2  ALA 544           HB2      ALA 544   7.313  19.823   3.142
  290    HB3  ALA 544           HB3      ALA 544   8.468  18.543   3.509