
data_3ebx.pdb                                

# Written with the PDB to CIF Convertor v0.9c  November 1993 [PEB]

_audit_creation_date        ?  
_audit_creation_method      'PDB2CIF Convertor version 0.9c'

_database_code_PDB                  3EBX 

_chemical_name_common 
;    ERABUTOXIN $B                                                
; 
_chemical_compound_source 
; SEA SNAKE (LATICAUDA $SEMIFASCIATA) VENOM                    
; 

_audit_contact_author_name  ' J.L.SMITH              '
_audit_contact_author_address    ? 
_audit_contact_author_phone      ? 
_audit_contact_author_fax        ? 
_audit_contact_author_email      ? 

loop_ 
_audit_author_name 
_audit_author_address 
' P.W.R.CORFIELD         '   ?  
' W.A.HENDRICKSON        '   ?  
' B.W.LOW                '   ?  

loop_
_database_PDB_rev_num
_database_PDB_rev_author_name
_database_PDB_rev_date
_database_PDB_rev_date_original
_database_PDB_rev_replaces
_database_PDB_rev_status
_database_PDB_rev_mod_type
  1   ?   88-APR-16    88-JAN-15 ?  ?   0 
  2   ?   88-OCT-09    88-JAN-15 ?  ?   1 

loop_
_database_PDB_rev_rec_rev_num
_database_PDB_rev_rec_type
   2     JRNL

loop_
_citation_id
_citation_coordinate_linkage
_citation_title
_citation_country
_citation_journal_abbrev
_citation_journal_volume
_citation_journal_issue
_citation_page_first
_citation_year
_citation_journal_coden_ASTM
_citation_journal_codon_ISSN
_citation_journal_codon_PDB
_citation_book_title
_citation_book_publisher
_citation_book_codon_ISBM
_citation_special_details
 
primary   yes
; REFINEMENT AT 1.4 ANGSTROMS RESOLUTION OF A MODEL  
  OF ERABUTOXIN $B.  TREATMENT OF ORDERED SOLVENT AND
  DISCRETE DISORDER                                  
;
 DK 'ACTA CRYSTALLOGR.,SECT.A    '   44  ?     357   1988 
'ACACEQ         ' '0108-7673                ' ? ? ? ? ?
 
  2       no
; THEORETICAL AND MODEL STUDIES                      
;
 SI 'ASIA PAC.J.PHARMACOL.       '    2  ?     115   1987 
'APJPEV         ' '0217-9687                ' ? ? ? ? ?
 
  3       no
; ERABUTOXIN $B. STRUCTURE(SLASH)FUNCTION            
  RELATIONSHIPS FOLLOWING INITIAL PROTEIN REFINEMENT 
  AT 0.140-NM RESOLUTION                             
;
 IX 'EUR.J.BIOCHEM.              '  161  ?     579   1986 
'EJBCAI         ' '0014-2956                ' ? ? ? ? ?
 
  4       no
; SEQUENCE ANALYSIS AT 0.140-NM RESOLUTION           
;
 IX 'EUR.J.BIOCHEM.              '  153  ?     521   1985 
'EJBCAI         ' '0014-2956                ' ? ? ? ? ?
 
  5       no
; THE TOXIN-*AGGLUTININ FOLD. A NEW GROUP OF SMALL   
  PROTEIN STRUCTURES ORGANIZED AROUND A              
  FOUR-DISULFIDE CORE                                
;
 US 'J.BIOL.CHEM.                '  255  ?    2652   1980 
'JBCHA3         ' '0021-9258                ' ? ? ? ? ?
 
  6       no
; MOLECULAR CONFORMATION OF ERABUTOXIN $B. ATOMIC    
  COORDINATES AT 2.5 ANGSTROMS RESOLUTION            
;
 US 'BIOCHEM.BIOPHYS.RES.COMM.   '   88  ?     950   1979 
'BBRCA9         ' '0006-291X                ' ? ? ? ? ?
 
  7       no
; THE THREE-*DIMENSIONAL STRUCTURE OF POSTSYNAPTIC   
  SNAKE NEUROTOXINS. CONSIDERATION OF STRUCTURE AND  
  FUNCTION                                           
;
 GW 'HANDB.EXP.PHARMACOL.        '   52  ?     213   1979 
'HEPHD2         ' '0171-2004                ' ? ? ? ? ?
 
  8       no
; THREE DIMENSIONAL STRUCTURE OF ERABUTOXIN $B       
  NEUROTOXIC PROTEIN. INHIBITOR OF ACETYLCHOLINE     
  RECEPTOR                                           
;
 US 'PROC.NAT.ACAD.SCI.USA       '   73  ?    2991   1976 
'PNASA6         ' '0027-8424                ' ? ? ? ? ?
 
  9       no
; X-RAY CRYSTALLOGRAPHIC STUDY OF THE ERABUTOXINS AND
  OF A DIIODO DERIVATIVE                             
;
 US 'J.BIOL.CHEM.                '  246  ?    4366   1971 
'JBCHA3         ' '0021-9258                ' ? ? ? ? ?

loop_
_citation_author_citation_id
_citation_author_name
 primary   'J.L.SMITH           ' 
 primary   'P.W.R.CORFIELD      ' 
 primary   'W.A.HENDRICKSON     ' 
 primary   'B.W.LOW             ' 
   2       'B.W.LOW             ' 
   2       'P.W.R.CORFIELD                             ' 
   3       'B.W.LOW             ' 
   3       'P.W.R.CORFIELD                             ' 
   4       'P.E.BOURNE          ' 
   4       'A.SATO              ' 
   4       'P.W.R.CORFIELD      ' 
   4       'L.S.ROSEN           ' 
   4       'S.BIRKEN            ' 
   4       'B.W.LOW                                   ' 
   5       'J.DRENTH            ' 
   5       'B.W.LOW             ' 
   5       'J.S.RICHARDSON      ' 
   5       'C.S.WRIGHT          ' 
   6       'M.R.KIMBALL         ' 
   6       'A.SATO              ' 
   6       'J.S.RICHARDSON      ' 
   6       'L.S.ROSEN           ' 
   6       'B.W.LOW             ' 
   7       'B.W.LOW                                            ' 
   8       'B.W.LOW             ' 
   8       'H.S.PRESTON         ' 
   8       'A.SATO              ' 
   8       'L.S.ROSEN           ' 
   8       'J.E.SEARL           ' 
   8       'A.D.RUDKO           ' 
   8       'J.S.RICHARDSON                           ' 
   9       'B.W.LOW             ' 
   9       'R.POTTER            ' 
   9       'R.B.JACKSON         ' 
   9       'N.TAMIYA            ' 
   9       'S.SATO              ' 

_diffrn_overall_dspacing_min ' 1.4 ANGSTROMS.                              ' 

loop_
_database_PDB_rev_remark_id
_database_PDB_rev_remark_text
  3
;                                                              
 REFINEMENT. BY THE RESTRAINED LEAST-SQUARES PROCEDURE OF J.  
  KONNERT AND W. HENDRICKSON (PROGRAM *PROLSQ*).  THE         
  STARTING COORDINATES WERE THOSE OF P. BOURNE ET AL.         
  (PREVIOUSLY DISTRIBUTED BY THE PROTEIN DATA BANK AS ENTRY   
  *2EBX*).  THE R VALUE IS 0.14 FOR 7732 REFLECTIONS WITH     
  FOBS**2 .GT. 2.0*SIGMA(FOBS)**2, REPRESENTING 74 PER CENT   
  OF THE TOTAL AVAILABLE DATA IN THE RESOLUTION RANGE 10.0    
  TO 1.4 ANGSTROMS.  (THE R VALUE IS 0.176 FOR ALL 10405      
  REFLECTIONS IN THIS SAME RANGE).  THE RMS DEVIATION FROM    
  IDEALITY OF THE BOND LENGTHS IS 0.016 ANGSTROMS. THE RMS    
  DEVIATION FROM IDEALITY OF THE BOND ANGLES IS 1.5 DEGREES.  
;

  4
;                                                              
 IN THIS STAGE OF THE REFINEMENT, EMPHASIS WAS ON DEFINING    
 DISORDERED GROUPS WITHIN THE PROTEIN AND ON EXTENDING THE    
 DESCRIPTION OF THE SOLVENT STRUCTURE.  THE FINAL MODEL       
 INCLUDES A TOTAL OF 111 SITES FOR WATER MOLECULES WITH       
 OCCUPANCY FACTORS RANGING FROM 0.3 TO 1.0.  THE SUM OF ALL   
 WATER OCCUPANCY FACTORS EQUALS 65.  ONE HALF-WEIGHT SULFATE  
 ION ALSO WAS LOCATED.  SOLVENT NUMBERING HERE CORRESPONDS    
 TO THAT PRESENTED IN THE *JRNL* REFERENCE ABOVE.  FOR THE    
 PROTEIN, THE FINAL MODEL INCLUDES TWO WELL-DEFINED           
 CONFORMERS FOR EACH OF SEVEN SIDE CHAINS, AND TWO LESS       
 WELL-DEFINED CONFORMERS FOR THE OCTAPEPTIDE SEGMENT 44-51.   
;

  5
;                                                              
 SHIFTS FROM ENTRY *2EBX* IN POSITIONS OF NON-DISORDERED      
 PROTEIN ATOMS ARE VERY SMALL. THE RMS DEVIATION IS 0.5       
 ANGSTROMS FOR ALL NON-DISORDERED ATOMS AND 0.07 ANGSTROMS    
 FOR MAIN CHAIN ATOMS.                                        
;

  6
;                                                              
 THE PREVIOUS REFINEMENT ESTABLISHED THE STRUCTURAL IDENTITY  
 OF ERABUTOXIN B AND NEUROTOXIN B.  ERABUTOXIN B WAS          
 ISOLATED FROM THE VENOM OF LATICAUDA SEMIFASCIATA FOUND OFF  
 THE OKINAWAS (RYUKU ISLANDS).  NEUROTOXIN B WAS ALSO         
 ISOLATED FROM THE VENOM OF LATICAUDA SEMIFASCIATA BUT FOUND  
 IN DIFFERENT PACIFIC OCEAN WATERS.  PREVIOUS CHEMICAL        
 SEQUENCE ERRORS IN THESE TOXINS AT HIS 6-GLU 7 AND           
 SER 18-PRO 19 WERE CORRECTED IN ENTRY *2EBX*.  THE CHEMICAL  
 DESIGNATION VAL 59 (CITED AS ARG 59 IN NEUROTOXIN B) WAS     
 ALSO UNAMBIGUOUSLY VERIFED.                                  
;

  7
;                                                              
 THE POSTSYNAPTIC NEUROTOXINS OF SEA SNAKE VENOM ARE          
 ANTAGONISTS OF THE NICOTINIC ACETYLCHOLINE RECEPTOR.  THE    
 HOMOLOGY BETWEEN ALL THESE VENOM NEUROTOXINS OF BOTH SHORT   
 AND LONG CHAIN SERIES IS ACKNOWLEDGED IN SOME PUBLICATIONS   
 BY SEQUENCE NUMBER CHANGES (SEE REFERENCE 6 ABOVE FOR        
 DETAILS).                                                    
;

  8
;                                                              
 THE FEATURES OF THE REACTIVE SITE OF ERABUTOXIN B ESTABLISH  
 IT AS A VALID PROTOTYPE FOR ALL THE POSTSYNAPTIC             
 NEUROTOXINS OF THIS SNAKE VENOM SERIES.  SITE *RCT* BELOW    
 PRESENTS THE SERIES INVARIANT RESIDUES OF THE REACTIVE       
 SITE.  FIVE OF THESE RESIDUES (PHE 32, ILE 36, GLU 38, ILE   
 50, LEU 52) ARE TYPE-CONSERVED THROUGHOUT THE SERIES.  THE   
 ENUMERATION IS FOR A 62-RESIDUE TOXIN.  SITE *FNR* BELOW     
 PRESENTS THE RESIDUES IN THE REACTIVE SITE SHOWN CHEMICALLY  
 TO BIND DIRECTLY TO RECEPTOR.  SITE *CMR* PRESENTS THE       
 RESIDUES, INCLUDING FOUR CYSTINE LINKAGES, WHICH AID IN      
 MAINTAINING THE UNIQUE TOXIN FOLD CONFORMATION.  ALL         
 RESIDUES PRESENTED ON *SITE* RECORDS BELOW ARE               
 COMMON-INVARIANT OR TYPE-CONSERVED HOMOLOGOUS SERIES         
 RESIDUES, EXCEPT GLY 42.  (IN THE LONG SERIES, INVARIANT     
 GLY 42 IS SUBSTITUTED BY INVARIANT ALA, ALA, THR.)           
;

  9
;                                                              
 ONLY MAIN-CHAIN TO MAIN-CHAIN HYDROGEN BONDS ARE PRESENTED   
 ON THE *CONECT* RECORDS BELOW.  SALT BRIDGES, MAIN-CHAIN TO  
 SIDE-CHAIN, SIDE-CHAIN TO SIDE-CHAIN AND HYDROGEN BONDS      
 INVOLVING WATER MOLECULES ARE NOT INCLUDED.                  
 THE RANGE OF N-H...O DISTANCES IS 2.77 TO 3.21 ANGSTROMS.    
 THE MEAN OF N-H...O IN BETA TURNS IS 3.15 ANGSTROMS.         
 THE MEAN OF N-H...O NOT IN TURNS IS 2.91 ANGSTROMS.          
;

 10
;                                                              
 THE BETA SHEET *DCE* WAS INADVERTENTLY NOT INCLUDED IN       
 ENTRY *2EBX*.                                                
;

 11
;                                                              
 CORRECTION. UPDATE JRNL REFERENCE TO REFLECT PUBLICATION.    
  09-OCT-88.                                                  
; 


loop_ 
_entity_poly_seq_entity_id
_entity_poly_seq_num
_entity_poly_seq_mon_id
 A    1 ARG A    2 ILE A    3 CYS A    4 PHE A    5 ASN A    6 HIS A    7 GLN
 A    8 SER A    9 SER A   10 GLN A   11 PRO A   12 GLN A   13 THR
 A   14 THR A   15 LYS A   16 THR A   17 CYS A   18 SER A   19 PRO A   20 GLY
 A   21 GLU A   22 SER A   23 SER A   24 CYS A   25 TYR A   26 HIS
 A   27 LYS A   28 GLN A   29 TRP A   30 SER A   31 ASP A   32 PHE A   33 ARG
 A   34 GLY A   35 THR A   36 ILE A   37 ILE A   38 GLU A   39 ARG
 A   40 GLY A   41 CYS A   42 GLY A   43 CYS A   44 PRO A   45 THR A   46 VAL
 A   47 LYS A   48 PRO A   49 GLY A   50 ILE A   51 LYS A   52 LEU
 A   53 SER A   54 CYS A   55 CYS A   56 GLU A   57 SER A   58 GLU A   59 VAL
 A   60 CYS A   61 ASN A   62 ASN

loop_
_atom_sites_footnote_id  
_atom_sites_footnote_text 
    1
;                                                              
  SEE REMARK 4.                                                
; 


loop_ 
_struct_conf_type_id
_struct_conf_type_criteria
_struct_conf_type_reference
  STRN        'From PDB'   ? 
  TURN        'From PDB'   ? 

loop_ 
_struct_conf_id
_struct_conf_conf_type_id
_struct_conf_beg_label_res_id
_struct_conf_beg_label_asym_id
_struct_conf_beg_label_seq_id
_struct_conf_end_label_res_id
_struct_conf_end_label_asym_id
_struct_conf_end_label_seq_id
_struct_conf_special_details
 'STRN AB'  STRN      ARG A    1 ASN A    5           ?
 'STRN AB'  STRN      THR A   13 CYS A   17           ?
 'STRNDCE'  STRN      GLY A   34 CYS A   41           ?
 'STRNDCE'  STRN      SER A   23 ASP A   31           ?
 'STRNDCE'  STRN      ILE A   50 CYS A   55           ?
 'TURN T1'  TURN      GLN A    7 GLN A   10   'TYPE II(PRIME) BEND           '
 'TURN T2'  TURN      SER A   18 GLU A   21   'TYPE II BEND                  '
 'TURN T3'  TURN      ASP A   31 GLY A   34   'TYPE I/III BEND               '
 'TURN T4'  TURN      LYS A   47 ILE A   50   'TYPE II BEND                  '
 'TURN T5'  TURN      SER A   57 CYS A   60   'TYPE II BEND (DISTORTED)      '

loop_
_struct_site_id
_struct_site_special_details
 RCT  ?
 RCT  ?
 RCT  ?
 RCT  ?
 RCT  ?
 FNR  ?
 CMR  ?
 CMR  ?
 CMR  ?
 CMR  ?

loop_
_struct_site_gen_id
_struct_site_gen_site_id
_struct_site_gen_label_res_id
_struct_site_gen_label_asym_id
_struct_site_gen_label_seq_id
_struct_site_gen_label_alt_id
_struct_site_gen_symmetry
_struct_site_gen_special_details
  1 RCT TYR A   25 ? 1_555 ? 
  2 RCT LYS A   27 ? 1_555 ? 
  3 RCT TRP A   29 ? 1_555 ? 
  4 RCT ASP A   31 ? 1_555 ? 
  5 RCT PHE A   32 ? 1_555 ? 
  6 RCT ARG A   33 ? 1_555 ? 
  7 RCT GLY A   34 ? 1_555 ? 
  8 RCT ILE A   36 ? 1_555 ? 
  9 RCT GLU A   38 ? 1_555 ? 
 10 RCT GLY A   40 ? 1_555 ? 
 11 RCT CYS A   41 ? 1_555 ? 
 12 RCT GLY A   42 ? 1_555 ? 
 13 RCT CYS A   43 ? 1_555 ? 
 14 RCT PRO A   44 ? 1_555 ? 
 15 RCT VAL A   46 ? 1_555 ? 
 16 RCT LYS A   47 ? 1_555 ? 
 17 RCT GLY A   49 ? 1_555 ? 
 18 RCT ILE A   50 ? 1_555 ? 
 19 RCT LEU A   52 ? 1_555 ? 
 20 RCT CYS A   54 ? 1_555 ? 
 21 FNR LYS A   27 ? 1_555 ? 
 22 FNR TRP A   29 ? 1_555 ? 
 23 FNR ARG A   33 ? 1_555 ? 
 24 FNR LYS A   47 ? 1_555 ? 
 25 CMR CYS A    3 ? 1_555 ? 
 26 CMR PHE A    4 ? 1_555 ? 
 27 CMR CYS A   17 ? 1_555 ? 
 28 CMR CYS A   24 ? 1_555 ? 
 29 CMR TYR A   25 ? 1_555 ? 
 30 CMR GLY A   40 ? 1_555 ? 
 31 CMR CYS A   41 ? 1_555 ? 
 32 CMR GLY A   42 ? 1_555 ? 
 33 CMR CYS A   43 ? 1_555 ? 
 34 CMR CYS A   54 ? 1_555 ? 
 35 CMR CYS A   55 ? 1_555 ? 
 36 CMR CYS A   60 ? 1_555 ? 
 37 CMR ASN A   61 ? 1_555 ? 

_cell_length_a           49.940 
_cell_length_b           46.580 
_cell_length_c           21.590 
_cell_angle_alpha        90.000 
_cell_angle_beta         90.000 
_cell_angle_gamma        90.000 
_cell_volume           168219.0 
_cell_special_details         ? 
_cell_formula_units_Z         4 

_symmetry_space_group_name_H_M   ' P 21 21 21' 


_atom_sites_Cartn_transform_axes       ?
_atom_sites_fract_tran_matrix_11    0.020024
_atom_sites_fract_tran_matrix_12    0.000000
_atom_sites_fract_tran_matrix_13    0.000000
_atom_sites_fract_tran_vector_11     0.00000
_atom_sites_fract_tran_matrix_21    0.000000
_atom_sites_fract_tran_matrix_22    0.021468
_atom_sites_fract_tran_matrix_23    0.000000
_atom_sites_fract_tran_vector_22     0.00000
_atom_sites_fract_tran_matrix_31    0.000000
_atom_sites_fract_tran_matrix_32    0.000000
_atom_sites_fract_tran_matrix_33    0.046948
_atom_sites_fract_tran_vector_33     0.00000

loop_
_struct_conn_type_id
_struct_conn_type_criteria
_struct_conn_type_reference
saltbr  'defined by user in PDB file'  ?
hydrog  'defined by user in PDB file'  ?
disulf  'defined by user in PDB file'  ?

loop_
_struct_conn_id
_struct_conn_conn_type_id
_struct_conn_par1_label_res_id
_struct_conn_par1_label_asym_id
_struct_conn_par1_label_seq_id
_struct_conn_par1_label_atom_id
_struct_conn_par1_label_alt_id
_struct_conn_role_par1
_struct_conn_symmetry_par1
_struct_conn_par2_label_res_id
_struct_conn_par2_label_asym_id
_struct_conn_par2_label_seq_id
_struct_conn_par2_label_atom_id
_struct_conn_par2_label_alt_id
_struct_conn_role_par2
_struct_conn_symmetry_par2
_struct_conn_special_details
  1 covale ARG A    1 ' O  '  ?   ? 1_555 ARG A    1 ' C  '  ?   ? 1_555 ?
  2 hydrog ARG A    1 ' O  '  ? acc 1_555 CYS A   17 ' N  '  ? don 1_555 ?
  3 covale ILE A    2 ' O  '  ?   ? 1_555 ILE A    2 ' C  '  ?   ? 1_555 ?
  4 hydrog ILE A    2 ' O  '  ? acc 1_555 VAL A   59 ' N  '  ? don 1_555 ?
  5 covale CYS A    3 ' N  '  ?   ? 1_555 ILE A    2 ' C  '  ?   ? 1_555 ?
  6 covale CYS A    3 ' N  '  ?   ? 1_555 CYS A    3 ' CA '  ?   ? 1_555 ?
  7 hydrog CYS A    3 ' N  '  ? don 1_555 LYS A   15 ' O  '  ? acc 1_555 ?
  8 covale CYS A    3 ' O  '  ?   ? 1_555 CYS A    3 ' C  '  ?   ? 1_555 ?
  9 hydrog CYS A    3 ' O  '  ? acc 1_555 LYS A   15 ' N  '  ? don 1_555 ?
 10 covale CYS A    3 ' SG '  ?   ? 1_555 CYS A    3 ' CB '  ?   ? 1_555 ?
 11 covale CYS A    3 ' SG '  ?   ? 1_555 CYS A   24 ' SG '  ?   ? 1_555 ?
 12 covale ASN A    5 ' N  '  ?   ? 1_555 PHE A    4 ' C  '  ?   ? 1_555 ?
 13 covale ASN A    5 ' N  '  ?   ? 1_555 ASN A    5 ' CA '  ?   ? 1_555 ?
 14 hydrog ASN A    5 ' N  '  ? don 1_555 THR A   13 ' O  '  ? acc 1_555 ?
 15 covale GLN A    7 ' O  '  ?   ? 1_555 GLN A    7 ' C  '  ?   ? 1_555 ?
 16 hydrog GLN A    7 ' O  '  ? acc 1_555 GLN A   10 ' N  '  ? don 1_555 ?
 17 covale SER A    8 ' N  '  ?   ? 1_555 GLN A    7 ' C  '  ?   ? 1_555 ?
 18 covale SER A    8 ' N  '  ?   ? 1_555 SER A    8 ' CA '  ?   ? 1_555 ?
 19 hydrog SER A    8 ' N  '  ? don 1_555 ILE A   37 ' O  '  ? acc 1_555 ?
 20 covale GLN A   10 ' N  '  ?   ? 1_555 SER A    9 ' C  '  A   ? 1_555 ?
 21 covale GLN A   10 ' N  '  ?   ? 1_555 SER A    9 ' C  '  B   ? 1_555 ?
 22 covale GLN A   10 ' N  '  ?   ? 1_555 GLN A   10 ' CA '  ?   ? 1_555 ?
 23 hydrog GLN A   10 ' N  '  ? don 1_555 GLN A    7 ' O  '  ? acc 1_555 ?
 24 covale THR A   13 ' O  '  ?   ? 1_555 THR A   13 ' C  '  ?   ? 1_555 ?
 25 hydrog THR A   13 ' O  '  ? acc 1_555 ASN A    5 ' N  '  ? don 1_555 ?
 26 covale LYS A   15 ' N  '  ?   ? 1_555 THR A   14 ' C  '  ?   ? 1_555 ?
 27 covale LYS A   15 ' N  '  ?   ? 1_555 LYS A   15 ' CA '  ?   ? 1_555 ?
 28 hydrog LYS A   15 ' N  '  ? don 1_555 CYS A    3 ' O  '  ? acc 1_555 ?
 29 covale LYS A   15 ' O  '  ?   ? 1_555 LYS A   15 ' C  '  ?   ? 1_555 ?
 30 hydrog LYS A   15 ' O  '  ? acc 1_555 CYS A    3 ' N  '  ? don 1_555 ?
 31 covale CYS A   17 ' N  '  ?   ? 1_555 THR A   16 ' C  '  ?   ? 1_555 ?
 32 covale CYS A   17 ' N  '  ?   ? 1_555 CYS A   17 ' CA '  ?   ? 1_555 ?
 33 hydrog CYS A   17 ' N  '  ? don 1_555 ARG A    1 ' O  '  ? acc 1_555 ?
 34 covale CYS A   17 ' SG '  ?   ? 1_555 CYS A   17 ' CB '  ?   ? 1_555 ?
 35 covale CYS A   17 ' SG '  ?   ? 1_555 CYS A   41 ' SG '  ?   ? 1_555 ?
 36 covale SER A   18 ' O  '  ?   ? 1_555 SER A   18 ' C  '  ?   ? 1_555 ?
 37 hydrog SER A   18 ' O  '  ? acc 1_555 GLU A   21 ' N  '  ? don 1_555 ?
 38 covale GLU A   21 ' N  '  ?   ? 1_555 GLY A   20 ' C  '  ?   ? 1_555 ?
 39 covale GLU A   21 ' N  '  ?   ? 1_555 GLU A   21 ' CA '  ?   ? 1_555 ?
 40 hydrog GLU A   21 ' N  '  ? don 1_555 SER A   18 ' O  '  ? acc 1_555 ?
 41 covale SER A   23 ' O  '  ?   ? 1_555 SER A   23 ' C  '  ?   ? 1_555 ?
 42 hydrog SER A   23 ' O  '  ? acc 1_555 GLY A   42 ' N  '  ? don 1_555 ?
 43 covale CYS A   24 ' N  '  ?   ? 1_555 SER A   23 ' C  '  ?   ? 1_555 ?
 44 covale CYS A   24 ' N  '  ?   ? 1_555 CYS A   24 ' CA '  ?   ? 1_555 ?
 45 hydrog CYS A   24 ' N  '  ? don 1_555 CYS A   55 ' O  '  ? acc 1_555 ?
 46 covale CYS A   24 ' O  '  ?   ? 1_555 CYS A   24 ' C  '  ?   ? 1_555 ?
 47 hydrog CYS A   24 ' O  '  ? acc 1_555 CYS A   55 ' N  '  ? don 1_555 ?
 48 covale CYS A   24 ' SG '  ?   ? 1_555 CYS A    3 ' SG '  ?   ? 1_555 ?
 49 covale CYS A   24 ' SG '  ?   ? 1_555 CYS A   24 ' CB '  ?   ? 1_555 ?
 50 covale TYR A   25 ' N  '  ?   ? 1_555 CYS A   24 ' C  '  ?   ? 1_555 ?
 51 covale TYR A   25 ' N  '  ?   ? 1_555 TYR A   25 ' CA '  ?   ? 1_555 ?
 52 hydrog TYR A   25 ' N  '  ? don 1_555 GLY A   40 ' O  '  ? acc 1_555 ?
 53 covale TYR A   25 ' O  '  ?   ? 1_555 TYR A   25 ' C  '  ?   ? 1_555 ?
 54 hydrog TYR A   25 ' O  '  ? acc 1_555 GLY A   40 ' N  '  ? don 1_555 ?
 55 covale HIS A   26 ' N  '  ?   ? 1_555 TYR A   25 ' C  '  ?   ? 1_555 ?
 56 covale HIS A   26 ' N  '  ?   ? 1_555 HIS A   26 ' CA '  ?   ? 1_555 ?
 57 hydrog HIS A   26 ' N  '  ? don 1_555 SER A   53 ' O  '  ? acc 1_555 ?
 58 covale HIS A   26 ' O  '  ?   ? 1_555 HIS A   26 ' C  '  ?   ? 1_555 ?
 59 hydrog HIS A   26 ' O  '  ? acc 1_555 SER A   53 ' N  '  ? don 1_555 ?
 60 covale LYS A   27 ' N  '  ?   ? 1_555 HIS A   26 ' C  '  ?   ? 1_555 ?
 61 covale LYS A   27 ' N  '  ?   ? 1_555 LYS A   27 ' CA '  ?   ? 1_555 ?
 62 hydrog LYS A   27 ' N  '  ? don 1_555 GLU A   38 ' O  '  ? acc 1_555 ?
 63 covale LYS A   27 ' O  '  ?   ? 1_555 LYS A   27 ' C  '  ?   ? 1_555 ?
 64 hydrog LYS A   27 ' O  '  ? acc 1_555 GLU A   38 ' N  '  ? don 1_555 ?
 65 covale GLN A   28 ' N  '  ?   ? 1_555 LYS A   27 ' C  '  ?   ? 1_555 ?
 66 covale GLN A   28 ' N  '  ?   ? 1_555 GLN A   28 ' CA '  ?   ? 1_555 ?
 67 hydrog GLN A   28 ' N  '  ? don 1_555 LYS A   51 ' O  '  A acc 1_555 ?
 68 hydrog GLN A   28 ' N  '  ? don 1_555 LYS A   51 ' O  '  B acc 1_555 ?
 69 covale GLN A   28 ' O  '  ?   ? 1_555 GLN A   28 ' C  '  ?   ? 1_555 ?
 70 hydrog GLN A   28 ' O  '  ? acc 1_555 LYS A   51 ' N  '  A don 1_555 ?
 71 hydrog GLN A  GLN '    '  ? acc 1_555 LYS A   51 ' N  '  B don 1_555 ?
 72 covale TRP A   29 ' N  '  ?   ? 1_555 GLN A   28 ' C  '  ?   ? 1_555 ?
 73 covale TRP A   29 ' N  '  ?   ? 1_555 TRP A   29 ' CA '  ?   ? 1_555 ?
 74 hydrog TRP A   29 ' N  '  ? don 1_555 ILE A   36 ' O  '  ? acc 1_555 ?
 75 covale TRP A   29 ' O  '  ?   ? 1_555 TRP A   29 ' C  '  ?   ? 1_555 ?
 76 hydrog TRP A   29 ' O  '  ? acc 1_555 ILE A   36 ' N  '  ? don 1_555 ?
 77 covale ASP A   31 ' O  '  ?   ? 1_555 ASP A   31 ' C  '  ?   ? 1_555 ?
 78 hydrog ASP A   31 ' O  '  ? acc 1_555 GLY A   34 ' N  '  ? don 1_555 ?
 79 covale GLY A   34 ' N  '  ?   ? 1_555 ARG A   33 ' C  '  ?   ? 1_555 ?
 80 covale GLY A   34 ' N  '  ?   ? 1_555 GLY A   34 ' CA '  ?   ? 1_555 ?
 81 hydrog GLY A   34 ' N  '  ? don 1_555 ASP A   31 ' O  '  ? acc 1_555 ?
 82 covale ILE A   36 ' N  '  ?   ? 1_555 THR A   35 ' C  '  ?   ? 1_555 ?
 83 covale ILE A   36 ' N  '  ?   ? 1_555 ILE A   36 ' CA '  ?   ? 1_555 ?
 84 hydrog ILE A   36 ' N  '  ? don 1_555 TRP A   29 ' O  '  ? acc 1_555 ?
 85 covale ILE A   36 ' O  '  ?   ? 1_555 ILE A   36 ' C  '  ?   ? 1_555 ?
 86 hydrog ILE A   36 ' O  '  ? acc 1_555 TRP A   29 ' N  '  ? don 1_555 ?
 87 covale ILE A   37 ' O  '  ?   ? 1_555 ILE A   37 ' C  '  ?   ? 1_555 ?
 88 hydrog ILE A   37 ' O  '  ? acc 1_555 SER A    8 ' N  '  ? don 1_555 ?
 89 covale GLU A   38 ' N  '  ?   ? 1_555 ILE A   37 ' C  '  ?   ? 1_555 ?
 90 covale GLU A   38 ' N  '  ?   ? 1_555 GLU A   38 ' CA '  ?   ? 1_555 ?
 91 hydrog GLU A   38 ' N  '  ? don 1_555 LYS A   27 ' O  '  ? acc 1_555 ?
 92 covale GLU A   38 ' O  '  ?   ? 1_555 GLU A   38 ' C  '  ?   ? 1_555 ?
 93 hydrog GLU A   38 ' O  '  ? acc 1_555 LYS A   27 ' N  '  ? don 1_555 ?
 94 covale GLY A   40 ' N  '  ?   ? 1_555 ARG A   39 ' C  '  ?   ? 1_555 ?
 95 covale GLY A   40 ' N  '  ?   ? 1_555 GLY A   40 ' CA '  ?   ? 1_555 ?
 96 hydrog GLY A   40 ' N  '  ? don 1_555 TYR A   25 ' O  '  ? acc 1_555 ?
 97 covale GLY A   40 ' O  '  ?   ? 1_555 GLY A   40 ' C  '  ?   ? 1_555 ?
 98 hydrog GLY A   40 ' O  '  ? acc 1_555 TYR A   25 ' N  '  ? don 1_555 ?
 99 covale CYS A   41 ' SG '  ?   ? 1_555 CYS A   17 ' SG '  ?   ? 1_555 ?
100 covale CYS A   41 ' SG '  ?   ? 1_555 CYS A   41 ' CB '  ?   ? 1_555 ?
101 covale GLY A   42 ' N  '  ?   ? 1_555 CYS A   41 ' C  '  ?   ? 1_555 ?
102 covale GLY A   42 ' N  '  ?   ? 1_555 GLY A   42 ' CA '  ?   ? 1_555 ?
103 hydrog GLY A   42 ' N  '  ? don 1_555 SER A   23 ' O  '  ? acc 1_555 ?
104 covale CYS A   43 ' SG '  ?   ? 1_555 CYS A   43 ' CB '  ?   ? 1_555 ?
105 covale CYS A   43 ' SG '  ?   ? 1_555 CYS A   54 ' SG '  ?   ? 1_555 ?
106 covale LYS A   47 ' O  '  B   ? 1_555 LYS A   47 ' C  '  B   ? 1_555 ?
107 hydrog LYS A   47 ' O  '  B acc 1_555 ILE A   50 ' N  '  A don 1_555 ?
108 covale ILE A   50 ' N  '  A   ? 1_555 GLY A   49 ' C  '  A   ? 1_555 ?
109 covale ILE A   50 ' N  '  A   ? 1_555 ILE A   50 ' CA '  A   ? 1_555 ?
110 hydrog ILE A   50 ' N  '  A don 1_555 LYS A   47 ' O  '  B acc 1_555 ?
111 covale LYS A   51 ' N  '  A   ? 1_555 ILE A   50 ' C  '  A   ? 1_555 ?
112 covale LYS A   51 ' N  '  A   ? 1_555 LYS A   51 ' CA '  A   ? 1_555 ?
113 hydrog LYS A   51 ' N  '  A don 1_555 GLN A   28 ' O  '  ? acc 1_555 ?
114 covale LYS A   51 ' N  '  B   ? 1_555 ILE A   50 ' C  '  B   ? 1_555 ?
115 covale LYS A   51 ' N  '  B   ? 1_555 LYS A   51 ' CA '  B   ? 1_555 ?
116 hydrog LYS A   51 ' N  '  B don 1_555 GLN A   28 ' O  '  ? acc 1_555 ?
117 covale LYS A   51 ' O  '  A   ? 1_555 LYS A   51 ' C  '  A   ? 1_555 ?
118 hydrog LYS A   51 ' O  '  A acc 1_555 GLN A   28 ' N  '  ? don 1_555 ?
119 covale LYS A   51 ' O  '  B   ? 1_555 LYS A   51 ' C  '  B   ? 1_555 ?
120 hydrog LYS A   51 ' O  '  B acc 1_555 GLN A   28 ' N  '  ? don 1_555 ?
121 covale SER A   53 ' N  '  ?   ? 1_555 LEU A   52 ' C  '  ?   ? 1_555 ?
122 covale SER A   53 ' N  '  ?   ? 1_555 SER A   53 ' CA '  ?   ? 1_555 ?
123 hydrog SER A   53 ' N  '  ? don 1_555 HIS A   26 ' O  '  ? acc 1_555 ?
124 covale SER A   53 ' O  '  ?   ? 1_555 SER A   53 ' C  '  ?   ? 1_555 ?
125 hydrog SER A   53 ' O  '  ? acc 1_555 HIS A   26 ' N  '  ? don 1_555 ?
126 covale CYS A   54 ' SG '  ?   ? 1_555 CYS A   43 ' SG '  ?   ? 1_555 ?
127 covale CYS A   54 ' SG '  ?   ? 1_555 CYS A   54 ' CB '  ?   ? 1_555 ?
128 covale CYS A   55 ' N  '  ?   ? 1_555 CYS A   54 ' C  '  ?   ? 1_555 ?
129 covale CYS A   55 ' N  '  ?   ? 1_555 CYS A   55 ' CA '  ?   ? 1_555 ?
130 hydrog CYS A   55 ' N  '  ? don 1_555 CYS A   24 ' O  '  ? acc 1_555 ?
131 covale CYS A   55 ' O  '  ?   ? 1_555 CYS A   55 ' C  '  ?   ? 1_555 ?
132 hydrog CYS A   55 ' O  '  ? acc 1_555 CYS A   24 ' N  '  ? don 1_555 ?
133 covale CYS A   55 ' SG '  ?   ? 1_555 CYS A   55 ' CB '  ?   ? 1_555 ?
134 covale CYS A   55 ' SG '  ?   ? 1_555 CYS A   60 ' SG '  ?   ? 1_555 ?
135 covale SER A   57 ' O  '  A   ? 1_555 SER A   57 ' C  '  A   ? 1_555 ?
136 hydrog SER A   57 ' O  '  A acc 1_555 CYS A   60 ' N  '  ? don 1_555 ?
137 covale SER A   57 ' O  '  B   ? 1_555 SER A   57 ' C  '  B   ? 1_555 ?
138 hydrog SER A   57 ' O  '  B acc 1_555 CYS A   60 ' N  '  ? don 1_555 ?
139 covale VAL A   59 ' N  '  ?   ? 1_555 GLU A   58 ' C  '  ?   ? 1_555 ?
140 covale VAL A   59 ' N  '  ?   ? 1_555 VAL A   59 ' CA '  ?   ? 1_555 ?
141 hydrog VAL A   59 ' N  '  ? don 1_555 ILE A    2 ' O  '  ? acc 1_555 ?
142 covale CYS A   60 ' N  '  ?   ? 1_555 VAL A   59 ' C  '  ?   ? 1_555 ?
143 covale CYS A   60 ' N  '  ?   ? 1_555 CYS A   60 ' CA '  ?   ? 1_555 ?
144 hydrog CYS A   60 ' N  '  ? don 1_555 SER A   57 ' O  '  A acc 1_555 ?
145 hydrog CYS A   60 ' N  '  ? don 1_555 SER A   57 ' O  '  B acc 1_555 ?
146 covale CYS A   60 ' SG '  ?   ? 1_555 CYS A   55 ' SG '  ?   ? 1_555 ?
147 covale CYS A   60 ' SG '  ?   ? 1_555 CYS A   60 ' CB '  ?   ? 1_555 ?
148 covale SO4 A    1 ' S  '  ?   ? 1_555 SO4 A    1 ' O1 '  ?   ? 1_555 ?
149 covale SO4 A    1 ' S  '  ?   ? 1_555 SO4 A    1 ' O2 '  ?   ? 1_555 ?
150 covale SO4 A    1 ' S  '  ?   ? 1_555 SO4 A    1 ' O3 '  ?   ? 1_555 ?
151 covale SO4 A    1 ' S  '  ?   ? 1_555 SO4 A    1 ' O4 '  ?   ? 1_555 ?
152 covale SO4 A    1 ' O1 '  ?   ? 1_555 SO4 A    1 ' S  '  ?   ? 1_555 ?
153 covale SO4 A    1 ' O2 '  ?   ? 1_555 SO4 A    1 ' S  '  ?   ? 1_555 ?
154 covale SO4 A    1 ' O3 '  ?   ? 1_555 SO4 A    1 ' S  '  ?   ? 1_555 ?
155 covale SO4 A    1 ' O4 '  ?   ? 1_555 SO4 A    1 ' S  '  ?   ? 1_555 ?
156 disulf CYS A '   3'  ?    ?   ? 1_555 CYS A '  24'  ?    ?   ? 1_555
'?                             '
157 disulf CYS A '  17'  ?    ?   ? 1_555 CYS A '  41'  ?    ?   ? 1_555
'?                             '
158 disulf CYS A '  43'  ?    ?   ? 1_555 CYS A '  54'  ?    ?   ? 1_555
'?                             '
159 disulf CYS A '  55'  ?    ?   ? 1_555 CYS A '  60'  ?    ?   ? 1_555
'?                             '

loop_
_entity_id
_entity_type
_entity_name_common
_entity_name_systematic
_entity_name_systematic_system
_entity_source
_entity_special_details
 HOH  non-polymer           ?             ? ? ? ? 

loop_ 
_entity_poly_entity_id
_entity_poly_type
_entity_poly_formula_weight
_entity_poly_non_s_chirality
_entity_poly_non_s_linkage
_entity_poly_non_s_monomer
_entity_poly_type_details

loop_
_entity_nonp_id
_entity_nonp_entity_id
_entity_nonp_formula
_entity_nonp_formula_weight
_entity_nonp_number_of_nh_atoms
_entity_nonp_model_source
_entity_nonp_model_erf
_entity_nonp_model_details
   1 SO4 'O4 S1 --                                            ' ? ? ? ? ?
   2 HOH '111(H2 O1)                                          ' ? ? ? ? ?

loop_
_atom_sites_alt_id
_atom_sites_alt_details
   A    ? 
   B    ? 

loop_
_atom_site_group_PDB
_atom_site_type_symbol 
_atom_site_label_atom_id 
_atom_site_label_res_id 
_atom_site_label_asym_id 
_atom_site_label_seq_id 
_atom_site_label_alt_id 
_atom_site_Cartn_x 
_atom_site_Cartn_y 
_atom_site_Cartn_z 
_atom_site_occupancy
_atom_site_B_iso_or_equiv 
_atom_site_footnote_id
_atom_site_entity_id
_atom_site_entity_seq_num
  ATOM N ' N  ' ARG A    1 ?   11.065    7.352    9.598  1.00  9.90  ?    A    1
  ATOM C ' CA ' ARG A    1 ?   12.436    7.764    9.902  1.00  8.93  ?    A    1
  ATOM C ' C  ' ARG A    1 ?   12.883    7.090   11.208  1.00  8.54  ?    A    1
  ATOM O ' O  ' ARG A    1 ?   12.088    7.000   12.147  1.00  9.45  ?    A    1
  ATOM C ' CB ' ARG A    1 ?   12.611    9.264   10.060  1.00  9.90  ?    A    1
  ATOM C ' CG ' ARG A    1 ?   13.934    9.828   10.490  1.00 12.23  ?    A    1
  ATOM C ' CD ' ARG A    1 ?   15.037    9.669    9.467  1.00 11.95  ?    A    1
  ATOM N ' NE ' ARG A    1 ?   14.741   10.489    8.291  1.00 12.32  ?    A    1
  ATOM C ' CZ ' ARG A    1 ?   14.442   10.077    7.055  1.00 14.48  ?    A    1
  ATOM N ' NH1' ARG A    1 ?   14.416    8.776    6.715  1.00 15.99  ?    A    1
  ATOM N ' NH2' ARG A    1 ?   14.192   11.041    6.158  1.00 15.84  ?    A    1
  ATOM N ' N  ' ILE A    2 ?   14.105    6.667   11.195  1.00  6.77  ?    A    2
  ATOM C ' CA ' ILE A    2 ?   14.738    6.044   12.368  1.00  7.83  ?    A    2
  ATOM C ' C  ' ILE A    2 ?   15.979    6.942   12.628  1.00  8.57  ?    A    2
  ATOM O ' O  ' ILE A    2 ?   16.691    7.299   11.653  1.00  8.87  ?    A    2
  ATOM C ' CB ' ILE A    2 ?   15.182    4.556   12.120  1.00  9.88  ?    A    2
  ATOM C ' CG1' ILE A    2 ?   13.888    3.688   12.093  1.00 15.37  ?    A    2
  ATOM C ' CG2' ILE A    2 ?   16.132    4.170   13.275  1.00 11.34  ?    A    2
  ATOM C ' CD1' ILE A    2 ?   14.101    2.246   11.521  1.00 18.74  ?    A    2
  ATOM N ' N  ' CYS A    3 ?   16.149    7.340   13.890  1.00  6.37  ?    A    3
  ATOM C ' CA ' CYS A    3 ?   17.317    8.191   14.194  1.00  7.05  ?    A    3
  ATOM C ' C  ' CYS A    3 ?   18.089    7.606   15.365  1.00  7.14  ?    A    3
  ATOM O ' O  ' CYS A    3 ?   17.520    6.890   16.183  1.00  8.19  ?    A    3
  ATOM C ' CB ' CYS A    3 ?   16.742    9.548   14.704  1.00  7.18  ?    A    3
  ATOM S ' SG ' CYS A    3 ?   15.807   10.533   13.546  1.00  6.75  ?    A    3
  ATOM N ' N  ' PHE A    4 ?   19.355    7.993   15.480  1.00  6.87  ?    A    4
  ATOM C ' CA ' PHE A    4 ?   20.072    7.601   16.712  1.00  6.16  ?    A    4
  ATOM C ' C  ' PHE A    4 ?   19.513    8.393   17.864  1.00  6.14  ?    A    4
  ATOM O ' O  ' PHE A    4 ?   19.006    9.534   17.659  1.00  6.93  ?    A    4
  ATOM C ' CB ' PHE A    4 ?   21.567    7.923   16.558  1.00  7.38  ?    A    4
  ATOM C ' CG ' PHE A    4 ?   22.297    6.952   15.676  1.00  8.82  ?    A    4
  ATOM C ' CD1' PHE A    4 ?   22.956    7.333   14.524  1.00 11.78  ?    A    4
  ATOM C ' CD2' PHE A    4 ?   22.247    5.593   16.102  1.00 11.69  ?    A    4
  ATOM C ' CE1' PHE A    4 ?   23.610    6.358   13.762  1.00 13.33  ?    A    4
  ATOM C ' CE2' PHE A    4 ?   22.936    4.612   15.353  1.00 12.61  ?    A    4
  ATOM C ' CZ ' PHE A    4 ?   23.591    5.037   14.200  1.00 13.57  ?    A    4
  ATOM N ' N  ' ASN A    5 ?   19.516    7.862   19.069  1.00  6.62  ?    A    5
  ATOM C ' CA ' ASN A    5 ?   19.033    8.640   20.222  1.00  7.91  ?    A    5
  ATOM C ' C  ' ASN A    5 ?   19.994    8.470   21.466  1.00  7.22  ?    A    5
  ATOM O ' O  ' ASN A    5 ?   19.505    8.838   22.534  1.00  9.46  ?    A    5
  ATOM C ' CB ' ASN A    5 ?   17.577    8.380   20.559  1.00 10.30  ?    A    5
  ATOM C ' CG ' ASN A    5 ?   17.333    7.047   21.229  1.00 10.13  ?    A    5
  ATOM O ' OD1' ASN A    5 ?   18.067    6.093   21.024  1.00 11.97  ?    A    5
  ATOM N ' ND2' ASN A    5 ?   16.271    7.035   22.016  1.00 11.14  ?    A    5
  ATOM N ' N  ' HIS A    6 ?   21.169    7.976   21.223  1.00  7.56  ?    A    6
  ATOM C ' CA ' HIS A    6 ?   22.133    7.774   22.381  1.00  9.69  ?    A    6
  ATOM C ' C  ' HIS A    6 ?   22.847    9.087   22.662  1.00 11.47  ?    A    6
  ATOM O ' O  ' HIS A    6 ?   22.929    9.993   21.828  1.00 10.04  ?    A    6
  ATOM C ' CB ' HIS A    6 ?   23.121    6.645   22.100  1.00 10.23  ?    A    6
  ATOM C ' CG ' HIS A    6 ?   23.961    6.915   20.898  1.00  9.67  ?    A    6
  ATOM N ' ND1' HIS A    6 ?   23.459    6.946   19.618  1.00  9.44  ?    A    6
  ATOM C ' CD2' HIS A    6 ?   25.301    7.119   20.774  1.00 10.08  ?    A    6
  ATOM C ' CE1' HIS A    6 ?   24.442    7.184   18.773  1.00  9.96  ?    A    6
  ATOM N ' NE2' HIS A    6 ?   25.563    7.233   19.467  1.00 10.52  ?    A    6
  ATOM N ' N  ' GLN A    7 ?   23.290    9.199   23.910  1.00 11.80  ?    A    7
  ATOM C ' CA ' GLN A    7 ?   23.982   10.391   24.401  1.00 13.13  ?    A    7
  ATOM C ' C  ' GLN A    7 ?   25.464   10.163   24.195  1.00 15.51  ?    A    7
  ATOM O ' O  ' GLN A    7 ?   25.981    9.042   24.301  1.00 14.68  ?    A    7
  ATOM C ' CB ' GLN A    7 ?   23.611   10.574   25.904  1.00 16.15  ?    A    7
  ATOM C ' CG ' GLN A    7 ?   24.487   11.659   26.523  1.00 24.21  ?    A    7
  ATOM C ' CD ' GLN A    7 ?   24.033   12.160   27.889  1.00 29.91  ?    A    7
  ATOM O ' OE1' GLN A    7 ?   23.340   13.172   28.051  1.00 31.18  ?    A    7
  ATOM N ' NE2' GLN A    7 ?   24.426   11.388   28.909  1.00 31.71  ?    A    7
  ATOM N ' N  ' SER A    8 ?   26.178   11.206   23.795  1.00 16.90  ?    A    8
  ATOM C ' CA ' SER A    8 ?   27.609   11.227   23.613  1.00 17.69  ?    A    8
  ATOM C ' C  ' SER A    8 ?   28.196   10.011   22.966  1.00 18.20  ?    A    8
  ATOM O ' O  ' SER A    8 ?   27.780    9.638   21.858  1.00 17.22  ?    A    8
  ATOM C ' CB ' SER A    8 ?   28.276   11.529   24.970  1.00 18.89  ?    A    8
  ATOM O ' OG ' SER A    8 ?   27.652   12.716   25.553  1.00 21.44  ?    A    8
  ATOM N ' N  ' SER A    9 A   29.162    9.372   23.645  0.50 18.55   1   A    9
  ATOM N ' N  ' SER A    9 B   29.129    9.401   23.680  0.50 19.19   1   A    9
  ATOM C ' CA ' SER A    9 A   29.804    8.193   23.040  0.50 18.40   1   A    9
  ATOM C ' CA ' SER A    9 B   29.899    8.242   23.278  0.50 19.69   1   A    9
  ATOM C ' C  ' SER A    9 A   29.328    6.866   23.604  0.50 18.67   1   A    9
  ATOM C ' C  ' SER A    9 B   29.356    6.884   23.698  0.50 19.30   1   A    9
  ATOM O ' O  ' SER A    9 A   30.058    5.862   23.421  0.50 18.78   1   A    9
  ATOM O ' O  ' SER A    9 B   30.089    5.884   23.493  0.50 19.55   1   A    9
  ATOM C ' CB ' SER A    9 A   31.330    8.333   23.002  0.50 18.98   1   A    9
  ATOM C ' CB ' SER A    9 B   31.303    8.365   23.978  0.50 21.17   1   A    9
  ATOM O ' OG ' SER A    9 A   31.693    9.281   21.996  0.50 18.48   1   A    9
  ATOM O ' OG ' SER A    9 B   31.072    8.237   25.391  0.50 23.53   1   A    9
  ATOM N ' N  ' GLN A   10 ?   28.169    6.840   24.231  1.00 17.24  ?    A   10
  ATOM C ' CA ' GLN A   10 ?   27.552    5.614   24.747  1.00 16.32  ?    A   10
  ATOM C ' C  ' GLN A   10 ?   27.147    4.679   23.626  1.00 16.05  ?    A   10
  ATOM O ' O  ' GLN A   10 ?   27.127    5.043   22.450  1.00 13.69  ?    A   10
  ATOM C ' CB ' GLN A   10 ?   26.392    5.999   25.651  1.00 16.46  ?    A   10
  ATOM C ' CG ' GLN A   10 ?   26.895    6.828   26.816  1.00 21.77  ?    A   10
  ATOM C ' CD ' GLN A   10 ?   25.759    7.414   27.626  1.00 22.86  ?    A   10
  ATOM O ' OE1' GLN A   10 ?   25.943    8.475   28.246  1.00 28.10  ?    A   10
  ATOM N ' NE2' GLN A   10 ?   24.594    6.813   27.639  1.00 23.08  ?    A   10
  ATOM N ' N  ' PRO A   11 ?   26.864    3.400   23.975  1.00 15.53  ?    A   11
  ATOM C ' CA ' PRO A   11 ?   26.500    2.395   22.983  1.00 14.33  ?    A   11
  ATOM C ' C  ' PRO A   11 ?   25.355    3.000   22.143  1.00 10.47  ?    A   11
  ATOM O ' O  ' PRO A   11 ?   24.477    3.603   22.732  1.00  9.78  ?    A   11
  ATOM C ' CB ' PRO A   11 ?   26.081    1.202   23.858  1.00 15.27  ?    A   11
  ATOM C ' CG ' PRO A   11 ?   27.084    1.338   25.036  1.00 15.70  ?    A   11
  ATOM C ' CD ' PRO A   11 ?   26.917    2.855   25.360  1.00 16.14  ?    A   11
  ATOM N ' N  ' GLN A   12 ?   25.357    2.720   20.887  1.00 10.96  ?    A   12
  ATOM C ' CA ' GLN A   12 ?   24.322    3.241   19.984  1.00 10.47  ?    A   12
  ATOM C ' C  ' GLN A   12 ?   22.951    2.664   20.245  1.00 11.44  ?    A   12
  ATOM O ' O  ' GLN A   12 ?   22.776    1.477   20.429  1.00 11.14  ?    A   12
  ATOM C ' CB ' GLN A   12 ?   24.704    2.865   18.543  1.00 12.99  ?    A   12
  ATOM C ' CG ' GLN A   12 ?   25.942    3.592   18.078  1.00 13.06  ?    A   12
  ATOM C ' CD ' GLN A   12 ?   26.285    3.324   16.665  1.00 16.10  ?    A   12
  ATOM O ' OE1' GLN A   12 ?   25.914    2.302   16.110  1.00 18.35  ?    A   12
  ATOM N ' NE2' GLN A   12 ?   26.954    4.280   16.016  1.00 21.13  ?    A   12
  ATOM N ' N  ' THR A   13 ?   21.967    3.546   20.183  1.00  9.26  ?    A   13
  ATOM C ' CA ' THR A   13 ?   20.561    3.198   20.314  1.00  9.89  ?    A   13
  ATOM C ' C  ' THR A   13 ?   19.785    3.981   19.249  1.00  9.40  ?    A   13
  ATOM O ' O  ' THR A   13 ?   20.300    5.060   18.855  1.00  8.57  ?    A   13
  ATOM C ' CB ' THR A   13 ?   19.908    3.384   21.701  1.00  9.47  ?    A   13
  ATOM O ' OG1' THR A   13 ?   20.047    4.787   22.100  1.00 12.66  ?    A   13
  ATOM C ' CG2' THR A   13 ?   20.589    2.443   22.741  1.00 13.21  ?    A   13
  ATOM N ' N  ' THR A   14 ?   18.660    3.425   18.841  1.00  8.74  ?    A   14
  ATOM C ' CA ' THR A   14 ?   17.860    4.126   17.818  1.00  9.01  ?    A   14
  ATOM C ' C  ' THR A   14 ?   16.436    4.306   18.338  1.00 11.13  ?    A   14
  ATOM O ' O  ' THR A   14 ?   15.971    3.609   19.251  1.00 11.19  ?    A   14
  ATOM C ' CB ' THR A   14 ?   17.864    3.362   16.449  1.00 11.81  ?    A   14
  ATOM O ' OG1' THR A   14 ?   17.099    2.133   16.732  1.00 12.39  ?    A   14
  ATOM C ' CG2' THR A   14 ?   19.264    3.144   15.903  1.00 10.70  ?    A   14
  ATOM N ' N  ' LYS A   15 ?   15.761    5.208   17.694  1.00  9.76  ?    A   15
  ATOM C ' CA ' LYS A   15 ?   14.353    5.551   17.932  1.00 11.59  ?    A   15
  ATOM C ' C  ' LYS A   15 ?   13.620    5.647   16.620  1.00 10.07  ?    A   15
  ATOM O ' O  ' LYS A   15 ?   14.101    6.262   15.669  1.00  8.10  ?    A   15
  ATOM C ' CB ' LYS A   15 ?   14.259    6.874   18.660  1.00 13.49  ?    A   15
  ATOM C ' CG ' LYS A   15 ?   12.851    7.182   19.146  1.00 18.63  ?    A   15
  ATOM C ' CD ' LYS A   15 ?   12.814    8.533   19.790  1.00 24.50  ?    A   15
  ATOM C ' CE ' LYS A   15 ?   11.464    8.848   20.378  1.00 28.25  ?    A   15
  ATOM N ' NZ ' LYS A   15 ?   11.538   10.275   20.859  1.00 30.38  ?    A   15
  ATOM N ' N  ' THR A   16 ?   12.442    5.051   16.574  1.00  9.76  ?    A   16
  ATOM C ' CA ' THR A   16 ?   11.594    5.162   15.385  1.00  8.90  ?    A   16
  ATOM C ' C  ' THR A   16 ?   10.719    6.415   15.592  1.00  7.83  ?    A   16
  ATOM O ' O  ' THR A   16 ?   10.012    6.494   16.601  1.00  9.76  ?    A   16
  ATOM C ' CB ' THR A   16 ?   10.678    3.920   15.120  1.00 10.36  ?    A   16
  ATOM O ' OG1' THR A   16 ?   11.652    2.850   14.941  1.00 14.50  ?    A   16
  ATOM C ' CG2' THR A   16 ?    9.808    4.079   13.852  1.00 12.84  ?    A   16
  ATOM N ' N  ' CYS A   17 ?   10.803    7.389   14.697  1.00  6.33  ?    A   17
  ATOM C ' CA ' CYS A   17 ?   10.077    8.656   14.860  1.00  8.35  ?    A   17
  ATOM C ' C  ' CYS A   17 ?    8.593    8.520   14.573  1.00  8.80  ?    A   17
  ATOM O ' O  ' CYS A   17 ?    8.161    7.491   14.066  1.00  9.23  ?    A   17
  ATOM C ' CB ' CYS A   17 ?   10.706    9.750   13.984  1.00  8.91  ?    A   17
  ATOM S ' SG ' CYS A   17 ?   12.534    9.834   14.112  1.00  9.01  ?    A   17
  ATOM N ' N  ' SER A   18 ?    7.902    9.621   14.878  1.00  8.15  ?    A   18
  ATOM C ' CA ' SER A   18 ?    6.436    9.552   14.567  1.00 10.68  ?    A   18
  ATOM C ' C  ' SER A   18 ?    6.287    9.730   13.049  1.00 10.82  ?    A   18
  ATOM O ' O  ' SER A   18 ?    7.124   10.246   12.306  1.00 11.90  ?    A   18
  ATOM C ' CB ' SER A   18 ?    5.687   10.570   15.337  1.00 14.98  ?    A   18
  ATOM O ' OG ' SER A   18 A    6.225   11.165   16.468  0.50 14.28   1   A   18
  ATOM O ' OG ' SER A   18 B    6.181   11.830   15.086  0.50  9.85   1   A   18
  ATOM N ' N  ' PRO A   19 ?    5.119    9.294   12.538  1.00 11.31  ?    A   19
  ATOM C ' CA ' PRO A   19 ?    4.792    9.427   11.112  1.00 12.97  ?    A   19
  ATOM C ' C  ' PRO A   19 ?    4.905   10.856   10.596  1.00 13.57  ?    A   19
  ATOM O ' O  ' PRO A   19 ?    4.432   11.779   11.259  1.00 15.42  ?    A   19
  ATOM C ' CB ' PRO A   19 ?    3.299    8.972   11.035  1.00 13.95  ?    A   19
  ATOM C ' CG ' PRO A   19 ?    3.238    7.947   12.157  1.00 12.13  ?    A   19
  ATOM C ' CD ' PRO A   19 ?    4.016    8.660   13.303  1.00 12.79  ?    A   19
  ATOM N ' N  ' GLY A   20 ?    5.562   10.984    9.445  1.00 16.34  ?    A   20
  ATOM C ' CA ' GLY A   20 ?    5.750   12.275    8.808  1.00 16.51  ?    A   20
  ATOM C ' C  ' GLY A   20 ?    6.941   13.037    9.356  1.00 17.77  ?    A   20
  ATOM O ' O  ' GLY A   20 ?    7.178   14.175    8.904  1.00 19.15  ?    A   20
  ATOM N ' N  ' GLU A   21 ?    7.616   12.470   10.369  1.00 16.80  ?    A   21
  ATOM C ' CA ' GLU A   21 ?    8.802   13.255   10.857  1.00 15.09  ?    A   21
  ATOM C ' C  ' GLU A   21 ?    9.948   12.836    9.967  1.00 16.54  ?    A   21
  ATOM O ' O  ' GLU A   21 ?   10.308   11.633    9.843  1.00 17.81  ?    A   21
  ATOM C ' CB ' GLU A   21 ?    9.082   12.888   12.297  1.00 13.14  ?    A   21
  ATOM C ' CG ' GLU A   21 ?   10.401   13.525   12.870  1.00 13.60  ?    A   21
  ATOM C ' CD ' GLU A   21 ?   10.448   15.017   12.651  1.00 15.80  ?    A   21
  ATOM O ' OE1' GLU A   21 ?   11.067   15.533   11.722  1.00 16.91  ?    A   21
  ATOM O ' OE2' GLU A   21 ?    9.705   15.659   13.448  1.00 17.65  ?    A   21
  ATOM N ' N  ' SER A   22 ?   10.599   13.780    9.281  1.00 15.18  ?    A   22
  ATOM C ' CA ' SER A   22 ?   11.699   13.387    8.379  1.00 15.02  ?    A   22
  ATOM C ' C  ' SER A   22 ?   13.100   13.741    8.902  1.00 12.77  ?    A   22
  ATOM O ' O  ' SER A   22 ?   14.050   13.270    8.255  1.00 13.54  ?    A   22
  ATOM C ' CB ' SER A   22 ?   11.491   14.080    7.014  1.00 17.96  ?    A   22
  ATOM O ' OG ' SER A   22 ?   11.703   15.508    7.201  1.00 22.59  ?    A   22
  ATOM N ' N  ' SER A   23 ?   13.165   14.435   10.030  1.00 11.36  ?    A   23
  ATOM C ' CA ' SER A   23 ?   14.488   14.855   10.510  1.00 10.17  ?    A   23
  ATOM C ' C  ' SER A   23 ?   14.992   14.129   11.730  1.00  9.19  ?    A   23
  ATOM O ' O  ' SER A   23 ?   14.176   13.541   12.460  1.00  8.96  ?    A   23
  ATOM C ' CB ' SER A   23 ?   14.365   16.351   10.953  1.00 11.72  ?    A   23
  ATOM O ' OG ' SER A   23 ?   14.034   17.134    9.833  1.00 17.36  ?    A   23
  ATOM N ' N  ' CYS A   24 ?   16.292   14.250   11.942  1.00  8.01  ?    A   24
  ATOM C ' CA ' CYS A   24 ?   16.962   13.757   13.147  1.00  6.86  ?    A   24
  ATOM C ' C  ' CYS A   24 ?   17.805   14.956   13.642  1.00  8.67  ?    A   24
  ATOM O ' O  ' CYS A   24 ?   18.154   15.805   12.769  1.00  9.40  ?    A   24
  ATOM C ' CB ' CYS A   24 ?   17.927   12.608   12.880  1.00  6.90  ?    A   24
  ATOM S ' SG ' CYS A   24 ?   17.196   11.134   12.179  1.00  8.11  ?    A   24
  ATOM N ' N  ' TYR A   25 ?   18.202   14.904   14.880  1.00  7.59  ?    A   25
  ATOM C ' CA ' TYR A   25 ?   19.053   16.033   15.347  1.00  8.44  ?    A   25
  ATOM C ' C  ' TYR A   25 ?   20.191   15.486   16.207  1.00  8.32  ?    A   25
  ATOM O ' O  ' TYR A   25 ?   20.183   14.370   16.755  1.00  7.62  ?    A   25
  ATOM C ' CB ' TYR A   25 ?   18.241   17.101   16.113  1.00  9.01  ?    A   25
  ATOM C ' CG ' TYR A   25 ?   17.764   16.611   17.455  1.00  7.33  ?    A   25
  ATOM C ' CD1' TYR A   25 ?   18.589   16.730   18.586  1.00  9.53  ?    A   25
  ATOM C ' CD2' TYR A   25 ?   16.501   15.984   17.631  1.00  8.76  ?    A   25
  ATOM C ' CE1' TYR A   25 ?   18.176   16.278   19.844  1.00  9.89  ?    A   25
  ATOM C ' CE2' TYR A   25 ?   16.112   15.575   18.878  1.00  9.03  ?    A   25
  ATOM C ' CZ ' TYR A   25 ?   16.911   15.699   20.009  1.00 11.57  ?    A   25
  ATOM O ' OH ' TYR A   25 ?   16.487   15.317   21.245  1.00 13.66  ?    A   25
  ATOM N ' N  ' HIS A   26 ?   21.156   16.369   16.283  1.00  9.57  ?    A   26
  ATOM C ' CA ' HIS A   26 ?   22.382   16.199   17.089  1.00  9.17  ?    A   26
  ATOM C ' C  ' HIS A   26 ?   22.585   17.556   17.762  1.00  9.48  ?    A   26
  ATOM O ' O  ' HIS A   26 ?   22.715   18.611   17.105  1.00 10.43  ?    A   26
  ATOM C ' CB ' HIS A   26 ?   23.571   15.762   16.222  1.00 13.17  ?    A   26
  ATOM C ' CG ' HIS A   26 ?   24.931   15.862   16.863  1.00 15.07  ?    A   26
  ATOM N ' ND1' HIS A   26 ?   25.853   14.845   16.853  1.00 16.16  ?    A   26
  ATOM C ' CD2' HIS A   26 ?   25.467   16.931   17.504  1.00 14.50  ?    A   26
  ATOM C ' CE1' HIS A   26 ?   26.954   15.314   17.478  1.00 14.43  ?    A   26
  ATOM N ' NE2' HIS A   26 ?   26.722   16.534   17.869  1.00 15.24  ?    A   26
  ATOM N ' N  ' LYS A   27 ?   22.514   17.622   19.070  1.00 10.49  ?    A   27
  ATOM C ' CA ' LYS A   27 ?   22.650   18.855   19.862  1.00 11.03  ?    A   27
  ATOM C ' C  ' LYS A   27 ?   23.874   18.691   20.778  1.00 11.80  ?    A   27
  ATOM O ' O  ' LYS A   27 ?   24.026   17.607   21.348  1.00 12.92  ?    A   27
  ATOM C ' CB ' LYS A   27 ?   21.474   18.955   20.866  1.00 16.44  ?    A   27
  ATOM C ' CG ' LYS A   27 ?   20.315   19.787   20.422  1.00 25.93  ?    A   27
  ATOM C ' CD ' LYS A   27 ?   19.500   20.353   21.588  1.00 29.44  ?    A   27
  ATOM C ' CE ' LYS A   27 ?   18.689   19.310   22.308  1.00 31.79  ?    A   27
  ATOM N ' NZ ' LYS A   27 ?   17.343   19.866   22.653  1.00 32.99  ?    A   27
  ATOM N ' N  ' GLN A   28 ?   24.596   19.771   20.893  1.00 11.37  ?    A   28
  ATOM C ' CA ' GLN A   28 ?   25.796   19.621   21.748  1.00 11.23  ?    A   28
  ATOM C ' C  ' GLN A   28 ?   25.942   20.893   22.574  1.00  9.88  ?    A   28
  ATOM O ' O  ' GLN A   28 ?   25.744   21.995   22.016  1.00 11.56  ?    A   28
  ATOM C ' CB ' GLN A   28 ?   26.992   19.548   20.795  1.00 14.24  ?    A   28
  ATOM C ' CG ' GLN A   28 ?   28.330   19.362   21.483  1.00 17.58  ?    A   28
  ATOM C ' CD ' GLN A   28 ?   29.458   19.176   20.479  1.00 22.62  ?    A   28
  ATOM O ' OE1' GLN A   28 ?   30.462   19.848   20.662  1.00 27.19  ?    A   28
  ATOM N ' NE2' GLN A   28 ?   29.276   18.343   19.450  1.00 24.95  ?    A   28
  ATOM N ' N  ' TRP A   29 ?   26.351   20.695   23.797  1.00  9.19  ?    A   29
  ATOM C ' CA ' TRP A   29 ?   26.571   21.916   24.635  1.00 10.23  ?    A   29
  ATOM C ' C  ' TRP A   29 ?   27.469   21.433   25.782  1.00 10.51  ?    A   29
  ATOM O ' O  ' TRP A   29 ?   27.728   20.244   25.932  1.00 11.98  ?    A   29
  ATOM C ' CB ' TRP A   29 ?   25.289   22.513   25.145  1.00 13.48  ?    A   29
  ATOM C ' CG ' TRP A   29 ?   24.609   21.758   26.224  1.00 13.73  ?    A   29
  ATOM C ' CD1' TRP A   29 ?   24.725   21.921   27.585  1.00 15.22  ?    A   29
  ATOM C ' CD2' TRP A   29 ?   23.650   20.715   26.042  1.00 13.55  ?    A   29
  ATOM N ' NE1' TRP A   29 ?   23.923   21.022   28.242  1.00 15.44  ?    A   29
  ATOM C ' CE2' TRP A   29 ?   23.240   20.270   27.318  1.00 14.52  ?    A   29
  ATOM C ' CE3' TRP A   29 ?   23.099   20.150   24.885  1.00 13.49  ?    A   29
  ATOM C ' CZ2' TRP A   29 ?   22.303   19.278   27.535  1.00 15.98  ?    A   29
  ATOM C ' CZ3' TRP A   29 ?   22.172   19.149   25.106  1.00 16.88  ?    A   29
  ATOM C ' CH2' TRP A   29 ?   21.798   18.728   26.358  1.00 15.61  ?    A   29
  ATOM N ' N  ' SER A   30 ?   27.910   22.381   26.528  1.00  9.37  ?    A   30
  ATOM C ' CA ' SER A   30 ?   28.742   22.179   27.728  1.00 10.57  ?    A   30
  ATOM C ' C  ' SER A   30 ?   28.054   22.667   28.976  1.00 11.49  ?    A   30
  ATOM O ' O  ' SER A   30 ?   27.286   23.638   28.965  1.00 15.12  ?    A   30
  ATOM C ' CB ' SER A   30 ?   30.055   22.970   27.551  1.00 16.55  ?    A   30
  ATOM O ' OG ' SER A   30 ?   30.834   22.327   26.547  1.00 20.42  ?    A   30
  ATOM N ' N  ' ASP A   31 ?   28.270   21.944   30.063  1.00 11.60  ?    A   31
  ATOM C ' CA ' ASP A   31 ?   27.784   22.386   31.365  1.00 11.57  ?    A   31
  ATOM C ' C  ' ASP A   31 ?   29.033   22.116   32.270  1.00  9.87  ?    A   31
  ATOM O ' O  ' ASP A   31 ?   30.074   21.687   31.787  1.00  9.62  ?    A   31
  ATOM C ' CB ' ASP A   31 ?   26.464   21.890   31.817  1.00 14.69  ?    A   31
  ATOM C ' CG ' ASP A   31 ?   26.429   20.429   32.141  1.00 13.94  ?    A   31
  ATOM O ' OD1' ASP A   31 ?   27.422   19.735   32.318  1.00 13.53  ?    A   31
  ATOM O ' OD2' ASP A   31 ?   25.297   19.902   32.267  1.00 20.88  ?    A   31
  ATOM N ' N  ' PHE A   32 ?   28.798   22.375   33.550  1.00 10.54  ?    A   32
  ATOM C ' CA ' PHE A   32 ?   29.905   22.152   34.510  1.00 12.74  ?    A   32
  ATOM C ' C  ' PHE A   32 ?   30.326   20.683   34.546  1.00 12.64  ?    A   32
  ATOM O ' O  ' PHE A   32 ?   31.434   20.462   35.037  1.00 14.90  ?    A   32
  ATOM C ' CB ' PHE A   32 ?   29.519   22.729   35.883  1.00 13.92  ?    A   32
  ATOM C ' CG ' PHE A   32 ?   28.407   21.998   36.584  1.00 12.81  ?    A   32
  ATOM C ' CD1' PHE A   32 ?   27.081   22.403   36.358  1.00 16.01  ?    A   32
  ATOM C ' CD2' PHE A   32 ?   28.661   20.913   37.412  1.00 14.73  ?    A   32
  ATOM C ' CE1' PHE A   32 ?   26.025   21.797   36.998  1.00 15.67  ?    A   32
  ATOM C ' CE2' PHE A   32 ?   27.574   20.264   38.045  1.00 17.15  ?    A   32
  ATOM C ' CZ ' PHE A   32 ?   26.290   20.690   37.811  1.00 14.30  ?    A   32
  ATOM N ' N  ' ARG A   33 ?   29.551   19.725   34.086  1.00 12.30  ?    A   33
  ATOM C ' CA ' ARG A   33 ?   29.917   18.296   34.153  1.00 12.20  ?    A   33
  ATOM C ' C  ' ARG A   33 ?   30.767   17.852   32.966  1.00 11.16  ?    A   33
  ATOM O ' O  ' ARG A   33 ?   31.542   16.872   33.076  1.00 13.79  ?    A   33
  ATOM C ' CB ' ARG A   33 ?   28.688   17.407   34.200  1.00 13.11  ?    A   33
  ATOM C ' CG ' ARG A   33 A   27.803   17.577   35.457  0.50 11.82   1   A   33
  ATOM C ' CG ' ARG A   33 B   27.548   17.740   35.165  0.50 15.06   1   A   33
  ATOM C ' CD ' ARG A   33 A   26.615   16.693   35.324  0.50 14.41   1   A   33
  ATOM C ' CD ' ARG A   33 B   26.404   16.823   34.793  0.50 17.54   1   A   33
  ATOM N ' NE ' ARG A   33 A   25.900   16.833   34.063  0.50 15.77   1   A   33
  ATOM N ' NE ' ARG A   33 B   26.643   15.483   35.257  0.50 19.62   1   A   33
  ATOM C ' CZ ' ARG A   33 A   25.228   15.890   33.415  0.50 13.92   1   A   33
  ATOM C ' CZ ' ARG A   33 B   26.258   14.294   34.850  0.50 18.88   1   A   33
  ATOM N ' NH1' ARG A   33 A   24.583   16.145   32.267  0.50 15.61   1   A   33
  ATOM N ' NH1' ARG A   33 B   26.641   13.227   35.571  0.50 18.62   1   A   33
  ATOM N ' NH2' ARG A   33 A   25.198   14.639   33.828  0.50 14.36   1   A   33
  ATOM N ' NH2' ARG A   33 B   25.509   14.102   33.762  0.50 18.90   1   A   33
  ATOM N ' N  ' GLY A   34 ?   30.602   18.522   31.848  1.00  8.79  ?    A   34
  ATOM C ' CA ' GLY A   34 ?   31.385   18.107   30.649  1.00 10.04  ?    A   34
  ATOM C ' C  ' GLY A   34 ?   30.670   18.507   29.402  1.00  9.22  ?    A   34
  ATOM O ' O  ' GLY A   34 ?   29.801   19.410   29.383  1.00  9.73  ?    A   34
  ATOM N ' N  ' THR A   35 ?   31.010   17.834   28.317  1.00  7.83  ?    A   35
  ATOM C ' CA ' THR A   35 ?   30.436   18.141   26.985  1.00  8.43  ?    A   35
  ATOM C ' C  ' THR A   35 ?   29.363   17.084   26.718  1.00  8.77  ?    A   35
  ATOM O ' O  ' THR A   35 ?   29.636   15.865   26.880  1.00 10.63  ?    A   35
  ATOM C ' CB ' THR A   35 ?   31.532   18.006   25.880  1.00 11.22  ?    A   35
  ATOM O ' OG1' THR A   35 ?   32.551   18.984   26.155  1.00 13.74  ?    A   35
  ATOM C ' CG2' THR A   35 ?   30.892   18.277   24.518  1.00 10.63  ?    A   35
  ATOM N ' N  ' ILE A   36 ?   28.172   17.558   26.399  1.00  8.76  ?    A   36
  ATOM C ' CA ' ILE A   36 ?   27.073   16.644   26.168  1.00 11.24  ?    A   36
  ATOM C ' C  ' ILE A   36 ?   26.614   16.663   24.726  1.00 11.09  ?    A   36
  ATOM O ' O  ' ILE A   36 ?   26.509   17.744   24.126  1.00  9.55  ?    A   36
  ATOM C ' CB ' ILE A   36 ?   25.835   17.102   27.068  1.00 14.20  ?    A   36
  ATOM C ' CG1' ILE A   36 ?   26.243   17.044   28.558  1.00 17.02  ?    A   36
  ATOM C ' CG2' ILE A   36 ?   24.574   16.249   26.726  1.00 18.24  ?    A   36
  ATOM C ' CD1' ILE A   36 ?   25.841   18.319   29.369  1.00 20.55  ?    A   36
  ATOM N ' N  ' ILE A   37 ?   26.306   15.479   24.211  1.00 10.29  ?    A   37
  ATOM C ' CA ' ILE A   37 ?   25.687   15.365   22.884  1.00  9.06  ?    A   37
  ATOM C ' C  ' ILE A   37 ?   24.351   14.620   23.108  1.00 10.10  ?    A   37
  ATOM O ' O  ' ILE A   37 ?   24.419   13.525   23.684  1.00 10.26  ?    A   37
  ATOM C ' CB ' ILE A   37 ?   26.559   14.577   21.853  1.00 11.77  ?    A   37
  ATOM C ' CG1' ILE A   37 ?   27.819   15.452   21.596  1.00 10.62  ?    A   37
  ATOM C ' CG2' ILE A   37 ?   25.715   14.246   20.586  1.00 14.51  ?    A   37
  ATOM C ' CD1' ILE A   37 ?   28.917   14.599   20.912  1.00 16.47  ?    A   37
  ATOM N ' N  ' GLU A   38 ?   23.331   15.247   22.624  1.00  8.98  ?    A   38
  ATOM C ' CA ' GLU A   38 ?   21.978   14.580   22.703  1.00  9.46  ?    A   38
  ATOM C ' C  ' GLU A   38 ?   21.502   14.364   21.272  1.00  9.59  ?    A   38
  ATOM O ' O  ' GLU A   38 ?   21.785   15.228   20.426  1.00  9.43  ?    A   38
  ATOM C ' CB ' GLU A   38 ?   21.021   15.479   23.505  1.00 12.89  ?    A   38
  ATOM C ' CG ' GLU A   38 A   19.562   15.105   23.639  0.50 13.24   1   A   38
  ATOM C ' CG ' GLU A   38 B   21.344   15.277   25.022  0.50 13.13   1   A   38
  ATOM C ' CD ' GLU A   38 A   18.583   16.202   23.907  0.50 12.40   1   A   38
  ATOM C ' CD ' GLU A   38 B   20.288   15.728   25.972  0.50 15.37   1   A   38
  ATOM O ' OE1' GLU A   38 A   17.689   16.584   23.183  0.50 12.70   1   A   38
  ATOM O ' OE1' GLU A   38 B   20.364   15.568   27.179  0.50 16.64   1   A   38
  ATOM O ' OE2' GLU A   38 A   18.780   16.808   24.988  0.50 12.79   1   A   38
  ATOM O ' OE2' GLU A   38 B   19.319   16.277   25.403  0.50 14.38   1   A   38
  ATOM N ' N  ' ARG A   39 ?   20.839   13.233   21.054  1.00  7.76  ?    A   39
  ATOM C ' CA ' ARG A   39 ?   20.378   12.910   19.659  1.00  6.77  ?    A   39
  ATOM C ' C  ' ARG A   39 ?   18.933   12.464   19.702  1.00  7.28  ?    A   39
  ATOM O ' O  ' ARG A   39 ?   18.518   11.848   20.723  1.00  8.64  ?    A   39
  ATOM C ' CB ' ARG A   39 ?   21.188   11.713   19.163  1.00  5.59  ?    A   39
  ATOM C ' CG ' ARG A   39 ?   22.673   11.945   18.947  1.00  7.87  ?    A   39
  ATOM C ' CD ' ARG A   39 ?   23.405   10.758   18.447  1.00  8.14  ?    A   39
  ATOM N ' NE ' ARG A   39 ?   24.853   10.994   18.276  1.00 10.09  ?    A   39
  ATOM C ' CZ ' ARG A   39 ?   25.760   10.809   19.238  1.00 13.02  ?    A   39
  ATOM N ' NH1' ARG A   39 ?   27.044   10.993   18.876  1.00 15.33  ?    A   39
  ATOM N ' NH2' ARG A   39 ?   25.486   10.490   20.507  1.00 11.81  ?    A   39
  ATOM N ' N  ' GLY A   40 ?   18.177   12.723   18.647  1.00  5.69  ?    A   40
  ATOM C ' CA ' GLY A   40 ?   16.788   12.222   18.677  1.00  7.41  ?    A   40
  ATOM C ' C  ' GLY A   40 ?   16.108   12.526   17.351  1.00  8.40  ?    A   40
  ATOM O ' O  ' GLY A   40 ?   16.742   12.854   16.352  1.00  8.80  ?    A   40
  ATOM N ' N  ' CYS A   41 ?   14.780   12.350   17.430  1.00  6.63  ?    A   41
  ATOM C ' CA ' CYS A   41 ?   13.954   12.604   16.223  1.00  9.52  ?    A   41
  ATOM C ' C  ' CYS A   41 ?   13.576   14.074   16.162  1.00 10.01  ?    A   41
  ATOM O ' O  ' CYS A   41 ?   13.366   14.686   17.233  1.00 11.32  ?    A   41
  ATOM C ' CB ' CYS A   41 ?   12.644   11.806   16.346  1.00  8.50  ?    A   41
  ATOM S ' SG ' CYS A   41 ?   12.871   10.017   16.070  1.00  8.87  ?    A   41
  ATOM N ' N  ' GLY A   42 ?   13.372   14.589   14.973  1.00 11.01  ?    A   42
  ATOM C ' CA ' GLY A   42 ?   12.931   15.963   14.751  1.00 10.83  ?    A   42
  ATOM C ' C  ' GLY A   42 ?   14.123   16.916   14.609  1.00 12.02  ?    A   42
  ATOM O ' O  ' GLY A   42 ?   15.280   16.564   14.512  1.00 11.93  ?    A   42
  ATOM N ' N  ' CYS A   43 ?   13.716   18.175   14.526  1.00 13.78  ?    A   43
  ATOM C ' CA ' CYS A   43 ?   14.673   19.282   14.431  1.00 15.32  ?    A   43
  ATOM C ' C  ' CYS A   43 ?   14.149   20.350   15.361  1.00 17.24  ?    A   43
  ATOM O ' O  ' CYS A   43 ?   13.335   21.138   14.882  1.00 18.80  ?    A   43
  ATOM C ' CB ' CYS A   43 ?   14.804   19.795   12.988  1.00 14.24  ?    A   43
  ATOM S ' SG ' CYS A   43 ?   16.131   21.036   12.977  1.00 16.66  ?    A   43
  ATOM N ' N  ' PRO A   44 A   14.623   20.358   16.588  0.60 18.18   1   A   44
  ATOM N ' N  ' PRO A   44 B   14.556   20.330   16.609  0.40 18.37   1   A   44
  ATOM C ' CA ' PRO A   44 A   14.145   21.338   17.563  0.60 19.67   1   A   44
  ATOM C ' CA ' PRO A   44 B   14.060   21.322   17.579  0.40 19.57   1   A   44
  ATOM C ' C  ' PRO A   44 A   14.565   22.761   17.269  0.60 20.20   1   A   44
  ATOM C ' C  ' PRO A   44 B   14.557   22.716   17.256  0.40 20.10   1   A   44
  ATOM O ' O  ' PRO A   44 A   15.287   23.078   16.316  0.60 20.62   1   A   44
  ATOM O ' O  ' PRO A   44 B   15.536   22.877   16.507  0.40 21.30   1   A   44
  ATOM C ' CB ' PRO A   44 A   14.623   20.808   18.898  0.60 20.21   1   A   44
  ATOM C ' CB ' PRO A   44 B   14.527   20.775   18.917  0.40 20.02   1   A   44
  ATOM C ' CG ' PRO A   44 A   15.641   19.760   18.618  0.60 18.82   1   A   44
  ATOM C ' CG ' PRO A   44 B   15.746   19.961   18.591  0.40 19.17   1   A   44
  ATOM C ' CD ' PRO A   44 A   15.603   19.424   17.159  0.60 18.17   1   A   44
  ATOM C ' CD ' PRO A   44 B   15.514   19.389   17.210  0.40 18.53   1   A   44
  ATOM N ' N  ' THR A   45 A   14.034   23.688   18.063  0.60 22.16   1   A   45
  ATOM N ' N  ' THR A   45 B   13.877   23.741   17.771  0.40 20.94   1   A   45
  ATOM C ' CA ' THR A   45 A   14.341   25.120   17.929  0.60 22.38   1   A   45
  ATOM C ' CA ' THR A   45 B   14.291   25.128   17.517  0.40 21.46   1   A   45
  ATOM C ' C  ' THR A   45 A   15.808   25.413   18.269  0.60 23.67   1   A   45
  ATOM C ' C  ' THR A   45 B   15.518   25.482   18.373  0.40 22.52   1   A   45
  ATOM O ' O  ' THR A   45 A   16.330   24.787   19.215  0.60 23.14   1   A   45
  ATOM O ' O  ' THR A   45 B   15.706   24.947   19.477  0.40 21.19   1   A   45
  ATOM C ' CB ' THR A   45 A   13.416   25.962   18.924  0.60 24.04   1   A   45
  ATOM C ' CB ' THR A   45 B   13.151   26.192   17.774  0.40 22.70   1   A   45
  ATOM O ' OG1' THR A   45 A   12.059   25.446   18.797  0.60 24.60   1   A   45
  ATOM O ' OG1' THR A   45 B   12.008   25.792   16.971  0.40 23.44   1   A   45
  ATOM C ' CG2' THR A   45 A   13.499   27.469   18.684  0.60 22.22   1   A   45
  ATOM C ' CG2' THR A   45 B   13.573   27.639   17.484  0.40 22.50   1   A   45
  ATOM N ' N  ' VAL A   46 A   16.440   26.342   17.536  0.60 24.11   1   A   46
  ATOM N ' N  ' VAL A   46 B   16.289   26.399   17.806  0.40 23.35   1   A   46
  ATOM C ' CA ' VAL A   46 A   17.837   26.703   17.881  0.60 25.45   1   A   46
  ATOM C ' CA ' VAL A   46 B   17.502   26.958   18.394  0.40 24.01   1   A   46
  ATOM C ' C  ' VAL A   46 A   17.711   27.569   19.158  0.60 24.71   1   A   46
  ATOM C ' C  ' VAL A   46 B   17.172   27.618   19.748  0.40 23.79   1   A   46
  ATOM O ' O  ' VAL A   46 A   16.871   28.493   19.217  0.60 25.04   1   A   46
  ATOM O ' O  ' VAL A   46 B   16.159   28.304   19.902  0.40 22.90   1   A   46
  ATOM C ' CB ' VAL A   46 A   18.667   27.296   16.749  0.60 26.99   1   A   46
  ATOM C ' CB ' VAL A   46 B   18.169   27.942   17.407  0.40 26.38   1   A   46
  ATOM C ' CG1' VAL A   46 A   19.161   26.266   15.724  0.60 28.74   1   A   46
  ATOM C ' CG1' VAL A   46 B   17.195   29.012   16.899  0.40 27.44   1   A   46
  ATOM C ' CG2' VAL A   46 A   18.025   28.453   16.017  0.60 27.92   1   A   46
  ATOM C ' CG2' VAL A   46 B   19.415   28.599   17.988  0.40 26.32   1   A   46
  ATOM N ' N  ' LYS A   47 A   18.460   27.164   20.165  0.60 23.80   1   A   47
  ATOM N ' N  ' LYS A   47 B   18.076   27.384   20.661  0.40 22.93   1   A   47
  ATOM C ' CA ' LYS A   47 A   18.524   27.782   21.489  0.60 21.96   1   A   47
  ATOM C ' CA ' LYS A   47 B   18.122   27.845   22.050  0.40 22.32   1   A   47
  ATOM C ' C  ' LYS A   47 A   19.919   28.446   21.606  0.60 20.71   1   A   47
  ATOM C ' C  ' LYS A   47 B   19.576   28.227   22.342  0.40 20.27   1   A   47
  ATOM O ' O  ' LYS A   47 A   20.880   27.976   21.020  0.60 19.65   1   A   47
  ATOM O ' O  ' LYS A   47 B   20.492   27.434   22.122  0.40 17.71   1   A   47
  ATOM C ' CB ' LYS A   47 A   18.390   26.874   22.686  0.60 24.28   1   A   47
  ATOM C ' CB ' LYS A   47 B   17.624   26.731   22.977  0.40 25.91   1   A   47
  ATOM C ' CG ' LYS A   47 A   17.050   26.526   23.271  0.60 25.18   1   A   47
  ATOM C ' CG ' LYS A   47 B   16.508   25.945   22.256  0.40 30.73   1   A   47
  ATOM C ' CD ' LYS A   47 A   17.172   25.608   24.484  0.60 26.51   1   A   47
  ATOM C ' CD ' LYS A   47 B   15.932   24.808   23.071  0.40 34.89   1   A   47
  ATOM C ' CE ' LYS A   47 A   16.009   24.683   24.715  0.60 25.98   1   A   47
  ATOM C ' CE ' LYS A   47 B   14.417   24.708   22.898  0.40 36.06   1   A   47
  ATOM N ' NZ ' LYS A   47 A   14.663   25.319   24.688  0.60 26.34   1   A   47
  ATOM N ' NZ ' LYS A   47 B   13.870   23.597   23.721  0.40 37.64   1   A   47
  ATOM N ' N  ' PRO A   48 A   19.941   29.523   22.374  0.60 19.86   1   A   48
  ATOM N ' N  ' PRO A   48 B   19.774   29.473   22.736  0.40 19.12   1   A   48
  ATOM C ' CA ' PRO A   48 A   21.205   30.247   22.563  0.60 18.77   1   A   48
  ATOM C ' CA ' PRO A   48 B   21.095   30.030   23.006  0.40 18.53   1   A   48
  ATOM C ' C  ' PRO A   48 A   22.233   29.385   23.259  0.60 18.46   1   A   48
  ATOM C ' C  ' PRO A   48 B   22.066   29.122   23.731  0.40 18.14   1   A   48
  ATOM O ' O  ' PRO A   48 A   21.970   28.688   24.259  0.60 19.71   1   A   48
  ATOM O ' O  ' PRO A   48 B   21.740   28.464   24.743  0.40 18.67   1   A   48
  ATOM C ' CB ' PRO A   48 A   20.808   31.483   23.372  0.60 19.57   1   A   48
  ATOM C ' CB ' PRO A   48 B   20.808   31.303   23.824  0.40 18.80   1   A   48
  ATOM C ' CG ' PRO A   48 A   19.319   31.547   23.340  0.60 18.21   1   A   48
  ATOM C ' CG ' PRO A   48 B   19.336   31.339   24.060  0.40 18.13   1   A   48
  ATOM C ' CD ' PRO A   48 A   18.821   30.127   23.122  0.60 19.62   1   A   48
  ATOM C ' CD ' PRO A   48 B   18.710   30.483   22.967  0.40 19.06   1   A   48
  ATOM N ' N  ' GLY A   49 A   23.457   29.398   22.736  0.60 18.42   1   A   49
  ATOM N ' N  ' GLY A   49 B   23.298   29.112   23.240  0.40 17.66   1   A   49
  ATOM C ' CA ' GLY A   49 A   24.563   28.645   23.314  0.60 18.38   1   A   49
  ATOM C ' CA ' GLY A   49 B   24.423   28.369   23.776  0.40 17.48   1   A   49
  ATOM C ' C  ' GLY A   49 A   24.639   27.195   22.894  0.60 18.43   1   A   49
  ATOM C ' C  ' GLY A   49 B   24.436   26.887   23.507  0.40 17.41   1   A   49
  ATOM O ' O  ' GLY A   49 A   25.736   26.621   23.025  0.60 18.32   1   A   49
  ATOM O ' O  ' GLY A   49 B   25.124   26.100   24.191  0.40 18.79   1   A   49
  ATOM N ' N  ' ILE A   50 A   23.543   26.594   22.472  0.60 17.47   1   A   50
  ATOM N ' N  ' ILE A   50 B   23.689   26.462   22.502  0.40 16.55   1   A   50
  ATOM C ' CA ' ILE A   50 A   23.476   25.206   22.016  0.60 16.49   1   A   50
  ATOM C ' CA ' ILE A   50 B   23.667   25.022   22.154  0.40 15.23   1   A   50
  ATOM C ' C  ' ILE A   50 A   23.877   25.088   20.548  0.60 14.02   1   A   50
  ATOM C ' C  ' ILE A   50 B   23.779   24.889   20.646  0.40 13.34   1   A   50
  ATOM O ' O  ' ILE A   50 A   23.541   25.924   19.691  0.60 15.04   1   A   50
  ATOM O ' O  ' ILE A   50 B   23.043   25.518   19.868  0.40 13.50   1   A   50
  ATOM C ' CB ' ILE A   50 A   22.030   24.615   22.241  0.60 16.82   1   A   50
  ATOM C ' CB ' ILE A   50 B   22.457   24.336   22.857  0.40 15.41   1   A   50
  ATOM C ' CG1' ILE A   50 A   21.620   24.912   23.701  0.60 18.66   1   A   50
  ATOM C ' CG1' ILE A   50 B   22.602   24.549   24.396  0.40 14.15   1   A   50
  ATOM C ' CG2' ILE A   50 A   21.947   23.118   21.830  0.60 15.00   1   A   50
  ATOM C ' CG2' ILE A   50 B   22.290   22.848   22.492  0.40 15.14   1   A   50
  ATOM C ' CD1' ILE A   50 A   21.050   23.704   24.479  0.60 23.30   1   A   50
  ATOM C ' CD1' ILE A   50 B   21.723   23.651   25.293  0.40 15.52   1   A   50
  ATOM N ' N  ' LYS A   51 A   24.612   24.051   20.223  0.60 12.43   1   A   51
  ATOM N ' N  ' LYS A   51 B   24.737   24.093   20.220  0.40 12.31   1   A   51
  ATOM C ' CA ' LYS A   51 A   25.021   23.821   18.815  0.60 11.85   1   A   51
  ATOM C ' CA ' LYS A   51 B   24.992   23.839   18.794  0.40 11.96   1   A   51
  ATOM C ' C  ' LYS A   51 A   24.039   22.773   18.307  0.60 12.11   1   A   51
  ATOM C ' C  ' LYS A   51 B   24.015   22.769   18.336  0.40 12.26   1   A   51
  ATOM O ' O  ' LYS A   51 A   23.935   21.717   18.985  0.60 12.67   1   A   51
  ATOM O ' O  ' LYS A   51 B   23.906   21.721   19.010  0.40 12.58   1   A   51
  ATOM C ' CB ' LYS A   51 A   26.437   23.333   18.730  0.60 10.65   1   A   51
  ATOM C ' CB ' LYS A   51 B   26.420   23.388   18.571  0.40 11.13   1   A   51
  ATOM C ' CG ' LYS A   51 A   27.475   24.388   19.210  0.60 13.93   1   A   51
  ATOM C ' CG ' LYS A   51 B   27.426   24.535   18.841  0.40 12.42   1   A   51
  ATOM C ' CD ' LYS A   51 A   28.811   23.664   19.318  0.60 16.03   1   A   51
  ATOM C ' CD ' LYS A   51 B   28.823   24.072   18.462  0.40 14.87   1   A   51
  ATOM C ' CE ' LYS A   51 A   29.751   24.208   20.337  0.60 19.09   1   A   51
  ATOM C ' CE ' LYS A   51 B   29.424   23.140   19.502  0.40 14.64   1   A   51
  ATOM N ' NZ ' LYS A   51 A   31.164   23.906   19.984  0.60 22.13   1   A   51
  ATOM N ' NZ ' LYS A   51 B   30.689   22.571   18.935  0.40 15.56   1   A   51
  ATOM N ' N  ' LEU A   52 ?   23.313   23.049   17.267  1.00 11.98  ?    A   52
  ATOM C ' CA ' LEU A   52 ?   22.302   22.079   16.750  1.00 12.45  ?    A   52
  ATOM C ' C  ' LEU A   52 ?   22.571   21.808   15.296  1.00 12.80  ?    A   52
  ATOM O ' O  ' LEU A   52 ?   22.904   22.749   14.525  1.00 14.85  ?    A   52
  ATOM C ' CB ' LEU A   52 ?   20.915   22.748   17.042  1.00 15.98  ?    A   52
  ATOM C ' CG ' LEU A   52 ?   19.724   22.015   16.410  1.00 14.81  ?    A   52
  ATOM C ' CD1' LEU A   52 ?   19.430   20.713   17.119  1.00 14.83  ?    A   52
  ATOM C ' CD2' LEU A   52 ?   18.477   22.914   16.485  1.00 15.89  ?    A   52
  ATOM N ' N  ' SER A   53 ?   22.445   20.571   14.900  1.00 12.27  ?    A   53
  ATOM C ' CA ' SER A   53 ?   22.615   20.082   13.539  1.00 13.02  ?    A   53
  ATOM C ' C  ' SER A   53 ?   21.422   19.160   13.238  1.00 13.89  ?    A   53
  ATOM O ' O  ' SER A   53 ?   21.203   18.199   14.011  1.00 13.84  ?    A   53
  ATOM C ' CB ' SER A   53 ?   23.879   19.218   13.432  1.00 16.18  ?    A   53
  ATOM O ' OG ' SER A   53 ?   24.077   18.728   12.137  1.00 20.00  ?    A   53
  ATOM N ' N  ' CYS A   54 ?   20.686   19.431   12.208  1.00 12.98  ?    A   54
  ATOM C ' CA ' CYS A   54 ?   19.542   18.589   11.761  1.00 11.10  ?    A   54
  ATOM C ' C  ' CYS A   54 ?   19.928   18.017   10.405  1.00 12.11  ?    A   54
  ATOM O ' O  ' CYS A   54 ?   20.742   18.552    9.652  1.00 14.24  ?    A   54
  ATOM C ' CB ' CYS A   54 ?   18.260   19.377   11.717  1.00 13.87  ?    A   54
  ATOM S ' SG ' CYS A   54 ?   17.853   19.989   13.391  1.00 15.31  ?    A   54
  ATOM N ' N  ' CYS A   55 ?   19.386   16.826   10.143  1.00 10.53  ?    A   55
  ATOM C ' CA ' CYS A   55 ?   19.648   16.090    8.895  1.00 11.17  ?    A   55
  ATOM C ' C  ' CYS A   55 ?   18.321   15.352    8.610  1.00 12.00  ?    A   55
  ATOM O ' O  ' CYS A   55 ?   17.491   15.223    9.536  1.00 12.62  ?    A   55
  ATOM C ' CB ' CYS A   55 ?   20.899   15.234    8.975  1.00 11.83  ?    A   55
  ATOM S ' SG ' CYS A   55 ?   20.871   14.113   10.416  1.00 11.80  ?    A   55
  ATOM N ' N  ' GLU A   56 ?   18.163   14.964    7.358  1.00 11.81  ?    A   56
  ATOM C ' CA ' GLU A   56 ?   16.906   14.342    6.922  1.00 15.45  ?    A   56
  ATOM C ' C  ' GLU A   56 ?   17.117   13.040    6.219  1.00 15.90  ?    A   56
  ATOM O ' O  ' GLU A   56 ?   16.572   12.840    5.081  1.00 19.85  ?    A   56
  ATOM C ' CB ' GLU A   56 ?   16.144   15.341    6.028  1.00 15.67  ?    A   56
  ATOM C ' CG ' GLU A   56 A   15.339   16.468    6.629  0.50 21.38   1   A   56
  ATOM C ' CG ' GLU A   56 B   15.624   16.566    6.796  0.50 18.34   1   A   56
  ATOM C ' CD ' GLU A   56 A   14.175   16.982    5.838  0.50 23.20   1   A   56
  ATOM C ' CD ' GLU A   56 B   15.202   17.768    6.016  0.50 20.00   1   A   56
  ATOM O ' OE1' GLU A   56 A   13.442   16.292    5.152  0.50 26.60   1   A   56
  ATOM O ' OE1' GLU A   56 B   15.445   17.927    4.836  0.50 19.48   1   A   56
  ATOM O ' OE2' GLU A   56 A   13.971   18.214    5.929  0.50 26.79   1   A   56
  ATOM O ' OE2' GLU A   56 B   14.604   18.644    6.706  0.50 22.12   1   A   56
  ATOM N ' N  ' SER A   57 A   17.839   12.118    6.799  0.50 15.99   1   A   57
  ATOM N ' N  ' SER A   57 B   17.845   12.125    6.799  0.50 16.28   1   A   57
  ATOM C ' CA ' SER A   57 A   18.061   10.775    6.206  0.50 14.79   1   A   57
  ATOM C ' CA ' SER A   57 B   18.101   10.788    6.229  0.50 15.51   1   A   57
  ATOM C ' C  ' SER A   57 A   18.148    9.782    7.359  0.50 14.87   1   A   57
  ATOM C ' C  ' SER A   57 B   18.142    9.781    7.381  0.50 15.18   1   A   57
  ATOM O ' O  ' SER A   57 A   18.401   10.203    8.502  0.50 13.49   1   A   57
  ATOM O ' O  ' SER A   57 B   18.388   10.193    8.526  0.50 13.74   1   A   57
  ATOM C ' CB ' SER A   57 A   19.237   10.722    5.267  0.50 16.85   1   A   57
  ATOM C ' CB ' SER A   57 B   19.424   10.731    5.471  0.50 18.34   1   A   57
  ATOM O ' OG ' SER A   57 A   20.503   10.633    5.862  0.50 17.66   1   A   57
  ATOM O ' OG ' SER A   57 B   19.740   11.912    4.777  0.50 23.38   1   A   57
  ATOM N ' N  ' GLU A   58 ?   18.005    8.501    7.076  1.00 14.09  ?    A   58
  ATOM C ' CA ' GLU A   58 ?   18.056    7.432    8.076  1.00 15.09  ?    A   58
  ATOM C ' C  ' GLU A   58 ?   19.317    7.448    8.901  1.00 14.68  ?    A   58
  ATOM O ' O  ' GLU A   58 ?   20.422    7.527    8.316  1.00 16.80  ?    A   58
  ATOM C ' CB ' GLU A   58 ?   17.967    6.002    7.471  1.00 16.74  ?    A   58
  ATOM C ' CG ' GLU A   58 ?   16.602    5.613    6.901  1.00 19.06  ?    A   58
  ATOM C ' CD ' GLU A   58 ?   15.558    5.565    8.006  1.00 17.65  ?    A   58
  ATOM O ' OE1' GLU A   58 ?   14.995    6.544    8.389  1.00 17.14  ?    A   58
  ATOM O ' OE2' GLU A   58 ?   15.356    4.417    8.434  1.00 19.85  ?    A   58
  ATOM N ' N  ' VAL A   59 ?   19.176    7.358   10.234  1.00 14.09  ?    A   59
  ATOM C ' CA ' VAL A   59 ?   20.276    7.347   11.185  1.00 14.49  ?    A   59
  ATOM C ' C  ' VAL A   59 ?   21.391    8.314   10.754  1.00 13.27  ?    A   59
  ATOM O ' O  ' VAL A   59 ?   22.576    7.929   10.793  1.00 15.75  ?    A   59
  ATOM C ' CB ' VAL A   59 ?   20.813    5.948   11.525  1.00 16.78  ?    A   59
  ATOM C ' CG1' VAL A   59 ?   19.884    5.193   12.486  1.00 17.29  ?    A   59
  ATOM C ' CG2' VAL A   59 ?   21.143    5.099   10.311  1.00 15.34  ?    A   59
  ATOM N ' N  ' CYS A   60 ?   21.021    9.511   10.407  1.00 11.43  ?    A   60
  ATOM C ' CA ' CYS A   60 ?   22.021   10.503    9.930  1.00 12.68  ?    A   60
  ATOM C ' C  ' CYS A   60 ?   22.744   11.278   10.993  1.00 11.38  ?    A   60
  ATOM O ' O  ' CYS A   60 ?   23.747   11.976   10.742  1.00 12.68  ?    A   60
  ATOM C ' CB ' CYS A   60 ?   21.288   11.467    8.945  1.00 12.19  ?    A   60
  ATOM S ' SG ' CYS A   60 ?   19.950   12.442    9.708  1.00 11.34  ?    A   60
  ATOM N ' N  ' ASN A   61 ?   22.260   11.238   12.218  1.00 10.35  ?    A   61
  ATOM C ' CA ' ASN A   61 ?   22.726   12.016   13.369  1.00 10.03  ?    A   61
  ATOM C ' C  ' ASN A   61 ?   23.750   11.399   14.270  1.00 12.84  ?    A   61
  ATOM O ' O  ' ASN A   61 ?   23.795   11.854   15.441  1.00 13.27  ?    A   61
  ATOM C ' CB ' ASN A   61 ?   21.446   12.534   14.116  1.00  6.62  ?    A   61
  ATOM C ' CG ' ASN A   61 ?   20.669   11.348   14.678  1.00  7.82  ?    A   61
  ATOM O ' OD1' ASN A   61 ?   20.669   10.257   14.168  1.00  9.40  ?    A   61
  ATOM N ' ND2' ASN A   61 ?   20.017   11.624   15.806  1.00  7.16  ?    A   61
  ATOM N ' N  ' ASN A   62 A   24.676   10.595   13.796  0.50 15.36   1   A   62
  ATOM N ' N  ' ASN A   62 B   24.535   10.425   13.864  0.50 14.11   1   A   62
  ATOM C ' CA ' ASN A   62 A   25.733   10.036   14.703  0.50 18.44   1   A   62
  ATOM C ' CA ' ASN A   62 B   25.557    9.879   14.817  0.50 15.70   1   A   62
  ATOM C ' C  ' ASN A   62 A   26.547   11.216   15.253  0.50 18.79   1   A   62
  ATOM C ' C  ' ASN A   62 B   26.679   10.945   14.767  0.50 15.44   1   A   62
  ATOM O ' O  ' ASN A   62 A   26.704   12.146   14.420  0.50 17.72   1   A   62
  ATOM O ' O  ' ASN A   62 B   27.262   10.893   13.654  0.50 14.67   1   A   62
  ATOM C ' CB ' ASN A   62 A   26.557    8.971   14.016  0.50 23.66   1   A   62
  ATOM C ' CB ' ASN A   62 B   26.048    8.490   14.464  0.50 18.79   1   A   62
  ATOM C ' CG ' ASN A   62 A   26.891    9.209   12.566  0.50 26.34   1   A   62
  ATOM C ' CG ' ASN A   62 B   27.097    7.981   15.450  0.50 18.06   1   A   62
  ATOM O ' OD1' ASN A   62 A   26.697    8.311   11.723  0.50 27.92   1   A   62
  ATOM O ' OD1' ASN A   62 B   26.774    7.332   16.449  0.50 21.12   1   A   62
  ATOM N ' ND2' ASN A   62 A   27.399   10.393   12.247  0.50 26.11   1   A   62
  ATOM N ' ND2' ASN A   62 B   28.357    8.298   15.165  0.50 18.10   1   A   62
  ATOM O ' OXT' ASN A   62 A   26.944   11.211   16.432  0.50 17.62   1   A   62
  ATOM O ' OXT' ASN A   62 B   26.811   11.723   15.720  0.50 16.44   1   A   62
HETATM S ' S  ' SO4 ?    1 ?   13.711    8.933   24.513  0.50 32.59  ?  SO4    1
HETATM O ' O1 ' SO4 ?    1 ?   13.865    8.756   23.026  0.50 32.50  ?  SO4    1
HETATM O ' O2 ' SO4 ?    1 ?   12.326    9.426   24.800  0.50 31.45  ?  SO4    1
HETATM O ' O3 ' SO4 ?    1 ?   14.742    9.918   24.980  0.50 31.41  ?  SO4    1
HETATM O ' O4 ' SO4 ?    1 ?   13.902    7.609   25.193  0.50 32.20  ?  SO4    1
HETATM O ' O  ' HOH ?   63 ?   20.364   11.540   23.509  1.00 12.89  ?  HOH   63
HETATM O ' O  ' HOH ?   64 ?   20.056   15.028   26.974  0.50 12.14  ?  HOH   64
HETATM O ' O  ' HOH ?   65 ?    9.124   12.019   16.071  0.50  9.63  ?  HOH   65
HETATM O ' O  ' HOH ?   66 ?   17.450    1.139   20.344  0.95 19.71  ?  HOH   66
HETATM O ' O  ' HOH ?   67 ?    9.001    8.885   10.709  0.50 16.16  ?  HOH   67
HETATM O ' O  ' HOH ?   68 ?   22.277    7.065   25.605  1.00 25.70  ?  HOH   68
HETATM O ' O  ' HOH ?   69 ?   24.333   14.388   30.787  0.50 22.99  ?  HOH   69
HETATM O ' O  ' HOH ?   70 ?   32.505   21.721   30.569  1.00 22.54  ?  HOH   70
HETATM O ' O  ' HOH ?   71 ?   11.416    3.702   18.931  0.78 16.22  ?  HOH   71
HETATM O ' O  ' HOH ?   72 ?   23.012   20.611   30.976  0.68 12.70  ?  HOH   72
HETATM O ' O  ' HOH ?   73 ?   16.816    8.448   25.702  0.50 18.44  ?  HOH   73
HETATM O ' O  ' HOH ?   74 ?    8.503    8.431   18.368  0.97 35.52  ?  HOH   74
HETATM O ' O  ' HOH ?   76 ?   27.525    0.972   20.029  0.70 15.31  ?  HOH   76
HETATM O ' O  ' HOH ?   77 ?   15.719   19.230    9.207  0.82 22.14  ?  HOH   77
HETATM O ' O  ' HOH ?   78 ?   14.182    2.278   16.457  0.50 13.17  ?  HOH   78
HETATM O ' O  ' HOH ?   79 ?   29.874    9.216   26.567  0.50 10.57  ?  HOH   79
HETATM O ' O  ' HOH ?   80 ?   12.272    4.684    8.990  0.77 23.10  ?  HOH   80
HETATM O ' O  ' HOH ?   81 ?   30.426   14.342   24.736  1.00 32.38  ?  HOH   81
HETATM O ' O  ' HOH ?   83 ?   21.245   22.061   10.701  1.00 21.38  ?  HOH   83
HETATM O ' O  ' HOH ?   84 ?   22.001    8.513   28.222  0.61 18.31  ?  HOH   84
HETATM O ' O  ' HOH ?   85 ?   15.863   11.847   21.962  0.50 17.43  ?  HOH   85
HETATM O ' O  ' HOH ?   86 ?   29.911   22.303   23.817  0.76 23.74  ?  HOH   86
HETATM O ' O  ' HOH ?   87 ?   18.479   19.091    7.573  0.88 26.85  ?  HOH   87
HETATM O ' O  ' HOH ?   88 ?   16.214    3.684   22.102  0.50 23.63  ?  HOH   88
HETATM O ' O  ' HOH ?   89 ?    8.627   14.802   15.542  1.00 30.95  ?  HOH   89
HETATM O ' O  ' HOH ?   90 ?   28.785    4.917   20.303  0.52 16.69  ?  HOH   90
HETATM O ' O  ' HOH ?   91 ?   22.895    4.660   25.293  0.40 25.66  ?  HOH   91
HETATM O ' O  ' HOH ?   93 ?   27.358   10.964    8.149  0.50 35.62  ?  HOH   93
HETATM O ' O  ' HOH ?   94 ?   28.155    7.413   18.548  0.73 24.71  ?  HOH   94
HETATM O ' O  ' HOH ?   95 ?   30.275    3.134   23.567  0.70 22.55  ?  HOH   95
HETATM O ' O  ' HOH ?   96 ?   31.827   14.865   35.170  1.00 28.11  ?  HOH   96
HETATM O ' O  ' HOH ?   97 ?   13.727   12.121   20.029  0.73 17.70  ?  HOH   97
HETATM O ' O  ' HOH ?   98 ?   27.578   24.771   22.521  0.60 23.25  ?  HOH   98
HETATM O ' O  ' HOH ?   99 ?   15.772   13.578    2.605  0.50 23.92  ?  HOH   99
HETATM O ' O  ' HOH ?  101 ?   32.701   24.632   30.415  0.64 31.42  ?  HOH  101
HETATM O ' O  ' HOH ?  102 ?   30.898   12.177   22.856  0.44 21.15  ?  HOH  102
HETATM O ' O  ' HOH ?  104 ?   10.726   18.324   13.721  0.50 15.79  ?  HOH  104
HETATM O ' O  ' HOH ?  105 ?   19.585    6.098   24.909  0.50 21.97  ?  HOH  105
HETATM O ' O  ' HOH ?  106 ?   12.841   17.258   18.135  0.50 19.84  ?  HOH  106
HETATM O ' O  ' HOH ?  107 ?   33.763   20.365   32.530  0.50 29.75  ?  HOH  107
HETATM O ' O  ' HOH ?  109 ?   27.422   25.066   25.473  0.52 21.60  ?  HOH  109
HETATM O ' O  ' HOH ?  110 ?   33.618   22.329   35.782  1.00 33.38  ?  HOH  110
HETATM O ' O  ' HOH ?  111 ?   17.866   18.515   26.493  0.45 22.83  ?  HOH  111
HETATM O ' O  ' HOH ?  112 ?   32.765   21.118   27.595  0.37 17.19  ?  HOH  112
HETATM O ' O  ' HOH ?  113 ?   13.221   23.557   12.425  0.60 33.58  ?  HOH  113
HETATM O ' O  ' HOH ?  114 ?   18.899   23.421    9.696  0.50 37.39  ?  HOH  114
HETATM O ' O  ' HOH ?  116 ?   13.853   14.783   21.719  0.80 30.68  ?  HOH  116
HETATM O ' O  ' HOH ?  117 ?   10.152    0.768   16.688  0.56 29.08  ?  HOH  117
HETATM O ' O  ' HOH ?  118 ?   22.858   28.487   19.359  0.91 25.84  ?  HOH  118
HETATM O ' O  ' HOH ?  119 ?   16.008   24.549   14.050  0.54 20.51  ?  HOH  119
HETATM O ' O  ' HOH ?  120 ?   11.154   17.848   10.439  0.40 14.42  ?  HOH  120
HETATM O ' O  ' HOH ?  121 ?   21.042   12.989   26.190  0.50 19.74  ?  HOH  121
HETATM O ' O  ' HOH ?  122 ?   19.731   27.833   26.341  1.00 44.46  ?  HOH  122
HETATM O ' O  ' HOH ?  124 ?   15.574   30.068   19.914  0.60 24.02  ?  HOH  124
HETATM O ' O  ' HOH ?  125 ?    9.403   11.468   17.958  0.50 29.92  ?  HOH  125
HETATM O ' O  ' HOH ?  128 ?   15.751   27.226   14.938  0.40 25.68  ?  HOH  128
HETATM O ' O  ' HOH ?  129 ?    9.365    6.312   11.505  0.50 17.33  ?  HOH  129
HETATM O ' O  ' HOH ?  130 ?   17.556    0.116   15.070  0.67 27.50  ?  HOH  130
HETATM O ' O  ' HOH ?  131 ?   13.526    2.182   19.511  0.50 22.68  ?  HOH  131
HETATM O ' O  ' HOH ?  133 ?   11.946   12.193   23.218  0.38 23.03  ?  HOH  133
HETATM O ' O  ' HOH ?  134 ?   13.022   19.419    3.614  0.40 23.66  ?  HOH  134
HETATM O ' O  ' HOH ?  137 ?   18.225   23.341   20.456  1.00 33.34  ?  HOH  137
HETATM O ' O  ' HOH ?  138 ?   20.138   25.118   19.692  0.85 38.07  ?  HOH  138
HETATM O ' O  ' HOH ?  140 ?   14.717   24.027   21.105  0.60 36.81  ?  HOH  140
HETATM O ' O  ' HOH ?  141 ?   20.584   22.109   27.494  0.50 19.57  ?  HOH  141
HETATM O ' O  ' HOH ?  142 ?   33.941   18.841   35.203  0.50 32.42  ?  HOH  142
HETATM O ' O  ' HOH ?  143 ?   31.032    7.049   26.552  0.50 20.76  ?  HOH  143
HETATM O ' O  ' HOH ?  145 ?   30.617   16.097   37.655  0.58 33.58  ?  HOH  145
HETATM O ' O  ' HOH ?  146 ?   29.659    9.141   15.543  0.50 33.11  ?  HOH  146
HETATM O ' O  ' HOH ?  148 ?    9.834   13.829   18.993  0.50 35.12  ?  HOH  148
HETATM O ' O  ' HOH ?  150 ?   19.262   25.114   27.404  0.40 24.08  ?  HOH  150
HETATM O ' O  ' HOH ?  151 ?   25.558   26.792   26.769  0.43 27.86  ?  HOH  151
HETATM O ' O  ' HOH ?  152 ?   31.143   18.427   16.728  0.58 33.31  ?  HOH  152
HETATM O ' O  ' HOH ?  153 ?   10.335    9.069    7.310  0.51 24.56  ?  HOH  153
HETATM O ' O  ' HOH ?  154 ?    9.171   16.536   18.150  0.70 25.34  ?  HOH  154
HETATM O ' O  ' HOH ?  157 ?   31.747   25.296   25.517  0.47 25.54  ?  HOH  157
HETATM O ' O  ' HOH ?  158 ?   29.891   11.448   19.691  0.38 24.04  ?  HOH  158
HETATM O ' O  ' HOH ?  165 ?   18.310    3.200   26.092  0.64 35.07  ?  HOH  165
HETATM O ' O  ' HOH ?  166 ?   28.087   13.925   14.338  0.50 15.26  ?  HOH  166
HETATM O ' O  ' HOH ?  168 ?   29.260   13.527   15.380  0.50 26.52  ?  HOH  168
HETATM O ' O  ' HOH ?  170 ?   29.987    1.924   20.321  0.50 38.02  ?  HOH  170
HETATM O ' O  ' HOH ?  172 ?   25.186    8.776   11.403  0.40 21.58  ?  HOH  172
HETATM O ' O  ' HOH ?  174 ?   14.727    9.830   22.064  0.50 29.63  ?  HOH  174
HETATM O ' O  ' HOH ?  175 ?   11.274   18.389   17.558  0.50 30.31  ?  HOH  175
HETATM O ' O  ' HOH ?  176 ?   15.343   16.934    2.996  0.50 23.26  ?  HOH  176
HETATM O ' O  ' HOH ?  267 ?    8.645    7.837   11.253  0.50 14.66  ?  HOH  267
HETATM O ' O  ' HOH ?  273 ?   17.399    9.878   24.511  0.50 23.62  ?  HOH  273
HETATM O ' O  ' HOH ?  274 ?    9.160    5.839   18.687  0.72 39.16  ?  HOH  274
HETATM O ' O  ' HOH ?  276 ?   28.231    1.705   19.176  0.30 20.08  ?  HOH  276
HETATM O ' O  ' HOH ?  278 ?   14.241    1.403   17.528  0.50 28.26  ?  HOH  278
HETATM O ' O  ' HOH ?  279 ?   28.640    9.886   27.757  0.50 17.01  ?  HOH  279
HETATM O ' O  ' HOH ?  284 ?   22.002    5.145   28.281  0.64 32.60  ?  HOH  284
HETATM O ' O  ' HOH ?  285 ?   17.288   12.303   23.631  0.50 27.21  ?  HOH  285
HETATM O ' O  ' HOH ?  288 ?   14.394    4.414   21.700  0.50 32.73  ?  HOH  288
HETATM O ' O  ' HOH ?  291 ?   23.226    3.070   25.252  0.60 18.91  ?  HOH  291
HETATM O ' O  ' HOH ?  293 ?   26.531   10.712   10.036  0.50 40.69  ?  HOH  293
HETATM O ' O  ' HOH ?  295 ?   30.748    3.665   21.750  0.30 26.48  ?  HOH  295
HETATM O ' O  ' HOH ?  296 ?   33.027   16.525   36.850  0.51 28.56  ?  HOH  296
HETATM O ' O  ' HOH ?  298 ?   29.383   24.820   23.036  0.40 30.81  ?  HOH  298
HETATM O ' O  ' HOH ?  299 ?   14.109   12.796    3.309  0.50 24.98  ?  HOH  299
HETATM O ' O  ' HOH ?  304 ?   10.514   18.610   15.200  0.50 18.40  ?  HOH  304
HETATM O ' O  ' HOH ?  305 ?   18.488    7.707   25.482  0.50 27.09  ?  HOH  305
HETATM O ' O  ' HOH ?  307 ?   33.881   18.554   33.131  0.50 22.41  ?  HOH  307
HETATM O ' O  ' HOH ?  309 ?   28.165   26.244   27.529  0.40 31.00  ?  HOH  309
HETATM O ' O  ' HOH ?  314 ?   17.469   22.054    9.470  0.50 26.95  ?  HOH  314
HETATM O ' O  ' HOH ?  315 ?   32.026   25.012   21.129  0.40 15.11  ?  HOH  315
HETATM O ' O  ' HOH ?  320 ?   11.623   19.772   10.941  0.50 27.73  ?  HOH  320
HETATM O ' O  ' HOH ?  325 ?    9.797   12.260   19.800  0.50 29.61  ?  HOH  325
HETATM O ' O  ' HOH ?  326 ?    9.646    1.986   11.441  0.50 23.96  ?  HOH  326
HETATM O ' O  ' HOH ?  346 ?   29.531   11.678   16.525  0.40 33.34  ?  HOH  346
HETATM O ' O  ' HOH ?  348 ?   11.838   14.042   19.550  0.50 28.80  ?  HOH  348

# REMARK records parsed 	=   134;# specified by PDB 	=   134
# FTNOTE records parsed 	=     2;# specified by PDB 	=     2
# HET records parsed 		=     1;# specified by PDB 	=     1
# HELIX records parsed 		=     0;# specified by PDB 	=     0
# SHEET records parsed 		=     5;# specified by PDB 	=     5
# TURN records parsed 		=     5;# specified by PDB 	=     5
# SITE records parsed 		=    10;# specified by PDB 	=    10
# AT+HET records parsed 	=   685;# specified by PDB 	=   685
# CONECT records parsed 	=    64;# specified by PDB 	=    64
# SEQRES records parsed 	=     5;# specified by PDB 	=     5

# Total of   940 records processed from PDB file
