mmCIF - Example - HIV-1 Protease - 5HVP

Last Update Nov. 08, 1995
CIF Editor


###############################################
#                                             #
# Converted from PDB format to CIF format by  #
# pdb2cif version 1.0.9-alpha      2 Nov 95   #
# by Phil Bourne and Herbert J. Bernstein     #
# *************    WARNING   **************** #
# *                                         * #
# * THIS IS A TEST VERSION USE WITH CAUTION * #
# *                                         * #
# ******************************************* #
# Please report problems to yaya@aip.org      #
#                                             #
###############################################
#
#  Current major limitations:
#
#  When PDB entries have a blank chain identifier, the current version
#  of the code assigns "." for the corresponding _struct_asym.id.  This
#  is not a desirable choice.   Better approaches are under discussion.
#  Comments appreciated.
#
#  This version of pdb2cif will not run with all versions of awk, because
#  of the use of functions and a call to system.  When the code stabilizes,
#  versions for older awks will be made from this one.  Until then, if
#  you have trouble with /bin/awk, we would suggest using the gnu version
#  of awk, gawk.
#
###########################################################################
data_5HVP

_chemical.name_common 
;    HIV-1 Protease Complex With Acetyl-pepstatin              
; 

_chemical.name_common 
;     (NY5 Strain)                                              
; 
_chemical.compound_source 
;  NY5 Strain Of Human Immunodeficiency Virus Type 1           
  Expressed In (Escherichia coli), The Inhibitor Is From     
  (Streptomyces namwaensis)                                  
; 




########################
#                      #
# AUDIT_CONTACT_AUTHOR #
#                      #
########################


_audit_contact_author.name  'P.M.D.Fitzgerald'



####################
#                  #
# AUDIT_AUTHOR     #
#                  #
####################


loop_ 
_audit_author.name 
'B.M.McKeever' 
'J.F.VanMiddlesworth' 
'J.P.Springer' 

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_coden_ISSN
_citation.journal_coden_PDB
_citation.book_title
_citation.book_publisher
_citation.book_coden_ISBN
_citation.details
 
primary   yes
;  Acetyl-Pepstatin At 2.0-Angstroms Resolution     
;
 US 'J.BIOL.CHEM.                '  265  ?   14209   1990 
'JBCHA3         ' '0021-9258                ' ? ? ? ? ?
 
  2       no
; Three-dimensional Structure Of Aspartyl Protease   
   From Human Immunodeficiency Virus HIV-1          
;
 UK 'NATURE                      '  337  ?     615   1989 
'NATUAS         ' '0028-0836                ' ? ? ? ? ?
 
  3       no
; Crystallization Of The Aspartylprotease From The   
   Human Immunodefeciency Virus, HIV-1              
;
 US 'J.BIOL.CHEM.                '  264  ?    1919   1989 
'JBCHA3         ' '0021-9258                ' ? ? ? ? ?
 
  4       no
; Human Immunodeficiency Virus Protease.  Bacterial  
  Expression And Characterization Of The Purified    
  Aspartic Protease                                  
;
 US 'J.BIOL.CHEM.                '  264  ?    2307   1989 
'JBCHA3         ' '0021-9258                ' ? ? ? ? ?

loop_
_citation_author.citation_id
_citation_author.name
 primary   'P.M.D.Fitzgerald' 
 primary   'B.M.McKeever' 
 primary   'J.F.VanMiddlesworth' 
 primary   'J.P.Springer' 
 primary   'J.C.Heimbach' 
 primary   'C.-T.Leu' 
 primary   'W.K.Herber' 
 primary   'R.A.F.Dixon' 
 primary   'P.L.Darke' 
   2       'M.A.Navia' 
   2       'P.M.D.Fitzgerald' 
   2       'B.M.McKeever' 
   2       'C.-T.Leu' 
   2       'J.C.Heimbach' 
   2       'W.K.Herber' 
   2       'I.S.Sigal' 
   2       'P.L.Darke' 
   2       'J.P.Springer' 
   3       'B.M.McKeever' 
   3       'M.A.Navia' 
   3       'P.M.D.Fitzgerald' 
   3       'J.P.Springer' 
   3       'C.-T.Leu' 
   3       'J.C.Heimbach' 
   3       'W.K.Herber' 
   3       'I.S.Sigal' 
   3       'P.L.Darke' 
   4       'P.L.Darke' 
   4       'C.-T.Leu' 
   4       'L.J.Davis' 
   4       'J.C.Heimabch' 
   4       'R.E.Diehl' 
   4       'W.S.Hill' 
   4       'R.A.F.Dixon' 
   4       'I.S.Sigal' 

_reflns.d_resolution_high           2 

loop_
_database_PDB_remark.id
_database_PDB_remark.text
  3
;                                                              
 REFINEMENT. BY THE RESTRAINED LEAST-SQUARES PROCEDURE OF J.  
  KONNERT AND W. HENDRICKSON (PROGRAM *PROLSQ*).  THE R       
  VALUE IS 0.176 FOR 12901 REFLECTIONS IN THE RESOLUTION      
  RANGE 8.0 TO 2.0 ANGSTROMS WITH I .GT. SIGMA(I).            
                                                              
  RMS DEVIATIONS FROM IDEAL VALUES (THE VALUES OF             
      SIGMA, IN PARENTHESES, ARE THE INPUT ESTIMATED          
      STANDARD DEVIATIONS THAT DETERMINE THE RELATIVE         
      WEIGHTS OF THE CORRESPONDING RESTRAINTS)                
    DISTANCE RESTRAINTS (ANGSTROMS)                           
      BOND DISTANCE                            0.018(0.020)   
      ANGLE DISTANCE                           0.038(0.030)   
      PLANAR 1-4 DISTANCE                      0.043(0.040)   
    PLANE RESTRAINT (ANGSTROMS)                0.015(0.020)   
    CHIRAL-CENTER RESTRAINT (ANGSTROMS**3)     0.177(0.150)   
    NON-BONDED CONTACT RESTRAINTS (ANGSTROMS)                 
      SINGLE TORSION CONTACT                   0.216(0.500)   
      MULTIPLE TORSION CONTACT                 0.207(0.500)   
      POSSIBLE HYDROGEN BOND                   0.245(0.500)   
    CONFORMATIONAL TORSION ANGLE RESTRAINT (DEGREES)          
      PLANAR (OMEGA)                             2.6(3.0)     
      STAGGERED                                 17.4(15.0)    
      ORTHONORMAL                               18.1(20.0)    
;

  4
;                                                              
 THE TWO CHAINS OF THE DIMERIC ENZYME HAS BEEN ASSIGNED THE   
 THE CHAIN INDICATORS *A* AND *B*.                            
;

  5
;                                                              
 THE INHIBITOR HAS BEEN ASSIGNED THE CHAIN INDICATOR *C*.     
;

  6
;                                                              
 THE INHIBITOR BINDS TO THE ENZYME IN TWO ROUGHLY TWOFOLD     
 SYMMETRIC ORIENTATIONS.  THE ALTERNATE CONFORMATIONS ARE     
 REPRESENTED BY THE ALTERNATE LOCATION INDICATORS *1*         
 AND *2*.  THE FIRST ORIENTATION, *1*, WAS DENOTED A IN THE   
 PUBLICATION CITED IN THE *JRNL* RECORDS ABOVE, WHILE THE     
 ALTERNATE ORIENTATION, *2*, WAS DENOTED B.                   
;

  7
;                                                              
 IN THE PAPER CITED IN THE *JRNL* RECORDS ABOVE, THE *B*      
 CHAIN RESIDUES WERE NUMBERED FROM 201 TO 299.  THIS          
 NUMBERING SCHEME HAS BEEN RETAINED.                          
;

  8
;                                                              
 NO ELECTRON DENSITY WAS OBSERVED BEYOND THE POSITION OF THE  
 BETA CARBON OF RESIDUES ARG A 41, LYS A 43 AND GLN A 61 AND  
 NO ELECTRON DENSITY WAS OBSERVED FOR THE DELTA CARBON OF     
 RESIDUE ILE A 72.  THEREFORE THE CORRESPONDING COORDINATES   
 ARE NOT INCLUDED IN THIS ENTRY.                              
;

  9
;                                                              
 THE SHEET *S1* IS FORMED BY THE INTERDIGITATING STRANDS      
 FROM THE TWO MONOMERS OF THE DIMERIC ENZYME.  STRANDS 1 AND  
 3 ARE FROM CHAIN *A*.  STRANDS 2 AND 4 ARE FROM CHAIN *B*.   
;

 10
;                                                              
 WATER MOLECULES WITH ALTERNATE LOCATION INDICATOR *1* OR     
 *2* AND OCCUPANCY 0.50 EITHER CORRELATE WITH THE             
 APPROPRIATE ALTERNATE LOCATION (*1* OR *2*) OF AN AMINO      
 ACID SIDE CHAIN IN THE PROTEIN OR CORRELATE WITH A SECOND    
 WATER MOLECULE WHOSE POSITION CANNOT BE OCCUPIED             
 SIMULATANEOUSLY.                                             
;

 11
;                                                              
 THE SOLVENT AND CHLORIDE IONS ARE GIVEN IN THE HETATM LIST   
 IN ORDER OF INCREASING TEMPERATURE FACTORS.                  
; 


loop_ 
_struct_conf_type.id
_struct_conf_type.criteria
_struct_conf_type.reference
 HELX_RH_AL_P      'From PDB'   . 
 TURN              'From PDB'   . 

loop_ 
_struct_conf.id
_struct_conf.conf_type_id
_struct_conf.beg_label_comp_id
_struct_conf.beg_label_asym_id
_struct_conf.beg_label_seq_id
_struct_conf.end_label_comp_id
_struct_conf.end_label_asym_id
_struct_conf.end_label_seq_id
_struct_conf.details
helix_H1  HELX_RH_AL_P ARG A   87  GLN A   92  'RIGHT-HANDED ALPHA HELIX'
helix_H2  HELX_RH_AL_P ARG B  287  GLN B  292  'RIGHT-HANDED ALPHA HELIX'
turn_T1   TURN         ILE A   15  GLN A   18  'TYPE I(PRIME)'
turn_T2   TURN         GLY A   49  GLY A   52  'TYPE II'
turn_T3   TURN         ILE A   66  HIS A   69  'TYPE I(PRIME)'
turn_T4   TURN         THR A   91  GLY A   94  'TYPE I'
turn_T5   TURN         ILE B  215  GLN B  218  'TYPE I(PRIME)'
turn_T6   TURN         GLY B  249  GLY B  252  'TYPE I'
turn_T7   TURN         ILE B  266  HIS B  269  'TYPE I(PRIME)'
turn_T8   TURN         THR B  291  GLY B  294  'TYPE I'

_cell.length_a           58.390 
_cell.length_b           86.700 
_cell.length_c           46.270 
_cell.angle_alpha        90.000 
_cell.angle_beta         90.000 
_cell.angle_gamma        90.000 
_cell.volume            234237.8 
_cell.details         ? 
_cell.Z_PDB                 4 

_symmetry.space_group_name_H-M   ' P 21 21 2 ' 




##############################
#                            #
# STRUCT_CONN_TYPE           #
#                            #
##############################



loop_
_struct_conn_type.id
_struct_conn_type.criteria
_struct_conn_type.reference
  .     'unknown bond type from PDB file' ?
saltbr  'defined by user in PDB file'     ?
hydrog  'defined by user in PDB file'     ?



##############################
#                            #
# STRUCT_CONN                #
#                            #
##############################



loop_
_struct_conn.id
_struct_conn.conn_type_id
_struct_conn.ptnr1_label_res_id
_struct_conn.ptnr1_label_asym_id
_struct_conn.ptnr1_label_seq_id
_struct_conn.ptnr1_label_atom_id
_struct_conn.ptnr1_label_alt_id
_struct_conn.ptnr1_role
_struct_conn.ptnr1_symmetry
_struct_conn.ptnr2_label_res_id
_struct_conn.ptnr2_label_asym_id
_struct_conn.ptnr2_label_seq_id
_struct_conn.ptnr2_label_atom_id
_struct_conn.ptnr2_label_alt_id
_struct_conn.ptnr2_role
_struct_conn.ptnr2_symmetry
_struct_conn.details
  1   .    STA C    4  N    1   ? 1_555 STA C    4  CA   1   ? 1_555 .
  2   .    STA C    4  CA   1   ? 1_555 STA C    4  N    1   ? 1_555 .
  3   .    STA C    4  CA   1   ? 1_555 STA C    4  CB   1   ? 1_555 .
  4   .    STA C    4  CA   1   ? 1_555 STA C    4  CH   1   ? 1_555 .
  5   .    STA C    4  CB   1   ? 1_555 STA C    4  CA   1   ? 1_555 .
  6   .    STA C    4  CB   1   ? 1_555 STA C    4  CG   1   ? 1_555 .
  7   .    STA C    4  CG   1   ? 1_555 STA C    4  CB   1   ? 1_555 .
  8   .    STA C    4  CG   1   ? 1_555 STA C    4  CD1  1   ? 1_555 .
  9   .    STA C    4  CG   1   ? 1_555 STA C    4  CD2  1   ? 1_555 .
 10   .    STA C    4  CD1  1   ? 1_555 STA C    4  CG   1   ? 1_555 .
 11   .    STA C    4  CD2  1   ? 1_555 STA C    4  CG   1   ? 1_555 .
 12   .    STA C    4  CH   1   ? 1_555 STA C    4  CA   1   ? 1_555 .
 13   .    STA C    4  CH   1   ? 1_555 STA C    4  OH   1   ? 1_555 .
 14   .    STA C    4  CH   1   ? 1_555 STA C    4  CM   1   ? 1_555 .
 15   .    STA C    4  OH   1   ? 1_555 STA C    4  CH   1   ? 1_555 .
 16   .    STA C    4  CM   1   ? 1_555 STA C    4  CH   1   ? 1_555 .
 17   .    STA C    4  CM   1   ? 1_555 STA C    4  C    1   ? 1_555 .
 18   .    STA C    4  C    1   ? 1_555 STA C    4  CM   1   ? 1_555 .
 19   .    STA C    4  C    1   ? 1_555 STA C    4  O    1   ? 1_555 .
 20   .    STA C    4  O    1   ? 1_555 STA C    4  C    1   ? 1_555 .
 21   .    STA C    6  N    1   ? 1_555 STA C    6  CA   1   ? 1_555 .
 22   .    STA C    6  CA   1   ? 1_555 STA C    6  N    1   ? 1_555 .
 23   .    STA C    6  CA   1   ? 1_555 STA C    6  CB   1   ? 1_555 .
 24   .    STA C    6  CA   1   ? 1_555 STA C    6  CH   1   ? 1_555 .
 25   .    STA C    6  CB   1   ? 1_555 STA C    6  CA   1   ? 1_555 .
 26   .    STA C    6  CB   1   ? 1_555 STA C    6  CG   1   ? 1_555 .
 27   .    STA C    6  CG   1   ? 1_555 STA C    6  CB   1   ? 1_555 .
 28   .    STA C    6  CG   1   ? 1_555 STA C    6  CD1  1   ? 1_555 .
 29   .    STA C    6  CG   1   ? 1_555 STA C    6  CD2  1   ? 1_555 .
 30   .    STA C    6  CD1  1   ? 1_555 STA C    6  CG   1   ? 1_555 .
 31   .    STA C    6  CD2  1   ? 1_555 STA C    6  CG   1   ? 1_555 .
 32   .    STA C    6  CH   1   ? 1_555 STA C    6  CA   1   ? 1_555 .
 33   .    STA C    6  CH   1   ? 1_555 STA C    6  OH   1   ? 1_555 .
 34   .    STA C    6  CH   1   ? 1_555 STA C    6  CM   1   ? 1_555 .
 35   .    STA C    6  OH   1   ? 1_555 STA C    6  CH   1   ? 1_555 .
 36   .    STA C    6  CM   1   ? 1_555 STA C    6  CH   1   ? 1_555 .
 37   .    STA C    6  CM   1   ? 1_555 STA C    6  C    1   ? 1_555 .
 38   .    STA C    6  C    1   ? 1_555 STA C    6  CM   1   ? 1_555 .
 39   .    STA C    6  C    1   ? 1_555 STA C    6  O    1   ? 1_555 .
 40   .    STA C    6  C    1   ? 1_555 STA C    6  OXT  1   ? 1_555 .
 41   .    STA C    6  O    1   ? 1_555 STA C    6  C    1   ? 1_555 .
 42   .    STA C    6  OXT  1   ? 1_555 STA C    6  C    1   ? 1_555 .
 43   .    STA C    4  N    2   ? 1_555 STA C    4  CA   2   ? 1_555 .
 44   .    STA C    4  CA   2   ? 1_555 STA C    4  N    2   ? 1_555 .
 45   .    STA C    4  CA   2   ? 1_555 STA C    4  CB   2   ? 1_555 .
 46   .    STA C    4  CA   2   ? 1_555 STA C    4  CH   2   ? 1_555 .
 47   .    STA C    4  CB   2   ? 1_555 STA C    4  CA   2   ? 1_555 .
 48   .    STA C    4  CB   2   ? 1_555 STA C    4  CG   2   ? 1_555 .
 49   .    STA C    4  CG   2   ? 1_555 STA C    4  CB   2   ? 1_555 .
 50   .    STA C    4  CG   2   ? 1_555 STA C    4  CD1  2   ? 1_555 .
 51   .    STA C    4  CG   2   ? 1_555 STA C    4  CD2  2   ? 1_555 .
 52   .    STA C    4  CD1  2   ? 1_555 STA C    4  CG   2   ? 1_555 .
 53   .    STA C    4  CD2  2   ? 1_555 STA C    4  CG   2   ? 1_555 .
 54   .    STA C    4  CH   2   ? 1_555 STA C    4  CA   2   ? 1_555 .
 55   .    STA C    4  CH   2   ? 1_555 STA C    4  OH   2   ? 1_555 .
 56   .    STA C    4  CH   2   ? 1_555 STA C    4  CM   2   ? 1_555 .
 57   .    STA C    4  OH   2   ? 1_555 STA C    4  CH   2   ? 1_555 .
 58   .    STA C    4  CM   2   ? 1_555 STA C    4  CH   2   ? 1_555 .
 59   .    STA C    4  CM   2   ? 1_555 STA C    4  C    2   ? 1_555 .
 60   .    STA C    4  C    2   ? 1_555 STA C    4  CM   2   ? 1_555 .
 61   .    STA C    4  C    2   ? 1_555 STA C    4  O    2   ? 1_555 .
 62   .    STA C    4  O    2   ? 1_555 STA C    4  C    2   ? 1_555 .
 63   .    STA C    6  N    2   ? 1_555 STA C    6  CA   2   ? 1_555 .
 64   .    STA C    6  CA   2   ? 1_555 STA C    6  N    2   ? 1_555 .
 65   .    STA C    6  CA   2   ? 1_555 STA C    6  CB   2   ? 1_555 .
 66   .    STA C    6  CA   2   ? 1_555 STA C    6  CH   2   ? 1_555 .
 67   .    STA C    6  CB   2   ? 1_555 STA C    6  CA   2   ? 1_555 .
 68   .    STA C    6  CB   2   ? 1_555 STA C    6  CG   2   ? 1_555 .
 69   .    STA C    6  CG   2   ? 1_555 STA C    6  CB   2   ? 1_555 .
 70   .    STA C    6  CG   2   ? 1_555 STA C    6  CD1  2   ? 1_555 .
 71   .    STA C    6  CG   2   ? 1_555 STA C    6  CD2  2   ? 1_555 .
 72   .    STA C    6  CD1  2   ? 1_555 STA C    6  CG   2   ? 1_555 .
 73   .    STA C    6  CD2  2   ? 1_555 STA C    6  CG   2   ? 1_555 .
 74   .    STA C    6  CH   2   ? 1_555 STA C    6  CA   2   ? 1_555 .
 75   .    STA C    6  CH   2   ? 1_555 STA C    6  OH   2   ? 1_555 .
 76   .    STA C    6  CH   2   ? 1_555 STA C    6  CM   2   ? 1_555 .
 77   .    STA C    6  OH   2   ? 1_555 STA C    6  CH   2   ? 1_555 .
 78   .    STA C    6  CM   2   ? 1_555 STA C    6  CH   2   ? 1_555 .
 79   .    STA C    6  CM   2   ? 1_555 STA C    6  C    2   ? 1_555 .
 80   .    STA C    6  C    2   ? 1_555 STA C    6  CM   2   ? 1_555 .
 81   .    STA C    6  C    2   ? 1_555 STA C    6  O    2   ? 1_555 .
 82   .    STA C    6  C    2   ? 1_555 STA C    6  OXT  2   ? 1_555 .
 83   .    STA C    6  O    2   ? 1_555 STA C    6  C    2   ? 1_555 .
 84   .    STA C    6  OXT  2   ? 1_555 STA C    6  C    2   ? 1_555 .



####################
#                  #
# AUDIT            #
#                  #
####################


_audit.revision_id         5HVP 
_audit.creation_date       1990-04-30
_audit.update_record
; 1995-11-02 Converted to mmCIF format by pdb2cif
;
##########################
#                        #
# ENTITY_POLY_SEQ        #
#                        #
##########################

loop_ 
_entity_poly_seq.entity_id
_entity_poly_seq.num
_entity_poly_seq.mon_id
     1    1 PRO     1    2 GLN     1    3 ILE     1    4 THR     1    5 LEU
     1    6 TRP     1    7 GLN     1    8 ARG     1    9 PRO     1   10 LEU
     1   11 VAL     1   12 THR     1   13 ILE     1   14 LYS     1   15 ILE
     1   16 GLY     1   17 GLY     1   18 GLN     1   19 LEU     1   20 LYS
     1   21 GLU     1   22 ALA     1   23 LEU     1   24 LEU     1   25 ASP
     1   26 THR     1   27 GLY     1   28 ALA     1   29 ASP     1   30 ASP
     1   31 THR     1   32 VAL     1   33 LEU     1   34 GLU     1   35 GLU
     1   36 MET     1   37 ASN     1   38 LEU     1   39 PRO     1   40 GLY
     1   41 ARG     1   42 TRP     1   43 LYS     1   44 PRO     1   45 LYS
     1   46 MET     1   47 ILE     1   48 GLY     1   49 GLY     1   50 ILE
     1   51 GLY     1   52 GLY     1   53 PHE     1   54 ILE     1   55 LYS
     1   56 VAL     1   57 ARG     1   58 GLN     1   59 TYR     1   60 ASP
     1   61 GLN     1   62 ILE     1   63 LEU     1   64 ILE     1   65 GLU
     1   66 ILE     1   67 CYS     1   68 GLY     1   69 HIS     1   70 LYS
     1   71 ALA     1   72 ILE     1   73 GLY     1   74 THR     1   75 VAL
     1   76 LEU     1   77 VAL     1   78 GLY     1   79 PRO     1   80 THR
     1   81 PRO     1   82 VAL     1   83 ASN     1   84 ILE     1   85 ILE
     1   86 GLY     1   87 ARG     1   88 ASN     1   89 LEU     1   90 LEU
     1   91 THR     1   92 GLN     1   93 ILE     1   94 GLY     1   95 CYS
     1   96 THR     1   97 LEU     1   98 ASN     1   99 PHE
     3  100 ACE     3  101 VAL     3  102 VAL     3  103 STA     3  104 ALA
     3  105 STA

loop_
_entity.id
_entity.type
_entity.details
     1  polymer
; Protein chain: A, B
;
     3  polymer
; Protein chain: C
;
     4  non-polymer 'het group  CL'
     5  water       'HOH' 

loop_
_struct_asym.entity_id
_struct_asym.id
     1 A
     3 C
     4  CL
     5 HOH

loop_ 
_entity_poly.entity_id
_entity_poly.type
_entity_poly.nstd_chirality
_entity_poly.nstd_linkage
_entity_poly.nstd_monomer
_entity_poly.type_details
  1  ?   ?   ?   ?   ?
  1  ?   ?   ?   ?   ?
  3  ?   ?   ?   ?   ?



####################
#                  #
# CHEM_COMP        #
#                  #
####################


loop_
_chem_comp.id
_chem_comp.mon_nstd_flag
_chem_comp.formula
 STA yes
; 2(C8 H17 N1 O3)                                    
; 
  CL no 
; 2(CL1 -)                                           
; 
 HOH no 
; 170(H2 O1)                                         
; 



######################
#                    #
# ATOM_SITES         #
#                    #
######################






loop_ 
_database_pdb_matrix.origx[1][1]
_database_pdb_matrix.origx[1][2]
_database_pdb_matrix.origx[1][3]
_database_pdb_matrix.origx_vector[1] 
_database_pdb_matrix.origx[2][1]
_database_pdb_matrix.origx[2][2]
_database_pdb_matrix.origx[2][3]
_database_pdb_matrix.origx_vector[2] 
_database_pdb_matrix.origx[3][1]
_database_pdb_matrix.origx[3][2]
_database_pdb_matrix.origx[3][3]
_database_pdb_matrix.origx_vector[3] 
  0.017126   0.000000   0.000000    0.00000
  0.000000   0.011534   0.000000    0.00000
  0.000000   0.000000   0.021612    0.00000

_atom_sites.cartn_transform_axes
  'See _atom_sites.frac_transf_matrix[i][j]'
loop_
_atom_sites.frac_transf_matrix[1][1]
_atom_sites.frac_transf_matrix[1][2]
_atom_sites.frac_transf_matrix[1][3]
_atom_sites.frac_transf_vector[1]
_atom_sites.frac_transf_matrix[2][1]
_atom_sites.frac_transf_matrix[2][2]
_atom_sites.frac_transf_matrix[2][3]
_atom_sites.frac_transf_vector[2]
_atom_sites.frac_transf_matrix[3][1]
_atom_sites.frac_transf_matrix[3][2]
_atom_sites.frac_transf_matrix[3][3]
_atom_sites.frac_transf_vector[3]
  0.017126   0.000000   0.000000    0.00000
  0.000000   0.011534   0.000000    0.00000
  0.000000   0.000000   0.021612    0.00000



####################
#                  #
# ATOM_SITES_ALT   #
#                  #
####################



loop_
_atom_sites_alt.id
_atom_sites_alt.details
   2    ? 
   1    ? 



######################
#                    #
# ATOM_SITES_FOOTNOTE#
#                    #
######################



loop_
_atom_sites_footnote.id  
_atom_sites_footnote.text 
  1
;                                                            
  SIDE CHAINS OF THESE RESIDUES HAVE BEEN MODELED IN TWO     
  ALTERNATE CONFORMATIONS AND ASSIGNED ALTERNATE LOCATION    
  INDICATORS *1* AND *2*.                                    
; 
  2
;                                                            
  THE OCCUPANCIES OF SOLVENT MOLECULES WHICH CORRELATED WITH 
  STATIC DISORDER IN THE PROTEIN HAVE BEEN SET TO LESS THAN  
  UNITY.  WATER MOLECULES WITH ALTERNATE LOCATION INDICATOR  
   *1* AND OCCUPANCY 0.58 CORRELATE WITH INHIBITOR ORIENTATIO
  *1*.  WATER MOLECULES WITH ALTERNATE LOCATION INDICATOR *2*
  AND OCCUPANCY 0.42 CORRELATE WITH INHIBITOR ORIENTATION *2*
  IF THE SOLVENT MOLECULE IS DISTANT FROM THE BOUND INHIBITOR
  AN OCCUPANCY OF 0.50 HAS BEEN ASSIGNED.                    
;



####################
#                  #
# ATOM_SITE        #
#                  #
####################



loop_
_atom_site.entity_seq_num
_atom_site.group_PDB
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_comp_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.id
# *** WARNING *** only    50% homology to chain   C
1
  ATOM  N  N    PRO A    1  .  29.061  39.981   4.981  1.00 28.69  .    1      1
1
  ATOM  C  CA   PRO A    1  .  29.970  38.922   4.561  1.00 29.08  .    1      2
1
  ATOM  C  C    PRO A    1  .  29.325  38.106   3.429  1.00 29.19  .    1      3
1
  ATOM  O  O    PRO A    1  .  28.097  38.168   3.298  1.00 29.87  .    1      4
1
  ATOM  C  CB   PRO A    1  .  30.106  38.013   5.789  1.00 29.07  .    1      5
1
  ATOM  C  CG   PRO A    1  .  28.749  38.112   6.413  1.00 28.59  .    1      6
1
  ATOM  C  CD   PRO A    1  .  28.387  39.600   6.246  1.00 29.21  .    1      7
2
  ATOM  N  N    GLN A    2  .  30.153  37.412   2.681  1.00 28.13  .    1      8
2
  ATOM  C  CA   GLN A    2  .  29.636  36.572   1.593  1.00 27.95  .    1      9
2
  ATOM  C  C    GLN A    2  .  29.861  35.139   2.082  1.00 27.28  .    1     10
2
  ATOM  O  O    GLN A    2  .  31.038  34.773   2.266  1.00 27.61  .    1     11
2
  ATOM  C  CB   GLN A    2  .  30.373  36.787   0.305  1.00 28.43  .    1     12
2
  ATOM  C  CG   GLN A    2  .  30.346  35.501  -0.539  1.00 29.40  .    1     13
2
  ATOM  C  CD   GLN A    2  .  30.921  35.844  -1.899  1.00 29.51  .    1     14
2
  ATOM  O  OE1  GLN A    2  .  31.894  35.283  -2.340  1.00 30.56  .    1     15
2
  ATOM  N  NE2  GLN A    2  .  30.288  36.839  -2.518  1.00 30.01  .    1     16
3
  ATOM  N  N    ILE A    3  .  28.781  34.445   2.318  1.00 25.31  .    1     17
3
  ATOM  C  CA   ILE A    3  .  28.879  33.060   2.829  1.00 23.38  .    1     18
3
  ATOM  C  C    ILE A    3  .  28.737  32.124   1.637  1.00 22.61  .    1     19
3
  ATOM  O  O    ILE A    3  .  27.836  32.313   0.835  1.00 21.98  .    1     20
3
  ATOM  C  CB   ILE A    3  .  27.725  32.943   3.878  1.00 23.09  .    1     21
3
  ATOM  C  CG1  ILE A    3  .  27.924  34.066   4.950  1.00 23.06  .    1     22
3
  ATOM  C  CG2  ILE A    3  .  27.537  31.564   4.529  1.00 22.44  .    1     23
3
  ATOM  C  CD1  ILE A    3  .  26.701  34.133   5.945  1.00 23.02  .    1     24
4
  ATOM  N  N    THR A    4  .  29.617  31.137   1.532  1.00 21.67  .    1     25
4
  ATOM  C  CA   THR A    4  .  29.513  30.113   0.468  1.00 19.49  .    1     26
4
  ATOM  C  C    THR A    4  .  28.695  28.979   1.096  1.00 18.82  .    1     27
4
  ATOM  O  O    THR A    4  .  28.553  28.960   2.335  1.00 18.30  .    1     28
4
  ATOM  C  CB   THR A    4  .  30.920  29.641  -0.032  1.00 19.93  .    1     29
4
  ATOM  O  OG1  THR A    4  .  31.632  29.194   1.195  1.00 20.26  .    1     30
4
  ATOM  C  CG2  THR A    4  .  31.629  30.778  -0.752  1.00 19.66  .    1     31
5
  ATOM  N  N    LEU A    5  .  28.199  28.090   0.273  1.00 18.18  .    1     32
5
  ATOM  C  CA   LEU A    5  .  27.327  27.003   0.728  1.00 17.71  .    1     33
5
  ATOM  C  C    LEU A    5  .  27.942  25.635   0.667  1.00 16.85  .    1     34
5
  ATOM  O  O    LEU A    5  .  27.204  24.650   0.484  1.00 17.09  .    1     35
5
  ATOM  C  CB   LEU A    5  .  26.007  27.179  -0.085  1.00 16.76  .    1     36
5
  ATOM  C  CG   LEU A    5  .  25.319  28.529   0.128  1.00 17.80  .    1     37
5
  ATOM  C  CD1  LEU A    5  .  24.267  28.790  -0.914  1.00 17.33  .    1     38
5
  ATOM  C  CD2  LEU A    5  .  24.760  28.634   1.525  1.00 16.65  .    1     39
6
  ATOM  N  N    TRP A    6  .  29.241  25.547   0.821  1.00 16.49  .    1     40
6
  ATOM  C  CA   TRP A    6  .  29.974  24.273   0.856  1.00 15.93  .    1     41
6
  ATOM  C  C    TRP A    6  .  29.579  23.650   2.189  1.00 15.88  .    1     42
6
  ATOM  O  O    TRP A    6  .  29.417  22.421   2.259  1.00 14.82  .    1     43
6
  ATOM  C  CB   TRP A    6  .  31.463  24.442   0.690  1.00 16.51  .    1     44
6
  ATOM  C  CG   TRP A    6  .  32.037  24.918  -0.581  1.00 16.94  .    1     45
6
  ATOM  C  CD1  TRP A    6  .  32.659  26.119  -0.816  1.00 17.13  .    1     46
6
  ATOM  C  CD2  TRP A    6  .  32.103  24.177  -1.829  1.00 17.44  .    1     47
6
  ATOM  N  NE1  TRP A    6  .  33.088  26.201  -2.118  1.00 17.87  .    1     48
6
  ATOM  C  CE2  TRP A    6  .  32.790  24.985  -2.747  1.00 18.34  .    1     49
6
  ATOM  C  CE3  TRP A    6  .  31.676  22.929  -2.214  1.00 18.98  .    1     50
6
  ATOM  C  CZ2  TRP A    6  .  33.038  24.593  -4.057  1.00 18.87  .    1     51
6
  ATOM  C  CZ3  TRP A    6  .  31.970  22.474  -3.504  1.00 19.09  .    1     52
6
  ATOM  C  CH2  TRP A    6  .  32.620  23.310  -4.417  1.00 18.63  .    1     53
7
  ATOM  N  N    GLN A    7  .  29.323  24.540   3.154  1.00 15.33  .    1     54
7
  ATOM  C  CA   GLN A    7  .  28.869  23.997   4.484  1.00 15.88  .    1     55
7
  ATOM  C  C    GLN A    7  .  27.502  24.592   4.839  1.00 15.32  .    1     56
7
  ATOM  O  O    GLN A    7  .  27.088  25.559   4.199  1.00 14.31  .    1     57
7
  ATOM  C  CB   GLN A    7  .  29.819  24.531   5.588  1.00 16.42  .    1     58
7
  ATOM  C  CG   GLN A    7  .  31.188  23.883   5.546  1.00 18.12  .    1     59
7
  ATOM  C  CD   GLN A    7  .  32.241  24.312   4.612  1.00 18.67  .    1     60
7
  ATOM  O  OE1  GLN A    7  .  32.716  25.442   4.407  1.00 18.62  .    1     61
7
  ATOM  N  NE2  GLN A    7  .  32.840  23.261   3.934  1.00 19.38  .    1     62
8
  ATOM  N  N    ARG A    8  .  26.952  24.059   5.919  1.00 15.78  .    1     63
8
  ATOM  C  CA   ARG A    8  .  25.689  24.716   6.375  1.00 16.84  .    1     64
8
  ATOM  C  C    ARG A    8  .  26.014  26.142   6.777  1.00 16.79  .    1     65
8
  ATOM  O  O    ARG A    8  .  26.952  26.417   7.594  1.00 16.86  .    1     66
8
  ATOM  C  CB   ARG A    8  .  25.168  23.982   7.615  1.00 16.91  .    1     67
8
  ATOM  C  CG   ARG A    8  .  24.736  22.578   7.194  1.00 17.67  .    1     68
8
  ATOM  C  CD   ARG A    8  .  23.806  22.038   8.308  1.00 18.68  .    1     69
8
  ATOM  N  NE   ARG A    8  .  23.212  20.826   7.685  1.00 18.52  .    1     70
8
  ATOM  C  CZ   ARG A    8  .  23.209  19.775   8.562  1.00 20.11  .    1     71
8
  ATOM  N  NH1  ARG A    8  .  22.865  18.553   8.231  1.00 19.48  .    1     72
8
  ATOM  N  NH2  ARG A    8  .  23.560  20.080   9.807  1.00 19.94  .    1     73
9
  ATOM  N  N    PRO A    9  .  25.215  27.070   6.255  1.00 16.01  .    1     74
9
  ATOM  C  CA   PRO A    9  .  25.415  28.480   6.613  1.00 15.07  .    1     75
9
  ATOM  C  C    PRO A    9  .  24.957  28.708   8.047  1.00 14.72  .    1     76
9
  ATOM  O  O    PRO A    9  .  23.901  29.299   8.192  1.00 12.46  .    1     77
9
  ATOM  C  CB   PRO A    9  .  24.469  29.227   5.655  1.00 14.50  .    1     78
9
  ATOM  C  CG   PRO A    9  .  23.490  28.243   5.179  1.00 14.45  .    1     79
9
  ATOM  C  CD   PRO A    9  .  24.117  26.857   5.291  1.00 15.06  .    1     80
10
  ATOM  N  N    LEU A   10  .  25.755  28.437   9.067  1.00 16.67  .    1     81
10
  ATOM  C  CA   LEU A   10  .  25.452  28.653  10.471  1.00 17.14  .    1     82
10
  ATOM  C  C    LEU A   10  .  26.111  29.924  11.002  1.00 18.34  .    1     83
10
  ATOM  O  O    LEU A   10  .  27.298  30.181  10.680  1.00 18.34  .    1     84
10
  ATOM  C  CB   LEU A   10  .  25.929  27.501  11.355  1.00 17.99  .    1     85
10
  ATOM  C  CG   LEU A   10  .  25.257  26.163  11.238  1.00 18.72  .    1     86
10
  ATOM  C  CD1  LEU A   10  .  26.026  25.108  12.055  1.00 18.37  .    1     87
10
  ATOM  C  CD2  LEU A   10  .  23.804  26.194  11.734  1.00 19.00  .    1     88
11
  ATOM  N  N    VAL A   11  .  25.369  30.691  11.795  1.00 17.93  .    1     89
11
  ATOM  C  CA   VAL A   11  .  25.970  31.965  12.332  1.00 17.75  .    1     90
11
  ATOM  C  C    VAL A   11  .  25.569  32.010  13.808  1.00 17.83  .    1     91
11
  ATOM  O  O    VAL A   11  .  24.735  31.190  14.167  1.00 17.53  .    1     92
11
  ATOM  C  CB   VAL A   11  .  25.379  33.146  11.540  1.00 17.66  .    1     93
11
  ATOM  C  CG1  VAL A   11  .  25.584  33.034  10.030  1.00 18.86  .    1     94
11
  ATOM  C  CG2  VAL A   11  .  23.933  33.309  11.872  1.00 17.12  .    1     95
12
  ATOM  N  N    THR A   12  .  26.095  32.930  14.590  1.00 18.97   1   1     96
12
  ATOM  C  CA   THR A   12  .  25.734  32.995  16.032  1.00 19.80   1   1     97
12
  ATOM  C  C    THR A   12  .  24.695  34.106  16.113  1.00 20.92   1   1     98
12
  ATOM  O  O    THR A   12  .  24.869  35.118  15.421  1.00 21.84   1   1     99
12
  ATOM  C  CB   THR A   12  .  26.911  33.346  17.018  1.00 20.51   1   1    100
12
  ATOM  O  OG1  THR A   12  1  27.946  33.921  16.183  0.50 20.29   1   1    101
12
  ATOM  O  OG1  THR A   12  2  27.769  32.142  17.103  0.50 20.59   1   1    102
12
  ATOM  C  CG2  THR A   12  1  27.418  32.181  17.878  0.50 20.47   1   1    103
12
  ATOM  C  CG2  THR A   12  2  26.489  33.778  18.426  0.50 20.00   1   1    104
13
  ATOM  N  N    ILE A   13  .  23.664  33.855  16.884  1.00 22.08  .    1    105
13
  ATOM  C  CA   ILE A   13  .  22.623  34.850  17.093  1.00 23.44  .    1    106
13
  ATOM  C  C    ILE A   13  .  22.657  35.113  18.610  1.00 25.77  .    1    107
13
  ATOM  O  O    ILE A   13  .  23.123  34.250  19.406  1.00 26.28  .    1    108
13
  ATOM  C  CB   ILE A   13  .  21.236  34.463  16.492  1.00 22.67  .    1    109
13
  ATOM  C  CG1  ILE A   13  .  20.478  33.469  17.371  1.00 22.14  .    1    110
13
  ATOM  C  CG2  ILE A   13  .  21.357  33.986  15.016  1.00 21.75  .    1    111
13
  ATOM  C  CD1  ILE A   13  .  19.090  32.994  16.868  1.00 20.60  .    1    112
14
  ATOM  N  N    LYS A   14  .  22.263  36.312  18.908  1.00 27.34  .    1    113
14
  ATOM  C  CA   LYS A   14  .  22.119  36.770  20.294  1.00 29.57  .    1    114
14
  ATOM  C  C    LYS A   14  .  20.614  37.079  20.408  1.00 29.89  .    1    115
14
  ATOM  O  O    LYS A   14  .  20.045  37.964  19.757  1.00 29.85  .    1    116
14
  ATOM  C  CB   LYS A   14  .  23.022  37.882  20.722  1.00 30.15  .    1    117
14
  ATOM  C  CG   LYS A   14  .  22.826  38.293  22.201  1.00 32.07  .    1    118
14
  ATOM  C  CD   LYS A   14  .  23.886  39.292  22.658  1.00 33.14  .    1    119
14
  ATOM  C  CE   LYS A   14  .  25.171  38.599  23.093  1.00 34.34  .    1    120
14
  ATOM  N  NZ   LYS A   14  .  26.025  39.416  24.014  1.00 34.83  .    1    121
15
  ATOM  N  N    ILE A   15  .  19.994  36.244  21.220  1.00 31.26  .    1    122
15
  ATOM  C  CA   ILE A   15  .  18.567  36.359  21.484  1.00 33.34  .    1    123
15
  ATOM  C  C    ILE A   15  .  18.273  36.274  22.978  1.00 34.25  .    1    124
15
  ATOM  O  O    ILE A   15  .  18.456  35.246  23.637  1.00 35.18  .    1    125
15
  ATOM  C  CB   ILE A   15  .  17.727  35.261  20.720  1.00 32.75  .    1    126
15
  ATOM  C  CG1  ILE A   15  .  16.282  35.694  20.956  1.00 33.18  .    1    127
15
  ATOM  C  CG2  ILE A   15  .  18.093  33.858  21.235  1.00 32.63  .    1    128
15
  ATOM  C  CD1  ILE A   15  .  15.127  34.713  20.918  1.00 32.99  .    1    129
16
  ATOM  N  N    GLY A   16  .  17.865  37.409  23.485  1.00 36.22  .    1    130
16
  ATOM  C  CA   GLY A   16  .  17.474  37.557  24.900  1.00 38.05  .    1    131
16
  ATOM  C  C    GLY A   16  .  18.617  37.147  25.821  1.00 39.33  .    1    132
16
  ATOM  O  O    GLY A   16  .  18.475  36.345  26.757  1.00 39.33  .    1    133
17
  ATOM  N  N    GLY A   17  .  19.735  37.806  25.492  1.00 39.78  .    1    134
17
  ATOM  C  CA   GLY A   17  .  20.968  37.625  26.215  1.00 40.80  .    1    135
17
  ATOM  C  C    GLY A   17  .  21.644  36.293  25.969  1.00 41.15  .    1    136
17
  ATOM  O  O    GLY A   17  .  22.779  36.164  26.498  1.00 42.19  .    1    137
18
  ATOM  N  N    GLN A   18  .  21.006  35.403  25.245  1.00 40.52  .    1    138
18
  ATOM  C  CA   GLN A   18  .  21.591  34.080  24.961  1.00 39.85  .    1    139
18
  ATOM  C  C    GLN A   18  .  22.227  34.107  23.582  1.00 38.55  .    1    140
18
  ATOM  O  O    GLN A   18  .  21.678  34.727  22.667  1.00 38.54  .    1    141
18
  ATOM  C  CB   GLN A   18  .  20.541  32.974  25.103  1.00 40.69  .    1    142
18
  ATOM  C  CG   GLN A   18  .  19.621  33.425  26.233  1.00 41.88  .    1    143
18
  ATOM  C  CD   GLN A   18  .  18.898  32.292  26.866  1.00 42.93  .    1    144
18
  ATOM  O  OE1  GLN A   18  .  18.419  31.368  26.197  1.00 43.74  .    1    145
18
  ATOM  N  NE2  GLN A   18  .  18.841  32.391  28.202  1.00 43.72  .    1    146
19
  ATOM  N  N    LEU A   19  .  23.369  33.458  23.517  1.00 37.16  .    1    147
19
  ATOM  C  CA   LEU A   19  .  24.147  33.356  22.254  1.00 35.95  .    1    148
19
  ATOM  C  C    LEU A   19  .  23.807  31.971  21.692  1.00 34.32  .    1    149
19
  ATOM  O  O    LEU A   19  .  23.963  31.001  22.449  1.00 34.28  .    1    150
19
  ATOM  C  CB   LEU A   19  .  25.593  33.606  22.578  1.00 36.59  .    1    151
19
  ATOM  C  CG   LEU A   19  .  26.111  35.019  22.438  1.00 37.46  .    1    152
19
  ATOM  C  CD1  LEU A   19  .  27.483  35.101  23.085  1.00 38.09  .    1    153
19
  ATOM  C  CD2  LEU A   19  .  26.223  35.360  20.955  1.00 37.90  .    1    154
20
  ATOM  N  N    LYS A   20  .  23.320  31.938  20.468  1.00 32.38  .    1    155
20
  ATOM  C  CA   LYS A   20  .  22.914  30.691  19.833  1.00 30.25  .    1    156
20
  ATOM  C  C    LYS A   20  .  23.437  30.612  18.402  1.00 28.62  .    1    157
20
  ATOM  O  O    LYS A   20  .  23.980  31.571  17.851  1.00 27.14  .    1    158
20
  ATOM  C  CB   LYS A   20  .  21.423  30.434  19.760  1.00 30.87  .    1    159
20
  ATOM  C  CG   LYS A   20  .  20.597  30.883  20.943  1.00 31.54  .    1    160
20
  ATOM  C  CD   LYS A   20  .  19.297  30.083  21.062  1.00 32.10  .    1    161
20
  ATOM  C  CE   LYS A   20  .  19.030  29.881  22.546  1.00 32.80  .    1    162
20
  ATOM  N  NZ   LYS A   20  .  18.197  28.661  22.768  1.00 33.84  .    1    163
21
  ATOM  N  N    GLU A   21  .  23.263  29.401  17.907  1.00 27.06  .    1    164
21
  ATOM  C  CA   GLU A   21  .  23.701  29.067  16.562  1.00 26.86  .    1    165
21
  ATOM  C  C    GLU A   21  .  22.431  28.860  15.721  1.00 23.95  .    1    166
21
  ATOM  O  O    GLU A   21  .  21.587  28.110  16.225  1.00 23.73  .    1    167
21
  ATOM  C  CB   GLU A   21  .  24.432  27.734  16.448  1.00 29.21  .    1    168
21
  ATOM  C  CG   GLU A   21  .  25.880  27.657  16.910  1.00 31.59  .    1    169
21
  ATOM  C  CD   GLU A   21  .  26.773  28.630  16.189  1.00 33.27  .    1    170
21
  ATOM  O  OE1  GLU A   21  .  27.008  28.534  14.989  1.00 34.73  .    1    171
21
  ATOM  O  OE2  GLU A   21  .  27.205  29.530  16.946  1.00 34.83  .    1    172
22
  ATOM  N  N    ALA A   22  .  22.436  29.441  14.550  1.00 21.08  .    1    173
22
  ATOM  C  CA   ALA A   22  .  21.222  29.190  13.723  1.00 18.26  .    1    174
22
  ATOM  C  C    ALA A   22  .  21.629  29.165  12.273  1.00 17.34  .    1    175
22
  ATOM  O  O    ALA A   22  .  22.654  29.714  11.891  1.00 17.30  .    1    176
22
  ATOM  C  CB   ALA A   22  .  20.182  30.253  14.091  1.00 17.51  .    1    177
23
  ATOM  N  N    LEU A   23  .  20.814  28.489  11.486  1.00 15.59  .    1    178
23
  ATOM  C  CA   LEU A   23  .  20.835  28.282  10.073  1.00 13.92  .    1    179
23
  ATOM  C  C    LEU A   23  .  20.188  29.436   9.309  1.00 12.68  .    1    180
23
  ATOM  O  O    LEU A   23  .  19.027  29.829   9.601  1.00 14.33  .    1    181
23
  ATOM  C  CB   LEU A   23  .  20.045  26.950   9.810  1.00 13.68  .    1    182
23
  ATOM  C  CG   LEU A   23  .  20.177  26.437   8.398  1.00 13.67  .    1    183
23
  ATOM  C  CD1  LEU A   23  .  21.646  26.039   8.241  1.00 14.76  .    1    184
23
  ATOM  C  CD2  LEU A   23  .  19.306  25.184   8.210  1.00 14.27  .    1    185
24
  ATOM  N  N    LEU A   24  .  20.856  29.999   8.354  1.00 11.23  .    1    186
24
  ATOM  C  CA   LEU A   24  .  20.284  31.051   7.500  1.00 11.69  .    1    187
24
  ATOM  C  C    LEU A   24  .  19.538  30.205   6.421  1.00 11.35  .    1    188
24
  ATOM  O  O    LEU A   24  .  20.177  29.718   5.514  1.00 12.63  .    1    189
24
  ATOM  C  CB   LEU A   24  .  21.326  31.972   6.913  1.00 10.72  .    1    190
24
  ATOM  C  CG   LEU A   24  .  22.279  32.685   7.929  1.00 10.37  .    1    191
24
  ATOM  C  CD1  LEU A   24  .  23.181  33.621   7.173  1.00  9.31  .    1    192
24
  ATOM  C  CD2  LEU A   24  .  21.388  33.423   8.915  1.00  8.95  .    1    193
25
  ATOM  N  N    ASP A   25  .  18.253  30.133   6.560  1.00 10.98  .    1    194
25
  ATOM  C  CA   ASP A   25  .  17.440  29.314   5.604  1.00  8.53  .    1    195
25
  ATOM  C  C    ASP A   25  .  16.612  30.166   4.688  1.00  8.11  .    1    196
25
  ATOM  O  O    ASP A   25  .  15.562  30.716   5.086  1.00  6.81  .    1    197
25
  ATOM  C  CB   ASP A   25  .  16.643  28.411   6.584  1.00  9.11  .    1    198
25
  ATOM  C  CG   ASP A   25  .  15.943  27.310   5.810  1.00 10.79  .    1    199
25
  ATOM  O  OD1  ASP A   25  .  15.233  26.517   6.479  1.00 12.24  .    1    200
25
  ATOM  O  OD2  ASP A   25  .  16.085  27.333   4.573  1.00 10.55  .    1    201
26
  ATOM  N  N    THR A   26  .  16.912  30.237   3.397  1.00  7.23  .    1    202
26
  ATOM  C  CA   THR A   26  .  16.178  30.995   2.416  1.00  6.11  .    1    203
26
  ATOM  C  C    THR A   26  .  14.927  30.185   2.029  1.00  8.33  .    1    204
26
  ATOM  O  O    THR A   26  .  14.038  30.802   1.328  1.00  8.76  .    1    205
26
  ATOM  C  CB   THR A   26  .  17.046  31.296   1.101  1.00  6.11  .    1    206
26
  ATOM  O  OG1  THR A   26  .  17.429  29.986   0.669  1.00  4.91  .    1    207
26
  ATOM  C  CG2  THR A   26  .  18.221  32.235   1.393  1.00  4.90  .    1    208
27
  ATOM  N  N    GLY A   27  .  14.856  28.988   2.587  1.00  7.27  .    1    209
27
  ATOM  C  CA   GLY A   27  .  13.688  28.119   2.289  1.00  9.57  .    1    210
27
  ATOM  C  C    GLY A   27  .  12.707  28.130   3.433  1.00  9.23  .    1    211
27
  ATOM  O  O    GLY A   27  .  11.787  27.260   3.394  1.00 11.82  .    1    212
28
  ATOM  N  N    ALA A   28  .  12.814  28.972   4.373  1.00  9.48  .    1    213
28
  ATOM  C  CA   ALA A   28  .  11.968  29.134   5.550  1.00 10.91  .    1    214
28
  ATOM  C  C    ALA A   28  .  11.246  30.496   5.468  1.00 12.49  .    1    215
28
  ATOM  O  O    ALA A   28  .  11.938  31.535   5.464  1.00 12.63  .    1    216
28
  ATOM  C  CB   ALA A   28  .  12.794  29.256   6.799  1.00 11.29  .    1    217
29
  ATOM  N  N    ASP A   29  .   9.932  30.426   5.493  1.00 12.83  .    1    218
29
  ATOM  C  CA   ASP A   29  .   9.261  31.774   5.451  1.00 13.20  .    1    219
29
  ATOM  C  C    ASP A   29  .   9.520  32.544   6.764  1.00 14.95  .    1    220
29
  ATOM  O  O    ASP A   29  .   9.432  33.786   6.722  1.00 13.87  .    1    221
29
  ATOM  C  CB   ASP A   29  .   7.775  31.547   5.327  1.00 12.85  .    1    222
29
  ATOM  C  CG   ASP A   29  .   7.323  30.882   4.088  1.00 14.05  .    1    223
29
  ATOM  O  OD1  ASP A   29  .   6.255  30.293   4.267  1.00 15.02  .    1    224
29
  ATOM  O  OD2  ASP A   29  .   8.012  30.955   3.055  1.00 13.17  .    1    225
30
  ATOM  N  N    ASP A   30  .   9.596  31.762   7.842  1.00 15.74  .    1    226
30
  ATOM  C  CA   ASP A   30  .   9.701  32.290   9.183  1.00 18.14  .    1    227
30
  ATOM  C  C    ASP A   30  .  10.835  31.672  10.001  1.00 17.30  .    1    228
30
  ATOM  O  O    ASP A   30  .  11.372  30.648   9.676  1.00 18.09  .    1    229
30
  ATOM  C  CB   ASP A   30  .   8.385  32.065  10.007  1.00 19.67  .    1    230
30
  ATOM  C  CG   ASP A   30  .   7.172  32.604   9.296  1.00 21.52  .    1    231
30
  ATOM  O  OD1  ASP A   30  .   7.146  33.849   8.957  1.00 22.81  .    1    232
30
  ATOM  O  OD2  ASP A   30  .   6.318  31.717   9.094  1.00 22.06  .    1    233
31
  ATOM  N  N    THR A   31  .  11.199  32.465  11.005  1.00 16.67  .    1    234
31
  ATOM  C  CA   THR A   31  .  12.298  32.063  11.920  1.00 15.56  .    1    235
31
  ATOM  C  C    THR A   31  .  11.648  31.144  12.944  1.00 16.06  .    1    236
31
  ATOM  O  O    THR A   31  .  10.620  31.480  13.565  1.00 15.68  .    1    237
31
  ATOM  C  CB   THR A   31  .  12.896  33.375  12.523  1.00 14.85  .    1    238
31
  ATOM  O  OG1  THR A   31  .  13.396  34.062  11.340  1.00 14.67  .    1    239
31
  ATOM  C  CG2  THR A   31  .  13.939  33.206  13.632  1.00 14.90  .    1    240
32
  ATOM  N  N    VAL A   32  .  12.304  29.993  13.133  1.00 16.03  .    1    241
32
  ATOM  C  CA   VAL A   32  .  11.805  29.029  14.119  1.00 15.27  .    1    242
32
  ATOM  C  C    VAL A   32  .  12.974  28.679  15.044  1.00 16.12  .    1    243
32
  ATOM  O  O    VAL A   32  .  13.993  28.207  14.489  1.00 16.22  .    1    244
32
  ATOM  C  CB   VAL A   32  .  11.280  27.739  13.447  1.00 15.73  .    1    245
32
  ATOM  C  CG1  VAL A   32  .  10.675  26.846  14.525  1.00 15.44  .    1    246
32
  ATOM  C  CG2  VAL A   32  .  10.441  27.985  12.261  1.00 15.05  .    1    247
33
  ATOM  N  N    LEU A   33  .  12.768  28.928  16.306  1.00 16.25  .    1    248
33
  ATOM  C  CA   LEU A   33  .  13.809  28.635  17.312  1.00 17.39  .    1    249
33
  ATOM  C  C    LEU A   33  .  13.497  27.405  18.124  1.00 17.74  .    1    250
33
  ATOM  O  O    LEU A   33  .  12.347  26.949  18.210  1.00 16.67  .    1    251
33
  ATOM  C  CB   LEU A   33  .  13.899  29.926  18.153  1.00 18.28  .    1    252
33
  ATOM  C  CG   LEU A   33  .  14.688  31.053  17.477  1.00 18.16  .    1    253
33
  ATOM  C  CD1  LEU A   33  .  15.313  31.854  18.624  1.00 18.33  .    1    254
33
  ATOM  C  CD2  LEU A   33  .  15.837  30.509  16.651  1.00 17.37  .    1    255
34
  ATOM  N  N    GLU A   34  .  14.546  26.796  18.676  1.00 18.95  .    1    256
34
  ATOM  C  CA   GLU A   34  .  14.268  25.576  19.490  1.00 20.17  .    1    257
34
  ATOM  C  C    GLU A   34  .  13.627  26.085  20.782  1.00 20.65  .    1    258
34
  ATOM  O  O    GLU A   34  .  13.859  27.258  21.122  1.00 17.69  .    1    259
34
  ATOM  C  CB   GLU A   34  .  15.603  24.881  19.742  1.00 21.58  .    1    260
34
  ATOM  C  CG   GLU A   34  .  16.195  24.214  18.443  1.00 23.61  .    1    261
34
  ATOM  C  CD   GLU A   34  .  17.535  23.626  18.766  1.00 25.21  .    1    262
34
  ATOM  O  OE1  GLU A   34  .  17.894  23.582  19.939  1.00 26.57  .    1    263
34
  ATOM  O  OE2  GLU A   34  .  18.232  23.204  17.854  1.00 26.53  .    1    264
35
  ATOM  N  N    GLU A   35  .  12.831  25.264  21.421  1.00 21.71  .    1    265
35
  ATOM  C  CA   GLU A   35  .  12.126  25.524  22.655  1.00 24.32  .    1    266
35
  ATOM  C  C    GLU A   35  .  12.816  26.402  23.681  1.00 24.95  .    1    267
35
  ATOM  O  O    GLU A   35  .  13.893  26.065  24.162  1.00 25.78  .    1    268
35
  ATOM  C  CB   GLU A   35  .  11.949  24.199  23.453  1.00 25.93  .    1    269
35
  ATOM  C  CG   GLU A   35  .  10.616  24.086  24.154  1.00 27.79  .    1    270
35
  ATOM  C  CD   GLU A   35  .   9.440  24.404  23.267  1.00 29.49  .    1    271
35
  ATOM  O  OE1  GLU A   35  .   8.721  25.381  23.418  1.00 30.08  .    1    272
35
  ATOM  O  OE2  GLU A   35  .   9.346  23.546  22.355  1.00 30.04  .    1    273
36
  ATOM  N  N    MET A   36  .  12.175  27.467  24.072  1.00 25.31  .    1    274
36
  ATOM  C  CA   MET A   36  .  12.663  28.435  25.016  1.00 27.06  .    1    275
36
  ATOM  C  C    MET A   36  .  11.512  29.390  25.350  1.00 28.17  .    1    276
36
  ATOM  O  O    MET A   36  .  10.564  29.605  24.578  1.00 27.54  .    1    277
36
  ATOM  C  CB   MET A   36  .  13.840  29.260  24.423  1.00 27.54  .    1    278
36
  ATOM  C  CG   MET A   36  .  13.348  30.196  23.369  1.00 27.84  .    1    279
36
  ATOM  S  SD   MET A   36  .  14.755  31.141  22.671  1.00 29.46  .    1    280
36
  ATOM  C  CE   MET A   36  .  15.424  31.910  24.125  1.00 29.05  .    1    281
37
  ATOM  N  N    ASN A   37  .  11.740  29.961  26.508  1.00 29.93  .    1    282
37
  ATOM  C  CA   ASN A   37  .  10.858  30.963  27.104  1.00 31.75  .    1    283
37
  ATOM  C  C    ASN A   37  .  11.311  32.359  26.649  1.00 31.72  .    1    284
37
  ATOM  O  O    ASN A   37  .  12.461  32.803  26.819  1.00 31.94  .    1    285
37
  ATOM  C  CB   ASN A   37  .  10.854  30.860  28.644  1.00 33.85  .    1    286
37
  ATOM  C  CG   ASN A   37  .   9.695  31.755  29.098  1.00 35.30  .    1    287
37
  ATOM  O  OD1  ASN A   37  .   9.937  32.716  29.847  1.00 36.50  .    1    288
37
  ATOM  N  ND2  ASN A   37  .   8.535  31.421  28.494  1.00 35.68  .    1    289
38
  ATOM  N  N    LEU A   38  .  10.375  32.996  26.005  1.00 31.63  .    1    290
38
  ATOM  C  CA   LEU A   38  .  10.479  34.332  25.463  1.00 31.98  .    1    291
38
  ATOM  C  C    LEU A   38  .   9.315  35.056  26.164  1.00 32.92  .    1    292
38
  ATOM  O  O    LEU A   38  .   8.240  34.465  26.282  1.00 34.03  .    1    293
38
  ATOM  C  CB   LEU A   38  .  10.282  34.338  23.965  1.00 31.16  .    1    294
38
  ATOM  C  CG   LEU A   38  .  11.447  34.110  23.051  1.00 30.58  .    1    295
38
  ATOM  C  CD1  LEU A   38  .  11.006  34.240  21.597  1.00 30.94  .    1    296
38
  ATOM  C  CD2  LEU A   38  .  12.485  35.188  23.396  1.00 30.77  .    1    297
39
  ATOM  N  N    PRO A   39  .   9.573  36.268  26.521  1.00 33.79  .    1    298
39
  ATOM  C  CA   PRO A   39  .   8.561  37.096  27.206  1.00 33.99  .    1    299
39
  ATOM  C  C    PRO A   39  .   7.556  37.630  26.204  1.00 33.84  .    1    300
39
  ATOM  O  O    PRO A   39  .   7.757  37.753  24.993  1.00 33.92  .    1    301
39
  ATOM  C  CB   PRO A   39  .   9.407  38.177  27.871  1.00 34.32  .    1    302
39
  ATOM  C  CG   PRO A   39  .  10.806  37.557  27.916  1.00 34.46  .    1    303
39
  ATOM  C  CD   PRO A   39  .  10.873  36.971  26.456  1.00 34.11  .    1    304
40
  ATOM  N  N    GLY A   40  .   6.408  37.970  26.772  1.00 33.85  .    1    305
40
  ATOM  C  CA   GLY A   40  .   5.318  38.535  25.889  1.00 34.05  .    1    306
40
  ATOM  C  C    GLY A   40  .   4.340  37.343  25.711  1.00 33.27  .    1    307
40
  ATOM  O  O    GLY A   40  .   4.686  36.199  26.044  1.00 33.54  .    1    308
41
  ATOM  N  N    ARG A   41  .   3.191  37.724  25.200  1.00 32.11  .    1    309
41
  ATOM  C  CA   ARG A   41  .   2.136  36.716  24.968  1.00 31.32  .    1    310
41
  ATOM  C  C    ARG A   41  .   2.433  36.052  23.634  1.00 30.40  .    1    311
41
  ATOM  O  O    ARG A   41  .   3.173  36.617  22.789  1.00 29.63  .    1    312
41
  ATOM  C  CB   ARG A   41  .   0.790  37.415  25.038  1.00 31.99  .    1    313
42
  ATOM  N  N    TRP A   42  .   1.851  34.881  23.451  1.00 29.89  .    1    320
42
  ATOM  C  CA   TRP A   42  .   2.050  34.133  22.196  1.00 29.16  .    1    321
42
  ATOM  C  C    TRP A   42  .   0.764  33.505  21.697  1.00 28.78  .    1    322
42
  ATOM  O  O    TRP A   42  .  -0.276  33.358  22.390  1.00 29.53  .    1    323
42
  ATOM  C  CB   TRP A   42  .   3.174  33.113  22.367  1.00 30.16  .    1    324
42
  ATOM  C  CG   TRP A   42  .   2.820  32.156  23.458  1.00 30.80  .    1    325
42
  ATOM  C  CD1  TRP A   42  .   3.148  32.244  24.771  1.00 31.00  .    1    326
42
  ATOM  C  CD2  TRP A   42  .   1.994  30.994  23.320  1.00 31.20  .    1    327
42
  ATOM  N  NE1  TRP A   42  .   2.596  31.192  25.458  1.00 31.28  .    1    328
42
  ATOM  C  CE2  TRP A   42  .   1.873  30.421  24.594  1.00 31.21  .    1    329
42
  ATOM  C  CE3  TRP A   42  .   1.320  30.420  22.248  1.00 31.58  .    1    330
42
  ATOM  C  CZ2  TRP A   42  .   1.139  29.268  24.817  1.00 31.43  .    1    331
42
  ATOM  C  CZ3  TRP A   42  .   0.596  29.261  22.471  1.00 31.97  .    1    332
42
  ATOM  C  CH2  TRP A   42  .   0.502  28.694  23.749  1.00 31.22  .    1    333
43
  ATOM  N  N    LYS A   43  .   0.852  33.141  20.432  1.00 26.73  .    1    334
43
  ATOM  C  CA   LYS A   43  .  -0.252  32.491  19.704  1.00 25.46  .    1    335
43
  ATOM  C  C    LYS A   43  .   0.293  31.209  19.061  1.00 24.26  .    1    336
43
  ATOM  O  O    LYS A   43  .   1.387  31.215  18.513  1.00 23.71  .    1    337
43
  ATOM  C  CB   LYS A   43  .  -0.846  33.471  18.706  1.00 25.18  .    1    338
44
  ATOM  N  N    PRO A   44  .  -0.504  30.161  19.131  1.00 23.69  .    1    343
44
  ATOM  C  CA   PRO A   44  .  -0.173  28.865  18.548  1.00 22.30  .    1    344
44
  ATOM  C  C    PRO A   44  .  -0.386  28.987  17.043  1.00 21.70  .    1    345
44
  ATOM  O  O    PRO A   44  .  -1.291  29.612  16.492  1.00 22.06  .    1    346
44
  ATOM  C  CB   PRO A   44  .  -1.154  27.891  19.187  1.00 22.67  .    1    347
44
  ATOM  C  CG   PRO A   44  .  -2.350  28.706  19.587  1.00 22.69  .    1    348
44
  ATOM  C  CD   PRO A   44  .  -1.842  30.116  19.773  1.00 23.91  .    1    349
45
  ATOM  N  N    LYS A   45  .   0.467  28.313  16.364  1.00 20.15   1   1    350
45
  ATOM  C  CA   LYS A   45  .   0.561  28.262  14.915  1.00 18.74   1   1    351
45
  ATOM  C  C    LYS A   45  .   1.132  26.887  14.621  1.00 17.71   1   1    352
45
  ATOM  O  O    LYS A   45  .   1.716  26.281  15.537  1.00 17.52   1   1    353
45
  ATOM  C  CB   LYS A   45  .   1.617  29.306  14.471  1.00 18.96   1   1    354
45
  ATOM  C  CG   LYS A   45  .   1.544  29.549  12.992  1.00 18.72   1   1    355
45
  ATOM  C  CD   LYS A   45  .   2.543  30.574  12.490  1.00 20.05   1   1    356
45
  ATOM  C  CE   LYS A   45  .   2.075  31.154  11.154  1.00 19.91   1   1    357
45
  ATOM  N  NZ   LYS A   45  1   1.384  32.469  11.471  0.50 20.17   1   1    358
45
  ATOM  N  NZ   LYS A   45  2   3.340  31.578  10.427  0.50 19.50   1   1    359
46
  ATOM  N  N    MET A   46  .   0.886  26.476  13.434  1.00 18.14  .    1    360
46
  ATOM  C  CA   MET A   46  .   1.338  25.238  12.847  1.00 18.68  .    1    361
46
  ATOM  C  C    MET A   46  .   2.216  25.633  11.640  1.00 17.05  .    1    362
46
  ATOM  O  O    MET A   46  .   1.721  26.404  10.804  1.00 15.77  .    1    363
46
  ATOM  C  CB   MET A   46  .   0.153  24.373  12.316  1.00 20.79  .    1    364
46
  ATOM  C  CG   MET A   46  .  -0.727  23.908  13.480  1.00 22.75  .    1    365
46
  ATOM  S  SD   MET A   46  .   0.114  22.441  14.148  1.00 25.84  .    1    366
46
  ATOM  C  CE   MET A   46  .  -0.455  21.215  12.936  1.00 25.26  .    1    367
47
  ATOM  N  N    ILE A   47  .   3.397  25.011  11.602  1.00 16.08  .    1    368
47
  ATOM  C  CA   ILE A   47  .   4.280  25.251  10.429  1.00 15.51  .    1    369
47
  ATOM  C  C    ILE A   47  .   4.652  23.907   9.842  1.00 14.95  .    1    370
47
  ATOM  O  O    ILE A   47  .   4.891  22.937  10.556  1.00 16.05  .    1    371
47
  ATOM  C  CB   ILE A   47  .   5.563  26.077  10.784  1.00 15.23  .    1    372
47
  ATOM  C  CG1  ILE A   47  .   6.377  25.267  11.810  0.58 14.51  .    1    373
47
  ATOM  C  CG2  ILE A   47  .   5.166  27.506  11.220  0.58 15.19  .    1    374
47
  ATOM  C  CD1  ILE A   47  .   7.617  26.010  12.376  0.58 14.76  .    1    375
48
  ATOM  N  N    GLY A   48  .   4.759  23.842   8.555  1.00 15.31  .    1    376
48
  ATOM  C  CA   GLY A   48  .   5.051  22.587   7.866  1.00 15.20  .    1    377
48
  ATOM  C  C    GLY A   48  .   6.350  22.578   7.150  1.00 15.08  .    1    378
48
  ATOM  O  O    GLY A   48  .   7.037  23.583   7.040  1.00 15.21  .    1    379
49
  ATOM  N  N    GLY A   49  .   6.614  21.385   6.661  1.00 16.23  .    1    380
49
  ATOM  C  CA   GLY A   49  .   7.841  21.161   5.884  1.00 17.67  .    1    381
49
  ATOM  C  C    GLY A   49  .   7.988  19.681   5.597  1.00 17.69  .    1    382
49
  ATOM  O  O    GLY A   49  .   6.975  18.974   5.488  1.00 17.48  .    1    383
50
  ATOM  N  N    ILE A   50  .   9.289  19.352   5.446  1.00 17.37  .    1    384
50
  ATOM  C  CA   ILE A   50  .   9.560  17.928   5.178  1.00 18.18  .    1    385
50
  ATOM  C  C    ILE A   50  .   9.239  17.189   6.471  1.00 17.70  .    1    386
50
  ATOM  O  O    ILE A   50  .   9.666  17.620   7.586  1.00 16.29  .    1    387
50
  ATOM  C  CB   ILE A   50  .  10.977  17.667   4.602  1.00 18.88  .    1    388
50
  ATOM  C  CG1  ILE A   50  .  10.918  18.082   3.089  1.00 19.28  .    1    389
50
  ATOM  C  CG2  ILE A   50  .  11.458  16.191   4.737  1.00 18.58  .    1    390
50
  ATOM  C  CD1  ILE A   50  .  12.128  17.635   2.250  1.00 20.12  .    1    391
51
  ATOM  N  N    GLY A   51  .   8.375  16.183   6.285  1.00 17.62  .    1    392
51
  ATOM  C  CA   GLY A   51  .   7.984  15.371   7.445  1.00 18.36  .    1    393
51
  ATOM  C  C    GLY A   51  .   6.648  15.835   8.044  1.00 18.86  .    1    394
51
  ATOM  O  O    GLY A   51  .   6.244  15.210   9.056  1.00 19.97  .    1    395
52
  ATOM  N  N    GLY A   52  .   6.082  16.910   7.545  1.00 18.41  .    1    396
52
  ATOM  C  CA   GLY A   52  .   4.768  17.350   8.081  1.00 17.63  .    1    397
52
  ATOM  C  C    GLY A   52  .   4.799  18.606   8.901  1.00 17.21  .    1    398
52
  ATOM  O  O    GLY A   52  .   5.643  19.459   8.710  1.00 17.77  .    1    399
53
  ATOM  N  N    PHE A   53  .   3.857  18.777   9.803  1.00 17.06  .    1    400
53
  ATOM  C  CA   PHE A   53  .   3.659  19.944  10.621  1.00 16.21  .    1    401
53
  ATOM  C  C    PHE A   53  .   3.986  19.797  12.069  1.00 16.94  .    1    402
53
  ATOM  O  O    PHE A   53  .   3.749  18.713  12.640  1.00 18.11  .    1    403
53
  ATOM  C  CB   PHE A   53  .   2.147  20.375  10.434  1.00 15.36  .    1    404
53
  ATOM  C  CG   PHE A   53  .   1.902  21.022   9.109  1.00 14.60  .    1    405
53
  ATOM  C  CD1  PHE A   53  .   1.916  22.419   9.030  1.00 14.82  .    1    406
53
  ATOM  C  CD2  PHE A   53  .   1.666  20.319   7.938  1.00 14.66  .    1    407
53
  ATOM  C  CE1  PHE A   53  .   1.753  23.132   7.876  1.00 14.27  .    1    408
53
  ATOM  C  CE2  PHE A   53  .   1.421  21.005   6.746  1.00 14.55  .    1    409
53
  ATOM  C  CZ   PHE A   53  .   1.477  22.395   6.679  1.00 15.20  .    1    410
54
  ATOM  N  N    ILE A   54  .   4.547  20.837  12.677  1.00 16.72  .    1    411
54
  ATOM  C  CA   ILE A   54  .   4.823  20.962  14.088  1.00 15.86  .    1    412
54
  ATOM  C  C    ILE A   54  .   3.996  22.223  14.569  1.00 15.61  .    1    413
54
  ATOM  O  O    ILE A   54  .   3.656  23.077  13.762  1.00 14.25  .    1    414
54
  ATOM  C  CB   ILE A   54  .   6.280  21.089  14.595  1.00 16.14  .    1    415
54
  ATOM  C  CG1  ILE A   54  .   7.002  22.293  13.930  1.00 16.67  .    1    416
54
  ATOM  C  CG2  ILE A   54  .   7.062  19.747  14.346  1.00 16.15  .    1    417
54
  ATOM  C  CD1  ILE A   54  .   8.451  22.497  14.497  1.00 14.90  .    1    418
55
  ATOM  N  N    LYS A   55  .   3.630  22.198  15.804  1.00 15.82   1   1    419
55
  ATOM  C  CA   LYS A   55  .   2.863  23.268  16.477  1.00 16.48   1   1    420
55
  ATOM  C  C    LYS A   55  .   3.960  24.146  17.128  1.00 16.51   1   1    421
55
  ATOM  O  O    LYS A   55  .   4.856  23.482  17.691  1.00 17.59   1   1    422
55
  ATOM  C  CB   LYS A   55  .   2.048  22.696  17.651  1.00 17.18   1   1    423
55
  ATOM  C  CG   LYS A   55  .   1.071  23.790  18.143  1.00 18.91   1   1    424
55
  ATOM  C  CD   LYS A   55  .   0.128  23.336  19.245  1.00 20.87   1   1    425
55
  ATOM  C  CE   LYS A   55  .  -0.256  24.559  20.121  1.00 21.44   1   1    426
55
  ATOM  N  NZ   LYS A   55  1  -1.012  24.096  21.310  0.50 20.96   1   1    427
55
  ATOM  N  NZ   LYS A   55  2   0.962  25.220  20.720  0.50 21.43   1   1    428
56
  ATOM  N  N    VAL A   56  .   3.868  25.427  17.009  1.00 15.69  .    1    429
56
  ATOM  C  CA   VAL A   56  .   4.892  26.333  17.570  1.00 17.12  .    1    430
56
  ATOM  C  C    VAL A   56  .   4.123  27.490  18.257  1.00 17.53  .    1    431
56
  ATOM  O  O    VAL A   56  .   2.929  27.646  17.975  1.00 18.11  .    1    432
56
  ATOM  C  CB   VAL A   56  .   5.809  26.863  16.444  1.00 15.50  .    1    433
56
  ATOM  C  CG1  VAL A   56  .   6.738  25.911  15.766  1.00 14.44  .    1    434
56
  ATOM  C  CG2  VAL A   56  .   4.926  27.505  15.326  1.00 16.00  .    1    435
57
  ATOM  N  N    ARG A   57  .   4.827  28.206  19.087  1.00 18.25  .    1    436
57
  ATOM  C  CA   ARG A   57  .   4.231  29.416  19.741  1.00 19.95  .    1    437
57
  ATOM  C  C    ARG A   57  .   4.812  30.605  18.969  1.00 20.13  .    1    438
57
  ATOM  O  O    ARG A   57  .   6.046  30.636  18.785  1.00 19.68  .    1    439
57
  ATOM  C  CB   ARG A   57  .   4.657  29.451  21.198  1.00 21.28  .    1    440
57
  ATOM  C  CG   ARG A   57  .   4.380  28.197  21.953  1.00 23.47  .    1    441
57
  ATOM  C  CD   ARG A   57  .   4.465  28.305  23.432  1.00 25.56  .    1    442
57
  ATOM  N  NE   ARG A   57  .   5.715  28.932  23.880  1.00 27.80  .    1    443
57
  ATOM  C  CZ   ARG A   57  .   6.812  28.137  24.096  1.00 28.43  .    1    444
57
  ATOM  N  NH1  ARG A   57  .   6.760  26.823  23.913  1.00 28.11  .    1    445
57
  ATOM  N  NH2  ARG A   57  .   7.904  28.751  24.544  1.00 28.58  .    1    446
58
  ATOM  N  N    GLN A   58  .   3.988  31.488  18.478  1.00 19.56  .    1    447
58
  ATOM  C  CA   GLN A   58  .   4.457  32.656  17.734  1.00 20.94  .    1    448
58
  ATOM  C  C    GLN A   58  .   4.566  33.901  18.628  1.00 21.51  .    1    449
58
  ATOM  O  O    GLN A   58  .   3.506  34.267  19.237  1.00 21.40  .    1    450
58
  ATOM  C  CB   GLN A   58  .   3.336  32.996  16.697  1.00 21.47  .    1    451
58
  ATOM  C  CG   GLN A   58  .   3.652  34.356  16.114  1.00 22.85  .    1    452
58
  ATOM  C  CD   GLN A   58  .   2.444  34.781  15.294  1.00 24.11  .    1    453
58
  ATOM  O  OE1  GLN A   58  .   1.936  33.927  14.593  1.00 23.82  .    1    454
58
  ATOM  N  NE2  GLN A   58  .   2.127  36.073  15.528  1.00 24.80  .    1    455
59
  ATOM  N  N    TYR A   59  .   5.706  34.528  18.646  1.00 21.12  .    1    456
59
  ATOM  C  CA   TYR A   59  .   5.965  35.761  19.406  1.00 21.45  .    1    457
59
  ATOM  C  C    TYR A   59  .   6.272  36.838  18.328  1.00 22.14  .    1    458
59
  ATOM  O  O    TYR A   59  .   7.006  36.623  17.358  1.00 21.05  .    1    459
59
  ATOM  C  CB   TYR A   59  .   7.090  35.695  20.419  1.00 21.51  .    1    460
59
  ATOM  C  CG   TYR A   59  .   7.003  34.697  21.532  1.00 22.39  .    1    461
59
  ATOM  C  CD1  TYR A   59  .   7.190  33.339  21.273  1.00 23.04  .    1    462
59
  ATOM  C  CD2  TYR A   59  .   6.724  35.048  22.852  1.00 22.15  .    1    463
59
  ATOM  C  CE1  TYR A   59  .   7.180  32.354  22.249  1.00 23.25  .    1    464
59
  ATOM  C  CE2  TYR A   59  .   6.663  34.090  23.848  1.00 23.28  .    1    465
59
  ATOM  C  CZ   TYR A   59  .   6.894  32.748  23.564  1.00 23.57  .    1    466
59
  ATOM  O  OH   TYR A   59  .   6.842  31.812  24.565  1.00 24.25  .    1    467
60
  ATOM  N  N    ASP A   60  .   5.654  37.983  18.566  1.00 22.88   1   1    468
60
  ATOM  C  CA   ASP A   60  .   5.773  39.112  17.623  1.00 23.04   1   1    469
60
  ATOM  C  C    ASP A   60  .   6.809  40.079  18.168  1.00 23.93   1   1    470
60
  ATOM  O  O    ASP A   60  .   7.143  40.135  19.382  1.00 23.53   1   1    471
60
  ATOM  C  CB   ASP A   60  .   4.408  39.636  17.234  1.00 23.85   1   1    472
60
  ATOM  C  CG   ASP A   60  .   3.561  38.575  16.542  1.00 24.81   1   1    473
60
  ATOM  O  OD1  ASP A   60  1   4.102  37.830  15.703  0.50 24.83   1   1    474
60
  ATOM  O  OD1  ASP A   60  2   2.870  37.752  17.190  0.50 24.23   1   1    475
60
  ATOM  O  OD2  ASP A   60  1   2.347  38.524  16.845  0.50 25.03   1   1    476
60
  ATOM  O  OD2  ASP A   60  2   3.629  38.523  15.288  0.50 24.82   1   1    477
61
  ATOM  N  N    GLN A   61  .   7.366  40.798  17.208  1.00 24.52  .    1    478
61
  ATOM  C  CA   GLN A   61  .   8.380  41.814  17.473  1.00 25.25  .    1    479
61
  ATOM  C  C    GLN A   61  .   9.396  41.408  18.516  1.00 25.33  .    1    480
61
  ATOM  O  O    GLN A   61  .   9.547  42.097  19.555  1.00 26.21  .    1    481
61
  ATOM  C  CB   GLN A   61  .   7.663  43.123  17.891  1.00 25.04  .    1    482
62
  ATOM  N  N    ILE A   62  .  10.174  40.390  18.234  1.00 24.79  .    1    487
62
  ATOM  C  CA   ILE A   62  .  11.290  39.938  19.069  1.00 24.35  .    1    488
62
  ATOM  C  C    ILE A   62  .  12.529  40.568  18.401  1.00 25.53  .    1    489
62
  ATOM  O  O    ILE A   62  .  12.522  40.624  17.164  1.00 24.83  .    1    490
62
  ATOM  C  CB   ILE A   62  .  11.436  38.392  19.094  1.00 23.90  .    1    491
62
  ATOM  C  CG1  ILE A   62  .  10.111  37.754  19.605  1.00 23.49  .    1    492
62
  ATOM  C  CG2  ILE A   62  .  12.656  37.897  19.907  1.00 24.00  .    1    493
62
  ATOM  C  CD1  ILE A   62  .   9.775  38.162  21.061  1.00 23.66  .    1    494
63
  ATOM  N  N    LEU A   63  .  13.509  40.932  19.213  1.00 26.46  .    1    495
63
  ATOM  C  CA   LEU A   63  .  14.757  41.514  18.644  1.00 27.64  .    1    496
63
  ATOM  C  C    LEU A   63  .  15.820  40.418  18.616  1.00 27.70  .    1    497
63
  ATOM  O  O    LEU A   63  .  15.940  39.679  19.603  1.00 28.48  .    1    498
63
  ATOM  C  CB   LEU A   63  .  15.127  42.767  19.422  1.00 28.06  .    1    499
63
  ATOM  C  CG   LEU A   63  .  16.594  43.258  19.299  1.00 28.84  .    1    500
63
  ATOM  C  CD1  LEU A   63  .  16.821  44.055  18.046  1.00 28.94  .    1    501
63
  ATOM  C  CD2  LEU A   63  .  16.911  44.081  20.553  1.00 28.74  .    1    502
64
  ATOM  N  N    ILE A   64  .  16.476  40.236  17.519  1.00 28.25  .    1    503
64
  ATOM  C  CA   ILE A   64  .  17.535  39.224  17.355  1.00 29.07  .    1    504
64
  ATOM  C  C    ILE A   64  .  18.682  39.991  16.663  1.00 28.92  .    1    505
64
  ATOM  O  O    ILE A   64  .  18.378  40.871  15.855  1.00 28.74  .    1    506
64
  ATOM  C  CB   ILE A   64  .  17.147  37.976  16.501  1.00 29.99  .    1    507
64
  ATOM  C  CG1  ILE A   64  .  16.009  37.142  17.171  1.00 30.07  .    1    508
64
  ATOM  C  CG2  ILE A   64  .  18.327  37.006  16.185  1.00 29.52  .    1    509
64
  ATOM  C  CD1  ILE A   64  .  16.136  35.637  16.689  1.00 30.99  .    1    510
65
  ATOM  N  N    GLU A   65  .  19.870  39.613  17.048  1.00 29.52   1   1    511
65
  ATOM  C  CA   GLU A   65  .  21.051  40.198  16.396  1.00 30.85   1   1    512
65
  ATOM  C  C    GLU A   65  .  21.634  39.023  15.606  1.00 31.11   1   1    513
65
  ATOM  O  O    GLU A   65  .  22.010  38.060  16.274  1.00 31.04   1   1    514
65
  ATOM  C  CB   GLU A   65  .  22.136  40.643  17.356  1.00 31.48   1   1    515
65
  ATOM  C  CG   GLU A   65  .  21.577  41.412  18.556  1.00 32.98   1   1    516
65
  ATOM  C  CD   GLU A   65  .  22.600  42.252  19.267  1.00 33.87   1   1    517
65
  ATOM  O  OE1  GLU A   65  1  23.635  42.612  18.714  0.50 34.01   1   1    518
65
  ATOM  O  OE1  GLU A   65  2  22.248  43.334  19.761  0.50 34.21   1   1    519
65
  ATOM  O  OE2  GLU A   65  1  22.289  42.495  20.458  0.50 34.29   1   1    520
65
  ATOM  O  OE2  GLU A   65  2  23.736  41.743  19.294  0.50 33.46   1   1    521
66
  ATOM  N  N    ILE A   66  .  21.635  39.172  14.309  1.00 32.12  .    1    522
66
  ATOM  C  CA   ILE A   66  .  22.213  38.125  13.461  1.00 33.09  .    1    523
66
  ATOM  C  C    ILE A   66  .  23.566  38.609  12.974  1.00 34.70  .    1    524
66
  ATOM  O  O    ILE A   66  .  23.662  39.531  12.131  1.00 34.48  .    1    525
66
  ATOM  C  CB   ILE A   66  .  21.222  37.773  12.318  1.00 32.75  .    1    526
66
  ATOM  C  CG1  ILE A   66  .  19.881  37.306  12.931  1.00 32.41  .    1    527
66
  ATOM  C  CG2  ILE A   66  .  21.796  36.757  11.289  1.00 32.87  .    1    528
66
  ATOM  C  CD1  ILE A   66  .  18.750  38.355  12.759  1.00 32.51  .    1    529
67
  ATOM  N  N    CYS A   67  .  24.610  37.956  13.518  1.00 36.68  .    1    530
67
  ATOM  C  CA   CYS A   67  .  25.956  38.362  13.059  1.00 38.17  .    1    531
67
  ATOM  C  C    CYS A   67  .  26.146  39.856  13.300  1.00 38.24  .    1    532
67
  ATOM  O  O    CYS A   67  .  26.629  40.573  12.380  1.00 38.46  .    1    533
67
  ATOM  C  CB   CYS A   67  .  25.989  38.139  11.530  1.00 39.41  .    1    534
67
  ATOM  S  SG   CYS A   67  .  26.693  36.561  11.068  1.00 42.91  .    1    535
68
  ATOM  N  N    GLY A   68  .  25.750  40.298  14.488  1.00 37.96  .    1    536
68
  ATOM  C  CA   GLY A   68  .  25.925  41.684  14.855  1.00 37.56  .    1    537
68
  ATOM  C  C    GLY A   68  .  24.822  42.611  14.454  1.00 37.54  .    1    538
68
  ATOM  O  O    GLY A   68  .  24.634  43.581  15.226  1.00 38.20  .    1    539
69
  ATOM  N  N    HIS A   69  .  24.117  42.349  13.366  1.00 37.50  .    1    540
69
  ATOM  C  CA   HIS A   69  .  23.010  43.242  12.972  1.00 37.07  .    1    541
69
  ATOM  C  C    HIS A   69  .  21.717  42.904  13.707  1.00 36.60  .    1    542
69
  ATOM  O  O    HIS A   69  .  21.386  41.733  13.901  1.00 37.04  .    1    543
69
  ATOM  C  CB   HIS A   69  .  22.661  43.274  11.481  1.00 37.61  .    1    544
69
  ATOM  C  CG   HIS A   69  .  23.858  43.053  10.618  1.00 38.19  .    1    545
69
  ATOM  N  ND1  HIS A   69  .  24.819  42.127  10.896  1.00 38.39  .    1    546
69
  ATOM  C  CD2  HIS A   69  .  24.209  43.648   9.451  1.00 38.48  .    1    547
69
  ATOM  C  CE1  HIS A   69  .  25.736  42.163   9.934  1.00 38.85  .    1    548
69
  ATOM  N  NE2  HIS A   69  .  25.395  43.082   9.056  1.00 38.73  .    1    549
70
  ATOM  N  N    LYS A   70  .  20.986  43.973  14.016  1.00 35.65  .    1    550
70
  ATOM  C  CA   LYS A   70  .  19.706  43.879  14.709  1.00 34.21  .    1    551
70
  ATOM  C  C    LYS A   70  .  18.566  43.762  13.710  1.00 32.44  .    1    552
70
  ATOM  O  O    LYS A   70  .  18.528  44.296  12.590  1.00 31.97  .    1    553
70
  ATOM  C  CB   LYS A   70  .  19.506  45.007  15.712  1.00 35.52  .    1    554
70
  ATOM  C  CG   LYS A   70  .  20.549  44.941  16.826  1.00 36.50  .    1    555
70
  ATOM  C  CD   LYS A   70  .  20.291  46.034  17.870  1.00 37.60  .    1    556
70
  ATOM  C  CE   LYS A   70  .  21.413  46.176  18.886  1.00 37.90  .    1    557
70
  ATOM  N  NZ   LYS A   70  .  22.506  47.064  18.408  1.00 37.72  .    1    558
71
  ATOM  N  N    ALA A   71  .  17.631  42.924  14.148  1.00 29.88  .    1    559
71
  ATOM  C  CA   ALA A   71  .  16.433  42.630  13.359  1.00 27.38  .    1    560
71
  ATOM  C  C    ALA A   71  .  15.252  42.431  14.299  1.00 25.84  .    1    561
71
  ATOM  O  O    ALA A   71  .  15.399  41.854  15.404  1.00 26.35  .    1    562
71
  ATOM  C  CB   ALA A   71  .  16.756  41.447  12.463  1.00 26.59  .    1    563
72
  ATOM  N  N    ILE A   72  .  14.085  42.922  13.900  1.00 23.05  .    1    564
72
  ATOM  C  CA   ILE A   72  .  12.865  42.730  14.707  1.00 21.58  .    1    565
72
  ATOM  C  C    ILE A   72  .  11.927  41.910  13.801  1.00 19.40  .    1    566
72
  ATOM  O  O    ILE A   72  .  11.829  42.256  12.600  1.00 18.43  .    1    567
72
  ATOM  C  CB   ILE A   72  .  12.197  44.026  15.230  1.00 21.40  .    1    568
72
  ATOM  C  CG1  ILE A   72  .  13.196  45.069  15.678  1.00 21.07  .    1    569
72
  ATOM  C  CG2  ILE A   72  .  11.278  43.719  16.437  1.00 21.73  .    1    570
73
  ATOM  N  N    GLY A   73  .  11.224  40.980  14.434  1.00 18.42  .    1    572
73
  ATOM  C  CA   GLY A   73  .  10.281  40.156  13.675  1.00 17.73  .    1    573
73
  ATOM  C  C    GLY A   73  .   9.586  39.106  14.509  1.00 17.21  .    1    574
73
  ATOM  O  O    GLY A   73  .   9.753  39.063  15.723  1.00 18.51  .    1    575
74
  ATOM  N  N    THR A   74  .   8.779  38.306  13.828  1.00 17.53  .    1    576
74
  ATOM  C  CA   THR A   74  .   8.072  37.183  14.441  1.00 17.76  .    1    577
74
  ATOM  C  C    THR A   74  .   9.126  36.085  14.619  1.00 18.09  .    1    578
74
  ATOM  O  O    THR A   74  .  10.000  35.896  13.766  1.00 18.12  .    1    579
74
  ATOM  C  CB   THR A   74  .   6.852  36.621  13.619  1.00 18.64  .    1    580
74
  ATOM  O  OG1  THR A   74  .   5.847  37.672  13.704  1.00 18.99  .    1    581
74
  ATOM  C  CG2  THR A   74  .   6.251  35.291  14.064  1.00 17.64  .    1    582
75
  ATOM  N  N    VAL A   75  .   8.922  35.381  15.714  1.00 17.70  .    1    583
75
  ATOM  C  CA   VAL A   75  .   9.871  34.310  16.095  1.00 17.07  .    1    584
75
  ATOM  C  C    VAL A   75  .   8.964  33.185  16.540  1.00 17.08  .    1    585
75
  ATOM  O  O    VAL A   75  .   8.045  33.524  17.295  1.00 17.87  .    1    586
75
  ATOM  C  CB   VAL A   75  .  10.748  35.008  17.141  1.00 17.80  .    1    587
75
  ATOM  C  CG1  VAL A   75  .  11.207  34.058  18.214  1.00 18.63  .    1    588
75
  ATOM  C  CG2  VAL A   75  .  11.910  35.759  16.480  1.00 17.67  .    1    589
76
  ATOM  N  N    LEU A   76  .   9.053  32.029  15.966  1.00 16.07  .    1    590
76
  ATOM  C  CA   LEU A   76  .   8.234  30.857  16.343  1.00 15.28  .    1    591
76
  ATOM  C  C    LEU A   76  .   9.194  30.029  17.193  1.00 14.76  .    1    592
76
  ATOM  O  O    LEU A   76  .  10.409  30.049  16.899  1.00 15.49  .    1    593
76
  ATOM  C  CB   LEU A   76  .   7.813  30.140  15.086  1.00 15.26  .    1    594
76
  ATOM  C  CG   LEU A   76  .   7.273  30.943  13.934  1.00 15.36  .    1    595
76
  ATOM  C  CD1  LEU A   76  .   6.870  29.969  12.801  1.00 15.76  .    1    596
76
  ATOM  C  CD2  LEU A   76  .   6.013  31.671  14.391  1.00 13.31  .    1    597
77
  ATOM  N  N    VAL A   77  .   8.697  29.331  18.155  1.00 14.11  .    1    598
77
  ATOM  C  CA   VAL A   77  .   9.487  28.475  19.069  1.00 13.98  .    1    599
77
  ATOM  C  C    VAL A   77  .   8.731  27.139  19.112  1.00 14.47  .    1    600
77
  ATOM  O  O    VAL A   77  .   7.482  27.137  19.257  1.00 13.25  .    1    601
77
  ATOM  C  CB   VAL A   77  .   9.544  29.155  20.477  1.00 13.82  .    1    602
77
  ATOM  C  CG1  VAL A   77  .  10.125  28.211  21.515  1.00 12.58  .    1    603
77
  ATOM  C  CG2  VAL A   77  .  10.255  30.473  20.346  1.00 12.85  .    1    604
78
  ATOM  N  N    GLY A   78  .   9.508  26.071  18.919  1.00 15.74  .    1    605
78
  ATOM  C  CA   GLY A   78  .   8.826  24.747  18.832  1.00 15.22  .    1    606
78
  ATOM  C  C    GLY A   78  .   9.860  23.651  18.762  1.00 15.91  .    1    607
78
  ATOM  O  O    GLY A   78  .  11.063  23.966  18.805  1.00 15.40  .    1    608
79
  ATOM  N  N    PRO A   79  .   9.379  22.425  18.600  1.00 16.31  .    1    609
79
  ATOM  C  CA   PRO A   79  .  10.284  21.266  18.571  1.00 16.40  .    1    610
79
  ATOM  C  C    PRO A   79  .  11.057  21.153  17.304  1.00 16.98  .    1    611
79
  ATOM  O  O    PRO A   79  .  11.019  20.063  16.661  1.00 17.81  .    1    612
79
  ATOM  C  CB   PRO A   79  .   9.364  20.080  18.874  1.00 16.17  .    1    613
79
  ATOM  C  CG   PRO A   79  .   7.998  20.515  18.365  1.00 16.46  .    1    614
79
  ATOM  C  CD   PRO A   79  .   7.960  22.043  18.533  1.00 16.29  .    1    615
80
  ATOM  N  N    THR A   80  .  11.801  22.172  16.939  1.00 18.08  .    1    616
80
  ATOM  C  CA   THR A   80  .  12.617  22.212  15.726  1.00 17.83  .    1    617
80
  ATOM  C  C    THR A   80  .  14.006  21.620  16.006  1.00 19.43  .    1    618
80
  ATOM  O  O    THR A   80  .  14.625  21.928  17.015  1.00 19.31  .    1    619
80
  ATOM  C  CB   THR A   80  .  12.754  23.716  15.222  1.00 17.38  .    1    620
80
  ATOM  O  OG1  THR A   80  .  13.713  23.690  14.103  1.00 16.00  .    1    621
80
  ATOM  C  CG2  THR A   80  .  13.196  24.672  16.299  1.00 16.43  .    1    622
81
  ATOM  N  N    PRO A   81  .  14.498  20.824  15.056  1.00 20.69  .    1    623
81
  ATOM  C  CA   PRO A   81  .  15.775  20.159  15.164  1.00 21.19  .    1    624
81
  ATOM  C  C    PRO A   81  .  16.922  21.144  15.183  1.00 21.69  .    1    625
81
  ATOM  O  O    PRO A   81  .  17.980  20.803  15.754  1.00 23.67  .    1    626
81
  ATOM  C  CB   PRO A   81  .  15.811  19.219  13.929  1.00 21.78  .    1    627
81
  ATOM  C  CG   PRO A   81  .  14.931  19.949  12.941  1.00 21.29  .    1    628
81
  ATOM  C  CD   PRO A   81  .  13.765  20.408  13.821  1.00 20.92  .    1    629
82
  ATOM  N  N    VAL A   82  .  16.742  22.307  14.619  1.00 21.57  .    1    630
82
  ATOM  C  CA   VAL A   82  .  17.847  23.315  14.599  1.00 21.27  .    1    631
82
  ATOM  C  C    VAL A   82  .  17.217  24.706  14.647  1.00 20.29  .    1    632
82
  ATOM  O  O    VAL A   82  .  16.029  24.794  14.251  1.00 20.63  .    1    633
82
  ATOM  C  CB   VAL A   82  .  18.675  23.027  13.341  1.00 21.59  .    1    634
82
  ATOM  C  CG1  VAL A   82  .  17.868  22.982  12.048  1.00 21.38  .    1    635
82
  ATOM  C  CG2  VAL A   82  .  19.757  24.094  13.143  1.00 22.54  .    1    636
83
  ATOM  N  N    ASN A   83  .  17.961  25.678  15.091  1.00 18.84  .    1    637
83
  ATOM  C  CA   ASN A   83  .  17.457  27.057  15.086  1.00 18.89  .    1    638
83
  ATOM  C  C    ASN A   83  .  17.521  27.486  13.606  1.00 17.50  .    1    639
83
  ATOM  O  O    ASN A   83  .  18.507  27.222  12.911  1.00 18.18  .    1    640
83
  ATOM  C  CB   ASN A   83  .  18.146  28.021  16.032  1.00 18.62  .    1    641
83
  ATOM  C  CG   ASN A   83  .  18.114  27.501  17.474  1.00 19.09  .    1    642
83
  ATOM  O  OD1  ASN A   83  .  17.020  27.126  17.923  1.00 19.30  .    1    643
83
  ATOM  N  ND2  ASN A   83  .  19.273  27.484  18.132  1.00 18.32  .    1    644
84
  ATOM  N  N    ILE A   84  .  16.430  28.169  13.202  1.00 17.49  .    1    645
84
  ATOM  C  CA   ILE A   84  .  16.429  28.575  11.787  1.00 16.90  .    1    646
84
  ATOM  C  C    ILE A   84  .  16.055  30.033  11.631  1.00 15.09  .    1    647
84
  ATOM  O  O    ILE A   84  .  14.993  30.414  12.094  1.00 15.76  .    1    648
84
  ATOM  C  CB   ILE A   84  .  15.490  27.622  10.967  1.00 18.16  .    1    649
84
  ATOM  C  CG1  ILE A   84  .  16.154  26.275  10.583  1.00 18.58  .    1    650
84
  ATOM  C  CG2  ILE A   84  .  15.012  28.298   9.641  1.00 18.19  .    1    651
84
  ATOM  C  CD1  ILE A   84  .  15.084  25.137  10.823  1.00 21.14  .    1    652
85
  ATOM  N  N    ILE A   85  .  16.891  30.758  10.918  1.00 14.37  .    1    653
85
  ATOM  C  CA   ILE A   85  .  16.625  32.153  10.586  1.00 13.07  .    1    654
85
  ATOM  C  C    ILE A   85  .  15.915  32.128   9.207  1.00 12.74  .    1    655
85
  ATOM  O  O    ILE A   85  .  16.670  31.851   8.299  1.00 12.12  .    1    656
85
  ATOM  C  CB   ILE A   85  .  17.804  33.151  10.521  1.00 11.59  .    1    657
85
  ATOM  C  CG1  ILE A   85  .  18.669  33.018  11.783  1.00 12.38  .    1    658
85
  ATOM  C  CG2  ILE A   85  .  17.250  34.603  10.300  1.00 11.07  .    1    659
85
  ATOM  C  CD1  ILE A   85  .  18.108  33.320  13.158  1.00 11.86  .    1    660
86
  ATOM  N  N    GLY A   86  .  14.665  32.590   9.211  1.00 12.31  .    1    661
86
  ATOM  C  CA   GLY A   86  .  13.908  32.611   7.947  1.00 12.89  .    1    662
86
  ATOM  C  C    GLY A   86  .  13.887  33.979   7.273  1.00 13.14  .    1    663
86
  ATOM  O  O    GLY A   86  .  14.493  34.968   7.754  1.00 12.59  .    1    664
87
  ATOM  N  N    ARG A   87  .  13.214  33.996   6.147  1.00 12.60  .    1    665
87
  ATOM  C  CA   ARG A   87  .  13.090  35.152   5.233  1.00 12.19  .    1    666
87
  ATOM  C  C    ARG A   87  .  12.685  36.437   5.919  1.00 13.78  .    1    667
87
  ATOM  O  O    ARG A   87  .  13.239  37.530   5.643  1.00 14.60  .    1    668
87
  ATOM  C  CB   ARG A   87  .  12.165  34.801   4.058  1.00 11.07  .    1    669
87
  ATOM  C  CG   ARG A   87  .  12.845  33.790   3.066  1.00  9.98  .    1    670
87
  ATOM  C  CD   ARG A   87  .  12.079  33.857   1.753  1.00  8.59  .    1    671
87
  ATOM  N  NE   ARG A   87  .  10.695  33.464   1.981  1.00  8.93  .    1    672
87
  ATOM  C  CZ   ARG A   87  .   9.672  34.285   2.136  1.00  9.95  .    1    673
87
  ATOM  N  NH1  ARG A   87  .   8.469  33.825   2.517  1.00 10.84  .    1    674
87
  ATOM  N  NH2  ARG A   87  .   9.826  35.593   2.001  1.00 11.30  .    1    675
88
  ATOM  N  N    ASN A   88  .  11.802  36.345   6.865  1.00 14.36  .    1    676
88
  ATOM  C  CA   ASN A   88  .  11.249  37.435   7.675  1.00 13.53  .    1    677
88
  ATOM  C  C    ASN A   88  .  12.316  38.279   8.351  1.00 13.71  .    1    678
88
  ATOM  O  O    ASN A   88  .  12.018  39.489   8.581  1.00 13.96  .    1    679
88
  ATOM  C  CB   ASN A   88  .  10.191  36.833   8.609  1.00 12.46  .    1    680
88
  ATOM  C  CG   ASN A   88  .  10.640  36.329   9.948  1.00 13.28  .    1    681
88
  ATOM  O  OD1  ASN A   88  .  11.404  35.342  10.060  1.00 14.20  .    1    682
88
  ATOM  N  ND2  ASN A   88  .  10.246  36.937  11.085  1.00 13.18  .    1    683
89
  ATOM  N  N    LEU A   89  .  13.431  37.736   8.804  1.00 12.63  .    1    684
89
  ATOM  C  CA   LEU A   89  .  14.550  38.372   9.439  1.00 12.09  .    1    685
89
  ATOM  C  C    LEU A   89  .  15.707  38.529   8.485  1.00 12.93  .    1    686
89
  ATOM  O  O    LEU A   89  .  16.437  39.558   8.631  1.00 14.12  .    1    687
89
  ATOM  C  CB   LEU A   89  .  15.016  37.636  10.736  1.00 11.87  .    1    688
89
  ATOM  C  CG   LEU A   89  .  13.937  37.636  11.826  1.00 11.46  .    1    689
89
  ATOM  C  CD1  LEU A   89  .  14.392  36.775  13.000  1.00 12.65  .    1    690
89
  ATOM  C  CD2  LEU A   89  .  13.726  39.070  12.233  1.00 11.83  .    1    691
90
  ATOM  N  N    LEU A   90  .  15.858  37.640   7.523  1.00 13.26  .    1    692
90
  ATOM  C  CA   LEU A   90  .  16.951  37.736   6.539  1.00 13.98  .    1    693
90
  ATOM  C  C    LEU A   90  .  16.853  39.038   5.741  1.00 14.35  .    1    694
90
  ATOM  O  O    LEU A   90  .  17.849  39.695   5.454  1.00 14.29  .    1    695
90
  ATOM  C  CB   LEU A   90  .  16.956  36.494   5.632  1.00 13.80  .    1    696
90
  ATOM  C  CG   LEU A   90  .  17.363  35.179   6.261  1.00 13.41  .    1    697
90
  ATOM  C  CD1  LEU A   90  .  17.377  34.046   5.256  1.00 12.77  .    1    698
90
  ATOM  C  CD2  LEU A   90  .  18.776  35.284   6.819  1.00 14.02  .    1    699
91
  ATOM  N  N    THR A   91  .  15.642  39.359   5.350  1.00 14.79  .    1    700
91
  ATOM  C  CA   THR A   91  .  15.383  40.593   4.616  1.00 15.00  .    1    701
91
  ATOM  C  C    THR A   91  .  15.876  41.799   5.437  1.00 15.79  .    1    702
91
  ATOM  O  O    THR A   91  .  16.424  42.710   4.859  1.00 15.74  .    1    703
91
  ATOM  C  CB   THR A   91  .  13.869  40.751   4.323  1.00 14.45  .    1    704
91
  ATOM  O  OG1  THR A   91  .  13.236  40.737   5.626  1.00 14.17  .    1    705
91
  ATOM  C  CG2  THR A   91  .  13.311  39.798   3.275  1.00 14.30  .    1    706
92
  ATOM  N  N    GLN A   92  .  15.633  41.715   6.739  1.00 16.49  .    1    707
92
  ATOM  C  CA   GLN A   92  .  15.952  42.771   7.692  1.00 16.68  .    1    708
92
  ATOM  C  C    GLN A   92  .  17.393  43.177   7.774  1.00 16.85  .    1    709
92
  ATOM  O  O    GLN A   92  .  17.710  44.345   8.116  1.00 14.85  .    1    710
92
  ATOM  C  CB   GLN A   92  .  15.244  42.572   9.023  1.00 17.18  .    1    711
92
  ATOM  C  CG   GLN A   92  .  13.750  42.564   9.004  1.00 17.04  .    1    712
92
  ATOM  C  CD   GLN A   92  .  13.041  43.741   8.353  1.00 16.99  .    1    713
92
  ATOM  O  OE1  GLN A   92  .  12.552  43.716   7.200  1.00 16.12  .    1    714
92
  ATOM  N  NE2  GLN A   92  .  12.991  44.833   9.131  1.00 14.92  .    1    715
93
  ATOM  N  N    ILE A   93  .  18.294  42.226   7.572  1.00 17.81  .    1    716
93
  ATOM  C  CA   ILE A   93  .  19.718  42.404   7.594  1.00 17.96  .    1    717
93
  ATOM  C  C    ILE A   93  .  20.199  42.656   6.156  1.00 17.03  .    1    718
93
  ATOM  O  O    ILE A   93  .  21.394  42.854   6.046  1.00 18.32  .    1    719
93
  ATOM  C  CB   ILE A   93  .  20.527  41.226   8.226  1.00 18.83  .    1    720
93
  ATOM  C  CG1  ILE A   93  .  20.356  39.920   7.406  1.00 18.95  .    1    721
93
  ATOM  C  CG2  ILE A   93  .  20.156  40.967   9.701  1.00 19.28  .    1    722
93
  ATOM  C  CD1  ILE A   93  .  21.016  38.696   8.159  1.00 18.85  .    1    723
94
  ATOM  N  N    GLY A   94  .  19.384  42.626   5.130  1.00 16.71  .    1    724
94
  ATOM  C  CA   GLY A   94  .  19.906  42.920   3.781  1.00 16.64  .    1    725
94
  ATOM  C  C    GLY A   94  .  20.484  41.676   3.111  1.00 17.66  .    1    726
94
  ATOM  O  O    GLY A   94  .  21.274  41.697   2.155  1.00 16.82  .    1    727
95
  ATOM  N  N    CYS A   95  .  19.993  40.498   3.579  1.00 17.17   1   1    728
95
  ATOM  C  CA   CYS A   95  .  20.463  39.289   2.946  1.00 16.18   1   1    729
95
  ATOM  C  C    CYS A   95  .  19.955  39.081   1.532  1.00 16.37   1   1    730
95
  ATOM  O  O    CYS A   95  .  18.715  39.214   1.337  1.00 17.18   1   1    731
95
  ATOM  C  CB   CYS A   95  .  20.018  38.072   3.771  1.00 15.35   1   1    732
95
  ATOM  S  SG   CYS A   95  1  21.054  36.638   3.403  0.50 10.39   1   1    733
95
  ATOM  S  SG   CYS A   95  2  21.301  37.595   4.938  0.50 19.65   1   1    734
96
  ATOM  N  N    THR A   96  .  20.845  38.701   0.636  1.00 16.30  .    1    735
96
  ATOM  C  CA   THR A   96  .  20.506  38.362  -0.735  1.00 16.61  .    1    736
96
  ATOM  C  C    THR A   96  .  21.208  37.037  -1.122  1.00 16.83  .    1    737
96
  ATOM  O  O    THR A   96  .  22.160  36.561  -0.453  1.00 16.26  .    1    738
96
  ATOM  C  CB   THR A   96  .  20.755  39.458  -1.858  1.00 17.13  .    1    739
96
  ATOM  O  OG1  THR A   96  .  22.170  39.633  -1.923  1.00 16.85  .    1    740
96
  ATOM  C  CG2  THR A   96  .  20.075  40.798  -1.716  1.00 17.20  .    1    741
97
  ATOM  N  N    LEU A   97  .  20.738  36.469  -2.193  1.00 17.14   1   1    742
97
  ATOM  C  CA   LEU A   97  .  21.255  35.231  -2.813  1.00 17.60   1   1    743
97
  ATOM  C  C    LEU A   97  .  21.819  35.730  -4.161  1.00 19.21   1   1    744
97
  ATOM  O  O    LEU A   97  .  21.096  36.476  -4.853  1.00 18.83   1   1    745
97
  ATOM  C  CB   LEU A   97  .  20.107  34.266  -2.978  1.00 17.37   1   1    746
97
  ATOM  C  CG   LEU A   97  1  20.234  32.781  -2.846  0.50 17.44   1   1    747
97
  ATOM  C  CG   LEU A   97  2  19.442  33.593  -1.824  0.50 16.07   1   1    748
97
  ATOM  C  CD1  LEU A   97  1  20.871  32.351  -1.527  0.50 16.67   1   1    749
97
  ATOM  C  CD1  LEU A   97  2  18.164  32.917  -2.303  0.50 16.28   1   1    750
97
  ATOM  C  CD2  LEU A   97  1  18.813  32.182  -2.935  0.50 17.37   1   1    751
97
  ATOM  C  CD2  LEU A   97  2  20.456  32.565  -1.272  0.50 15.85   1   1    752
98
  ATOM  N  N    ASN A   98  .  23.070  35.413  -4.453  1.00 19.55   1   1    753
98
  ATOM  C  CA   ASN A   98  .  23.596  35.908  -5.720  1.00 22.38   1   1    754
98
  ATOM  C  C    ASN A   98  .  24.252  34.754  -6.509  1.00 22.89   1   1    755
98
  ATOM  O  O    ASN A   98  .  24.828  33.870  -5.862  1.00 23.46   1   1    756
98
  ATOM  C  CB   ASN A   98  .  24.569  37.075  -5.476  1.00 22.36   1   1    757
98
  ATOM  C  CG   ASN A   98  .  24.093  38.200  -4.607  1.00 22.66   1   1    758
98
  ATOM  O  OD1  ASN A   98  1  23.846  38.042  -3.403  0.50 22.83   1   1    759
98
  ATOM  O  OD1  ASN A   98  2  23.329  39.081  -5.048  0.50 22.49   1   1    760
98
  ATOM  N  ND2  ASN A   98  1  24.008  39.411  -5.198  0.50 22.78   1   1    761
98
  ATOM  N  ND2  ASN A   98  2  24.511  38.229  -3.338  0.50 22.51   1   1    762
99
  ATOM  N  N    PHE A   99  .  24.154  34.855  -7.809  1.00 23.63  .    1    763
99
  ATOM  C  CA   PHE A   99  .  24.853  33.899  -8.704  1.00 25.22  .    1    764
99
  ATOM  C  C    PHE A   99  .  24.847  34.401 -10.156  1.00 26.19  .    1    765
99
  ATOM  O  O    PHE A   99  .  25.466  33.710 -11.016  1.00 27.66  .    1    766
99
  ATOM  C  CB   PHE A   99  .  24.367  32.477  -8.571  1.00 24.13  .    1    767
99
  ATOM  C  CG   PHE A   99  .  22.940  32.349  -8.972  1.00 24.41  .    1    768
99
  ATOM  C  CD1  PHE A   99  .  22.578  32.079 -10.293  1.00 23.93  .    1    769
99
  ATOM  C  CD2  PHE A   99  .  21.946  32.555  -8.015  1.00 24.50  .    1    770
99
  ATOM  C  CE1  PHE A   99  .  21.259  31.958 -10.659  1.00 24.18  .    1    771
99
  ATOM  C  CE2  PHE A   99  .  20.595  32.456  -8.376  1.00 24.44  .    1    772
99
  ATOM  C  CZ   PHE A   99  .  20.258  32.160  -9.697  1.00 24.41  .    1    773
99
  ATOM  O  OXT  PHE A   99  .  24.245  35.433 -10.475  1.00 27.41  .    1    774
99
  TER   .  .    PHE A   99  .    .       .       .      .     .    .    1    775
1
  ATOM  N  N    PRO B  201  .  22.320  36.825 -11.115  1.00 29.93  .    1    776
1
  ATOM  C  CA   PRO B  201  .  21.291  37.750 -10.621  1.00 29.61  .    1    777
1
  ATOM  C  C    PRO B  201  .  21.462  37.833  -9.111  1.00 28.86  .    1    778
1
  ATOM  O  O    PRO B  201  .  22.205  37.010  -8.546  1.00 28.72  .    1    779
1
  ATOM  C  CB   PRO B  201  .  19.963  37.069 -10.977  1.00 30.19  .    1    780
1
  ATOM  C  CG   PRO B  201  .  20.302  35.583 -10.936  1.00 30.20  .    1    781
1
  ATOM  C  CD   PRO B  201  .  21.681  35.562 -11.613  1.00 30.16  .    1    782
2
  ATOM  N  N    GLN B  202  .  20.792  38.802  -8.540  1.00 28.10  .    1    783
2
  ATOM  C  CA   GLN B  202  .  20.862  38.982  -7.067  1.00 27.32  .    1    784
2
  ATOM  C  C    GLN B  202  .  19.400  38.809  -6.641  1.00 26.22  .    1    785
2
  ATOM  O  O    GLN B  202  .  18.587  39.513  -7.229  1.00 26.63  .    1    786
2
  ATOM  C  CB   GLN B  202  .  21.525  40.238  -6.645  1.00 28.27  .    1    787
2
  ATOM  C  CG   GLN B  202  .  20.966  40.871  -5.400  1.00 30.16  .    1    788
2
  ATOM  C  CD   GLN B  202  .  21.878  41.939  -4.842  1.00 31.84  .    1    789
2
  ATOM  O  OE1  GLN B  202  .  21.391  42.830  -4.140  1.00 33.03  .    1    790
2
  ATOM  N  NE2  GLN B  202  .  23.183  41.824  -5.142  1.00 32.25  .    1    791
3
  ATOM  N  N    ILE B  203  .  19.137  37.885  -5.755  1.00 24.40  .    1    792
3
  ATOM  C  CA   ILE B  203  .  17.737  37.596  -5.313  1.00 23.03  .    1    793
3
  ATOM  C  C    ILE B  203  .  17.419  38.066  -3.906  1.00 21.89  .    1    794
3
  ATOM  O  O    ILE B  203  .  18.084  37.626  -2.939  1.00 21.85  .    1    795
3
  ATOM  C  CB   ILE B  203  .  17.551  36.037  -5.505  1.00 22.84  .    1    796
3
  ATOM  C  CG1  ILE B  203  .  18.002  35.739  -6.964  1.00 23.48  .    1    797
3
  ATOM  C  CG2  ILE B  203  .  16.159  35.498  -5.204  1.00 22.08  .    1    798
3
  ATOM  C  CD1  ILE B  203  .  17.850  34.295  -7.414  1.00 22.95  .    1    799
4
  ATOM  N  N    THR B  204  .  16.396  38.900  -3.752  1.00 20.13  .    1    800
4
  ATOM  C  CA   THR B  204  .  16.034  39.393  -2.396  1.00 19.14  .    1    801
4
  ATOM  C  C    THR B  204  .  15.115  38.389  -1.744  1.00 17.57  .    1    802
4
  ATOM  O  O    THR B  204  .  14.603  37.511  -2.471  1.00 17.37  .    1    803
4
  ATOM  C  CB   THR B  204  .  15.536  40.877  -2.463  1.00 20.82  .    1    804
4
  ATOM  O  OG1  THR B  204  .  14.332  40.941  -3.297  1.00 20.04  .    1    805
4
  ATOM  C  CG2  THR B  204  .  16.628  41.867  -2.921  1.00 21.68  .    1    806
5
  ATOM  N  N    LEU B  205  .  14.835  38.514  -0.466  1.00 16.00  .    1    807
5
  ATOM  C  CA   LEU B  205  .  14.010  37.486   0.217  1.00 14.43  .    1    808
5
  ATOM  C  C    LEU B  205  .  12.647  37.962   0.665  1.00 14.04  .    1    809
5
  ATOM  O  O    LEU B  205  .  11.961  37.329   1.520  1.00 13.29  .    1    810
5
  ATOM  C  CB   LEU B  205  .  14.949  36.877   1.274  1.00 13.36  .    1    811
5
  ATOM  C  CG   LEU B  205  .  16.253  36.219   0.724  1.00 13.75  .    1    812
5
  ATOM  C  CD1  LEU B  205  .  17.185  35.832   1.832  1.00 12.82  .    1    813
5
  ATOM  C  CD2  LEU B  205  .  15.822  34.972  -0.072  1.00 13.20  .    1    814
6
  ATOM  N  N    TRP B  206  .  12.111  38.971   0.032  1.00 14.10  .    1    815
6
  ATOM  C  CA   TRP B  206  .  10.807  39.547   0.342  1.00 14.92  .    1    816
6
  ATOM  C  C    TRP B  206  .   9.762  38.516  -0.038  1.00 15.89  .    1    817
6
  ATOM  O  O    TRP B  206  .   8.754  38.416   0.720  1.00 17.77  .    1    818
6
  ATOM  C  CB   TRP B  206  .  10.523  40.943  -0.216  1.00 14.22  .    1    819
6
  ATOM  C  CG   TRP B  206  .  11.561  41.900   0.314  1.00 12.89  .    1    820
6
  ATOM  C  CD1  TRP B  206  .  12.682  42.258  -0.409  1.00 11.66  .    1    821
6
  ATOM  C  CD2  TRP B  206  .  11.649  42.520   1.587  1.00 11.31  .    1    822
6
  ATOM  N  NE1  TRP B  206  .  13.443  43.125   0.355  1.00 11.48  .    1    823
6
  ATOM  C  CE2  TRP B  206  .  12.813  43.308   1.574  1.00 10.50  .    1    824
6
  ATOM  C  CE3  TRP B  206  .  10.831  42.561   2.698  1.00 12.24  .    1    825
6
  ATOM  C  CZ2  TRP B  206  .  13.237  44.046   2.668  1.00 11.72  .    1    826
6
  ATOM  C  CZ3  TRP B  206  .  11.228  43.316   3.815  1.00 11.02  .    1    827
6
  ATOM  C  CH2  TRP B  206  .  12.376  44.042   3.802  1.00 10.93  .    1    828
7
  ATOM  N  N    GLN B  207  .  10.078  37.767  -1.061  1.00 15.68  .    1    829
7
  ATOM  C  CA   GLN B  207  .   9.150  36.718  -1.554  1.00 16.07  .    1    830
7
  ATOM  C  C    GLN B  207  .   9.964  35.439  -1.615  1.00 15.53  .    1    831
7
  ATOM  O  O    GLN B  207  .  11.211  35.450  -1.656  1.00 14.83  .    1    832
7
  ATOM  C  CB   GLN B  207  .   8.582  37.193  -2.909  1.00 17.03  .    1    833
7
  ATOM  C  CG   GLN B  207  .   7.397  38.152  -2.854  1.00 18.67  .    1    834
7
  ATOM  C  CD   GLN B  207  .   6.709  38.327  -4.188  1.00 19.61  .    1    835
7
  ATOM  O  OE1  GLN B  207  .   7.117  37.808  -5.221  1.00 20.06  .    1    836
7
  ATOM  N  NE2  GLN B  207  .   5.586  39.087  -4.237  1.00 20.50  .    1    837
8
  ATOM  N  N    ARG B  208  .   9.324  34.288  -1.606  1.00 16.10  .    1    838
8
  ATOM  C  CA   ARG B  208  .  10.075  32.995  -1.649  1.00 14.66  .    1    839
8
  ATOM  C  C    ARG B  208  .  10.960  33.067  -2.853  1.00 12.96  .    1    840
8
  ATOM  O  O    ARG B  208  .  10.445  33.484  -3.877  1.00 12.61  .    1    841
8
  ATOM  C  CB   ARG B  208  .   9.175  31.754  -1.824  1.00 14.73  .    1    842
8
  ATOM  C  CG   ARG B  208  .   8.514  31.365  -0.503  1.00 16.71  .    1    843
8
  ATOM  C  CD   ARG B  208  .   7.554  30.240  -0.748  1.00 18.62  .    1    844
8
  ATOM  N  NE   ARG B  208  .   6.753  30.134   0.469  1.00 19.99  .    1    845
8
  ATOM  C  CZ   ARG B  208  .   5.699  29.364   0.564  1.00 21.32  .    1    846
8
  ATOM  N  NH1  ARG B  208  .   4.987  29.326   1.648  1.00 21.84  .    1    847
8
  ATOM  N  NH2  ARG B  208  .   5.340  28.608  -0.484  1.00 23.09  .    1    848
9
  ATOM  N  N    PRO B  209  .  12.230  32.687  -2.696  1.00 11.76  .    1    849
9
  ATOM  C  CA   PRO B  209  .  13.131  32.692  -3.869  1.00 11.36  .    1    850
9
  ATOM  C  C    PRO B  209  .  12.846  31.562  -4.845  1.00 13.69  .    1    851
9
  ATOM  O  O    PRO B  209  .  13.639  30.589  -5.001  1.00 11.92  .    1    852
9
  ATOM  C  CB   PRO B  209  .  14.491  32.568  -3.208  1.00 10.99  .    1    853
9
  ATOM  C  CG   PRO B  209  .  14.280  31.815  -1.930  1.00  9.34  .    1    854
9
  ATOM  C  CD   PRO B  209  .  12.888  32.257  -1.476  1.00 10.53  .    1    855
10
  ATOM  N  N    LEU B  210  .  11.822  31.668  -5.676  1.00 15.88  .    1    856
10
  ATOM  C  CA   LEU B  210  .  11.389  30.706  -6.670  1.00 17.99  .    1    857
10
  ATOM  C  C    LEU B  210  .  12.065  30.935  -8.022  1.00 18.86  .    1    858
10
  ATOM  O  O    LEU B  210  .  12.121  32.076  -8.515  1.00 20.01  .    1    859
10
  ATOM  C  CB   LEU B  210  .   9.871  30.630  -6.804  1.00 18.81  .    1    860
10
  ATOM  C  CG   LEU B  210  .   8.979  30.286  -5.649  1.00 20.32  .    1    861
10
  ATOM  C  CD1  LEU B  210  .   7.536  30.093  -6.071  1.00 20.54  .    1    862
10
  ATOM  C  CD2  LEU B  210  .   9.403  28.940  -5.015  1.00 20.28  .    1    863
11
  ATOM  N  N    VAL B  211  .  12.632  29.878  -8.582  1.00 18.52  .    1    864
11
  ATOM  C  CA   VAL B  211  .  13.269  29.966  -9.894  1.00 18.66  .    1    865
11
  ATOM  C  C    VAL B  211  .  12.676  28.837 -10.788  1.00 18.25  .    1    866
11
  ATOM  O  O    VAL B  211  .  12.126  27.865 -10.267  1.00 17.63  .    1    867
11
  ATOM  C  CB   VAL B  211  .  14.796  29.836  -9.889  1.00 18.60  .    1    868
11
  ATOM  C  CG1  VAL B  211  .  15.509  30.950  -9.176  1.00 19.07  .    1    869
11
  ATOM  C  CG2  VAL B  211  .  15.230  28.435  -9.524  1.00 18.25  .    1    870
12
  ATOM  N  N    THR B  212  .  12.899  29.007 -12.076  1.00 18.65   1   1    871
12
  ATOM  C  CA   THR B  212  .  12.460  28.034 -13.074  1.00 18.43   1   1    872
12
  ATOM  C  C    THR B  212  .  13.668  27.090 -13.279  1.00 18.32   1   1    873
12
  ATOM  O  O    THR B  212  .  14.812  27.553 -13.363  1.00 18.64   1   1    874
12
  ATOM  C  CB   THR B  212  .  11.988  28.665 -14.438  1.00 19.17   1   1    875
12
  ATOM  O  OG1  THR B  212  1  13.113  29.116 -15.195  0.50 19.88   1   1    876
12
  ATOM  O  OG1  THR B  212  2  10.937  29.628 -14.111  0.50 18.52   1   1    877
12
  ATOM  C  CG2  THR B  212  1  10.930  29.770 -14.245  0.50 19.06   1   1    878
12
  ATOM  C  CG2  THR B  212  2  11.555  27.649 -15.488  0.50 18.04   1   1    879
13
  ATOM  N  N    ILE B  213  .  13.400  25.814 -13.259  1.00 16.97  .    1    880
13
  ATOM  C  CA   ILE B  213  .  14.464  24.801 -13.460  1.00 16.98  .    1    881
13
  ATOM  C  C    ILE B  213  .  13.991  24.002 -14.650  1.00 17.70  .    1    882
13
  ATOM  O  O    ILE B  213  .  12.755  23.977 -14.853  1.00 18.70  .    1    883
13
  ATOM  C  CB   ILE B  213  .  14.717  23.947 -12.168  1.00 15.78  .    1    884
13
  ATOM  C  CG1  ILE B  213  .  13.483  23.058 -11.935  1.00 16.27  .    1    885
13
  ATOM  C  CG2  ILE B  213  .  15.162  24.849 -10.979  1.00 15.33  .    1    886
13
  ATOM  C  CD1  ILE B  213  .  13.492  21.966 -10.865  1.00 15.66  .    1    887
14
  ATOM  N  N    LYS B  214  .  14.889  23.451 -15.412  1.00 18.00  .    1    888
14
  ATOM  C  CA   LYS B  214  .  14.488  22.629 -16.588  1.00 18.63  .    1    889
14
  ATOM  C  C    LYS B  214  .  15.036  21.251 -16.254  1.00 19.19  .    1    890
14
  ATOM  O  O    LYS B  214  .  16.218  21.169 -15.946  1.00 17.28  .    1    891
14
  ATOM  C  CB   LYS B  214  .  15.135  23.125 -17.879  1.00 19.08  .    1    892
14
  ATOM  C  CG   LYS B  214  .  14.374  22.698 -19.149  1.00 19.71  .    1    893
14
  ATOM  C  CD   LYS B  214  .  14.826  23.556 -20.355  1.00 20.23  .    1    894
14
  ATOM  C  CE   LYS B  214  .  15.876  22.932 -21.212  1.00 21.45  .    1    895
14
  ATOM  N  NZ   LYS B  214  .  16.056  23.676 -22.526  1.00 22.99  .    1    896
15
  ATOM  N  N    ILE B  215  .  14.150  20.247 -16.252  1.00 20.47  .    1    897
15
  ATOM  C  CA   ILE B  215  .  14.640  18.875 -15.942  1.00 20.74  .    1    898
15
  ATOM  C  C    ILE B  215  .  13.826  17.976 -16.862  1.00 22.13  .    1    899
15
  ATOM  O  O    ILE B  215  .  12.612  18.178 -16.907  1.00 22.24  .    1    900
15
  ATOM  C  CB   ILE B  215  .  14.498  18.581 -14.409  1.00 19.80  .    1    901
15
  ATOM  C  CG1  ILE B  215  .  15.234  17.247 -14.112  1.00 19.36  .    1    902
15
  ATOM  C  CG2  ILE B  215  .  13.044  18.617 -13.944  1.00 19.32  .    1    903
15
  ATOM  C  CD1  ILE B  215  .  15.229  16.767 -12.642  1.00 19.24  .    1    904
16
  ATOM  N  N    GLY B  216  .  14.483  17.086 -17.581  1.00 22.96  .    1    905
16
  ATOM  C  CA   GLY B  216  .  13.842  16.204 -18.525  1.00 24.39  .    1    906
16
  ATOM  C  C    GLY B  216  .  13.107  16.993 -19.622  1.00 26.69  .    1    907
16
  ATOM  O  O    GLY B  216  .  12.109  16.472 -20.174  1.00 26.79  .    1    908
17
  ATOM  N  N    GLY B  217  .  13.636  18.146 -20.001  1.00 27.57  .    1    909
17
  ATOM  C  CA   GLY B  217  .  13.036  18.963 -21.067  1.00 28.41  .    1    910
17
  ATOM  C  C    GLY B  217  .  11.795  19.665 -20.557  1.00 28.91  .    1    911
17
  ATOM  O  O    GLY B  217  .  11.185  20.397 -21.360  1.00 30.64  .    1    912
18
  ATOM  N  N    GLN B  218  .  11.443  19.479 -19.305  1.00 28.23  .    1    913
18
  ATOM  C  CA   GLN B  218  .  10.298  20.088 -18.632  1.00 27.88  .    1    914
18
  ATOM  C  C    GLN B  218  .  10.706  21.288 -17.750  1.00 25.46  .    1    915
18
  ATOM  O  O    GLN B  218  .  11.799  21.229 -17.146  1.00 24.22  .    1    916
18
  ATOM  C  CB   GLN B  218  .   9.692  19.068 -17.637  1.00 30.51  .    1    917
18
  ATOM  C  CG   GLN B  218  .   8.507  18.271 -18.120  1.00 33.73  .    1    918
18
  ATOM  C  CD   GLN B  218  .   8.604  16.865 -17.522  1.00 35.64  .    1    919
18
  ATOM  O  OE1  GLN B  218  .   9.614  16.149 -17.726  1.00 36.79  .    1    920
18
  ATOM  N  NE2  GLN B  218  .   7.562  16.517 -16.766  1.00 36.20  .    1    921
19
  ATOM  N  N    LEU B  219  .   9.845  22.290 -17.656  1.00 22.27  .    1    922
19
  ATOM  C  CA   LEU B  219  .  10.090  23.467 -16.821  1.00 20.27  .    1    923
19
  ATOM  C  C    LEU B  219  .   9.311  23.205 -15.496  1.00 20.32  .    1    924
19
  ATOM  O  O    LEU B  219  .   8.191  22.682 -15.556  1.00 19.55  .    1    925
19
  ATOM  C  CB   LEU B  219  .   9.560  24.768 -17.422  1.00 20.41  .    1    926
19
  ATOM  C  CG   LEU B  219  .  10.083  25.303 -18.752  1.00 19.72  .    1    927
19
  ATOM  C  CD1  LEU B  219  .   9.481  26.661 -18.994  1.00 19.18  .    1    928
19
  ATOM  C  CD2  LEU B  219  .  11.610  25.444 -18.659  1.00 19.90  .    1    929
20
  ATOM  N  N    LYS B  220  .   9.927  23.586 -14.416  1.00 20.17  .    1    930
20
  ATOM  C  CA   LYS B  220  .   9.348  23.442 -13.057  1.00 20.08  .    1    931
20
  ATOM  C  C    LYS B  220  .   9.836  24.648 -12.245  1.00 19.24  .    1    932
20
  ATOM  O  O    LYS B  220  .  10.767  25.323 -12.673  1.00 18.36  .    1    933
20
  ATOM  C  CB   LYS B  220  .   9.919  22.175 -12.454  1.00 21.68  .    1    934
20
  ATOM  C  CG   LYS B  220  .   9.101  20.929 -12.485  1.00 23.92  .    1    935
20
  ATOM  C  CD   LYS B  220  .   9.363  19.996 -13.647  1.00 25.02  .    1    936
20
  ATOM  C  CE   LYS B  220  .   8.392  18.810 -13.535  1.00 26.34  .    1    937
20
  ATOM  N  NZ   LYS B  220  .   8.124  18.560 -12.073  1.00 27.86  .    1    938
21
  ATOM  N  N    GLU B  221  .   9.171  24.948 -11.152  1.00 19.23  .    1    939
21
  ATOM  C  CA   GLU B  221  .   9.509  26.001 -10.219  1.00 19.16  .    1    940
21
  ATOM  C  C    GLU B  221  .  10.157  25.266  -9.017  1.00 17.43  .    1    941
21
  ATOM  O  O    GLU B  221  .   9.605  24.226  -8.643  1.00 16.74  .    1    942
21
  ATOM  C  CB   GLU B  221  .   8.316  26.716  -9.550  1.00 21.09  .    1    943
21
  ATOM  C  CG   GLU B  221  .   7.594  27.690 -10.515  1.00 24.39  .    1    944
21
  ATOM  C  CD   GLU B  221  .   8.543  28.769 -10.970  1.00 26.17  .    1    945
21
  ATOM  O  OE1  GLU B  221  .   9.351  28.566 -11.864  1.00 27.54  .    1    946
21
  ATOM  O  OE2  GLU B  221  .   8.430  29.812 -10.265  1.00 27.82  .    1    947
22
  ATOM  N  N    ALA B  222  .  11.215  25.876  -8.516  1.00 14.87  .    1    948
22
  ATOM  C  CA   ALA B  222  .  11.895  25.302  -7.362  1.00 12.88  .    1    949
22
  ATOM  C  C    ALA B  222  .  12.407  26.457  -6.504  1.00 12.44  .    1    950
22
  ATOM  O  O    ALA B  222  .  12.680  27.614  -6.992  1.00 11.81  .    1    951
22
  ATOM  C  CB   ALA B  222  .  12.998  24.354  -7.789  1.00 13.41  .    1    952
23
  ATOM  N  N    LEU B  223  .  12.482  26.172  -5.266  1.00 11.61  .    1    953
23
  ATOM  C  CA   LEU B  223  .  12.932  27.168  -4.244  1.00 12.98  .    1    954
23
  ATOM  C  C    LEU B  223  .  14.425  27.068  -4.046  1.00 13.35  .    1    955
23
  ATOM  O  O    LEU B  223  .  14.860  25.935  -3.770  1.00 12.42  .    1    956
23
  ATOM  C  CB   LEU B  223  .  12.156  26.704  -3.015  1.00 13.42  .    1    957
23
  ATOM  C  CG   LEU B  223  .  12.344  27.532  -1.708  1.00 13.46  .    1    958
23
  ATOM  C  CD1  LEU B  223  .  11.618  28.824  -2.006  1.00 13.71  .    1    959
23
  ATOM  C  CD2  LEU B  223  .  11.703  26.685  -0.606  1.00 12.60  .    1    960
24
  ATOM  N  N    LEU B  224  .  15.171  28.146  -4.047  1.00 13.82  .    1    961
24
  ATOM  C  CA   LEU B  224  .  16.640  28.062  -3.746  1.00 13.15  .    1    962
24
  ATOM  C  C    LEU B  224  .  16.644  28.047  -2.207  1.00 12.92  .    1    963
24
  ATOM  O  O    LEU B  224  .  16.144  29.031  -1.617  1.00 12.71  .    1    964
24
  ATOM  C  CB   LEU B  224  .  17.300  29.273  -4.370  1.00 13.13  .    1    965
24
  ATOM  C  CG   LEU B  224  .  17.099  29.515  -5.843  1.00 12.82  .    1    966
24
  ATOM  C  CD1  LEU B  224  .  18.017  30.661  -6.308  1.00 12.87  .    1    967
24
  ATOM  C  CD2  LEU B  224  .  17.522  28.289  -6.648  1.00 12.61  .    1    968
25
  ATOM  N  N    ASP B  225  .  17.138  26.957  -1.644  1.00 12.29  .    1    969
25
  ATOM  C  CA   ASP B  225  .  17.028  26.757  -0.186  1.00 10.63  .    1    970
25
  ATOM  C  C    ASP B  225  .  18.335  26.462   0.516  1.00 10.88  .    1    971
25
  ATOM  O  O    ASP B  225  .  18.862  25.324   0.540  1.00 10.12  .    1    972
25
  ATOM  C  CB   ASP B  225  .  16.000  25.578  -0.112  1.00 10.02  .    1    973
25
  ATOM  C  CG   ASP B  225  .  15.636  25.146   1.261  1.00 10.19  .    1    974
25
  ATOM  O  OD1  ASP B  225  .  14.859  24.226   1.439  1.00 11.51  .    1    975
25
  ATOM  O  OD2  ASP B  225  .  16.074  25.707   2.313  1.00 11.85  .    1    976
26
  ATOM  N  N    THR B  226  .  18.901  27.537   1.119  1.00  9.70  .    1    977
26
  ATOM  C  CA   THR B  226  .  20.187  27.411   1.776  1.00  9.48  .    1    978
26
  ATOM  C  C    THR B  226  .  20.064  26.533   3.008  1.00 10.16  .    1    979
26
  ATOM  O  O    THR B  226  .  21.096  26.091   3.567  1.00 10.52  .    1    980
26
  ATOM  C  CB   THR B  226  .  20.756  28.855   2.050  1.00 10.00  .    1    981
26
  ATOM  O  OG1  THR B  226  .  19.822  29.428   3.015  1.00 10.82  .    1    982
26
  ATOM  C  CG2  THR B  226  .  20.860  29.748   0.800  1.00 11.10  .    1    983
27
  ATOM  N  N    GLY B  227  .  18.841  26.281   3.447  1.00 10.32  .    1    984
27
  ATOM  C  CA   GLY B  227  .  18.755  25.434   4.684  1.00 11.07  .    1    985
27
  ATOM  C  C    GLY B  227  .  18.623  23.976   4.250  1.00 11.53  .    1    986
27
  ATOM  O  O    GLY B  227  .  18.305  23.174   5.159  1.00 12.04  .    1    987
28
  ATOM  N  N    ALA B  228  .  18.829  23.644   2.976  1.00  9.71  .    1    988
28
  ATOM  C  CA   ALA B  228  .  18.737  22.270   2.524  1.00  9.37  .    1    989
28
  ATOM  C  C    ALA B  228  .  20.055  21.750   2.021  1.00  8.93  .    1    990
28
  ATOM  O  O    ALA B  228  .  20.654  22.291   1.065  1.00  8.60  .    1    991
28
  ATOM  C  CB   ALA B  228  .  17.616  22.063   1.461  1.00 10.17  .    1    992
29
  ATOM  N  N    ASP B  229  .  20.547  20.710   2.650  1.00  8.57  .    1    993
29
  ATOM  C  CA   ASP B  229  .  21.787  20.051   2.249  1.00  8.62  .    1    994
29
  ATOM  C  C    ASP B  229  .  21.599  19.509   0.813  1.00  8.27  .    1    995
29
  ATOM  O  O    ASP B  229  .  22.458  19.586  -0.022  1.00  7.50  .    1    996
29
  ATOM  C  CB   ASP B  229  .  21.955  18.810   3.180  1.00  9.42  .    1    997
29
  ATOM  C  CG   ASP B  229  .  22.379  19.158   4.606  1.00 10.36  .    1    998
29
  ATOM  O  OD1  ASP B  229  .  22.414  18.316   5.493  1.00 10.60  .    1    999
29
  ATOM  O  OD2  ASP B  229  .  22.653  20.335   4.852  1.00 10.95  .    1   1000
30
  ATOM  N  N    ASP B  230  .  20.445  18.898   0.631  1.00  8.69   1   1   1001
30
  ATOM  C  CA   ASP B  230  .  20.149  18.183  -0.639  1.00  9.49   1   1   1002
30
  ATOM  C  C    ASP B  230  .  19.095  18.810  -1.488  1.00  9.59   1   1   1003
30
  ATOM  O  O    ASP B  230  .  18.247  19.566  -0.958  1.00  9.71   1   1   1004
30
  ATOM  C  CB   ASP B  230  .  19.583  16.803  -0.113  1.00 11.77   1   1   1005
30
  ATOM  C  CG   ASP B  230  .  20.653  16.028   0.702  1.00 13.11   1   1   1006
30
  ATOM  O  OD1  ASP B  230  1  20.502  14.997   1.337  0.58 13.58   1   1   1007
30
  ATOM  O  OD1  ASP B  230  2  20.376  15.965   1.923  0.42 12.43   1   1   1008
30
  ATOM  O  OD2  ASP B  230  1  21.798  16.553   0.642  0.58 12.99   1   1   1009
30
  ATOM  O  OD2  ASP B  230  2  21.575  15.546   0.038  0.42 12.43   1   1   1010
31
  ATOM  N  N    THR B  231  .  18.959  18.341  -2.730  1.00  8.90  .    1   1011
31
  ATOM  C  CA   THR B  231  .  17.934  18.812  -3.659  1.00  8.91  .    1   1012
31
  ATOM  C  C    THR B  231  .  16.807  17.738  -3.632  1.00  9.78  .    1   1013
31
  ATOM  O  O    THR B  231  .  17.078  16.573  -3.914  1.00  8.24  .    1   1014
31
  ATOM  C  CB   THR B  231  .  18.524  19.049  -5.064  1.00  9.63  .    1   1015
31
  ATOM  O  OG1  THR B  231  .  19.275  20.351  -5.094  1.00 10.03  .    1   1016
31
  ATOM  C  CG2  THR B  231  .  17.491  18.929  -6.211  1.00  8.58  .    1   1017
32
  ATOM  N  N    VAL B  232  .  15.592  18.119  -3.347  1.00 11.27  .    1   1018
32
  ATOM  C  CA   VAL B  232  .  14.395  17.271  -3.278  1.00 12.42  .    1   1019
32
  ATOM  C  C    VAL B  232  .  13.330  17.852  -4.231  1.00 13.19  .    1   1020
32
  ATOM  O  O    VAL B  232  .  12.879  18.955  -4.040  1.00 13.59  .    1   1021
32
  ATOM  C  CB   VAL B  232  .  13.746  17.284  -1.866  1.00 12.85  .    1   1022
32
  ATOM  C  CG1  VAL B  232  .  12.670  16.159  -1.762  1.00 14.07  .    1   1023
32
  ATOM  C  CG2  VAL B  232  .  14.752  17.156  -0.760  1.00 12.65  .    1   1024
33
  ATOM  N  N    LEU B  233  .  12.878  17.057  -5.142  1.00 13.18  .    1   1025
33
  ATOM  C  CA   LEU B  233  .  11.882  17.355  -6.116  1.00 14.62  .    1   1026
33
  ATOM  C  C    LEU B  233  .  10.633  16.494  -5.820  1.00 16.04  .    1   1027
33
  ATOM  O  O    LEU B  233  .  10.727  15.393  -5.265  1.00 15.99  .    1   1028
33
  ATOM  C  CB   LEU B  233  .  12.439  17.185  -7.556  1.00 11.16  .    1   1029
33
  ATOM  C  CG   LEU B  233  .  13.620  18.107  -7.869  1.00 12.21  .    1   1030
33
  ATOM  C  CD1  LEU B  233  .  14.106  17.738  -9.310  1.00 12.13  .    1   1031
33
  ATOM  C  CD2  LEU B  233  .  13.197  19.545  -7.895  1.00 10.20  .    1   1032
34
  ATOM  N  N    GLU B  234  .   9.503  17.116  -6.158  1.00 17.88  .    1   1033
34
  ATOM  C  CA   GLU B  234  .   8.221  16.368  -5.973  1.00 20.33  .    1   1034
34
  ATOM  C  C    GLU B  234  .   8.250  15.179  -6.937  1.00 21.59  .    1   1035
34
  ATOM  O  O    GLU B  234  .   8.890  15.244  -7.982  1.00 21.60  .    1   1036
34
  ATOM  C  CB   GLU B  234  .   7.052  17.262  -6.329  1.00 20.42  .    1   1037
34
  ATOM  C  CG   GLU B  234  .   6.873  18.500  -5.404  1.00 21.66  .    1   1038
34
  ATOM  C  CD   GLU B  234  .   6.198  19.616  -6.142  1.00 22.47  .    1   1039
34
  ATOM  O  OE1  GLU B  234  .   6.081  20.735  -5.723  1.00 23.38  .    1   1040
34
  ATOM  O  OE2  GLU B  234  .   5.730  19.245  -7.239  1.00 23.36  .    1   1041
35
  ATOM  N  N    GLU B  235  .   7.473  14.156  -6.600  1.00 24.47  .    1   1042
35
  ATOM  C  CA   GLU B  235  .   7.358  12.951  -7.398  1.00 27.56  .    1   1043
35
  ATOM  C  C    GLU B  235  .   7.404  13.236  -8.898  1.00 28.95  .    1   1044
35
  ATOM  O  O    GLU B  235  .   6.652  14.081  -9.431  1.00 29.07  .    1   1045
35
  ATOM  C  CB   GLU B  235  .   6.162  12.062  -7.066  1.00 28.48  .    1   1046
35
  ATOM  C  CG   GLU B  235  .   6.058  10.837  -7.980  1.00 29.93  .    1   1047
35
  ATOM  C  CD   GLU B  235  .   7.214   9.878  -8.006  1.00 31.33  .    1   1048
35
  ATOM  O  OE1  GLU B  235  .   7.694   9.338  -9.016  1.00 31.90  .    1   1049
35
  ATOM  O  OE2  GLU B  235  .   7.663   9.617  -6.848  1.00 32.36  .    1   1050
36
  ATOM  N  N    MET B  236  .   8.336  12.539  -9.558  1.00 30.54  .    1   1051
36
  ATOM  C  CA   MET B  236  .   8.524  12.673 -11.000  1.00 32.11  .    1   1052
36
  ATOM  C  C    MET B  236  .   9.283  11.479 -11.571  1.00 32.90  .    1   1053
36
  ATOM  O  O    MET B  236  .  10.003  10.758 -10.855  1.00 33.68  .    1   1054
36
  ATOM  C  CB   MET B  236  .   9.161  13.997 -11.321  1.00 33.77  .    1   1055
36
  ATOM  C  CG   MET B  236  .  10.504  14.203 -10.670  1.00 34.59  .    1   1056
36
  ATOM  S  SD   MET B  236  .  11.206  15.673 -11.543  1.00 36.50  .    1   1057
36
  ATOM  C  CE   MET B  236  .  10.851  15.214 -13.269  1.00 35.75  .    1   1058
37
  ATOM  N  N    ASN B  237  .   9.076  11.239 -12.858  1.00 33.22  .    1   1059
37
  ATOM  C  CA   ASN B  237  .   9.756  10.098 -13.501  1.00 33.78  .    1   1060
37
  ATOM  C  C    ASN B  237  .  11.217  10.491 -13.755  1.00 33.11  .    1   1061
37
  ATOM  O  O    ASN B  237  .  11.463  11.455 -14.517  1.00 33.65  .    1   1062
37
  ATOM  C  CB   ASN B  237  .   9.012   9.618 -14.736  1.00 34.94  .    1   1063
37
  ATOM  C  CG   ASN B  237  .   7.776   8.801 -14.413  1.00 36.48  .    1   1064
37
  ATOM  O  OD1  ASN B  237  .   6.675   9.033 -14.983  1.00 37.12  .    1   1065
37
  ATOM  N  ND2  ASN B  237  .   7.900   7.832 -13.493  1.00 36.95  .    1   1066
38
  ATOM  N  N    LEU B  238  .  12.139   9.769 -13.118  1.00 31.15  .    1   1067
38
  ATOM  C  CA   LEU B  238  .  13.572  10.088 -13.416  1.00 29.89  .    1   1068
38
  ATOM  C  C    LEU B  238  .  14.179   8.800 -13.971  1.00 29.56  .    1   1069
38
  ATOM  O  O    LEU B  238  .  13.666   7.700 -13.664  1.00 30.22  .    1   1070
38
  ATOM  C  CB   LEU B  238  .  14.238  10.708 -12.206  1.00 28.98  .    1   1071
38
  ATOM  C  CG   LEU B  238  .  14.086  12.200 -11.964  1.00 27.58  .    1   1072
38
  ATOM  C  CD1  LEU B  238  .  15.031  12.674 -10.865  1.00 27.41  .    1   1073
38
  ATOM  C  CD2  LEU B  238  .  14.431  12.964 -13.236  1.00 26.95  .    1   1074
39
  ATOM  N  N    PRO B  239  .  15.240   8.951 -14.724  1.00 29.03  .    1   1075
39
  ATOM  C  CA   PRO B  239  .  15.951   7.839 -15.346  1.00 28.01  .    1   1076
39
  ATOM  C  C    PRO B  239  .  17.024   7.210 -14.480  1.00 26.54  .    1   1077
39
  ATOM  O  O    PRO B  239  .  17.819   7.869 -13.745  1.00 26.79  .    1   1078
39
  ATOM  C  CB   PRO B  239  .  16.575   8.519 -16.585  1.00 28.49  .    1   1079
39
  ATOM  C  CG   PRO B  239  .  17.090   9.826 -15.956  1.00 29.47  .    1   1080
39
  ATOM  C  CD   PRO B  239  .  15.836  10.260 -15.142  1.00 29.65  .    1   1081
40
  ATOM  N  N    GLY B  240  .  17.005   5.890 -14.565  1.00 24.63  .    1   1082
40
  ATOM  C  CA   GLY B  240  .  17.977   5.014 -13.892  1.00 22.81  .    1   1083
40
  ATOM  C  C    GLY B  240  .  17.491   4.419 -12.578  1.00 20.00  .    1   1084
40
  ATOM  O  O    GLY B  240  .  16.327   4.500 -12.227  1.00 21.51  .    1   1085
41
  ATOM  N  N    ARG B  241  .  18.420   3.862 -11.837  1.00 17.79  .    1   1086
41
  ATOM  C  CA   ARG B  241  .  18.171   3.241 -10.546  1.00 16.46  .    1   1087
41
  ATOM  C  C    ARG B  241  .  18.212   4.316  -9.471  1.00 15.49  .    1   1088
41
  ATOM  O  O    ARG B  241  .  19.011   5.300  -9.524  1.00 14.79  .    1   1089
41
  ATOM  C  CB   ARG B  241  .  19.294   2.216 -10.231  1.00 14.89  .    1   1090
41
  ATOM  C  CG   ARG B  241  .  19.185   1.034 -11.184  1.00 15.05  .    1   1091
41
  ATOM  C  CD   ARG B  241  .  20.138  -0.068 -10.941  1.00 14.37  .    1   1092
41
  ATOM  N  NE   ARG B  241  .  20.010  -0.634  -9.611  1.00 14.29  .    1   1093
41
  ATOM  C  CZ   ARG B  241  .  19.075  -1.553  -9.253  1.00 13.24  .    1   1094
41
  ATOM  N  NH1  ARG B  241  .  18.172  -1.959 -10.137  1.00 12.04  .    1   1095
41
  ATOM  N  NH2  ARG B  241  .  19.175  -2.022  -7.982  1.00 12.83  .    1   1096
42
  ATOM  N  N    TRP B  242  .  17.483   4.053  -8.438  1.00 14.92  .    1   1097
42
  ATOM  C  CA   TRP B  242  .  17.463   4.984  -7.284  1.00 14.29  .    1   1098
42
  ATOM  C  C    TRP B  242  .  17.920   4.123  -6.111  1.00 14.85  .    1   1099
42
  ATOM  O  O    TRP B  242  .  17.939   2.898  -6.265  1.00 14.31  .    1   1100
42
  ATOM  C  CB   TRP B  242  .  16.152   5.628  -7.071  1.00 13.41  .    1   1101
42
  ATOM  C  CG   TRP B  242  .  15.037   4.637  -6.880  1.00 12.84  .    1   1102
42
  ATOM  C  CD1  TRP B  242  .  14.328   4.017  -7.851  1.00 12.87  .    1   1103
42
  ATOM  C  CD2  TRP B  242  .  14.551   4.167  -5.629  1.00 13.04  .    1   1104
42
  ATOM  N  NE1  TRP B  242  .  13.350   3.217  -7.273  1.00 12.76  .    1   1105
42
  ATOM  C  CE2  TRP B  242  .  13.483   3.291  -5.900  1.00 12.22  .    1   1106
42
  ATOM  C  CE3  TRP B  242  .  14.908   4.469  -4.298  1.00 12.97  .    1   1107
42
  ATOM  C  CZ2  TRP B  242  .  12.767   2.647  -4.924  1.00 12.03  .    1   1108
42
  ATOM  C  CZ3  TRP B  242  .  14.150   3.812  -3.307  1.00 12.68  .    1   1109
42
  ATOM  C  CH2  TRP B  242  .  13.125   2.935  -3.622  1.00 13.12  .    1   1110
43
  ATOM  N  N    LYS B  243  .  18.374   4.868  -5.109  1.00 15.31   1   1   1111
43
  ATOM  C  CA   LYS B  243  .  18.822   4.148  -3.878  1.00 16.51   1   1   1112
43
  ATOM  C  C    LYS B  243  .  18.062   4.841  -2.773  1.00 15.58   1   1   1113
43
  ATOM  O  O    LYS B  243  .  17.592   5.948  -3.034  1.00 15.50   1   1   1114
43
  ATOM  C  CB   LYS B  243  .  20.288   3.951  -3.805  1.00 17.70   1   1   1115
43
  ATOM  C  CG   LYS B  243  .  21.189   5.181  -3.688  1.00 19.39   1   1   1116
43
  ATOM  C  CD   LYS B  243  .  22.530   4.731  -3.032  1.00 19.84   1   1   1117
43
  ATOM  C  CE   LYS B  243  .  23.695   5.564  -3.545  1.00 20.55   1   1   1118
43
  ATOM  N  NZ   LYS B  243  1  24.948   5.121  -2.852  0.50 19.45   1   1   1119
43
  ATOM  N  NZ   LYS B  243  2  23.379   6.057  -4.932  0.50 20.59   1   1   1120
44
  ATOM  N  N    PRO B  244  .  17.846   4.187  -1.657  1.00 15.77  .    1   1121
44
  ATOM  C  CA   PRO B  244  .  17.101   4.691  -0.524  1.00 16.56  .    1   1122
44
  ATOM  C  C    PRO B  244  .  17.863   5.756   0.265  1.00 16.65  .    1   1123
44
  ATOM  O  O    PRO B  244  .  19.071   5.653   0.383  1.00 16.88  .    1   1124
44
  ATOM  C  CB   PRO B  244  .  16.893   3.483   0.410  1.00 16.03  .    1   1125
44
  ATOM  C  CG   PRO B  244  .  17.387   2.330  -0.356  1.00 15.96  .    1   1126
44
  ATOM  C  CD   PRO B  244  .  18.402   2.847  -1.352  1.00 16.21  .    1   1127
45
  ATOM  N  N    LYS B  245  .  17.154   6.765   0.770  1.00 16.41  .    1   1128
45
  ATOM  C  CA   LYS B  245  .  17.784   7.822   1.533  1.00 17.09  .    1   1129
45
  ATOM  C  C    LYS B  245  .  16.742   8.396   2.493  1.00 18.19  .    1   1130
45
  ATOM  O  O    LYS B  245  .  15.546   8.523   2.062  1.00 17.70  .    1   1131
45
  ATOM  C  CB   LYS B  245  .  18.368   8.973   0.647  1.00 16.44  .    1   1132
45
  ATOM  C  CG   LYS B  245  .  19.286   9.744   1.651  1.00 18.48  .    1   1133
45
  ATOM  C  CD   LYS B  245  .  19.909  11.027   1.197  1.00 19.04  .    1   1134
45
  ATOM  C  CE   LYS B  245  .  20.999  11.496   2.130  1.00 20.75  .    1   1135
45
  ATOM  N  NZ   LYS B  245  .  21.724  12.659   1.493  1.00 23.21  .    1   1136
46
  ATOM  N  N    MET B  246  .  17.143   8.623   3.692  1.00 19.94  .    1   1137
46
  ATOM  C  CA   MET B  246  .  16.269   9.176   4.751  1.00 22.49  .    1   1138
46
  ATOM  C  C    MET B  246  .  16.710  10.630   4.931  1.00 21.38  .    1   1139
46
  ATOM  O  O    MET B  246  .  17.890  10.888   4.935  1.00 21.59  .    1   1140
46
  ATOM  C  CB   MET B  246  .  16.383   8.414   6.060  1.00 25.10  .    1   1141
46
  ATOM  C  CG   MET B  246  .  15.587   7.110   5.965  1.00 28.88  .    1   1142
46
  ATOM  S  SD   MET B  246  .  13.990   7.442   6.842  1.00 32.57  .    1   1143
46
  ATOM  C  CE   MET B  246  .  14.728   8.234   8.327  1.00 31.58  .    1   1144
47
  ATOM  N  N    ILE B  247  .  15.760  11.539   5.075  1.00 21.28  .    1   1145
47
  ATOM  C  CA   ILE B  247  .  16.100  12.945   5.281  1.00 20.68  .    1   1146
47
  ATOM  C  C    ILE B  247  .  15.253  13.474   6.440  1.00 20.02  .    1   1147
47
  ATOM  O  O    ILE B  247  .  14.170  12.909   6.704  1.00 20.17  .    1   1148
47
  ATOM  C  CB   ILE B  247  .  15.954  13.735   3.939  1.00 21.20  .    1   1149
47
  ATOM  C  CG1  ILE B  247  .  14.588  13.397   3.269  1.00 22.11  .    1   1150
47
  ATOM  C  CG2  ILE B  247  .  17.126  13.548   2.957  1.00 21.36  .    1   1151
47
  ATOM  C  CD1  ILE B  247  .  14.268  14.370   2.084  1.00 22.26  .    1   1152
48
  ATOM  N  N    GLY B  248  .  15.783  14.466   7.121  1.00 18.73  .    1   1153
48
  ATOM  C  CA   GLY B  248  .  15.032  15.081   8.283  1.00 16.98  .    1   1154
48
  ATOM  C  C    GLY B  248  .  14.544  16.447   7.834  1.00 16.38  .    1   1155
48
  ATOM  O  O    GLY B  248  .  15.113  17.140   6.978  1.00 15.44  .    1   1156
49
  ATOM  N  N    GLY B  249  .  13.431  16.887   8.366  1.00 17.22  .    1   1157
49
  ATOM  C  CA   GLY B  249  .  12.815  18.171   8.034  1.00 17.30  .    1   1158
49
  ATOM  C  C    GLY B  249  .  12.286  18.713   9.329  1.00 17.67  .    1   1159
49
  ATOM  O  O    GLY B  249  .  12.601  18.204  10.381  1.00 16.65  .    1   1160
50
  ATOM  N  N    ILE B  250  .  11.471  19.742   9.163  1.00 19.83  .    1   1161
50
  ATOM  C  CA   ILE B  250  .  10.869  20.371  10.365  1.00 21.64  .    1   1162
50
  ATOM  C  C    ILE B  250  .   9.932  19.374  11.020  1.00 22.22  .    1   1163
50
  ATOM  O  O    ILE B  250  .   9.870  19.328  12.262  1.00 22.01  .    1   1164
50
  ATOM  C  CB   ILE B  250  .  10.231  21.752  10.004  1.00 22.04  .    1   1165
50
  ATOM  C  CG1  ILE B  250  .  10.048  22.624  11.280  1.00 22.17  .    1   1166
50
  ATOM  C  CG2  ILE B  250  .   8.930  21.652   9.194  1.00 22.11  .    1   1167
50
  ATOM  C  CD1  ILE B  250  .  11.294  23.536  11.543  1.00 22.68  .    1   1168
51
  ATOM  N  N    GLY B  251  .   9.241  18.579  10.216  1.00 23.14  .    1   1169
51
  ATOM  C  CA   GLY B  251  .   8.255  17.617  10.767  1.00 23.28  .    1   1170
51
  ATOM  C  C    GLY B  251  .   8.788  16.294  11.219  1.00 24.12  .    1   1171
51
  ATOM  O  O    GLY B  251  .   8.123  15.648  12.053  1.00 24.99  .    1   1172
52
  ATOM  N  N    GLY B  252  .   9.940  15.848  10.796  1.00 24.16  .    1   1173
52
  ATOM  C  CA   GLY B  252  .  10.531  14.558  11.158  1.00 24.63  .    1   1174
52
  ATOM  C  C    GLY B  252  .  11.304  14.051   9.911  1.00 24.44  .    1   1175
52
  ATOM  O  O    GLY B  252  .  11.593  14.883   9.071  1.00 23.43  .    1   1176
53
  ATOM  N  N    PHE B  253  .  11.550  12.787   9.862  1.00 24.31  .    1   1177
53
  ATOM  C  CA   PHE B  253  .  12.257  12.066   8.788  1.00 24.61  .    1   1178
53
  ATOM  C  C    PHE B  253  .  11.291  11.436   7.808  1.00 25.17  .    1   1179
53
  ATOM  O  O    PHE B  253  .  10.175  11.091   8.242  1.00 26.28  .    1   1180
53
  ATOM  C  CB   PHE B  253  .  13.140  11.001   9.502  1.00 24.47  .    1   1181
53
  ATOM  C  CG   PHE B  253  .  14.174  11.712  10.355  1.00 24.73  .    1   1182
53
  ATOM  C  CD1  PHE B  253  .  15.420  11.998   9.807  1.00 25.09  .    1   1183
53
  ATOM  C  CD2  PHE B  253  .  13.862  12.116  11.647  1.00 25.13  .    1   1184
53
  ATOM  C  CE1  PHE B  253  .  16.392  12.634  10.570  1.00 25.43  .    1   1185
53
  ATOM  C  CE2  PHE B  253  .  14.814  12.792  12.438  1.00 25.01  .    1   1186
53
  ATOM  C  CZ   PHE B  253  .  16.085  13.066  11.886  1.00 25.03  .    1   1187
54
  ATOM  N  N    ILE B  254  .  11.598  11.360   6.541  1.00 24.67  .    1   1188
54
  ATOM  C  CA   ILE B  254  .  10.842  10.772   5.457  1.00 24.30  .    1   1189
54
  ATOM  C  C    ILE B  254  .  11.861   9.951   4.620  1.00 24.02  .    1   1190
54
  ATOM  O  O    ILE B  254  .  13.044  10.231   4.718  1.00 23.79  .    1   1191
54
  ATOM  C  CB   ILE B  254  .  10.066  11.730   4.497  1.00 24.51  .    1   1192
54
  ATOM  C  CG1  ILE B  254  .  11.030  12.418   3.538  1.00 24.69  .    1   1193
54
  ATOM  C  CG2  ILE B  254  .   9.171  12.719   5.288  1.00 25.55  .    1   1194
54
  ATOM  C  CD1  ILE B  254  .  10.648  13.634   2.671  1.00 24.41  .    1   1195
55
  ATOM  N  N    LYS B  255  .  11.331   9.038   3.822  1.00 24.57  .    1   1196
55
  ATOM  C  CA   LYS B  255  .  12.159   8.207   2.952  1.00 24.55  .    1   1197
55
  ATOM  C  C    LYS B  255  .  12.047   8.823   1.573  1.00 23.30  .    1   1198
55
  ATOM  O  O    LYS B  255  .  10.951   9.303   1.264  1.00 23.55  .    1   1199
55
  ATOM  C  CB   LYS B  255  .  11.618   6.792   2.936  1.00 26.67  .    1   1200
55
  ATOM  C  CG   LYS B  255  .  11.870   5.950   4.180  1.00 28.38  .    1   1201
55
  ATOM  C  CD   LYS B  255  .  13.299   5.572   4.418  1.00 29.89  .    1   1202
55
  ATOM  C  CE   LYS B  255  .  14.015   5.131   3.124  1.00 30.32  .    1   1203
55
  ATOM  N  NZ   LYS B  255  .  15.473   4.931   3.512  1.00 30.18  .    1   1204
56
  ATOM  N  N    VAL B  256  .  13.080   8.878   0.800  1.00 22.29  .    1   1205
56
  ATOM  C  CA   VAL B  256  .  13.059   9.460  -0.552  1.00 21.21  .    1   1206
56
  ATOM  C  C    VAL B  256  .  13.857   8.500  -1.423  1.00 20.62  .    1   1207
56
  ATOM  O  O    VAL B  256  .  14.578   7.666  -0.876  1.00 20.28  .    1   1208
56
  ATOM  C  CB   VAL B  256  .  13.673  10.863  -0.552  1.00 21.76  .    1   1209
56
  ATOM  C  CG1  VAL B  256  .  12.797  11.866   0.214  1.00 22.29  .    1   1210
56
  ATOM  C  CG2  VAL B  256  .  15.070  10.839   0.068  1.00 21.45  .    1   1211
57
  ATOM  N  N    ARG B  257  .  13.692   8.668  -2.695  1.00 20.68  .    1   1212
57
  ATOM  C  CA   ARG B  257  .  14.435   7.876  -3.695  1.00 21.06  .    1   1213
57
  ATOM  C  C    ARG B  257  .  15.582   8.790  -4.164  1.00 20.14  .    1   1214
57
  ATOM  O  O    ARG B  257  .  15.323   9.968  -4.522  1.00 20.19  .    1   1215
57
  ATOM  C  CB   ARG B  257  .  13.570   7.464  -4.885  1.00 22.31  .    1   1216
57
  ATOM  C  CG   ARG B  257  .  12.240   6.868  -4.508  1.00 24.66  .    1   1217
57
  ATOM  C  CD   ARG B  257  .  11.624   6.135  -5.635  1.00 27.52  .    1   1218
57
  ATOM  N  NE   ARG B  257  .  11.509   6.903  -6.866  1.00 29.92  .    1   1219
57
  ATOM  C  CZ   ARG B  257  .  10.486   7.793  -6.955  1.00 31.87  .    1   1220
57
  ATOM  N  NH1  ARG B  257  .   9.698   8.052  -5.908  1.00 32.21  .    1   1221
57
  ATOM  N  NH2  ARG B  257  .  10.201   8.381  -8.128  1.00 32.60  .    1   1222
58
  ATOM  N  N    GLN B  258  .  16.776   8.255  -4.205  1.00 18.27  .    1   1223
58
  ATOM  C  CA   GLN B  258  .  17.943   9.039  -4.652  1.00 17.43  .    1   1224
58
  ATOM  C  C    GLN B  258  .  18.445   8.686  -6.016  1.00 17.65  .    1   1225
58
  ATOM  O  O    GLN B  258  .  18.758   7.546  -6.318  1.00 19.10  .    1   1226
58
  ATOM  C  CB   GLN B  258  .  19.102   8.830  -3.625  1.00 17.80  .    1   1227
58
  ATOM  C  CG   GLN B  258  .  20.422   9.349  -4.152  1.00 17.88  .    1   1228
58
  ATOM  C  CD   GLN B  258  .  21.542   9.223  -3.171  1.00 17.72  .    1   1229
58
  ATOM  O  OE1  GLN B  258  .  21.341   9.055  -1.985  1.00 18.79  .    1   1230
58
  ATOM  N  NE2  GLN B  258  .  22.785   9.326  -3.656  1.00 18.63  .    1   1231
59
  ATOM  N  N    TYR B  259  .  18.577   9.644  -6.909  1.00 17.89  .    1   1232
59
  ATOM  C  CA   TYR B  259  .  19.089   9.511  -8.252  1.00 17.86  .    1   1233
59
  ATOM  C  C    TYR B  259  .  20.367  10.352  -8.380  1.00 18.66  .    1   1234
59
  ATOM  O  O    TYR B  259  .  20.379  11.476  -7.877  1.00 18.74  .    1   1235
59
  ATOM  C  CB   TYR B  259  .  18.118   9.928  -9.369  1.00 16.57  .    1   1236
59
  ATOM  C  CG   TYR B  259  .  16.798   9.220  -9.384  1.00 15.32  .    1   1237
59
  ATOM  C  CD1  TYR B  259  .  15.806   9.562  -8.468  1.00 15.01  .    1   1238
59
  ATOM  C  CD2  TYR B  259  .  16.495   8.220 -10.335  1.00 15.47  .    1   1239
59
  ATOM  C  CE1  TYR B  259  .  14.568   8.935  -8.450  1.00 15.20  .    1   1240
59
  ATOM  C  CE2  TYR B  259  .  15.235   7.605 -10.313  1.00 15.23  .    1   1241
59
  ATOM  C  CZ   TYR B  259  .  14.289   7.952  -9.384  1.00 15.18  .    1   1242
59
  ATOM  O  OH   TYR B  259  .  13.069   7.295  -9.370  1.00 16.18  .    1   1243
60
  ATOM  N  N    ASP B  260  .  21.397   9.762  -8.986  1.00 19.32  .    1   1244
60
  ATOM  C  CA   ASP B  260  .  22.620  10.439  -9.268  1.00 20.57  .    1   1245
60
  ATOM  C  C    ASP B  260  .  22.748  10.802 -10.749  1.00 20.72  .    1   1246
60
  ATOM  O  O    ASP B  260  .  22.135  10.179 -11.658  1.00 20.36  .    1   1247
60
  ATOM  C  CB   ASP B  260  .  23.862   9.718  -8.752  1.00 23.21  .    1   1248
60
  ATOM  C  CG   ASP B  260  .  23.498   9.316  -7.303  1.00 25.13  .    1   1249
60
  ATOM  O  OD1  ASP B  260  .  23.932   8.268  -6.863  1.00 26.17  .    1   1250
60
  ATOM  O  OD2  ASP B  260  .  22.748  10.178  -6.800  1.00 25.88  .    1   1251
61
  ATOM  N  N    GLN B  261  .  23.520  11.864 -10.860  1.00 19.77   1   1   1252
61
  ATOM  C  CA   GLN B  261  .  23.924  12.422 -12.124  1.00 20.16   1   1   1253
61
  ATOM  C  C    GLN B  261  .  22.769  12.947 -12.940  1.00 19.98   1   1   1254
61
  ATOM  O  O    GLN B  261  .  22.708  12.608 -14.120  1.00 20.50   1   1   1255
61
  ATOM  C  CB   GLN B  261  .  24.756  11.366 -12.899  1.00 20.18   1   1   1256
61
  ATOM  C  CG   GLN B  261  1  25.918  10.945 -11.969  0.50 20.57   1   1   1257
61
  ATOM  C  CG   GLN B  261  2  25.929  11.961 -13.648  0.50 19.89   1   1   1258
61
  ATOM  C  CD   GLN B  261  1  27.000  12.016 -12.015  0.50 20.78   1   1   1259
61
  ATOM  C  CD   GLN B  261  2  27.136  11.056 -13.713  0.50 19.78   1   1   1260
61
  ATOM  O  OE1  GLN B  261  1  27.656  12.342 -11.039  0.50 20.46   1   1   1261
61
  ATOM  O  OE1  GLN B  261  2  27.344  10.202 -12.834  0.50 20.29   1   1   1262
61
  ATOM  N  NE2  GLN B  261  1  27.174  12.509 -13.242  0.50 21.08   1   1   1263
61
  ATOM  N  NE2  GLN B  261  2  27.958  11.236 -14.727  0.50 18.93   1   1   1264
62
  ATOM  N  N    ILE B  262  .  21.910  13.703 -12.260  1.00 19.84  .    1   1265
62
  ATOM  C  CA   ILE B  262  .  20.753  14.275 -12.970  1.00 19.07  .    1   1266
62
  ATOM  C  C    ILE B  262  .  21.210  15.660 -13.414  1.00 18.82  .    1   1267
62
  ATOM  O  O    ILE B  262  .  21.821  16.406 -12.628  1.00 18.66  .    1   1268
62
  ATOM  C  CB   ILE B  262  .  19.455  14.291 -12.076  1.00 18.98  .    1   1269
62
  ATOM  C  CG1  ILE B  262  .  19.073  12.834 -11.648  1.00 18.61  .    1   1270
62
  ATOM  C  CG2  ILE B  262  .  18.287  15.003 -12.804  1.00 18.89  .    1   1271
62
  ATOM  C  CD1  ILE B  262  .  18.847  11.824 -12.808  1.00 17.95  .    1   1272
63
  ATOM  N  N    LEU B  263  .  21.005  15.925 -14.664  1.00 18.97  .    1   1273
63
  ATOM  C  CA   LEU B  263  .  21.318  17.268 -15.181  1.00 19.61  .    1   1274
63
  ATOM  C  C    LEU B  263  .  20.060  18.139 -14.939  1.00 19.38  .    1   1275
63
  ATOM  O  O    LEU B  263  .  18.931  17.721 -15.222  1.00 17.88  .    1   1276
63
  ATOM  C  CB   LEU B  263  .  21.551  17.103 -16.682  1.00 21.06  .    1   1277
63
  ATOM  C  CG   LEU B  263  .  21.553  18.503 -17.354  1.00 21.50  .    1   1278
63
  ATOM  C  CD1  LEU B  263  .  22.863  19.176 -17.218  1.00 21.16  .    1   1279
63
  ATOM  C  CD2  LEU B  263  .  21.124  18.232 -18.775  1.00 22.75  .    1   1280
64
  ATOM  N  N    ILE B  264  .  20.288  19.279 -14.391  1.00 19.93   1   1   1281
64
  ATOM  C  CA   ILE B  264  .  19.256  20.251 -14.092  1.00 21.57   1   1   1282
64
  ATOM  C  C    ILE B  264  .  19.778  21.606 -14.570  1.00 22.60   1   1   1283
64
  ATOM  O  O    ILE B  264  .  20.967  21.817 -14.464  1.00 22.35   1   1   1284
64
  ATOM  C  CB   ILE B  264  .  18.894  20.233 -12.577  1.00 21.46   1   1   1285
64
  ATOM  C  CG1  ILE B  264  1  17.591  21.031 -12.321  0.50 21.35   1   1   1286
64
  ATOM  C  CG1  ILE B  264  2  18.164  18.940 -12.169  0.50 21.18   1   1   1287
64
  ATOM  C  CG2  ILE B  264  1  20.058  20.681 -11.653  0.50 21.55   1   1   1288
64
  ATOM  C  CG2  ILE B  264  2  18.059  21.504 -12.214  0.50 20.95   1   1   1289
64
  ATOM  C  CD1  ILE B  264  1  16.853  20.577 -11.020  0.50 21.65   1   1   1290
64
  ATOM  C  CD1  ILE B  264  2  17.317  19.125 -10.867  0.50 21.17   1   1   1291
65
  ATOM  N  N    GLU B  265  .  18.948  22.424 -15.115  1.00 24.41  .    1   1292
65
  ATOM  C  CA   GLU B  265  .  19.357  23.781 -15.537  1.00 26.39  .    1   1293
65
  ATOM  C  C    GLU B  265  .  18.593  24.704 -14.587  1.00 26.41  .    1   1294
65
  ATOM  O  O    GLU B  265  .  17.358  24.580 -14.551  1.00 26.13  .    1   1295
65
  ATOM  C  CB   GLU B  265  .  18.956  24.134 -16.951  1.00 27.84  .    1   1296
65
  ATOM  C  CG   GLU B  265  .  19.816  25.292 -17.546  1.00 31.07  .    1   1297
65
  ATOM  C  CD   GLU B  265  .  19.462  25.427 -19.031  1.00 32.88  .    1   1298
65
  ATOM  O  OE1  GLU B  265  .  19.167  26.456 -19.596  1.00 33.56  .    1   1299
65
  ATOM  O  OE2  GLU B  265  .  19.459  24.268 -19.518  1.00 34.14  .    1   1300
66
  ATOM  N  N    ILE B  266  .  19.329  25.481 -13.846  1.00 26.81  .    1   1301
66
  ATOM  C  CA   ILE B  266  .  18.715  26.435 -12.885  1.00 27.61  .    1   1302
66
  ATOM  C  C    ILE B  266  .  19.055  27.806 -13.451  1.00 28.92  .    1   1303
66
  ATOM  O  O    ILE B  266  .  20.261  28.149 -13.416  1.00 27.83  .    1   1304
66
  ATOM  C  CB   ILE B  266  .  19.289  26.225 -11.454  1.00 27.12  .    1   1305
66
  ATOM  C  CG1  ILE B  266  .  19.132  24.708 -11.091  1.00 27.52  .    1   1306
66
  ATOM  C  CG2  ILE B  266  .  18.650  27.139 -10.402  1.00 27.15  .    1   1307
66
  ATOM  C  CD1  ILE B  266  .  20.369  24.154 -10.329  1.00 27.03  .    1   1308
67
  ATOM  N  N    CYS B  267  .  18.023  28.477 -13.923  1.00 30.30  .    1   1309
67
  ATOM  C  CA   CYS B  267  .  18.218  29.812 -14.540  1.00 32.45  .    1   1310
67
  ATOM  C  C    CYS B  267  .  19.287  29.742 -15.615  1.00 32.59  .    1   1311
67
  ATOM  O  O    CYS B  267  .  20.187  30.583 -15.692  1.00 32.77  .    1   1312
67
  ATOM  C  CB   CYS B  267  .  18.576  30.909 -13.563  1.00 33.52  .    1   1313
67
  ATOM  S  SG   CYS B  267  .  17.193  31.398 -12.514  1.00 36.20  .    1   1314
68
  ATOM  N  N    GLY B  268  .  19.109  28.688 -16.415  1.00 33.22  .    1   1315
68
  ATOM  C  CA   GLY B  268  .  20.048  28.483 -17.525  1.00 32.46  .    1   1316
68
  ATOM  C  C    GLY B  268  .  21.414  28.119 -16.989  1.00 31.50  .    1   1317
68
  ATOM  O  O    GLY B  268  .  22.338  28.117 -17.831  1.00 32.62  .    1   1318
69
  ATOM  N  N    HIS B  269  .  21.541  27.863 -15.693  1.00 29.54  .    1   1319
69
  ATOM  C  CA   HIS B  269  .  22.873  27.411 -15.211  1.00 28.07  .    1   1320
69
  ATOM  C  C    HIS B  269  .  22.798  25.874 -15.200  1.00 27.14  .    1   1321
69
  ATOM  O  O    HIS B  269  .  21.924  25.389 -14.450  1.00 26.25  .    1   1322
69
  ATOM  C  CB   HIS B  269  .  23.275  27.839 -13.785  1.00 28.37  .    1   1323
69
  ATOM  C  CG   HIS B  269  .  23.518  29.326 -13.874  1.00 29.36  .    1   1324
69
  ATOM  N  ND1  HIS B  269  .  24.732  29.897 -13.856  1.00 29.27  .    1   1325
69
  ATOM  C  CD2  HIS B  269  .  22.585  30.320 -14.036  1.00 29.88  .    1   1326
69
  ATOM  C  CE1  HIS B  269  .  24.576  31.221 -13.963  1.00 29.42  .    1   1327
69
  ATOM  N  NE2  HIS B  269  .  23.317  31.496 -14.105  1.00 30.19  .    1   1328
70
  ATOM  N  N    LYS B  270  .  23.702  25.238 -15.908  1.00 25.96  .    1   1329
70
  ATOM  C  CA   LYS B  270  .  23.660  23.754 -15.886  1.00 25.42  .    1   1330
70
  ATOM  C  C    LYS B  270  .  24.307  23.177 -14.660  1.00 23.13  .    1   1331
70
  ATOM  O  O    LYS B  270  .  25.327  23.662 -14.180  1.00 23.89  .    1   1332
70
  ATOM  C  CB   LYS B  270  .  24.165  23.159 -17.186  1.00 27.41  .    1   1333
70
  ATOM  C  CG   LYS B  270  .  23.075  23.335 -18.294  1.00 30.04  .    1   1334
70
  ATOM  C  CD   LYS B  270  .  23.409  22.360 -19.430  1.00 31.76  .    1   1335
70
  ATOM  C  CE   LYS B  270  .  22.760  22.767 -20.729  1.00 33.73  .    1   1336
70
  ATOM  N  NZ   LYS B  270  .  23.177  24.173 -21.086  1.00 34.16  .    1   1337
71
  ATOM  N  N    ALA B  271  .  23.690  22.215 -14.010  1.00 20.10  .    1   1338
71
  ATOM  C  CA   ALA B  271  .  24.121  21.511 -12.837  1.00 18.68  .    1   1339
71
  ATOM  C  C    ALA B  271  .  23.901  20.022 -13.118  1.00 18.37  .    1   1340
71
  ATOM  O  O    ALA B  271  .  22.978  19.651 -13.871  1.00 18.07  .    1   1341
71
  ATOM  C  CB   ALA B  271  .  23.576  21.971 -11.501  1.00 17.45  .    1   1342
72
  ATOM  N  N    ILE B  272  .  24.766  19.196 -12.556  1.00 17.20  .    1   1343
72
  ATOM  C  CA   ILE B  272  .  24.693  17.766 -12.693  1.00 16.56  .    1   1344
72
  ATOM  C  C    ILE B  272  .  24.955  17.172 -11.307  1.00 15.54  .    1   1345
72
  ATOM  O  O    ILE B  272  .  26.101  17.197 -10.842  1.00 15.81  .    1   1346
72
  ATOM  C  CB   ILE B  272  .  25.666  17.131 -13.765  1.00 16.94  .    1   1347
72
  ATOM  C  CG1  ILE B  272  .  25.334  17.602 -15.192  1.00 16.90  .    1   1348
72
  ATOM  C  CG2  ILE B  272  .  25.588  15.574 -13.646  1.00 15.47  .    1   1349
72
  ATOM  C  CD1  ILE B  272  .  26.517  17.843 -16.143  1.00 16.66  .    1   1350
73
  ATOM  N  N    GLY B  273  .  23.919  16.602 -10.716  1.00 14.63  .    1   1351
73
  ATOM  C  CA   GLY B  273  .  24.186  16.007  -9.378  1.00 14.83  .    1   1352
73
  ATOM  C  C    GLY B  273  .  23.073  15.140  -8.908  1.00 14.39  .    1   1353
73
  ATOM  O  O    GLY B  273  .  22.272  14.723  -9.736  1.00 15.14  .    1   1354
74
  ATOM  N  N    THR B  274  .  23.108  14.886  -7.638  1.00 14.75  .    1   1355
74
  ATOM  C  CA   THR B  274  .  22.149  14.077  -6.899  1.00 14.99  .    1   1356
74
  ATOM  C  C    THR B  274  .  20.856  14.795  -6.690  1.00 14.85  .    1   1357
74
  ATOM  O  O    THR B  274  .  20.956  15.968  -6.270  1.00 16.74  .    1   1358
74
  ATOM  C  CB   THR B  274  .  22.790  13.610  -5.526  1.00 15.27  .    1   1359
74
  ATOM  O  OG1  THR B  274  .  23.916  12.839  -6.060  1.00 17.19  .    1   1360
74
  ATOM  C  CG2  THR B  274  .  21.945  12.643  -4.679  1.00 16.18  .    1   1361
75
  ATOM  N  N    VAL B  275  .  19.741  14.154  -6.955  1.00 13.22  .    1   1362
75
  ATOM  C  CA   VAL B  275  .  18.409  14.690  -6.817  1.00 13.89  .    1   1363
75
  ATOM  C  C    VAL B  275  .  17.599  13.654  -6.031  1.00 13.78  .    1   1364
75
  ATOM  O  O    VAL B  275  .  17.733  12.457  -6.296  1.00 13.31  .    1   1365
75
  ATOM  C  CB   VAL B  275  .  17.801  14.922  -8.214  1.00 15.15  .    1   1366
75
  ATOM  C  CG1  VAL B  275  .  16.304  15.015  -8.194  1.00 15.53  .    1   1367
75
  ATOM  C  CG2  VAL B  275  .  18.469  16.067  -8.973  1.00 14.53  .    1   1368
76
  ATOM  N  N    LEU B  276  .  16.862  14.104  -5.088  1.00 13.97  .    1   1369
76
  ATOM  C  CA   LEU B  276  .  16.034  13.267  -4.211  1.00 14.51  .    1   1370
76
  ATOM  C  C    LEU B  276  .  14.586  13.517  -4.649  1.00 14.53  .    1   1371
76
  ATOM  O  O    LEU B  276  .  14.265  14.678  -5.008  1.00 14.96  .    1   1372
76
  ATOM  C  CB   LEU B  276  .  16.294  13.667  -2.772  1.00 13.98  .    1   1373
76
  ATOM  C  CG   LEU B  276  .  17.680  13.628  -2.158  1.00 14.21  .    1   1374
76
  ATOM  C  CD1  LEU B  276  .  17.564  13.690  -0.637  1.00 13.30  .    1   1375
76
  ATOM  C  CD2  LEU B  276  .  18.271  12.284  -2.621  1.00 13.31  .    1   1376
77
  ATOM  N  N    VAL B  277  .  13.768  12.471  -4.566  1.00 14.55  .    1   1377
77
  ATOM  C  CA   VAL B  277  .  12.337  12.599  -4.979  1.00 14.69  .    1   1378
77
  ATOM  C  C    VAL B  277  .  11.501  11.959  -3.853  1.00 14.83  .    1   1379
77
  ATOM  O  O    VAL B  277  .  11.782  10.838  -3.413  1.00 14.72  .    1   1380
77
  ATOM  C  CB   VAL B  277  .  12.279  11.861  -6.333  1.00 15.70  .    1   1381
77
  ATOM  C  CG1  VAL B  277  .  10.857  11.437  -6.717  1.00 15.80  .    1   1382
77
  ATOM  C  CG2  VAL B  277  .  12.913  12.622  -7.477  1.00 16.08  .    1   1383
78
  ATOM  N  N    GLY B  278  .  10.527  12.695  -3.362  1.00 15.02  .    1   1384
78
  ATOM  C  CA   GLY B  278  .   9.662  12.281  -2.253  1.00 16.12  .    1   1385
78
  ATOM  C  C    GLY B  278  .   8.649  13.415  -2.046  1.00 16.13  .    1   1386
78
  ATOM  O  O    GLY B  278  .   8.714  14.416  -2.810  1.00 16.45  .    1   1387
79
  ATOM  N  N    PRO B  279  .   7.849  13.221  -1.024  1.00 16.32  .    1   1388
79
  ATOM  C  CA   PRO B  279  .   6.791  14.189  -0.673  1.00 16.95  .    1   1389
79
  ATOM  C  C    PRO B  279  .   7.346  15.477  -0.130  1.00 17.26  .    1   1390
79
  ATOM  O  O    PRO B  279  .   7.662  15.586   1.052  1.00 18.05  .    1   1391
79
  ATOM  C  CB   PRO B  279  .   5.970  13.530   0.442  1.00 16.47  .    1   1392
79
  ATOM  C  CG   PRO B  279  .   6.515  12.161   0.600  1.00 16.38  .    1   1393
79
  ATOM  C  CD   PRO B  279  .   7.830  12.065  -0.130  1.00 16.13  .    1   1394
80
  ATOM  N  N    THR B  280  .   7.505  16.453  -0.984  1.00 18.26  .    1   1395
80
  ATOM  C  CA   THR B  280  .   7.981  17.775  -0.520  1.00 17.92  .    1   1396
80
  ATOM  C  C    THR B  280  .   6.920  18.764  -0.868  1.00 18.01  .    1   1397
80
  ATOM  O  O    THR B  280  .   6.261  18.639  -1.937  1.00 18.89  .    1   1398
80
  ATOM  C  CB   THR B  280  .   9.393  18.034  -1.180  1.00 18.23  .    1   1399
80
  ATOM  O  OG1  THR B  280  .   9.922  19.284  -0.549  1.00 18.89  .    1   1400
80
  ATOM  C  CG2  THR B  280  .   9.366  18.156  -2.692  1.00 18.38  .    1   1401
81
  ATOM  N  N    PRO B  281  .   6.732  19.751  -0.019  1.00 18.58  .    1   1402
81
  ATOM  C  CA   PRO B  281  .   5.755  20.832  -0.274  1.00 18.24  .    1   1403
81
  ATOM  C  C    PRO B  281  .   5.980  21.495  -1.617  1.00 18.28  .    1   1404
81
  ATOM  O  O    PRO B  281  .   5.010  21.950  -2.281  1.00 19.05  .    1   1405
81
  ATOM  C  CB   PRO B  281  .   5.924  21.735   0.918  1.00 18.50  .    1   1406
81
  ATOM  C  CG   PRO B  281  .   6.416  20.790   1.995  1.00 18.73  .    1   1407
81
  ATOM  C  CD   PRO B  281  .   7.453  19.940   1.270  1.00 18.40  .    1   1408
82
  ATOM  N  N    VAL B  282  .   7.242  21.678  -2.015  1.00 17.06  .    1   1409
82
  ATOM  C  CA   VAL B  282  .   7.705  22.255  -3.242  1.00 17.00  .    1   1410
82
  ATOM  C  C    VAL B  282  .   9.112  21.724  -3.560  1.00 15.52  .    1   1411
82
  ATOM  O  O    VAL B  282  .   9.797  21.279  -2.624  1.00 14.90  .    1   1412
82
  ATOM  C  CB   VAL B  282  .   7.885  23.807  -3.151  1.00 18.46  .    1   1413
82
  ATOM  C  CG1  VAL B  282  .   6.553  24.459  -2.830  1.00 18.88  .    1   1414
82
  ATOM  C  CG2  VAL B  282  .   8.906  24.116  -2.070  1.00 17.24  .    1   1415
83
  ATOM  N  N    ASN B  283  .   9.442  21.852  -4.804  1.00 14.47  .    1   1416
83
  ATOM  C  CA   ASN B  283  .  10.747  21.463  -5.340  1.00 13.73  .    1   1417
83
  ATOM  C  C    ASN B  283  .  11.758  22.376  -4.651  1.00 13.01  .    1   1418
83
  ATOM  O  O    ASN B  283  .  11.525  23.580  -4.547  1.00 14.42  .    1   1419
83
  ATOM  C  CB   ASN B  283  .  10.790  21.595  -6.879  1.00 13.74  .    1   1420
83
  ATOM  C  CG   ASN B  283  .   9.765  20.775  -7.594  1.00 14.08  .    1   1421
83
  ATOM  O  OD1  ASN B  283  .   9.707  19.566  -7.350  1.00 14.87  .    1   1422
83
  ATOM  N  ND2  ASN B  283  .   9.004  21.305  -8.578  1.00 13.69  .    1   1423
84
  ATOM  N  N    ILE B  284  .  12.807  21.828  -4.127  1.00 12.99   1   1   1424
84
  ATOM  C  CA   ILE B  284  .  13.809  22.604  -3.373  1.00 11.71   1   1   1425
84
  ATOM  C  C    ILE B  284  .  15.191  22.270  -3.951  1.00 12.40   1   1   1426
84
  ATOM  O  O    ILE B  284  .  15.524  21.140  -4.171  1.00 12.70   1   1   1427
84
  ATOM  C  CB   ILE B  284  .  13.661  22.154  -1.885  1.00 10.98   1   1   1428
84
  ATOM  C  CG1  ILE B  284  1  14.100  20.767  -1.499  0.50 10.50   1   1   1429
84
  ATOM  C  CG1  ILE B  284  2  12.508  22.815  -1.126  0.50 10.93   1   1   1430
84
  ATOM  C  CG2  ILE B  284  1  12.199  22.394  -1.376  0.50 11.53   1   1   1431
84
  ATOM  C  CG2  ILE B  284  2  15.021  22.262  -1.105  0.50 10.68   1   1   1432
84
  ATOM  C  CD1  ILE B  284  1  14.068  20.655   0.096  0.50  9.56   1   1   1433
84
  ATOM  C  CD1  ILE B  284  2  12.039  22.002   0.126  0.50  9.87   1   1   1434
85
  ATOM  N  N    ILE B  285  .  15.969  23.286  -4.218  1.00 13.09  .    1   1435
85
  ATOM  C  CA   ILE B  285  .  17.342  23.176  -4.722  1.00 13.04  .    1   1436
85
  ATOM  C  C    ILE B  285  .  18.184  23.421  -3.483  1.00 13.14  .    1   1437
85
  ATOM  O  O    ILE B  285  .  18.133  24.518  -2.832  1.00 13.57  .    1   1438
85
  ATOM  C  CB   ILE B  285  .  17.456  24.209  -5.919  1.00 13.38  .    1   1439
85
  ATOM  C  CG1  ILE B  285  .  16.419  23.888  -6.978  1.00 14.22  .    1   1440
85
  ATOM  C  CG2  ILE B  285  .  18.928  24.282  -6.388  1.00 13.01  .    1   1441
85
  ATOM  C  CD1  ILE B  285  .  16.618  22.687  -7.951  1.00 13.74  .    1   1442
86
  ATOM  N  N    GLY B  286  .  18.877  22.392  -3.008  1.00 11.93  .    1   1443
86
  ATOM  C  CA   GLY B  286  .  19.705  22.414  -1.819  1.00  9.79  .    1   1444
86
  ATOM  C  C    GLY B  286  .  21.121  22.830  -2.137  1.00  9.79  .    1   1445
86
  ATOM  O  O    GLY B  286  .  21.469  23.023  -3.302  1.00 10.27  .    1   1446
87
  ATOM  N  N    ARG B  287  .  21.951  22.923  -1.116  1.00  8.80  .    1   1447
87
  ATOM  C  CA   ARG B  287  .  23.345  23.354  -1.253  1.00  9.31  .    1   1448
87
  ATOM  C  C    ARG B  287  .  24.128  22.437  -2.199  1.00  9.37  .    1   1449
87
  ATOM  O  O    ARG B  287  .  25.062  22.974  -2.766  1.00  8.60  .    1   1450
87
  ATOM  C  CB   ARG B  287  .  23.992  23.345   0.130  1.00  8.39  .    1   1451
87
  ATOM  C  CG   ARG B  287  .  23.388  24.359   1.116  1.00  7.95  .    1   1452
87
  ATOM  C  CD   ARG B  287  .  24.286  24.437   2.317  1.00  8.57  .    1   1453
87
  ATOM  N  NE   ARG B  287  .  24.265  23.219   3.109  1.00  9.91  .    1   1454
87
  ATOM  C  CZ   ARG B  287  .  25.265  22.292   3.103  1.00  9.70  .    1   1455
87
  ATOM  N  NH1  ARG B  287  .  25.147  21.168   3.836  1.00  9.80  .    1   1456
87
  ATOM  N  NH2  ARG B  287  .  26.351  22.544   2.481  1.00  8.98  .    1   1457
88
  ATOM  N  N    ASN B  288  .  23.667  21.204  -2.436  1.00  9.10  .    1   1458
88
  ATOM  C  CA   ASN B  288  .  24.525  20.384  -3.376  1.00 11.68  .    1   1459
88
  ATOM  C  C    ASN B  288  .  24.597  20.977  -4.761  1.00 12.26  .    1   1460
88
  ATOM  O  O    ASN B  288  .  25.582  20.829  -5.526  1.00 13.34  .    1   1461
88
  ATOM  C  CB   ASN B  288  .  24.163  18.914  -3.342  1.00 11.72  .    1   1462
88
  ATOM  C  CG   ASN B  288  .  22.871  18.564  -4.007  1.00 12.41  .    1   1463
88
  ATOM  O  OD1  ASN B  288  .  21.858  19.171  -3.651  1.00 13.52  .    1   1464
88
  ATOM  N  ND2  ASN B  288  .  22.773  17.711  -5.042  1.00 13.01  .    1   1465
89
  ATOM  N  N    LEU B  289  .  23.512  21.574  -5.205  1.00 12.92  .    1   1466
89
  ATOM  C  CA   LEU B  289  .  23.388  22.156  -6.551  1.00 11.79  .    1   1467
89
  ATOM  C  C    LEU B  289  .  23.667  23.653  -6.479  1.00 12.40  .    1   1468
89
  ATOM  O  O    LEU B  289  .  24.169  24.208  -7.472  1.00 12.41  .    1   1469
89
  ATOM  C  CB   LEU B  289  .  22.101  21.708  -7.149  1.00 11.84  .    1   1470
89
  ATOM  C  CG   LEU B  289  .  21.788  20.268  -7.419  1.00 12.95  .    1   1471
89
  ATOM  C  CD1  LEU B  289  .  20.650  20.162  -8.482  1.00 12.27  .    1   1472
89
  ATOM  C  CD2  LEU B  289  .  23.039  19.566  -8.011  1.00 10.68  .    1   1473
90
  ATOM  N  N    LEU B  290  .  23.372  24.266  -5.350  1.00 13.35  .    1   1474
90
  ATOM  C  CA   LEU B  290  .  23.578  25.715  -5.191  1.00 14.33  .    1   1475
90
  ATOM  C  C    LEU B  290  .  25.067  26.028  -5.352  1.00 13.98  .    1   1476
90
  ATOM  O  O    LEU B  290  .  25.358  27.074  -5.933  1.00 15.57  .    1   1477
90
  ATOM  C  CB   LEU B  290  .  22.944  26.197  -3.877  1.00 12.48  .    1   1478
90
  ATOM  C  CG   LEU B  290  .  21.424  26.295  -3.807  1.00 12.55  .    1   1479
90
  ATOM  C  CD1  LEU B  290  .  20.961  26.625  -2.391  1.00 11.33  .    1   1480
90
  ATOM  C  CD2  LEU B  290  .  20.860  27.294  -4.787  1.00 10.49  .    1   1481
91
  ATOM  N  N    THR B  291  .  25.967  25.206  -4.831  1.00 14.78  .    1   1482
91
  ATOM  C  CA   THR B  291  .  27.375  25.416  -4.893  1.00 14.65  .    1   1483
91
  ATOM  C  C    THR B  291  .  27.870  25.194  -6.325  1.00 15.19  .    1   1484
91
  ATOM  O  O    THR B  291  .  28.885  25.785  -6.664  1.00 15.45  .    1   1485
91
  ATOM  C  CB   THR B  291  .  28.244  24.570  -3.903  1.00 14.69  .    1   1486
91
  ATOM  O  OG1  THR B  291  .  27.764  23.184  -4.125  1.00 16.37  .    1   1487
91
  ATOM  C  CG2  THR B  291  .  28.095  24.906  -2.450  1.00 15.04  .    1   1488
92
  ATOM  N  N    GLN B  292  .  27.197  24.384  -7.072  1.00 13.95  .    1   1489
92
  ATOM  C  CA   GLN B  292  .  27.512  24.050  -8.467  1.00 13.86  .    1   1490
92
  ATOM  C  C    GLN B  292  .  27.218  25.218  -9.371  1.00 14.20  .    1   1491
92
  ATOM  O  O    GLN B  292  .  27.891  25.345 -10.442  1.00 16.83  .    1   1492
92
  ATOM  C  CB   GLN B  292  .  26.692  22.829  -8.913  1.00 13.97  .    1   1493
92
  ATOM  C  CG   GLN B  292  .  27.312  21.528  -8.475  1.00 13.55  .    1   1494
92
  ATOM  C  CD   GLN B  292  .  26.899  20.473  -9.489  1.00 14.83  .    1   1495
92
  ATOM  O  OE1  GLN B  292  .  26.522  20.829 -10.620  1.00 15.41  .    1   1496
92
  ATOM  N  NE2  GLN B  292  .  26.820  19.247  -9.002  1.00 13.50  .    1   1497
93
  ATOM  N  N    ILE B  293  .  26.224  26.032  -9.039  1.00 13.78  .    1   1498
93
  ATOM  C  CA   ILE B  293  .  25.954  27.209  -9.910  1.00 13.16  .    1   1499
93
  ATOM  C  C    ILE B  293  .  26.594  28.464  -9.341  1.00 14.45  .    1   1500
93
  ATOM  O  O    ILE B  293  .  26.334  29.601  -9.853  1.00 17.23  .    1   1501
93
  ATOM  C  CB   ILE B  293  .  24.408  27.408 -10.137  1.00 11.58  .    1   1502
93
  ATOM  C  CG1  ILE B  293  .  23.778  27.669  -8.727  1.00 10.45  .    1   1503
93
  ATOM  C  CG2  ILE B  293  .  23.717  26.282 -10.892  1.00 10.29  .    1   1504
93
  ATOM  C  CD1  ILE B  293  .  22.537  28.621  -8.869  1.00 12.19  .    1   1505
94
  ATOM  N  N    GLY B  294  .  27.318  28.348  -8.262  1.00 14.45  .    1   1506
94
  ATOM  C  CA   GLY B  294  .  28.039  29.424  -7.621  1.00 14.41  .    1   1507
94
  ATOM  C  C    GLY B  294  .  27.186  30.322  -6.748  1.00 14.49  .    1   1508
94
  ATOM  O  O    GLY B  294  .  27.541  31.492  -6.557  1.00 13.74  .    1   1509
95
  ATOM  N  N    CYS B  295  .  26.134  29.794  -6.163  1.00 14.79   1   1   1510
95
  ATOM  C  CA   CYS B  295  .  25.317  30.645  -5.261  1.00 15.40   1   1   1511
95
  ATOM  C  C    CYS B  295  .  25.957  30.925  -3.919  1.00 16.42   1   1   1512
95
  ATOM  O  O    CYS B  295  .  26.421  30.001  -3.151  1.00 18.15   1   1   1513
95
  ATOM  C  CB   CYS B  295  .  23.999  29.894  -5.039  1.00 15.53   1   1   1514
95
  ATOM  S  SG   CYS B  295  1  22.490  30.807  -4.959  0.50 15.87   1   1   1515
95
  ATOM  S  SG   CYS B  295  2  22.901  30.933  -4.011  0.50 12.55   1   1   1516
96
  ATOM  N  N    THR B  296  .  25.870  32.210  -3.513  1.00 15.50  .    1   1517
96
  ATOM  C  CA   THR B  296  .  26.332  32.631  -2.186  1.00 15.07  .    1   1518
96
  ATOM  C  C    THR B  296  .  25.258  33.524  -1.551  1.00 14.77  .    1   1519
96
  ATOM  O  O    THR B  296  .  24.454  34.097  -2.264  1.00 12.98  .    1   1520
96
  ATOM  C  CB   THR B  296  .  27.691  33.419  -2.258  1.00 14.64  .    1   1521
96
  ATOM  O  OG1  THR B  296  .  27.290  34.670  -2.950  1.00 13.91  .    1   1522
96
  ATOM  C  CG2  THR B  296  .  28.772  32.689  -3.070  1.00 14.74  .    1   1523
97
  ATOM  N  N    LEU B  297  .  25.274  33.517  -0.236  1.00 15.42   1   1   1524
97
  ATOM  C  CA   LEU B  297  .  24.359  34.385   0.565  1.00 16.08   1   1   1525
97
  ATOM  C  C    LEU B  297  .  25.221  35.650   0.889  1.00 18.16   1   1   1526
97
  ATOM  O  O    LEU B  297  .  26.410  35.407   1.275  1.00 17.03   1   1   1527
97
  ATOM  C  CB   LEU B  297  .  24.069  33.586   1.815  1.00 16.72   1   1   1528
97
  ATOM  C  CG   LEU B  297  1  22.950  32.613   1.927  0.50 15.65   1   1   1529
97
  ATOM  C  CG   LEU B  297  2  22.758  33.656   2.539  0.50 16.90   1   1   1530
97
  ATOM  C  CD1  LEU B  297  1  23.089  31.821   3.232  0.50 15.92   1   1   1531
97
  ATOM  C  CD1  LEU B  297  2  21.576  33.784   1.576  0.50 17.00   1   1   1532
97
  ATOM  C  CD2  LEU B  297  1  21.617  33.364   1.957  0.50 16.44   1   1   1533
97
  ATOM  C  CD2  LEU B  297  2  22.611  32.454   3.451  0.50 16.66   1   1   1534
98
  ATOM  N  N    ASN B  298  .  24.698  36.867   0.674  1.00 17.52   1   1   1535
98
  ATOM  C  CA   ASN B  298  .  25.505  38.047   0.971  1.00 20.09   1   1   1536
98
  ATOM  C  C    ASN B  298  .  24.719  39.038   1.833  1.00 21.29   1   1   1537
98
  ATOM  O  O    ASN B  298  .  23.515  39.247   1.649  1.00 20.38   1   1   1538
98
  ATOM  C  CB   ASN B  298  .  25.883  38.777  -0.390  1.00 21.09   1   1   1539
98
  ATOM  C  CG   ASN B  298  .  26.659  37.766  -1.225  1.00 22.25   1   1   1540
98
  ATOM  O  OD1  ASN B  298  1  27.739  37.330  -0.765  0.50 21.81   1   1   1541
98
  ATOM  O  OD1  ASN B  298  2  26.010  36.942  -1.923  0.50 22.12   1   1   1542
98
  ATOM  N  ND2  ASN B  298  1  26.071  37.337  -2.326  0.50 22.30   1   1   1543
98
  ATOM  N  ND2  ASN B  298  2  27.973  37.792  -1.141  0.50 22.22   1   1   1544
99
  ATOM  N  N    PHE B  299  .  25.397  39.713   2.732  1.00 23.37  .    1   1545
99
  ATOM  C  CA   PHE B  299  .  24.738  40.750   3.567  1.00 24.56  .    1   1546
99
  ATOM  C  C    PHE B  299  .  25.880  41.523   4.250  1.00 25.66  .    1   1547
99
  ATOM  O  O    PHE B  299  .  25.531  42.536   4.873  1.00 26.22  .    1   1548
99
  ATOM  C  CB   PHE B  299  .  23.724  40.233   4.569  1.00 25.28  .    1   1549
99
  ATOM  C  CG   PHE B  299  .  24.258  39.275   5.579  1.00 25.05  .    1   1550
99
  ATOM  C  CD1  PHE B  299  .  24.480  39.664   6.883  1.00 25.94  .    1   1551
99
  ATOM  C  CD2  PHE B  299  .  24.583  37.979   5.194  1.00 26.32  .    1   1552
99
  ATOM  C  CE1  PHE B  299  .  24.998  38.775   7.826  1.00 26.11  .    1   1553
99
  ATOM  C  CE2  PHE B  299  .  25.100  37.061   6.123  1.00 26.32  .    1   1554
99
  ATOM  C  CZ   PHE B  299  .  25.286  37.478   7.443  1.00 25.96  .    1   1555
99
  ATOM  O  OXT  PHE B  299  .  27.001  40.997   4.109  1.00 26.77  .    1   1556
99
  TER   .  .    PHE B  299  .    .       .       .      .     .    .    1   1557
100
  ATOM  C  C    ACE C    1  1   4.949  27.758   6.793  0.58 16.95  .    3   1558
100
  ATOM  O  O    ACE C    1  1   4.800  26.678   7.393  0.58 16.85  .    3   1559
100
  ATOM  C  CH3  ACE C    1  1   4.171  29.012   7.116  0.58 17.27  .    3   1560
101
  ATOM  N  N    VAL C    2  1   5.930  27.841   5.869  0.58 16.43  .    3   1561
101
  ATOM  C  CA   VAL C    2  1   6.688  26.574   5.627  0.58 16.04  .    3   1562
101
  ATOM  C  C    VAL C    2  1   8.183  26.793   5.860  0.58 16.17  .    3   1563
101
  ATOM  O  O    VAL C    2  1   8.690  27.910   5.675  0.58 16.57  .    3   1564
101
  ATOM  C  CB   VAL C    2  1   6.529  26.178   4.139  0.58 15.92  .    3   1565
101
  ATOM  C  CG1  VAL C    2  1   7.686  25.256   3.685  0.58 15.51  .    3   1566
101
  ATOM  C  CG2  VAL C    2  1   5.166  25.563   3.805  0.58 16.10  .    3   1567
102
  ATOM  N  N    VAL C    3  1   8.838  25.670   6.185  0.58 15.53  .    3   1568
102
  ATOM  C  CA   VAL C    3  1  10.301  25.689   6.434  0.58 15.10  .    3   1569
102
  ATOM  C  C    VAL C    3  1  10.978  24.553   5.700  0.58 15.34  .    3   1570
102
  ATOM  O  O    VAL C    3  1  10.569  23.386   5.717  0.58 14.41  .    3   1571
102
  ATOM  C  CB   VAL C    3  1  10.418  25.590   7.983  0.58 15.38  .    3   1572
102
  ATOM  C  CG1  VAL C    3  1  11.799  25.185   8.480  0.58 15.02  .    3   1573
102
  ATOM  C  CG2  VAL C    3  1   9.895  26.911   8.621  0.58 14.68  .    3   1574
103
  HETA  N  N    STA C    4  1  12.126  24.878   5.008  0.58 15.30  .    3   1575
103
  HETA  C  CA   STA C    4  1  12.846  23.643   4.497  0.58 15.64  .    3   1576
103
  HETA  C  CB   STA C    4  1  12.228  23.417   3.092  0.58 14.66  .    3   1577
103
  HETA  C  CG   STA C    4  1  10.775  23.868   2.843  0.58 14.76  .    3   1578
103
  HETA  C  CD1  STA C    4  1  10.485  24.264   1.386  0.58 14.53  .    3   1579
103
  HETA  C  CD2  STA C    4  1   9.706  22.846   3.326  0.58 15.42  .    3   1580
103
  HETA  C  CH   STA C    4  1  14.377  23.783   4.659  0.58 16.09  .    3   1581
103
  HETA  O  OH   STA C    4  1  14.690  25.086   5.214  0.58 15.48  .    3   1582
103
  HETA  C  CM   STA C    4  1  15.073  22.755   5.634  0.58 16.56  .    3   1583
103
  HETA  C  C    STA C    4  1  14.767  21.286   5.304  0.58 16.67  .    3   1584
103
  HETA  O  O    STA C    4  1  13.666  20.739   5.524  0.58 16.86  .    3   1585
104
  ATOM  N  N    ALA C    5  1  15.827  20.674   4.766  0.58 16.24  .    3   1586
104
  ATOM  C  CA   ALA C    5  1  16.227  19.282   5.045  0.58 16.23  .    3   1587
104
  ATOM  C  C    ALA C    5  1  17.704  19.162   5.397  0.58 16.01  .    3   1588
104
  ATOM  O  O    ALA C    5  1  18.657  19.738   4.855  0.58 15.55  .    3   1589
104
  ATOM  C  CB   ALA C    5  1  15.855  18.433   3.797  0.58 16.43  .    3   1590
105
  HETA  N  N    STA C    6  1  17.913  18.389   6.465  0.58 16.21  .    3   1591
105
  HETA  C  CA   STA C    6  1  19.216  17.934   6.952  0.58 16.90  .    3   1592
105
  HETA  C  CB   STA C    6  1  19.416  18.441   8.425  0.58 16.80  .    3   1593
105
  HETA  C  CG   STA C    6  1  19.492  19.988   8.585  0.58 16.54  .    3   1594
105
  HETA  C  CD1  STA C    6  1  18.069  20.593   8.553  0.58 16.56  .    3   1595
105
  HETA  C  CD2  STA C    6  1  20.246  20.404   9.854  0.58 16.39  .    3   1596
105
  HETA  C  CH   STA C    6  1  19.248  16.400   6.717  0.58 17.28  .    3   1597
105
  HETA  O  OH   STA C    6  1  18.083  15.745   7.288  0.58 18.45  .    3   1598
105
  HETA  C  CM   STA C    6  1  19.317  15.994   5.211  0.58 16.63  .    3   1599
105
  HETA  C  C    STA C    6  1  20.347  14.858   5.001  0.58 16.77  .    3   1600
105
  HETA  O  O    STA C    6  1  20.936  14.302   5.936  0.58 16.53  .    3   1601
105
  HETA  O  OXT  STA C    6  1  20.573  14.552   3.703  0.58 16.89  .    3   1602
100
  ATOM  C  C    ACE C    1  2  19.663  15.657   6.261  0.42 18.88  .    3   1603
100
  ATOM  O  O    ACE C    1  2  18.768  14.830   6.422  0.42 18.41  .    3   1604
100
  ATOM  C  CH3  ACE C    1  2  21.086  15.170   5.853  0.42 18.90  .    3   1605
101
  ATOM  N  N    VAL C    2  2  19.579  16.978   6.423  0.42 18.72  .    3   1606
101
  ATOM  C  CA   VAL C    2  2  18.393  17.753   6.824  0.42 18.71  .    3   1607
101
  ATOM  C  C    VAL C    2  2  18.101  18.853   5.793  0.42 18.43  .    3   1608
101
  ATOM  O  O    VAL C    2  2  18.939  19.560   5.243  0.42 18.17  .    3   1609
101
  ATOM  C  CB   VAL C    2  2  18.553  18.354   8.247  0.42 18.95  .    3   1610
101
  ATOM  C  CG1  VAL C    2  2  17.633  19.570   8.512  0.42 19.16  .    3   1611
101
  ATOM  C  CG2  VAL C    2  2  18.320  17.314   9.370  0.42 18.90  .    3   1612
102
  ATOM  N  N    VAL C    3  2  16.796  18.974   5.525  0.42 18.46  .    3   1613
102
  ATOM  C  CA   VAL C    3  2  16.297  19.938   4.510  0.42 18.90  .    3   1614
102
  ATOM  C  C    VAL C    3  2  15.234  20.788   5.209  0.42 19.17  .    3   1615
102
  ATOM  O  O    VAL C    3  2  14.234  20.296   5.765  0.42 19.76  .    3   1616
102
  ATOM  C  CB   VAL C    3  2  15.720  19.142   3.307  0.42 18.77  .    3   1617
102
  ATOM  C  CG1  VAL C    3  2  14.739  19.932   2.422  0.42 18.88  .    3   1618
102
  ATOM  C  CG2  VAL C    3  2  16.820  18.531   2.399  0.42 18.85  .    3   1619
103
  HETA  N  N    STA C    4  2  15.468  22.108   5.234  0.42 19.16  .    3   1620
103
  HETA  C  CA   STA C    4  2  14.510  22.962   6.010  0.42 19.17  .    3   1621
103
  HETA  C  CB   STA C    4  2  15.243  23.319   7.324  0.42 18.08  .    3   1622
103
  HETA  C  CG   STA C    4  2  15.448  22.213   8.387  0.42 17.45  .    3   1623
103
  HETA  C  CD1  STA C    4  2  16.666  22.520   9.291  0.42 16.99  .    3   1624
103
  HETA  C  CD2  STA C    4  2  14.185  21.975   9.242  0.42 16.75  .    3   1625
103
  HETA  C  CH   STA C    4  2  14.126  24.132   5.060  0.42 19.64  .    3   1626
103
  HETA  O  OH   STA C    4  2  14.996  24.019   3.889  0.42 18.69  .    3   1627
103
  HETA  C  CM   STA C    4  2  12.654  24.175   4.554  0.42 20.41  .    3   1628
103
  HETA  C  C    STA C    4  2  11.557  24.225   5.627  0.42 21.24  .    3   1629
103
  HETA  O  O    STA C    4  2  11.181  23.263   6.308  0.42 20.56  .    3   1630
104
  ATOM  N  N    ALA C    5  2  10.971  25.421   5.774  0.42 21.84  .    3   1631
104
  ATOM  C  CA   ALA C    5  2   9.726  25.622   6.544  0.42 22.35  .    3   1632
104
  ATOM  C  C    ALA C    5  2   8.709  26.437   5.751  0.42 23.07  .    3   1633
104
  ATOM  O  O    ALA C    5  2   8.950  27.538   5.213  0.42 23.24  .    3   1634
104
  ATOM  C  CB   ALA C    5  2  10.062  26.418   7.834  0.42 22.40  .    3   1635
105
  HETA  N  N    STA C    6  2   7.475  25.908   5.659  0.42 23.43  .    3   1636
105
  HETA  C  CA   STA C    6  2   6.456  26.682   4.907  0.42 24.33  .    3   1637
105
  HETA  C  CB   STA C    6  2   6.008  25.836   3.690  0.42 24.52  .    3   1638
105
  HETA  C  CG   STA C    6  2   6.817  26.025   2.369  0.42 24.54  .    3   1639
105
  HETA  C  CD1  STA C    6  2   8.159  25.237   2.388  0.42 24.63  .    3   1640
105
  HETA  C  CD2  STA C    6  2   5.967  25.606   1.160  0.42 24.48  .    3   1641
105
  HETA  C  CH   STA C    6  2   5.385  27.134   5.927  0.42 24.90  .    3   1642
105
  HETA  O  OH   STA C    6  2   4.742  25.961   6.471  0.42 25.11  .    3   1643
105
  HETA  C  CM   STA C    6  2   5.908  28.009   7.114  0.42 25.41  .    3   1644
105
  HETA  C  C    STA C    6  2   4.783  28.970   7.590  0.42 25.57  .    3   1645
105
  HETA  O  O    STA C    6  2   3.613  28.832   7.209  0.42 25.84  .    3   1646
105
  HETA  O  OXT  STA C    6  2   5.185  29.974   8.416  0.42 25.36  .    3   1647
. HETA  O  O    HOH .  301  2  19.609   8.256 -11.680  0.50  3.60   2   5   1648
. HETA  O  O    HOH .  302  1  14.145   4.715 -12.845  0.50  7.49   2   5   1649
. HETA  O  O    HOH .  303  1  21.544  13.584  -0.953  0.42  6.33   2   5   1650
. HETA  O  O    HOH .  304  1  20.414   7.240 -10.171  0.50  7.84   2   5   1651
. HETA  O  O    HOH .  305  2  20.529  42.533  20.710  0.50 10.37   2   5   1652
. HETA  O  O    HOH .  306  .  21.990  23.978   4.762  1.00 11.52  .    5   1653
. HETA  O  O    HOH .  307  1  13.865  21.580  19.676  0.50 12.33   2   5   1654
. HETA  O  O    HOH .  308  .  11.556  20.972   6.581  1.00 12.08  .    5   1655
. HETA  O  O    HOH .  309  .  28.232  21.435   6.662  1.00 13.48  .    5   1656
. HETA  O  O    HOH .  310  2  24.438  43.839  18.167  0.50 14.61   2   5   1657
. HETA  O  O    HOH .  311  2   2.156  30.151   8.432  0.42 13.36   2   5   1658
. HETA  O  O    HOH .  312  2  12.913   5.625 -11.946  0.50 17.13   2   5   1659
. HETA  O  O    HOH .  313  .  20.992  22.291   6.269  1.00 16.90  .    5   1660
. HETA  O  O    HOH .  314  .  16.396  40.359   1.094  1.00 15.76  .    5   1661
. HETA  O  O    HOH .  315  2  13.061  22.336  21.051  0.50 16.22   2   5   1662
. HETA  O  O    HOH .  316  1  22.604  15.472  -1.686  0.58 15.28   2   5   1663
. HETA  O  O    HOH .  317  .  28.048  15.513 -11.350  1.00 17.32  .    5   1664
. HETA  O  O    HOH .  318  .  16.186  45.185  -0.190  1.00 17.30  .    5   1665
. HETA  O  O    HOH .  319  2  22.226  14.605   2.457  0.50 16.36   2   5   1666
. HETA  O  O    HOH .  320  .  10.125  40.156   5.370  1.00 17.05  .    5   1667
. HETA  O  O    HOH .  321  .  20.490  16.097  -3.172  1.00 17.33  .    5   1668
. HETA  O  O    HOH .  322  .  16.332  28.397  21.360  1.00 18.08  .    5   1669
. HETA  O  O    HOH .  323  .  30.893  26.875 -10.090  1.00 18.52  .    5   1670
. HETA  O  O    HOH .  324  .  11.138  30.992   1.336  1.00 18.93  .    5   1671
. HETA  O  O    HOH .  325  .  16.630  42.699   2.271  1.00 20.58  .    5   1672
. HETA  O  O    HOH .  326  .  28.539  28.580  -2.558  1.00 19.02  .    5   1673
. HETA  O  O    HOH .  327  .  14.805  29.343  28.071  1.00 20.30  .    5   1674
. HETA  O  O    HOH .  328  .   1.644  36.373  18.428  1.00 21.62  .    5   1675
. HETA  O  O    HOH .  329  .  14.451  45.047  11.620  1.00 22.76  .    5   1676
. HETA  O  O    HOH .  330  2  19.503  40.262  21.157  0.50 22.77   2   5   1677
. HETA  O  O    HOH .  331  .  16.938  45.838  11.029  1.00 25.82  .    5   1678
. HETA  O  O    HOH .  332  .   9.692  28.730   2.191  1.00 23.06  .    5   1679
. HETA  O  O    HOH .  333  .  11.714  39.207  -3.092  1.00 24.66  .    5   1680
. HETA  O  O    HOH .  334  .  25.412  12.832  -8.558  1.00 24.20  .    5   1681
. HETA  O  O    HOH .  335  .  10.378  18.322  14.455  1.00 25.44  .    5   1682
. HETA CL CL     CL .  336  .  25.517  16.297  -6.059  1.00 25.69  .    4   1683
. HETA  O  O    HOH .  337  .   4.199  38.495  21.414  1.00 26.56  .    5   1684
. HETA  O  O    HOH .  338  .  12.888  36.305  -3.863  1.00 26.82  .    5   1685
. HETA  O  O    HOH .  339  .  17.128  16.768 -17.355  1.00 26.33  .    5   1686
. HETA  O  O    HOH .  340  .   6.079  14.061  -4.567  1.00 27.10  .    5   1687
. HETA  O  O    HOH .  341  .  32.239  26.863   7.115  1.00 27.56  .    5   1688
. HETA  O  O    HOH .  342  .  28.515  27.966   4.557  1.00 27.34  .    5   1689
. HETA CL CL     CL .  343  .   8.030  39.142  10.823  1.00 27.91  .    4   1690
. HETA  O  O    HOH .  344  .   9.613  38.213   4.224  1.00 28.60  .    5   1691
. HETA  O  O    HOH .  345  .   8.529  35.703   5.266  1.00 26.67  .    5   1692
. HETA  O  O    HOH .  346  .   9.292  17.708  -9.559  1.00 27.52  .    5   1693
. HETA  O  O    HOH .  347  .   6.818  23.257 -10.636  1.00 27.35  .    5   1694
. HETA  O  O    HOH .  348  .   5.002  16.182  -3.395  1.00 29.66  .    5   1695
. HETA  O  O    HOH .  349  .  20.127   7.565   4.667  1.00 28.84  .    5   1696
. HETA  O  O    HOH .  350  .   6.407  34.773  -0.905  1.00 27.81  .    5   1697
. HETA  O  O    HOH .  351  2  26.692  38.809  20.152  0.50 29.74   2   5   1698
. HETA  O  O    HOH .  352  .  22.849  26.978  20.179  1.00 29.24  .    5   1699
. HETA  O  O    HOH .  353  .   6.659  25.399  21.439  1.00 29.33  .    5   1700
. HETA  O  O    HOH .  354  .  14.031  31.541 -13.122  1.00 29.49  .    5   1701
. HETA  O  O    HOH .  355  .  27.828  32.015 -10.716  1.00 31.25  .    5   1702
. HETA  O  O    HOH .  356  .  27.212  18.681  -5.983  1.00 31.03  .    5   1703
. HETA  O  O    HOH .  357  .   4.159  19.858  17.527  1.00 31.76  .    5   1704
. HETA  O  O    HOH .  358  .  20.873  -1.616  -5.508  1.00 32.98  .    5   1705
. HETA  O  O    HOH .  359  .   7.475  36.699   2.155  1.00 32.16  .    5   1706
. HETA  O  O    HOH .  360  .  27.586  20.757  -1.306  1.00 30.93  .    5   1707
. HETA  O  O    HOH .  361  .   6.483  20.469  -9.813  1.00 32.59  .    5   1708
. HETA  O  O    HOH .  362  .   7.191  15.718   3.496  1.00 32.60  .    5   1709
. HETA  O  O    HOH .  363  .   6.779  39.788  22.081  1.00 35.86  .    5   1710
. HETA  O  O    HOH .  364  .  28.250  34.103  -5.656  1.00 34.06  .    5   1711
. HETA  O  O    HOH .  365  .   4.014  31.299  -2.383  1.00 34.12  .    5   1712
. HETA  O  O    HOH .  366  .  24.900  39.886  -7.771  1.00 35.93  .    5   1713
. HETA  O  O    HOH .  367  .  25.276  19.601   0.359  1.00 33.76  .    5   1714
. HETA  O  O    HOH .  368  .   0.744  34.210  25.756  1.00 35.37  .    5   1715
. HETA  O  O    HOH .  369  .  20.331   1.241  -6.790  1.00 34.76  .    5   1716
. HETA  O  O    HOH .  370  .  14.813  16.187  11.513  1.00 33.52  .    5   1717
. HETA  O  O    HOH .  371  .  11.105  32.356 -12.040  1.00 36.20  .    5   1718
. HETA  O  O    HOH .  372  .  17.164  39.941  22.236  1.00 36.67  .    5   1719
. HETA  O  O    HOH .  373  1  18.856  42.804  22.226  0.50 26.65   2   5   1720
. HETA  O  O    HOH .  374  .   7.773  24.045  -6.218  1.00 36.71  .    5   1721
. HETA  O  O    HOH .  375  .  10.617   6.038  -1.435  1.00 38.25  .    5   1722
. HETA  O  O    HOH .  376  .  17.714  20.272 -18.200  1.00 39.33  .    5   1723
. HETA  O  O    HOH .  377  .  28.648  20.641  -3.619  1.00 36.83  .    5   1724
. HETA  O  O    HOH .  378  .   8.255   8.857   1.602  1.00 39.95  .    5   1725
. HETA  O  O    HOH .  379  .   4.627  22.272  -7.158  1.00 38.02  .    5   1726
. HETA  O  O    HOH .  380  .  33.132  40.146   5.257  1.00 39.23  .    5   1727
. HETA  O  O    HOH .  381  .  25.986  26.500 -19.146  1.00 38.51  .    5   1728
. HETA  O  O    HOH .  382  .   7.741  22.352 -20.071  1.00 41.04  .    5   1729
. HETA  O  O    HOH .  383  .  21.532   6.178  -8.055  1.00 39.97  .    5   1730
. HETA  O  O    HOH .  384  .   4.681  23.216  20.780  1.00 37.57  .    5   1731
. HETA  O  O    HOH .  385  .  12.520   3.839 -14.192  1.00 40.11  .    5   1732
. HETA  O  O    HOH .  386  .  31.006  27.199   2.955  1.00 37.81  .    5   1733
. HETA  O  O    HOH .  387  .  16.363  26.835 -16.616  1.00 39.62  .    5   1734
. HETA  O  O    HOH .  388  .  24.771  45.458  -4.999  1.00 40.16  .    5   1735
. HETA  O  O    HOH .  389  .  31.898  30.773   2.921  1.00 40.25  .    5   1736
. HETA  O  O    HOH .  390  .  25.886  18.383   2.355  1.00 43.30  .    5   1737
. HETA  O  O    HOH .  391  .  25.476  38.121  16.824  1.00 40.42  .    5   1738
. HETA  O  O    HOH .  392  .   5.770  29.056  -3.545  1.00 40.24  .    5   1739
. HETA  O  O    HOH .  393  .  19.488  13.412 -16.432  1.00 41.06  .    5   1740
. HETA  O  O    HOH .  394  .  21.319  44.274   0.457  1.00 41.48  .    5   1741
. HETA  O  O    HOH .  395  .   6.843  10.320 -11.022  1.00 43.17  .    5   1742
. HETA  O  O    HOH .  396  .  12.634  41.540  22.091  1.00 40.77  .    5   1743
. HETA  O  O    HOH .  397  .   6.459  16.502 -11.197  1.00 41.45  .    5   1744
. HETA  O  O    HOH .  398  .  15.253  36.377  -9.637  1.00 39.10  .    5   1745
. HETA  O  O    HOH .  399  .  28.625  37.031  -5.352  1.00 42.77  .    5   1746
. HETA  O  O    HOH .  400  .   8.831  34.292  -6.159  1.00 43.18  .    5   1747
. HETA  O  O    HOH .  401  .   5.493  13.906   4.165  1.00 42.14  .    5   1748
. HETA  O  O    HOH .  402  .   9.801   8.891  -3.116  1.00 42.42  .    5   1749
. HETA  O  O    HOH .  403  .  14.021  44.353  -3.403  1.00 40.40  .    5   1750
. HETA  O  O    HOH .  404  .   8.655  16.686 -21.639  1.00 44.77  .    5   1751
. HETA  O  O    HOH .  405  .   5.632  16.270  14.842  1.00 44.62  .    5   1752
. HETA  O  O    HOH .  406  .   5.260  33.466   1.411  1.00 45.78  .    5   1753
. HETA  O  O    HOH .  407  .  22.083   3.712  -7.841  1.00 45.29  .    5   1754
. HETA  O  O    HOH .  408  .  21.015  25.185  16.148  1.00 45.07  .    5   1755
. HETA  O  O    HOH .  409  .  29.887  27.688  14.520  1.00 43.62  .    5   1756
. HETA  O  O    HOH .  410  .  26.275   9.711  -3.949  1.00 49.36  .    5   1757
. HETA  O  O    HOH .  411  .  10.883   7.172 -12.465  1.00 46.19  .    5   1758
. HETA  O  O    HOH .  412  .   7.205  40.859  14.928  1.00 47.41  .    5   1759
. HETA  O  O    HOH .  413  .  12.764   5.053  -0.304  1.00 50.56  .    5   1760
. HETA  O  O    HOH .  414  .   9.344   4.655  -4.396  1.00 48.68  .    5   1761
. HETA  O  O    HOH .  415  .  12.655  37.357  -6.615  1.00 47.87  .    5   1762
. HETA  O  O    HOH .  416  .  19.610  26.505  21.044  1.00 48.34  .    5   1763
. HETA  O  O    HOH .  417  1  21.004  14.012   8.331  0.58 40.50   2   5   1764
. HETA  O  O    HOH .  418  .   6.733  20.961  21.723  1.00 52.72  .    5   1765
. HETA  O  O    HOH .  419  .  16.070  21.444 -24.165  1.00 49.16  .    5   1766
. HETA  O  O    HOH .  420  .   8.910  16.906  15.590  1.00 49.88  .    5   1767
. HETA  O  O    HOH .  421  .  22.527  45.937   5.985  1.00 48.55  .    5   1768
. HETA  O  O    HOH .  422  .  20.436  23.403  21.573  1.00 51.10  .    5   1769
. HETA  O  O    HOH .  423  .  31.118  30.136  -4.999  1.00 49.20  .    5   1770
. HETA  O  O    HOH .  424  .  13.210  34.486  -7.308  1.00 51.41  .    5   1771
. HETA  O  O    HOH .  425  .  10.762  19.938 -23.526  1.00 51.66  .    5   1772
. HETA  O  O    HOH .  426  .   6.741  40.273  -0.759  1.00 50.77  .    5   1773
. HETA  O  O    HOH .  427  .  32.100  34.057   4.917  1.00 50.70  .    5   1774
. HETA  O  O    HOH .  428  .  21.934   6.817   3.009  1.00 54.33  .    5   1775
. HETA  O  O    HOH .  429  .  22.381  29.129 -20.269  1.00 52.55  .    5   1776
. HETA  O  O    HOH .  430  .  24.564  42.064  -2.572  1.00 49.54  .    5   1777
. HETA  O  O    HOH .  431  .  25.664   6.947  -5.064  1.00 50.54  .    5   1778
. HETA  O  O    HOH .  432  .   7.971  13.332  13.757  1.00 50.51  .    5   1779
. HETA  O  O    HOH .  433  .  19.934  46.439   6.673  1.00 52.28  .    5   1780
. HETA  O  O    HOH .  434  .  21.768   0.286  -3.996  1.00 51.04  .    5   1781
. HETA  O  O    HOH .  435  .  28.418  39.504  -4.907  1.00 54.91  .    5   1782
. HETA  O  O    HOH .  436  .  31.515  29.312  -8.555  1.00 55.72  .    5   1783
. HETA  O  O    HOH .  437  .  29.069  25.318   8.683  1.00 54.42  .    5   1784
. HETA  O  O    HOH .  438  .  21.471  34.236 -14.917  1.00 52.70  .    5   1785
. HETA  O  O    HOH .  439  .  29.320  28.794   7.803  1.00 53.04  .    5   1786
. HETA  O  O    HOH .  440  .   4.229  15.631  11.962  1.00 52.37  .    5   1787
. HETA  O  O    HOH .  441  .  11.002  11.470  12.389  1.00 53.16  .    5   1788
. HETA  O  O    HOH .  442  .  18.146   4.576   3.604  1.00 52.16  .    5   1789
. HETA  O  O    HOH .  443  .  10.346  13.385 -16.341  1.00 53.44  .    5   1790
. HETA  O  O    HOH .  444  .   2.737  25.920   0.429  1.00 54.13  .    5   1791
. HETA  O  O    HOH .  445  .   5.877  33.211  -3.902  1.00 52.25  .    5   1792
. HETA  O  O    HOH .  446  .   1.657  39.855  13.193  1.00 57.40  .    5   1793
. HETA  O  O    HOH .  447  .  28.044  34.368  13.262  1.00 52.39  .    5   1794
. HETA  O  O    HOH .  448  .  14.519  34.117 -11.475  1.00 57.06  .    5   1795
. HETA  O  O    HOH .  449  .   4.065  37.065  11.353  1.00 61.58  .    5   1796
. HETA  O  O    HOH .  450  .  -2.347  35.511  23.276  1.00 58.33  .    5   1797
. HETA  O  O    HOH .  451  .  29.391  36.502  15.127  1.00 57.27  .    5   1798
. HETA  O  O    HOH .  452  .   6.526  13.023 -14.337  1.00 56.35  .    5   1799
. HETA  O  O    HOH .  453  .  18.486   9.101   9.149  1.00 56.86  .    5   1800
. HETA  O  O    HOH .  454  .   1.871  32.853  -0.794  1.00 55.39  .    5   1801
. HETA  O  O    HOH .  455  .  15.348  33.876  27.425  1.00 60.14  .    5   1802
. HETA  O  O    HOH .  456  .  24.620  21.870  11.410  1.00 55.03  .    5   1803
. HETA  O  O    HOH .  457  .  22.645  22.695  14.892  1.00 61.88  .    5   1804
. HETA  O  O    HOH .  458  .  21.000   3.439 -15.064  1.00 55.47  .    5   1805
. HETA  O  O    HOH .  459  .  27.668  25.257 -13.130  1.00 56.85  .    5   1806
. HETA  O  O    HOH .  460  .  12.551  16.056  13.298  1.00 58.82  .    5   1807
. HETA  O  O    HOH .  461  .  26.521  41.124  -3.405  1.00 63.59  .    5   1808
. HETA  O  O    HOH .  462  .   6.096  27.068  -5.213  1.00 58.17  .    5   1809
. HETA  O  O    HOH .  463  .  21.875   7.380  -0.272  1.00 58.23  .    5   1810
. HETA  O  O    HOH .  464  .  -2.584  31.731  23.419  1.00 58.88  .    5   1811
. HETA  O  O    HOH .  465  .   1.175  17.871  14.292  1.00 58.68  .    5   1812
. HETA  O  O    HOH .  466  .  25.304  47.424  17.654  1.00 64.11  .    5   1813
. HETA  O  O    HOH .  467  .  20.744  10.521   5.168  1.00 64.36  .    5   1814
. HETA  O  O    HOH .  468  .   1.783  29.137   4.181  1.00 60.69  .    5   1815
. HETA  O  O    HOH .  469  .   4.853  25.600  -8.919  1.00 59.74  .    5   1816
. HETA  O  O    HOH .  470  .  11.169  34.522  31.326  1.00 63.37  .    5   1817
. HETA  O  O    HOH .  471  .   8.171  28.125 -15.103  1.00 60.67  .    5   1818
. HETA  O  O    HOH .  472  .  22.143  17.188  10.848  1.00 64.29  .    5   1819



####################
#                  #
# DATABASE_2       #
#                  #
####################


_database_2.database_id			PDB 
_database_2.database_code		5HVP 



####################
#                  #
# DATABASE_PDB_REV #
#                  #
####################


_database_PDB_rev.date_original	1990-04-30

loop_
_database_PDB_rev.num
_database_PDB_rev.date
_database_PDB_rev.mod_type
  1	1991-10-15	0 



####################
#                  #
# STRUCT_BIOL      #
#                  #
####################


_struct_biol.id         5HVP 
_struct_biol.details   'HYDROLASE(ACID PROTEINASE)              '



################
#              #
# STRUCT_SHEET #
#              #
################

loop_
_struct_sheet.id
_struct_sheet.number_strands
 S1     4
 S2     2
 S3     3
 S4     2
 S5     2
 S6     2
 S7     3
 S8     2
 S9     2

loop_
_struct_sheet_hbond.sheet_id
_struct_sheet_hbond.range_id_1
_struct_sheet_hbond.range_id_2
_struct_sheet_hbond.range_1_beg_label_seq_id
_struct_sheet_hbond.range_1_beg_label_atom_id
_struct_sheet_hbond.range_2_beg_label_seq_id
_struct_sheet_hbond.range_2_beg_label_atom_id
_struct_sheet_hbond.range_1_end_label_seq_id
_struct_sheet_hbond.range_1_end_label_atom_id
_struct_sheet_hbond.range_2_end_label_seq_id
_struct_sheet_hbond.range_2_end_label_atom_id
 S1    1_S1    2_S1    3   N    297   O      3   N    297   O  
 S1    2_S1    3_S1  298   N     96   O    298   N     96   O  
 S1    3_S1    4_S1   97   N    203   O     97   N    203   O  
 S2    1_S2    2_S2   11   N     22   O     11   N     22   O  
 S3    1_S3    2_S3   23   N     83   O     23   N     83   O  
 S3    2_S3    3_S3   84   O     32   N     84   O     32   N  
 S4    1_S4    2_S4   43   N     58   O     43   N     58   O  
 S5    1_S5    2_S5   62   O     73   N     62   O     73   N  
 S6    1_S6    2_S6  211   N    222   O    211   N    222   O  
 S7    1_S7    2_S7  223   N    283   O    223   N    283   O  
 S7    2_S7    3_S7  284   O    232   N    284   O    232   N  
 S8    1_S8    2_S8  243   N    258   O    243   N    258   O  
 S9    1_S9    2_S9  262   O    273   N    262   O    273   N  

loop_
_struct_sheet_order.sheet_id
_struct_sheet_order.range_id_1
_struct_sheet_order.range_id_2
_struct_sheet_order.offset
_struct_sheet_order.sense
 S1    1_S1    2_S1 +1 anti-parallel
 S1    2_S1    3_S1 +1 anti-parallel
 S1    3_S1    4_S1 +1 anti-parallel
 S2    1_S2    2_S2 +1 anti-parallel
 S3    1_S3    2_S3 +1 parallel
 S3    2_S3    3_S3 +1 anti-parallel
 S4    1_S4    2_S4 +1 anti-parallel
 S5    1_S5    2_S5 +1 anti-parallel
 S6    1_S6    2_S6 +1 anti-parallel
 S7    1_S7    2_S7 +1 parallel
 S7    2_S7    3_S7 +1 anti-parallel
 S8    1_S8    2_S8 +1 anti-parallel
 S9    1_S9    2_S9 +1 anti-parallel

loop_
_struct_sheet_range.sheet_id
_struct_sheet_range.id
_struct_sheet_range.beg_label_comp_id
_struct_sheet_range.beg_label_asym_id
_struct_sheet_range.beg_label_seq_id
_struct_sheet_range.end_label_comp_id
_struct_sheet_range.end_label_asym_id
_struct_sheet_range.end_label_seq_id
 S1    1_S1 PRO A    1  LEU A    5 
 S1    2_S1 CYS B  295  PHE B  299 
 S1    3_S1 CYS A   95  PHE A   99 
 S1    4_S1 PRO B  201  LEU B  205 
 S2    1_S2 VAL A   11  ILE A   15 
 S2    2_S2 GLN A   18  ALA A   22 
 S3    1_S3 ALA A   22  LEU A   24 
 S3    2_S3 ASN A   83  GLY A   86 
 S3    3_S3 ASP A   30  VAL A   32 
 S4    1_S4 LYS A   43  GLY A   49 
 S4    2_S4 GLY A   52  GLN A   58 
 S5    1_S5 ILE A   62  ILE A   66 
 S5    2_S5 HIS A   69  GLY A   73 
 S6    1_S6 VAL B  211  ILE B  215 
 S6    2_S6 GLN B  218  ALA B  222 
 S7    1_S7 ALA B  222  LEU B  224 
 S7    2_S7 ASN B  283  GLY B  286 
 S7    3_S7 ASP B  230  VAL B  232 
 S8    1_S8 LYS B  243  GLY B  249 
 S8    2_S8 GLY B  252  GLN B  258 
 S9    1_S9 ILE B  262  ILE B  266 
 S9    2_S9 HIS B  269  GLY B  273 

# REMARK records parsed 	=     87;# specified by PDB 	=     87
# FTNOTE records parsed 	=     13;# specified by PDB 	=     13
# HET records parsed 		=      4;# specified by PDB 	=      4
# HELIX records parsed 		=      2;# specified by PDB 	=      2
# SHEET records parsed 		=     22;# specified by PDB 	=     22
# TURN records parsed 		=      8;# specified by PDB 	=      8
# SITE records parsed 		=      0;# specified by PDB 	=      0
# AT+HET records parsed 	=   1802;# specified by PDB 	=   1802
# TER records parsed 		=      2;# specified by PDB 	=      2
# CONECT records parsed 	=     46;# specified by PDB 	=     46
# SEQRES records parsed 	=     17;# specified by PDB 	=     17
# Total of   4064 records processed from PDB file