longtext: 9V2P-pdb

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HEADER    VIRAL PROTEIN/HYDROLASE                 20-MAY-25   9V2P
TITLE     COMPLEX STRUCTURE OF GX2012 SPIKE RBD BOUND TO HUMAN DPP4
COMPND    MOL_ID: 1;
COMPND   2 MOLECULE: DIPEPTIDYL PEPTIDASE 4 SOLUBLE FORM;
COMPND   3 CHAIN: A, B;
COMPND   4 SYNONYM: DIPEPTIDYL PEPTIDASE IV SOLUBLE FORM;
COMPND   5 ENGINEERED: YES;
COMPND   6 MOL_ID: 2;
COMPND   7 MOLECULE: SPIKE GLYCOPROTEIN;
COMPND   8 CHAIN: G;
COMPND   9 SYNONYM: S GLYCOPROTEIN,E2,PEPLOMER PROTEIN;
COMPND  10 ENGINEERED: YES
SOURCE    MOL_ID: 1;
SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
SOURCE   3 ORGANISM_COMMON: HUMAN;
SOURCE   4 ORGANISM_TAXID: 9606;
SOURCE   5 GENE: DPP4, ADCP2, CD26;
SOURCE   6 EXPRESSION_SYSTEM: HOMO SAPIENS;
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 9606;
SOURCE   8 MOL_ID: 2;
SOURCE   9 ORGANISM_SCIENTIFIC: BTTP-BETACOV/GX2012;
SOURCE  10 ORGANISM_TAXID: 1503304;
SOURCE  11 EXPRESSION_SYSTEM: TRICHOPLUSIA NI;
SOURCE  12 EXPRESSION_SYSTEM_TAXID: 7111
KEYWDS    GX2012 RBD, HUMAN DPP4, VIRAL PROTEIN, HYDROLASE, VIRAL
KEYWDS   2 PROTEIN/HYDROLASE, VIRAL PROTEIN-HYDROLASE COMPLEX
EXPDTA    ELECTRON MICROSCOPY
AUTHOR    X.WANG,Z.LIN
REVDAT   1   24-DEC-25 9V2P    0
JRNL        AUTH   X.WANG,Z.LIN
JRNL        TITL   COMPLEX STRUCTURE OF GX2012 SPIKE RBD BOUND TO HUMAN DPP4
JRNL        REF    TO BE PUBLISHED
JRNL        REFN
REMARK   2
REMARK   2 RESOLUTION.    2.40 ANGSTROMS.
REMARK   3
REMARK   3 REFINEMENT.
REMARK   3   SOFTWARE PACKAGES      : CRYOSPARC, COOT
REMARK   3   RECONSTRUCTION SCHEMA  : NULL
REMARK   3
REMARK   3 EM MAP-MODEL FITTING AND REFINEMENT
REMARK   3   PDB ENTRY                    : NULL
REMARK   3   REFINEMENT SPACE             : NULL
REMARK   3   REFINEMENT PROTOCOL          : NULL
REMARK   3   REFINEMENT TARGET            : NULL
REMARK   3   OVERALL ANISOTROPIC B VALUE  : NULL
REMARK   3
REMARK   3 FITTING PROCEDURE : NULL
REMARK   3
REMARK   3 EM IMAGE RECONSTRUCTION STATISTICS
REMARK   3   NOMINAL PIXEL SIZE (ANGSTROMS)    : NULL
REMARK   3   ACTUAL PIXEL SIZE  (ANGSTROMS)    : NULL
REMARK   3   EFFECTIVE RESOLUTION (ANGSTROMS)  : 2.400
REMARK   3   NUMBER OF PARTICLES               : 447216
REMARK   3   CTF CORRECTION METHOD             : NONE
REMARK   3
REMARK   3 EM RECONSTRUCTION MAGNIFICATION CALIBRATION: NULL
REMARK   3
REMARK   3 OTHER DETAILS: NULL
REMARK   4
REMARK   4 9V2P COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBC ON 23-MAY-25.
REMARK 100 THE DEPOSITION ID IS D_1300059646.
REMARK 245
REMARK 245 EXPERIMENTAL DETAILS
REMARK 245   RECONSTRUCTION METHOD          : SINGLE PARTICLE
REMARK 245   SPECIMEN TYPE                  : NULL
REMARK 245
REMARK 245 ELECTRON MICROSCOPE SAMPLE
REMARK 245   SAMPLE TYPE                    : PARTICLE
REMARK 245   PARTICLE TYPE                  : POINT
REMARK 245   NAME OF SAMPLE                 : COMPLEX STRUCTURE OF GX2012
REMARK 245                                    SPIKE RBD BOUND TO HUMAN DPP4
REMARK 245   SAMPLE CONCENTRATION (MG ML-1) : NULL
REMARK 245   SAMPLE SUPPORT DETAILS         : NULL
REMARK 245   SAMPLE VITRIFICATION DETAILS   : NULL
REMARK 245   SAMPLE BUFFER                  : NULL
REMARK 245   PH                             : 8.00
REMARK 245   SAMPLE DETAILS                 : NULL
REMARK 245
REMARK 245 DATA ACQUISITION
REMARK 245   DATE OF EXPERIMENT                : NULL
REMARK 245   NUMBER OF MICROGRAPHS-IMAGES      : NULL
REMARK 245   TEMPERATURE (KELVIN)              : NULL
REMARK 245   MICROSCOPE MODEL                  : TFS KRIOS
REMARK 245   DETECTOR TYPE                     : GATAN K3 (6K X 4K)
REMARK 245   MINIMUM DEFOCUS (NM)              : 1200.00
REMARK 245   MAXIMUM DEFOCUS (NM)              : 1800.00
REMARK 245   MINIMUM TILT ANGLE (DEGREES)      : NULL
REMARK 245   MAXIMUM TILT ANGLE (DEGREES)      : NULL
REMARK 245   NOMINAL CS                        : NULL
REMARK 245   IMAGING MODE                      : BRIGHT FIELD
REMARK 245   ELECTRON DOSE (ELECTRONS NM**-2)  : 5000.00
REMARK 245   ILLUMINATION MODE                 : FLOOD BEAM
REMARK 245   NOMINAL MAGNIFICATION             : NULL
REMARK 245   CALIBRATED MAGNIFICATION          : NULL
REMARK 245   SOURCE                            : FIELD EMISSION GUN
REMARK 245   ACCELERATION VOLTAGE (KV)         : 300
REMARK 245   IMAGING DETAILS                   : NULL
REMARK 247
REMARK 247 ELECTRON MICROSCOPY
REMARK 247  THE COORDINATES IN THIS ENTRY WERE GENERATED FROM ELECTRON
REMARK 247  MICROSCOPY DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE
REMARK 247  THAT CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES
REMARK 247  ON THESE RECORDS ARE MEANINGLESS EXCEPT FOR THE CALCULATION
REMARK 247  OF THE STRUCTURE FACTORS.
REMARK 300
REMARK 300 BIOMOLECULE: 1
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
REMARK 300 BURIED SURFACE AREA.
REMARK 350
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
REMARK 350
REMARK 350 BIOMOLECULE: 1
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC
REMARK 350 SOFTWARE USED: PISA
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, G, C, D, E, F, H, I, J,
REMARK 350                    AND CHAINS: K, L, M, N, O
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT
REMARK 500
REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.
REMARK 500
REMARK 500  ATM1  RES C  SSEQI   ATM2  RES C  SSEQI           DISTANCE
REMARK 500   O    VAL B   639     OG   SER B   642              2.11
REMARK 500   O    GLY B   580     OG   SER B   583              2.17
REMARK 500   O    GLU A   244     OH   TYR B   661              2.19
REMARK 500
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: COVALENT BOND ANGLES
REMARK 500
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 STANDARD TABLE:
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)
REMARK 500
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996
REMARK 500
REMARK 500  M RES CSSEQI ATM1   ATM2   ATM3
REMARK 500    CYS B 339   CA  -  CB  -  SG  ANGL. DEV. =   8.1 DEGREES
REMARK 500
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: TORSION ANGLES
REMARK 500
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 STANDARD TABLE:
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
REMARK 500
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400
REMARK 500
REMARK 500  M RES CSSEQI        PSI       PHI
REMARK 500    GLU A  73     -130.37     63.62
REMARK 500    SER A  93      166.85    179.21
REMARK 500    GLU A  97      -59.27   -120.35
REMARK 500    PHE A  98      111.24     66.12
REMARK 500    LYS A 139      -71.79   -116.35
REMARK 500    ARG A 140      -27.39   -149.08
REMARK 500    PRO A 149      160.20    -45.58
REMARK 500    ASN A 150       51.10    -91.09
REMARK 500    ASN A 151       21.67    174.66
REMARK 500    HIS A 162       43.41   -140.11
REMARK 500    ASP A 200     -168.50    -79.23
REMARK 500    VAL A 207      -64.26    -97.76
REMARK 500    SER A 242     -155.15     60.30
REMARK 500    ALA A 306      -91.40    -87.28
REMARK 500    GLN A 320       81.92    -49.21
REMARK 500    LYS A 423       12.16     59.05
REMARK 500    SER A 437      -70.17    -70.13
REMARK 500    ASN A 450       78.85   -159.29
REMARK 500    GLU A 464       -1.41     68.88
REMARK 500    ASN A 520     -129.52     62.96
REMARK 500    ALA A 548       16.70     47.85
REMARK 500    SER A 630     -115.45     62.90
REMARK 500    ASP A 678      -69.31    -95.80
REMARK 500    ASN A 679       18.37   -145.97
REMARK 500    SER A 686       45.52    -87.88
REMARK 500    ASN A 710      -61.76    -92.88
REMARK 500    MET A 733      119.90   -161.37
REMARK 500    HIS B  66       12.93   -142.37
REMARK 500    GLU B  73      -72.03     53.68
REMARK 500    PHE B  98       62.00     27.78
REMARK 500    TRP B 124     -169.02   -109.16
REMARK 500    LYS B 139      -70.36   -120.54
REMARK 500    ARG B 140      -17.88   -148.87
REMARK 500    GLU B 146       90.53     52.22
REMARK 500    ASN B 151       50.23   -109.53
REMARK 500    ASP B 192       -2.42     66.76
REMARK 500    ASP B 200     -169.70    -78.49
REMARK 500    VAL B 207      -61.26    -97.71
REMARK 500    SER B 242     -158.72     61.71
REMARK 500    ALA B 306       68.12   -101.56
REMARK 500    THR B 307      168.82     82.54
REMARK 500    GLU B 309      -32.98     78.85
REMARK 500    GLN B 320       35.11    -80.43
REMARK 500    ASN B 450       72.36   -159.82
REMARK 500    GLU B 464       -2.75     66.71
REMARK 500    ASN B 520     -130.25     62.89
REMARK 500    TYR B 547      -53.14   -122.08
REMARK 500    CYS B 551      -15.43     69.22
REMARK 500    TYR B 585       69.50   -100.39
REMARK 500    SER B 630     -114.85     63.82
REMARK 500
REMARK 500 THIS ENTRY HAS      58 RAMACHANDRAN OUTLIERS.
REMARK 500
REMARK 500 REMARK: NULL
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: EMD-64736   RELATED DB: EMDB
REMARK 900 COMPLEX STRUCTURE OF GX2012 SPIKE RBD BOUND TO HUMAN DPP4
DBREF  9V2P A   40   766  UNP    P27487   DPP4_HUMAN      40    766
DBREF  9V2P B   40   766  UNP    P27487   DPP4_HUMAN      40    766
DBREF1 9V2P G  386   594  UNP                  A0A0U1WJZ6_BCHK4
DBREF2 9V2P G     A0A0U1WJZ6                        386         594
SEQRES   1 A  727  ARG LYS THR TYR THR LEU THR ASP TYR LEU LYS ASN THR
SEQRES   2 A  727  TYR ARG LEU LYS LEU TYR SER LEU ARG TRP ILE SER ASP
SEQRES   3 A  727  HIS GLU TYR LEU TYR LYS GLN GLU ASN ASN ILE LEU VAL
SEQRES   4 A  727  PHE ASN ALA GLU TYR GLY ASN SER SER VAL PHE LEU GLU
SEQRES   5 A  727  ASN SER THR PHE ASP GLU PHE GLY HIS SER ILE ASN ASP
SEQRES   6 A  727  TYR SER ILE SER PRO ASP GLY GLN PHE ILE LEU LEU GLU
SEQRES   7 A  727  TYR ASN TYR VAL LYS GLN TRP ARG HIS SER TYR THR ALA
SEQRES   8 A  727  SER TYR ASP ILE TYR ASP LEU ASN LYS ARG GLN LEU ILE
SEQRES   9 A  727  THR GLU GLU ARG ILE PRO ASN ASN THR GLN TRP VAL THR
SEQRES  10 A  727  TRP SER PRO VAL GLY HIS LYS LEU ALA TYR VAL TRP ASN
SEQRES  11 A  727  ASN ASP ILE TYR VAL LYS ILE GLU PRO ASN LEU PRO SER
SEQRES  12 A  727  TYR ARG ILE THR TRP THR GLY LYS GLU ASP ILE ILE TYR
SEQRES  13 A  727  ASN GLY ILE THR ASP TRP VAL TYR GLU GLU GLU VAL PHE
SEQRES  14 A  727  SER ALA TYR SER ALA LEU TRP TRP SER PRO ASN GLY THR
SEQRES  15 A  727  PHE LEU ALA TYR ALA GLN PHE ASN ASP THR GLU VAL PRO
SEQRES  16 A  727  LEU ILE GLU TYR SER PHE TYR SER ASP GLU SER LEU GLN
SEQRES  17 A  727  TYR PRO LYS THR VAL ARG VAL PRO TYR PRO LYS ALA GLY
SEQRES  18 A  727  ALA VAL ASN PRO THR VAL LYS PHE PHE VAL VAL ASN THR
SEQRES  19 A  727  ASP SER LEU SER SER VAL THR ASN ALA THR SER ILE GLN
SEQRES  20 A  727  ILE THR ALA PRO ALA SER MET LEU ILE GLY ASP HIS TYR
SEQRES  21 A  727  LEU CYS ASP VAL THR TRP ALA THR GLN GLU ARG ILE SER
SEQRES  22 A  727  LEU GLN TRP LEU ARG ARG ILE GLN ASN TYR SER VAL MET
SEQRES  23 A  727  ASP ILE CYS ASP TYR ASP GLU SER SER GLY ARG TRP ASN
SEQRES  24 A  727  CYS LEU VAL ALA ARG GLN HIS ILE GLU MET SER THR THR
SEQRES  25 A  727  GLY TRP VAL GLY ARG PHE ARG PRO SER GLU PRO HIS PHE
SEQRES  26 A  727  THR LEU ASP GLY ASN SER PHE TYR LYS ILE ILE SER ASN
SEQRES  27 A  727  GLU GLU GLY TYR ARG HIS ILE CYS TYR PHE GLN ILE ASP
SEQRES  28 A  727  LYS LYS ASP CYS THR PHE ILE THR LYS GLY THR TRP GLU
SEQRES  29 A  727  VAL ILE GLY ILE GLU ALA LEU THR SER ASP TYR LEU TYR
SEQRES  30 A  727  TYR ILE SER ASN GLU TYR LYS GLY MET PRO GLY GLY ARG
SEQRES  31 A  727  ASN LEU TYR LYS ILE GLN LEU SER ASP TYR THR LYS VAL
SEQRES  32 A  727  THR CYS LEU SER CYS GLU LEU ASN PRO GLU ARG CYS GLN
SEQRES  33 A  727  TYR TYR SER VAL SER PHE SER LYS GLU ALA LYS TYR TYR
SEQRES  34 A  727  GLN LEU ARG CYS SER GLY PRO GLY LEU PRO LEU TYR THR
SEQRES  35 A  727  LEU HIS SER SER VAL ASN ASP LYS GLY LEU ARG VAL LEU
SEQRES  36 A  727  GLU ASP ASN SER ALA LEU ASP LYS MET LEU GLN ASN VAL
SEQRES  37 A  727  GLN MET PRO SER LYS LYS LEU ASP PHE ILE ILE LEU ASN
SEQRES  38 A  727  GLU THR LYS PHE TRP TYR GLN MET ILE LEU PRO PRO HIS
SEQRES  39 A  727  PHE ASP LYS SER LYS LYS TYR PRO LEU LEU LEU ASP VAL
SEQRES  40 A  727  TYR ALA GLY PRO CYS SER GLN LYS ALA ASP THR VAL PHE
SEQRES  41 A  727  ARG LEU ASN TRP ALA THR TYR LEU ALA SER THR GLU ASN
SEQRES  42 A  727  ILE ILE VAL ALA SER PHE ASP GLY ARG GLY SER GLY TYR
SEQRES  43 A  727  GLN GLY ASP LYS ILE MET HIS ALA ILE ASN ARG ARG LEU
SEQRES  44 A  727  GLY THR PHE GLU VAL GLU ASP GLN ILE GLU ALA ALA ARG
SEQRES  45 A  727  GLN PHE SER LYS MET GLY PHE VAL ASP ASN LYS ARG ILE
SEQRES  46 A  727  ALA ILE TRP GLY TRP SER TYR GLY GLY TYR VAL THR SER
SEQRES  47 A  727  MET VAL LEU GLY SER GLY SER GLY VAL PHE LYS CYS GLY
SEQRES  48 A  727  ILE ALA VAL ALA PRO VAL SER ARG TRP GLU TYR TYR ASP
SEQRES  49 A  727  SER VAL TYR THR GLU ARG TYR MET GLY LEU PRO THR PRO
SEQRES  50 A  727  GLU ASP ASN LEU ASP HIS TYR ARG ASN SER THR VAL MET
SEQRES  51 A  727  SER ARG ALA GLU ASN PHE LYS GLN VAL GLU TYR LEU LEU
SEQRES  52 A  727  ILE HIS GLY THR ALA ASP ASP ASN VAL HIS PHE GLN GLN
SEQRES  53 A  727  SER ALA GLN ILE SER LYS ALA LEU VAL ASP VAL GLY VAL
SEQRES  54 A  727  ASP PHE GLN ALA MET TRP TYR THR ASP GLU ASP HIS GLY
SEQRES  55 A  727  ILE ALA SER SER THR ALA HIS GLN HIS ILE TYR THR HIS
SEQRES  56 A  727  MET SER HIS PHE ILE LYS GLN CYS PHE SER LEU PRO
SEQRES   1 B  727  ARG LYS THR TYR THR LEU THR ASP TYR LEU LYS ASN THR
SEQRES   2 B  727  TYR ARG LEU LYS LEU TYR SER LEU ARG TRP ILE SER ASP
SEQRES   3 B  727  HIS GLU TYR LEU TYR LYS GLN GLU ASN ASN ILE LEU VAL
SEQRES   4 B  727  PHE ASN ALA GLU TYR GLY ASN SER SER VAL PHE LEU GLU
SEQRES   5 B  727  ASN SER THR PHE ASP GLU PHE GLY HIS SER ILE ASN ASP
SEQRES   6 B  727  TYR SER ILE SER PRO ASP GLY GLN PHE ILE LEU LEU GLU
SEQRES   7 B  727  TYR ASN TYR VAL LYS GLN TRP ARG HIS SER TYR THR ALA
SEQRES   8 B  727  SER TYR ASP ILE TYR ASP LEU ASN LYS ARG GLN LEU ILE
SEQRES   9 B  727  THR GLU GLU ARG ILE PRO ASN ASN THR GLN TRP VAL THR
SEQRES  10 B  727  TRP SER PRO VAL GLY HIS LYS LEU ALA TYR VAL TRP ASN
SEQRES  11 B  727  ASN ASP ILE TYR VAL LYS ILE GLU PRO ASN LEU PRO SER
SEQRES  12 B  727  TYR ARG ILE THR TRP THR GLY LYS GLU ASP ILE ILE TYR
SEQRES  13 B  727  ASN GLY ILE THR ASP TRP VAL TYR GLU GLU GLU VAL PHE
SEQRES  14 B  727  SER ALA TYR SER ALA LEU TRP TRP SER PRO ASN GLY THR
SEQRES  15 B  727  PHE LEU ALA TYR ALA GLN PHE ASN ASP THR GLU VAL PRO
SEQRES  16 B  727  LEU ILE GLU TYR SER PHE TYR SER ASP GLU SER LEU GLN
SEQRES  17 B  727  TYR PRO LYS THR VAL ARG VAL PRO TYR PRO LYS ALA GLY
SEQRES  18 B  727  ALA VAL ASN PRO THR VAL LYS PHE PHE VAL VAL ASN THR
SEQRES  19 B  727  ASP SER LEU SER SER VAL THR ASN ALA THR SER ILE GLN
SEQRES  20 B  727  ILE THR ALA PRO ALA SER MET LEU ILE GLY ASP HIS TYR
SEQRES  21 B  727  LEU CYS ASP VAL THR TRP ALA THR GLN GLU ARG ILE SER
SEQRES  22 B  727  LEU GLN TRP LEU ARG ARG ILE GLN ASN TYR SER VAL MET
SEQRES  23 B  727  ASP ILE CYS ASP TYR ASP GLU SER SER GLY ARG TRP ASN
SEQRES  24 B  727  CYS LEU VAL ALA ARG GLN HIS ILE GLU MET SER THR THR
SEQRES  25 B  727  GLY TRP VAL GLY ARG PHE ARG PRO SER GLU PRO HIS PHE
SEQRES  26 B  727  THR LEU ASP GLY ASN SER PHE TYR LYS ILE ILE SER ASN
SEQRES  27 B  727  GLU GLU GLY TYR ARG HIS ILE CYS TYR PHE GLN ILE ASP
SEQRES  28 B  727  LYS LYS ASP CYS THR PHE ILE THR LYS GLY THR TRP GLU
SEQRES  29 B  727  VAL ILE GLY ILE GLU ALA LEU THR SER ASP TYR LEU TYR
SEQRES  30 B  727  TYR ILE SER ASN GLU TYR LYS GLY MET PRO GLY GLY ARG
SEQRES  31 B  727  ASN LEU TYR LYS ILE GLN LEU SER ASP TYR THR LYS VAL
SEQRES  32 B  727  THR CYS LEU SER CYS GLU LEU ASN PRO GLU ARG CYS GLN
SEQRES  33 B  727  TYR TYR SER VAL SER PHE SER LYS GLU ALA LYS TYR TYR
SEQRES  34 B  727  GLN LEU ARG CYS SER GLY PRO GLY LEU PRO LEU TYR THR
SEQRES  35 B  727  LEU HIS SER SER VAL ASN ASP LYS GLY LEU ARG VAL LEU
SEQRES  36 B  727  GLU ASP ASN SER ALA LEU ASP LYS MET LEU GLN ASN VAL
SEQRES  37 B  727  GLN MET PRO SER LYS LYS LEU ASP PHE ILE ILE LEU ASN
SEQRES  38 B  727  GLU THR LYS PHE TRP TYR GLN MET ILE LEU PRO PRO HIS
SEQRES  39 B  727  PHE ASP LYS SER LYS LYS TYR PRO LEU LEU LEU ASP VAL
SEQRES  40 B  727  TYR ALA GLY PRO CYS SER GLN LYS ALA ASP THR VAL PHE
SEQRES  41 B  727  ARG LEU ASN TRP ALA THR TYR LEU ALA SER THR GLU ASN
SEQRES  42 B  727  ILE ILE VAL ALA SER PHE ASP GLY ARG GLY SER GLY TYR
SEQRES  43 B  727  GLN GLY ASP LYS ILE MET HIS ALA ILE ASN ARG ARG LEU
SEQRES  44 B  727  GLY THR PHE GLU VAL GLU ASP GLN ILE GLU ALA ALA ARG
SEQRES  45 B  727  GLN PHE SER LYS MET GLY PHE VAL ASP ASN LYS ARG ILE
SEQRES  46 B  727  ALA ILE TRP GLY TRP SER TYR GLY GLY TYR VAL THR SER
SEQRES  47 B  727  MET VAL LEU GLY SER GLY SER GLY VAL PHE LYS CYS GLY
SEQRES  48 B  727  ILE ALA VAL ALA PRO VAL SER ARG TRP GLU TYR TYR ASP
SEQRES  49 B  727  SER VAL TYR THR GLU ARG TYR MET GLY LEU PRO THR PRO
SEQRES  50 B  727  GLU ASP ASN LEU ASP HIS TYR ARG ASN SER THR VAL MET
SEQRES  51 B  727  SER ARG ALA GLU ASN PHE LYS GLN VAL GLU TYR LEU LEU
SEQRES  52 B  727  ILE HIS GLY THR ALA ASP ASP ASN VAL HIS PHE GLN GLN
SEQRES  53 B  727  SER ALA GLN ILE SER LYS ALA LEU VAL ASP VAL GLY VAL
SEQRES  54 B  727  ASP PHE GLN ALA MET TRP TYR THR ASP GLU ASP HIS GLY
SEQRES  55 B  727  ILE ALA SER SER THR ALA HIS GLN HIS ILE TYR THR HIS
SEQRES  56 B  727  MET SER HIS PHE ILE LYS GLN CYS PHE SER LEU PRO
SEQRES   1 G  209  THR GLU CYS ASP PHE SER PRO MET PHE LYS GLY VAL ALA
SEQRES   2 G  209  PRO GLN VAL TYR ASN PHE LYS ARG LEU VAL PHE SER ASN
SEQRES   3 G  209  CYS ASN TYR ASN LEU THR LYS LEU LEU SER LEU PHE ALA
SEQRES   4 G  209  VAL ASP GLU PHE SER CYS ASN GLY ILE SER PRO ASP ALA
SEQRES   5 G  209  ILE ALA ARG GLY CYS TYR SER THR LEU THR VAL ASP TYR
SEQRES   6 G  209  PHE ALA TYR PRO LEU SER MET LYS SER TYR ILE ARG PRO
SEQRES   7 G  209  GLY SER ALA GLY ASN ILE PRO LEU TYR ASN TYR LYS GLN
SEQRES   8 G  209  SER PHE ALA HIS PRO THR CYS ARG VAL LEU ALA SER VAL
SEQRES   9 G  209  PRO PRO ASN VAL THR ILE THR LYS PRO GLU ALA TYR GLY
SEQRES  10 G  209  TYR ILE SER LYS CYS SER ARG LEU THR GLY ASP TYR GLN
SEQRES  11 G  209  HIS ILE GLU THR PRO LEU TYR ILE ASN PRO GLY GLU TYR
SEQRES  12 G  209  SER ILE CYS ARG ASP PHE ALA PRO LEU GLY PHE SER GLU
SEQRES  13 G  209  ASP GLY GLN VAL PHE LYS ARG THR LEU THR GLN PHE GLU
SEQRES  14 G  209  GLY GLY GLY LEU LEU ILE GLY VAL GLY THR ARG VAL PRO
SEQRES  15 G  209  MET THR ALA ASN LEU GLU MET GLY PHE VAL ILE SER VAL
SEQRES  16 G  209  GLN TYR GLY ALA GLY THR ASP SER VAL CYS PRO MET LEU
SEQRES  17 G  209  ASP
HET    NAG  C   1      14
HET    NAG  C   2      14
HET    NAG  D   1      14
HET    NAG  D   2      14
HET    NAG  E   1      14
HET    NAG  E   2      14
HET    NAG  F   1      14
HET    NAG  F   2      14
HET    NAG  H   1      14
HET    NAG  H   2      14
HET    NAG  I   1      14
HET    NAG  I   2      14
HET    NAG  J   1      14
HET    NAG  J   2      14
HET    NAG  K   1      14
HET    NAG  K   2      14
HET    NAG  L   1      14
HET    NAG  L   2      14
HET    NAG  M   1      14
HET    NAG  M   2      14
HET    NAG  N   1      14
HET    NAG  N   2      14
HET    NAG  O   1      14
HET    NAG  O   2      14
HET    BMA  O   3      11
HET    NAG  A 801      14
HETNAM     NAG 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE
HETNAM     BMA BETA-D-MANNOPYRANOSE
HETSYN     NAG N-ACETYL-BETA-D-GLUCOSAMINE; 2-ACETAMIDO-2-DEOXY-BETA-
HETSYN   2 NAG  D-GLUCOSE; 2-ACETAMIDO-2-DEOXY-D-GLUCOSE; 2-ACETAMIDO-
HETSYN   3 NAG  2-DEOXY-GLUCOSE; N-ACETYL-D-GLUCOSAMINE
HETSYN     BMA BETA-D-MANNOSE; D-MANNOSE; MANNOSE
FORMUL   4  NAG    25(C8 H15 N O6)
FORMUL  15  BMA    C6 H12 O6
HELIX    1 AA1 THR A   44  ASN A   51  1                                   8
HELIX    2 AA2 SER A   93  GLU A   97  5                                   5
HELIX    3 AA3 ASP A  200  GLU A  206  1                                   7
HELIX    4 AA4 ASP A  274  LEU A  276  5                                   3
HELIX    5 AA5 LEU A  340  GLN A  344  5                                   5
HELIX    6 AA6 GLU A  421  MET A  425  5                                   5
HELIX    7 AA7 LYS A  463  ALA A  465  5                                   3
HELIX    8 AA8 ASN A  497  GLN A  505  1                                   9
HELIX    9 AA9 ASN A  562  GLU A  571  1                                  10
HELIX   10 AB1 ILE A  590  ASN A  595  5                                   6
HELIX   11 AB2 THR A  600  LYS A  615  1                                  16
HELIX   12 AB3 SER A  630  GLY A  641  1                                  12
HELIX   13 AB4 ARG A  658  TYR A  662  5                                   5
HELIX   14 AB5 ASP A  663  GLY A  672  1                                  10
HELIX   15 AB6 ASN A  679  SER A  686  1                                   8
HELIX   16 AB7 VAL A  688  VAL A  698  5                                  11
HELIX   17 AB8 HIS A  712  VAL A  726  1                                  15
HELIX   18 AB9 SER A  744  SER A  764  1                                  21
HELIX   19 AC1 THR B   44  LYS B   50  1                                   7
HELIX   20 AC2 SER B   93  GLU B   97  5                                   5
HELIX   21 AC3 ASP B  200  VAL B  207  1                                   8
HELIX   22 AC4 ASP B  274  LEU B  276  5                                   3
HELIX   23 AC5 LEU B  340  GLN B  344  5                                   5
HELIX   24 AC6 GLU B  421  MET B  425  5                                   5
HELIX   25 AC7 LYS B  463  ALA B  465  5                                   3
HELIX   26 AC8 ASN B  497  GLN B  505  1                                   9
HELIX   27 AC9 ASN B  562  ASN B  572  1                                  11
HELIX   28 AD1 GLY B  587  HIS B  592  1                                   6
HELIX   29 AD2 THR B  600  LYS B  615  1                                  16
HELIX   30 AD3 SER B  630  GLY B  641  1                                  12
HELIX   31 AD4 ARG B  658  TYR B  662  5                                   5
HELIX   32 AD5 ASP B  663  GLY B  672  1                                  10
HELIX   33 AD6 ASN B  679  ASN B  685  1                                   7
HELIX   34 AD7 SER B  686  THR B  687  5                                   2
HELIX   35 AD8 VAL B  688  VAL B  698  5                                  11
HELIX   36 AD9 HIS B  712  VAL B  726  1                                  15
HELIX   37 AE1 SER B  744  SER B  764  1                                  21
HELIX   38 AE2 PHE G  390  LYS G  395  5                                   6
HELIX   39 AE3 ASN G  415  PHE G  423  1                                   9
HELIX   40 AE4 SER G  434  ALA G  439  1                                   6
HELIX   41 AE5 GLY G  467  ASN G  473  1                                   7
SHEET    1 AA1 2 LYS A  41  THR A  42  0
SHEET    2 AA1 2 VAL A 507  GLN A 508  1  O  GLN A 508   N  LYS A  41
SHEET    1 AA2 4 ARG A  61  TRP A  62  0
SHEET    2 AA2 4 GLU A  67  TYR A  70 -1  O  LEU A  69   N  ARG A  61
SHEET    3 AA2 4 ILE A  76  ASN A  80 -1  O  PHE A  79   N  TYR A  68
SHEET    4 AA2 4 SER A  86  LEU A  90 -1  O  SER A  87   N  VAL A  78
SHEET    1 AA3 4 ASP A 104  ILE A 107  0
SHEET    2 AA3 4 PHE A 113  LYS A 122 -1  O  LEU A 115   N  SER A 106
SHEET    3 AA3 4 TYR A 128  ASP A 136 -1  O  ASP A 133   N  LEU A 116
SHEET    4 AA3 4 LEU A 142  ILE A 143 -1  O  ILE A 143   N  ILE A 134
SHEET    1 AA4 4 TRP A 154  TRP A 157  0
SHEET    2 AA4 4 LEU A 164  TRP A 168 -1  O  ALA A 165   N  THR A 156
SHEET    3 AA4 4 ASP A 171  LYS A 175 -1  O  TYR A 173   N  TYR A 166
SHEET    4 AA4 4 TYR A 183  ARG A 184 -1  O  TYR A 183   N  VAL A 174
SHEET    1 AA5 3 ILE A 194  ASN A 196  0
SHEET    2 AA5 3 PHE A 222  ASN A 229 -1  O  PHE A 228   N  TYR A 195
SHEET    3 AA5 3 LEU A 214  TRP A 216 -1  N  TRP A 215   O  ALA A 224
SHEET    1 AA6 4 ILE A 194  ASN A 196  0
SHEET    2 AA6 4 PHE A 222  ASN A 229 -1  O  PHE A 228   N  TYR A 195
SHEET    3 AA6 4 THR A 265  ASN A 272 -1  O  THR A 265   N  ASN A 229
SHEET    4 AA6 4 SER A 284  GLN A 286 -1  O  ILE A 285   N  VAL A 270
SHEET    1 AA7 2 LEU A 235  PHE A 240  0
SHEET    2 AA7 2 LYS A 250  PRO A 255 -1  O  LYS A 250   N  PHE A 240
SHEET    1 AA8 4 HIS A 298  TRP A 305  0
SHEET    2 AA8 4 ARG A 310  ARG A 317 -1  O  GLN A 314   N  CYS A 301
SHEET    3 AA8 4 SER A 323  TYR A 330 -1  O  VAL A 324   N  TRP A 315
SHEET    4 AA8 4 TRP A 337  ASN A 338 -1  O  ASN A 338   N  ASP A 329
SHEET    1 AA9 4 HIS A 298  TRP A 305  0
SHEET    2 AA9 4 ARG A 310  ARG A 317 -1  O  GLN A 314   N  CYS A 301
SHEET    3 AA9 4 SER A 323  TYR A 330 -1  O  VAL A 324   N  TRP A 315
SHEET    4 AA9 4 HIS A 345  GLU A 347 -1  O  HIS A 345   N  MET A 325
SHEET    1 AB1 4 HIS A 363  PHE A 364  0
SHEET    2 AB1 4 SER A 370  SER A 376 -1  O  TYR A 372   N  HIS A 363
SHEET    3 AB1 4 ARG A 382  GLN A 388 -1  O  CYS A 385   N  LYS A 373
SHEET    4 AB1 4 THR A 395  PHE A 396 -1  O  THR A 395   N  TYR A 386
SHEET    1 AB2 4 VAL A 404  LEU A 410  0
SHEET    2 AB2 4 TYR A 414  SER A 419 -1  O  ILE A 418   N  GLY A 406
SHEET    3 AB2 4 ASN A 430  GLN A 435 -1  O  TYR A 432   N  TYR A 417
SHEET    4 AB2 4 VAL A 442  CYS A 444 -1  O  THR A 443   N  LYS A 433
SHEET    1 AB3 4 TYR A 457  PHE A 461  0
SHEET    2 AB3 4 TYR A 467  CYS A 472 -1  O  ARG A 471   N  SER A 458
SHEET    3 AB3 4 LEU A 479  SER A 484 -1  O  LEU A 479   N  CYS A 472
SHEET    4 AB3 4 LYS A 489  GLU A 495 -1  O  GLU A 495   N  TYR A 480
SHEET    1 AB4 8 SER A 511  LEU A 519  0
SHEET    2 AB4 8 THR A 522  LEU A 530 -1  O  THR A 522   N  LEU A 519
SHEET    3 AB4 8 ILE A 574  PHE A 578 -1  O  VAL A 575   N  ILE A 529
SHEET    4 AB4 8 TYR A 540  VAL A 546  1  N  LEU A 543   O  ILE A 574
SHEET    5 AB4 8 VAL A 619  TRP A 629  1  O  ALA A 625   N  LEU A 544
SHEET    6 AB4 8 CYS A 649  VAL A 653  1  O  ILE A 651   N  GLY A 628
SHEET    7 AB4 8 GLU A 699  GLY A 705  1  O  LEU A 701   N  ALA A 652
SHEET    8 AB4 8 GLN A 731  TYR A 735  1  O  GLN A 731   N  TYR A 700
SHEET    1 AB5 2 LYS B  41  THR B  42  0
SHEET    2 AB5 2 VAL B 507  GLN B 508  1  O  GLN B 508   N  LYS B  41
SHEET    1 AB6 4 LEU B  60  TRP B  62  0
SHEET    2 AB6 4 GLU B  67  GLN B  72 -1  O  LEU B  69   N  ARG B  61
SHEET    3 AB6 4 ASN B  75  ASN B  80 -1  O  PHE B  79   N  TYR B  68
SHEET    4 AB6 4 SER B  86  LEU B  90 -1  O  SER B  87   N  VAL B  78
SHEET    1 AB7 3 ASP B 104  ILE B 107  0
SHEET    2 AB7 3 PHE B 113  LYS B 122 -1  O  GLU B 117   N  ASP B 104
SHEET    3 AB7 3 TYR B 128  ASP B 136 -1  O  TYR B 135   N  ILE B 114
SHEET    1 AB8 4 THR B 152  TRP B 157  0
SHEET    2 AB8 4 LEU B 164  TRP B 168 -1  O  VAL B 167   N  GLN B 153
SHEET    3 AB8 4 ASP B 171  LYS B 175 -1  O  TYR B 173   N  TYR B 166
SHEET    4 AB8 4 TYR B 183  ARG B 184 -1  O  TYR B 183   N  VAL B 174
SHEET    1 AB9 3 ILE B 194  ASN B 196  0
SHEET    2 AB9 3 PHE B 222  ASN B 229 -1  O  PHE B 228   N  TYR B 195
SHEET    3 AB9 3 LEU B 214  TRP B 216 -1  N  TRP B 215   O  ALA B 224
SHEET    1 AC1 4 ILE B 194  ASN B 196  0
SHEET    2 AC1 4 PHE B 222  ASN B 229 -1  O  PHE B 228   N  TYR B 195
SHEET    3 AC1 4 THR B 265  ASN B 272 -1  O  THR B 265   N  ASN B 229
SHEET    4 AC1 4 ILE B 285  GLN B 286 -1  O  ILE B 285   N  VAL B 270
SHEET    1 AC2 2 LEU B 235  PHE B 240  0
SHEET    2 AC2 2 LYS B 250  PRO B 255 -1  O  LYS B 250   N  PHE B 240
SHEET    1 AC3 4 HIS B 298  TRP B 305  0
SHEET    2 AC3 4 ARG B 310  ARG B 317 -1  O  LEU B 316   N  TYR B 299
SHEET    3 AC3 4 TYR B 322  ASP B 329 -1  O  VAL B 324   N  TRP B 315
SHEET    4 AC3 4 HIS B 345  MET B 348 -1  O  GLU B 347   N  SER B 323
SHEET    1 AC4 4 HIS B 363  PHE B 364  0
SHEET    2 AC4 4 SER B 370  SER B 376 -1  O  TYR B 372   N  HIS B 363
SHEET    3 AC4 4 ARG B 382  GLN B 388 -1  O  PHE B 387   N  PHE B 371
SHEET    4 AC4 4 THR B 395  PHE B 396 -1  O  THR B 395   N  TYR B 386
SHEET    1 AC5 4 VAL B 404  LEU B 410  0
SHEET    2 AC5 4 TYR B 414  SER B 419 -1  O  ILE B 418   N  GLY B 406
SHEET    3 AC5 4 ASN B 430  GLN B 435 -1  O  TYR B 432   N  TYR B 417
SHEET    4 AC5 4 VAL B 442  CYS B 444 -1  O  THR B 443   N  LYS B 433
SHEET    1 AC6 4 CYS B 454  PHE B 461  0
SHEET    2 AC6 4 TYR B 467  PRO B 475 -1  O  ARG B 471   N  SER B 458
SHEET    3 AC6 4 LEU B 479  SER B 484 -1  O  LEU B 479   N  CYS B 472
SHEET    4 AC6 4 LYS B 489  GLU B 495 -1  O  GLU B 495   N  TYR B 480
SHEET    1 AC7 8 SER B 511  LEU B 519  0
SHEET    2 AC7 8 THR B 522  LEU B 530 -1  O  THR B 522   N  LEU B 519
SHEET    3 AC7 8 ILE B 574  ASP B 579 -1  O  VAL B 575   N  ILE B 529
SHEET    4 AC7 8 TYR B 540  VAL B 546  1  N  LEU B 543   O  ILE B 574
SHEET    5 AC7 8 VAL B 619  TRP B 629  1  O  TRP B 627   N  LEU B 544
SHEET    6 AC7 8 CYS B 649  VAL B 653  1  O  ILE B 651   N  ILE B 626
SHEET    7 AC7 8 GLU B 699  GLY B 705  1  O  LEU B 701   N  ALA B 652
SHEET    8 AC7 8 GLN B 731  TYR B 735  1  O  GLN B 731   N  TYR B 700
SHEET    1 AC8 5 LYS G 405  PHE G 409  0
SHEET    2 AC8 5 THR G 445  ALA G 452 -1  O  VAL G 448   N  LEU G 407
SHEET    3 AC8 5 GLU G 573  GLN G 581 -1  O  GLY G 575   N  PHE G 451
SHEET    4 AC8 5 THR G 482  SER G 488 -1  N  ALA G 487   O  MET G 574
SHEET    5 AC8 5 ALA G 424  ASN G 431 -1  N  ASN G 431   O  THR G 482
SHEET    1 AC9 2 CYS G 412  TYR G 414  0
SHEET    2 AC9 2 VAL G 589  PRO G 591  1  O  CYS G 590   N  CYS G 412
SHEET    1 AD1 3 TYR G 501  ARG G 509  0
SHEET    2 AD1 3 LEU G 558  VAL G 566 -1  O  THR G 564   N  TYR G 503
SHEET    3 AD1 3 GLN G 544  THR G 549 -1  N  GLN G 544   O  GLY G 563
SSBOND   1 CYS A  328    CYS A  339                          1555   1555  2.03
SSBOND   2 CYS A  385    CYS A  394                          1555   1555  2.04
SSBOND   3 CYS A  444    CYS A  447                          1555   1555  2.03
SSBOND   4 CYS A  454    CYS A  472                          1555   1555  2.01
SSBOND   5 CYS A  649    CYS A  762                          1555   1555  2.02
SSBOND   6 CYS B  328    CYS B  339                          1555   1555  2.04
SSBOND   7 CYS B  385    CYS B  394                          1555   1555  2.03
SSBOND   8 CYS B  444    CYS B  447                          1555   1555  2.03
SSBOND   9 CYS B  454    CYS B  472                          1555   1555  2.03
SSBOND  10 CYS B  649    CYS B  762                          1555   1555  2.04
SSBOND  11 CYS G  388    CYS G  412                          1555   1555  2.03
SSBOND  12 CYS G  430    CYS G  483                          1555   1555  2.04
SSBOND  13 CYS G  442    CYS G  590                          1555   1555  2.03
SSBOND  14 CYS G  507    CYS G  531                          1555   1555  2.02
LINK         ND2 ASN A  85                 C1  NAG C   1     1555   1555  1.44
LINK         ND2 ASN A  92                 C1  NAG A 801     1555   1555  1.47
LINK         ND2 ASN A 150                 C1  NAG D   1     1555   1555  1.43
LINK         ND2 ASN A 219                 C1  NAG H   1     1555   1555  1.44
LINK         ND2 ASN A 229                 C1  NAG E   1     1555   1555  1.44
LINK         ND2 ASN A 281                 C1  NAG F   1     1555   1555  1.44
LINK         ND2 ASN A 321                 C1  NAG I   1     1555   1555  1.44
LINK         ND2 ASN B  85                 C1  NAG J   1     1555   1555  1.43
LINK         ND2 ASN B  92                 C1  NAG K   1     1555   1555  1.43
LINK         ND2 ASN B 150                 C1  NAG N   1     1555   1555  1.44
LINK         ND2 ASN B 229                 C1  NAG L   1     1555   1555  1.44
LINK         ND2 ASN B 281                 C1  NAG O   1     1555   1555  1.44
LINK         ND2 ASN B 321                 C1  NAG M   1     1555   1555  1.43
LINK         O4  NAG C   1                 C1  NAG C   2     1555   1555  1.44
LINK         O4  NAG D   1                 C1  NAG D   2     1555   1555  1.44
LINK         O4  NAG E   1                 C1  NAG E   2     1555   1555  1.44
LINK         O4  NAG F   1                 C1  NAG F   2     1555   1555  1.44
LINK         O4  NAG H   1                 C1  NAG H   2     1555   1555  1.44
LINK         O4  NAG I   1                 C1  NAG I   2     1555   1555  1.44
LINK         O4  NAG J   1                 C1  NAG J   2     1555   1555  1.44
LINK         O4  NAG K   1                 C1  NAG K   2     1555   1555  1.44
LINK         O4  NAG L   1                 C1  NAG L   2     1555   1555  1.44
LINK         O4  NAG M   1                 C1  NAG M   2     1555   1555  1.44
LINK         O4  NAG N   1                 C1  NAG N   2     1555   1555  1.44
LINK         O4  NAG O   1                 C1  NAG O   2     1555   1555  1.44
LINK         O4  NAG O   2                 C1  BMA O   3     1555   1555  1.44
CISPEP   1 GLY B  474    PRO B  475          0         0.47
CISPEP   2 ARG B  581    GLY B  582          0       -10.76
CISPEP   3 GLY B  584    TYR B  585          0        -8.19
CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1
ORIGX1      1.000000  0.000000  0.000000        0.00000
ORIGX2      0.000000  1.000000  0.000000        0.00000
ORIGX3      0.000000  0.000000  1.000000        0.00000
SCALE1      1.000000  0.000000  0.000000        0.00000
SCALE2      0.000000  1.000000  0.000000        0.00000
SCALE3      0.000000  0.000000  1.000000        0.00000
TER    5958      PRO A 766
TER   11916      PRO B 766
TER   13533      ASP G 594
MASTER      200    0   26   41  107    0    0    613891    3  402  129
END