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Database: PDB
Entry: 2KDI
LinkDB: 2KDI
Original site: 2KDI 
HEADER    SIGNALING PROTEIN                       09-JAN-09   2KDI              
TITLE     SOLUTION STRUCTURE OF A UBIQUITIN/UIM FUSION PROTEIN                  
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: UBIQUITIN, VACUOLAR PROTEIN SORTING-ASSOCIATED PROTEIN 27  
COMPND   3 FUSION PROTEIN;                                                      
COMPND   4 CHAIN: A;                                                            
COMPND   5 FRAGMENT: UIM 1;                                                     
COMPND   6 SYNONYM: GOLGI RETENTION DEFECTIVE PROTEIN 11;                       
COMPND   7 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;                       
SOURCE   3 ORGANISM_COMMON: YEAST;                                              
SOURCE   4 ORGANISM_TAXID: 4932;                                                
SOURCE   5 GENE: SCRG_04109, SCRG_05320,VPS27, DID7, GRD11, SSV17, VPL23,       
SOURCE   6 VPT27, YNR006W, N2038;                                               
SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   8 EXPRESSION_SYSTEM_TAXID: 562;                                        
SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PGIA                                       
KEYWDS    UBIQUITIN, UBIQUITIN INTERACTING MOTIF, UIM, PROTEIN DOMAIN           
KEYWDS   2 INTERFACE, ENDOSOME, MEMBRANE, METAL-BINDING, PHOSPHOPROTEIN, ZINC,  
KEYWDS   3 ZINC-FINGER, SIGNALING PROTEIN                                       
EXPDTA    SOLUTION NMR                                                          
NUMMDL    20                                                                    
AUTHOR    N.G.SGOURAKIS,M.M.PATEL,A.E.GARCIA,G.I.MAKHATADZE,S.A.MCCALLUM        
REVDAT   4   20-OCT-21 2KDI    1       SEQADV                                   
REVDAT   3   19-FEB-20 2KDI    1       REMARK SEQADV                            
REVDAT   2   02-MAR-10 2KDI    1       JRNL                                     
REVDAT   1   09-FEB-10 2KDI    0                                                
JRNL        AUTH   N.G.SGOURAKIS,M.M.PATEL,A.E.GARCIA,G.I.MAKHATADZE,           
JRNL        AUTH 2 S.A.MCCALLUM                                                 
JRNL        TITL   CONFORMATIONAL DYNAMICS AND STRUCTURAL PLASTICITY PLAY       
JRNL        TITL 2 CRITICAL ROLES IN THE UBIQUITIN RECOGNITION OF A UIM DOMAIN. 
JRNL        REF    J.MOL.BIOL.                   V. 396  1128 2010              
JRNL        REFN                   ISSN 0022-2836                               
JRNL        PMID   20053359                                                     
JRNL        DOI    10.1016/J.JMB.2009.12.052                                    
REMARK   1                                                                      
REMARK   1 REFERENCE 1                                                          
REMARK   1  AUTH   M.M.PATEL,N.G.SGOURAKIS,W.W.STREICHER,S.A.MCCALLUM,          
REMARK   1  AUTH 2 A.E.GARCIA,G.I.MAKHATADZE                                    
REMARK   1  TITL   FOLDING COOPERATIVITY AND DYNAMICS OF A UBIQUITIN/UIM FUSION 
REMARK   1  TITL 2 PROTEIN BY NMR, DSC, CD, FLUORESCENCE EXPERIMENTS AND MD     
REMARK   1  TITL 3 SIMULATIONS                                                  
REMARK   1  REF    TO BE PUBLISHED                                              
REMARK   1  REFN                                                                
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : CYANA 2.1, X-PLOR 2.18                               
REMARK   3   AUTHORS     : GUNTERT, MUMENTHALER AND WUTHRICH (CYANA), BRUNGER   
REMARK   3                 (X-PLOR)                                             
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 2KDI COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 13-JAN-09.                  
REMARK 100 THE DEPOSITION ID IS D_1000100985.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 300                                
REMARK 210  PH                             : 6                                  
REMARK 210  IONIC STRENGTH                 : 0.103                              
REMARK 210  PRESSURE                       : AMBIENT                            
REMARK 210  SAMPLE CONTENTS                : 1.24 MM [U-100% 13C; U-100% 15N]   
REMARK 210                                   UBIQUITIN/UIM FUSION PROTEIN-1,    
REMARK 210                                   3 MM SODIUM AZIDE-2, 20 MM         
REMARK 210                                   SODIUM PHOSPHATE-3, 50 MM SODIUM   
REMARK 210                                   CHLORIDE-4, 95% H2O/5% D2O; 1.1    
REMARK 210                                   MM [U-100% 15N] UBIQUITIN/UIM      
REMARK 210                                   FUSION PROTEIN-5, 3 MM SODIUM      
REMARK 210                                   AZIDE-6, 20 MM SODIUM PHOSPHATE-   
REMARK 210                                   7, 50 MM SODIUM CHLORIDE-8, 95%    
REMARK 210                                   H2O/5% D2O; 0.5 MM [U-100% 15N]    
REMARK 210                                   UBIQUITIN/UIM FUSION PROTEIN-9,    
REMARK 210                                   3 MM SODIUM AZIDE-10, 20 MM        
REMARK 210                                   SODIUM PHOSPHATE-11, 50 MM         
REMARK 210                                   SODIUM CHLORIDE-12, 95% H2O/5%     
REMARK 210                                   D2O                                
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D 1H-15N HSQC; 2D 1H-13C HSQC;    
REMARK 210                                   3D HN(COCA)CB; 3D HNCACB; 3D 1H-   
REMARK 210                                   15N NOESY; 3D 1H-13C NOESY; 3D     
REMARK 210                                   HCCH-COSY; 3D HNCO; 3D H(CCO)NH;   
REMARK 210                                   2D HN-IPAP; 3D 1H-15N TOCSY; 3D    
REMARK 210                                   HCCH-TOCSY; 3D (H)C(CCO)NH-TOCSY   
REMARK 210  SPECTROMETER FIELD STRENGTH    : 800 MHZ; 600 MHZ                   
REMARK 210  SPECTROMETER MODEL             : AVANCE                             
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : SPARKY 3.111, X-PLOR 2.18, TALOS   
REMARK 210                                   2003.027.13.05, PALES              
REMARK 210   METHOD USED                   : SIMULATED ANNEALING, TORSION       
REMARK 210                                   ANGLE DYNAMICS, MOLECULAR          
REMARK 210                                   DYNAMICS, ENERGY MINIMIZATION      
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 100                                
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 20                                 
REMARK 210 CONFORMERS, SELECTION CRITERIA  : STRUCTURES WITH THE LOWEST         
REMARK 210                                   ENERGY                             
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
REMARK 210                                                                      
REMARK 210 REMARK: NULL                                                         
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
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: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
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                                             
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    GLU A    60     H    ARG A    63              1.57            
REMARK 500   O    PHE A    13     H    LEU A    76              1.57            
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  1 HIS A   2       23.98    -78.90                                   
REMARK 500  1 HIS A   3      175.92     63.03                                   
REMARK 500  1 HIS A   7       60.82   -157.60                                   
REMARK 500  1 ILE A  45      125.19    -39.58                                   
REMARK 500  1 GLN A  71     -150.29    -70.71                                   
REMARK 500  1 ASP A  92      -78.79   -134.99                                   
REMARK 500  1 GLU A  93      -43.91   -146.79                                   
REMARK 500  1 LEU A 103      -70.22    -96.10                                   
REMARK 500  2 HIS A   4      100.88     69.91                                   
REMARK 500  2 VAL A  26     -169.31   -119.29                                   
REMARK 500  2 ASP A  30      158.58    -46.10                                   
REMARK 500  2 ILE A  45      128.89    -37.13                                   
REMARK 500  2 GLN A  71     -156.95     53.49                                   
REMARK 500  2 ALA A  90      -70.76    -82.45                                   
REMARK 500  2 ASP A  92      -86.43    -88.23                                   
REMARK 500  2 GLU A  93      -40.12   -140.63                                   
REMARK 500  2 LEU A 103      -74.44    -89.40                                   
REMARK 500  3 HIS A   4      -82.99     66.72                                   
REMARK 500  3 HIS A   5      157.46     66.50                                   
REMARK 500  3 HIS A   6      -46.02   -149.71                                   
REMARK 500  3 HIS A   7        3.47   -167.18                                   
REMARK 500  3 GLU A   9      -13.81   -140.69                                   
REMARK 500  3 ASN A  69       63.76     75.08                                   
REMARK 500  3 GLU A  73       45.41    -79.08                                   
REMARK 500  3 ASP A  92     -103.75    -88.19                                   
REMARK 500  3 LEU A 103      -69.66    -97.12                                   
REMARK 500  4 HIS A   3       92.97    -68.95                                   
REMARK 500  4 HIS A   7       13.31   -163.30                                   
REMARK 500  4 ASP A  30      158.76    -48.19                                   
REMARK 500  4 ILE A  45      123.89    -38.77                                   
REMARK 500  4 ALA A  55       41.45     71.24                                   
REMARK 500  4 ASN A  69       36.40     73.01                                   
REMARK 500  4 SER A  86      102.69     67.60                                   
REMARK 500  4 ASP A  92      -61.47   -135.22                                   
REMARK 500  4 GLU A  93      -62.62   -160.43                                   
REMARK 500  4 LEU A  96      -29.50    -39.27                                   
REMARK 500  4 LYS A  99      -71.34    -66.54                                   
REMARK 500  4 ALA A 100      -29.58    -38.79                                   
REMARK 500  4 LEU A 103      -68.36    -97.19                                   
REMARK 500  5 HIS A   5     -124.11    -79.03                                   
REMARK 500  5 HIS A   6      104.69     65.63                                   
REMARK 500  5 ASP A  30      153.10    -44.00                                   
REMARK 500  5 ASN A  69       38.66     77.58                                   
REMARK 500  5 GLN A  71     -135.09    -84.35                                   
REMARK 500  5 GLU A  73       44.83    -84.19                                   
REMARK 500  5 ALA A  90      -71.18    -74.68                                   
REMARK 500  5 ASP A  92       34.90   -142.73                                   
REMARK 500  5 GLU A  94      -82.48    156.73                                   
REMARK 500  5 LEU A 103      -73.96    -90.24                                   
REMARK 500  6 HIS A   2      172.95     64.06                                   
REMARK 500                                                                      
REMARK 500 THIS ENTRY HAS     228 RAMACHANDRAN OUTLIERS.                        
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: PLANAR GROUPS                                              
REMARK 500                                                                      
REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL                 
REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE                    
REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN                    
REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS                        
REMARK 500 AN RMSD GREATER THAN THIS VALUE                                      
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        RMS     TYPE                                    
REMARK 500  1 ARG A  51         0.27    SIDE CHAIN                              
REMARK 500  1 ARG A  63         0.30    SIDE CHAIN                              
REMARK 500  1 ARG A  72         0.28    SIDE CHAIN                              
REMARK 500  1 ARG A  81         0.15    SIDE CHAIN                              
REMARK 500  1 ARG A  83         0.30    SIDE CHAIN                              
REMARK 500  1 ARG A  98         0.27    SIDE CHAIN                              
REMARK 500  1 ARG A 109         0.28    SIDE CHAIN                              
REMARK 500  2 ARG A  51         0.31    SIDE CHAIN                              
REMARK 500  2 ARG A  63         0.30    SIDE CHAIN                              
REMARK 500  2 ARG A  72         0.30    SIDE CHAIN                              
REMARK 500  2 ARG A  81         0.31    SIDE CHAIN                              
REMARK 500  2 ARG A  83         0.30    SIDE CHAIN                              
REMARK 500  2 ARG A  98         0.31    SIDE CHAIN                              
REMARK 500  2 ARG A 109         0.31    SIDE CHAIN                              
REMARK 500  3 ARG A  51         0.27    SIDE CHAIN                              
REMARK 500  3 ARG A  63         0.31    SIDE CHAIN                              
REMARK 500  3 ARG A  72         0.31    SIDE CHAIN                              
REMARK 500  3 ARG A  81         0.30    SIDE CHAIN                              
REMARK 500  3 ARG A  83         0.22    SIDE CHAIN                              
REMARK 500  3 ARG A  98         0.31    SIDE CHAIN                              
REMARK 500  4 ARG A  51         0.31    SIDE CHAIN                              
REMARK 500  4 ARG A  63         0.29    SIDE CHAIN                              
REMARK 500  4 ARG A  72         0.31    SIDE CHAIN                              
REMARK 500  4 ARG A  81         0.29    SIDE CHAIN                              
REMARK 500  4 ARG A  83         0.26    SIDE CHAIN                              
REMARK 500  4 ARG A  98         0.30    SIDE CHAIN                              
REMARK 500  4 ARG A 109         0.30    SIDE CHAIN                              
REMARK 500  5 ARG A  51         0.27    SIDE CHAIN                              
REMARK 500  5 ARG A  63         0.29    SIDE CHAIN                              
REMARK 500  5 ARG A  72         0.30    SIDE CHAIN                              
REMARK 500  5 ARG A  81         0.30    SIDE CHAIN                              
REMARK 500  5 ARG A  83         0.31    SIDE CHAIN                              
REMARK 500  5 ARG A  98         0.31    SIDE CHAIN                              
REMARK 500  5 ARG A 109         0.23    SIDE CHAIN                              
REMARK 500  6 ARG A  51         0.31    SIDE CHAIN                              
REMARK 500  6 ARG A  63         0.31    SIDE CHAIN                              
REMARK 500  6 ARG A  72         0.30    SIDE CHAIN                              
REMARK 500  6 ARG A  81         0.31    SIDE CHAIN                              
REMARK 500  6 ARG A  83         0.30    SIDE CHAIN                              
REMARK 500  6 ARG A  98         0.30    SIDE CHAIN                              
REMARK 500  6 ARG A 109         0.29    SIDE CHAIN                              
REMARK 500  7 ARG A  51         0.28    SIDE CHAIN                              
REMARK 500  7 ARG A  63         0.18    SIDE CHAIN                              
REMARK 500  7 ARG A  72         0.31    SIDE CHAIN                              
REMARK 500  7 ARG A  81         0.30    SIDE CHAIN                              
REMARK 500  7 ARG A  83         0.28    SIDE CHAIN                              
REMARK 500  7 ARG A  98         0.31    SIDE CHAIN                              
REMARK 500  7 ARG A 109         0.27    SIDE CHAIN                              
REMARK 500  8 ARG A  51         0.26    SIDE CHAIN                              
REMARK 500  8 ARG A  63         0.29    SIDE CHAIN                              
REMARK 500                                                                      
REMARK 500 THIS ENTRY HAS     137 PLANE DEVIATIONS.                             
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 16114   RELATED DB: BMRB                                 
DBREF  2KDI A   11    85  UNP    B3LRG8   B3LRG8_YEAS1     2     76             
DBREF  2KDI A   92   111  UNP    P40343   VPS27_YEAST    258    277             
SEQADV 2KDI MET A    1  UNP  B3LRG8              EXPRESSION TAG                 
SEQADV 2KDI HIS A    2  UNP  B3LRG8              EXPRESSION TAG                 
SEQADV 2KDI HIS A    3  UNP  B3LRG8              EXPRESSION TAG                 
SEQADV 2KDI HIS A    4  UNP  B3LRG8              EXPRESSION TAG                 
SEQADV 2KDI HIS A    5  UNP  B3LRG8              EXPRESSION TAG                 
SEQADV 2KDI HIS A    6  UNP  B3LRG8              EXPRESSION TAG                 
SEQADV 2KDI HIS A    7  UNP  B3LRG8              EXPRESSION TAG                 
SEQADV 2KDI GLY A    8  UNP  B3LRG8              EXPRESSION TAG                 
SEQADV 2KDI GLU A    9  UNP  B3LRG8              EXPRESSION TAG                 
SEQADV 2KDI PHE A   10  UNP  B3LRG8              EXPRESSION TAG                 
SEQADV 2KDI ALA A   14  UNP  B3LRG8    VAL     5 ENGINEERED MUTATION            
SEQADV 2KDI TRP A   54  UNP  B3LRG8    PHE    45 ENGINEERED MUTATION            
SEQADV 2KDI ARG A   72  UNP  B3LRG8    LYS    63 ENGINEERED MUTATION            
SEQADV 2KDI SER A   86  UNP  B3LRG8              LINKER                         
SEQADV 2KDI MET A   87  UNP  B3LRG8              LINKER                         
SEQADV 2KDI GLY A   88  UNP  B3LRG8              LINKER                         
SEQADV 2KDI GLY A   89  UNP  B3LRG8              LINKER                         
SEQADV 2KDI ALA A   90  UNP  B3LRG8              LINKER                         
SEQADV 2KDI ALA A   91  UNP  B3LRG8              LINKER                         
SEQADV 2KDI GLY A  112  UNP  P40343              EXPRESSION TAG                 
SEQADV 2KDI GLY A  113  UNP  P40343              EXPRESSION TAG                 
SEQADV 2KDI TYR A  114  UNP  P40343              EXPRESSION TAG                 
SEQRES   1 A  114  MET HIS HIS HIS HIS HIS HIS GLY GLU PHE GLN ILE PHE          
SEQRES   2 A  114  ALA LYS THR LEU THR GLY LYS THR ILE THR LEU GLU VAL          
SEQRES   3 A  114  GLU SER SER ASP THR ILE ASP ASN VAL LYS SER LYS ILE          
SEQRES   4 A  114  GLN ASP LYS GLU GLY ILE PRO PRO ASP GLN GLN ARG LEU          
SEQRES   5 A  114  ILE TRP ALA GLY LYS GLN LEU GLU ASP GLY ARG THR LEU          
SEQRES   6 A  114  SER ASP TYR ASN ILE GLN ARG GLU SER THR LEU HIS LEU          
SEQRES   7 A  114  VAL LEU ARG LEU ARG GLY GLY SER MET GLY GLY ALA ALA          
SEQRES   8 A  114  ASP GLU GLU GLU LEU ILE ARG LYS ALA ILE GLU LEU SER          
SEQRES   9 A  114  LEU LYS GLU SER ARG ASN SER GLY GLY TYR                      
HELIX    1   1 THR A   31  GLY A   44  1                                  14    
HELIX    2   2 PRO A   46  ASP A   48  5                                   3    
HELIX    3   3 GLU A   94  LEU A  103  1                                  10    
HELIX    4   4 LEU A  105  SER A  111  1                                   7    
HELIX    5   5 GLY A  112  TYR A  114  5                                   3    
SHEET    1   A 5 THR A  21  GLU A  25  0                                        
SHEET    2   A 5 GLN A  11  THR A  16 -1  N  ALA A  14   O  ILE A  22           
SHEET    3   A 5 THR A  75  LEU A  80  1  O  LEU A  76   N  PHE A  13           
SHEET    4   A 5 GLN A  50  TRP A  54 -1  N  ARG A  51   O  VAL A  79           
SHEET    5   A 5 LYS A  57  GLN A  58 -1  O  LYS A  57   N  TRP A  54           
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                         
MODEL        1                                                                  
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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