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Database: PDB
Entry: 1K36
LinkDB: 1K36
Original site: 1K36 
HEADER    HORMONE/GROWTH FACTOR                   02-OCT-01   1K36              
TITLE     NMR STRUCTURE OF HUMAN EPIREGULIN                                     
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: EPIREGULIN;                                                
COMPND   3 CHAIN: A;                                                            
COMPND   4 FRAGMENT: RESIDUES 1-46;                                             
COMPND   5 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
SOURCE   4 ORGANISM_TAXID: 9606;                                                
SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
SOURCE   7 EXPRESSION_SYSTEM_STRAIN: AD494;                                     
SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET32A                                    
KEYWDS    EGF-LIKE FOLD, HORMONE/GROWTH FACTOR COMPLEX                          
EXPDTA    SOLUTION NMR                                                          
NUMMDL    40                                                                    
AUTHOR    K.SATO,K.MIURA,M.TADA,T.AIZAWA,K.MIYAMOTO,K.KAWANO                    
REVDAT   3   24-FEB-09 1K36    1       VERSN                                    
REVDAT   2   17-FEB-04 1K36    1       JRNL                                     
REVDAT   1   30-SEP-03 1K36    0                                                
JRNL        AUTH   K.SATO,T.NAKAMURA,M.MIZUGUCHI,K.MIURA,M.TADA,                
JRNL        AUTH 2 T.AIZAWA,T.GOMI,K.MIYAMOTO,K.KAWANO                          
JRNL        TITL   SOLUTION STRUCTURE OF EPIREGULIN AND THE EFFECT OF           
JRNL        TITL 2 ITS C-TERMINAL DOMAIN FOR RECEPTOR BINDING AFFINITY          
JRNL        REF    FEBS LETT.                    V. 553   232 2003              
JRNL        REFN                   ISSN 0014-5793                               
JRNL        PMID   14572630                                                     
JRNL        DOI    10.1016/S0014-5793(03)01005-6                                
REMARK   1                                                                      
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : X-PLOR 3.1                                           
REMARK   3   AUTHORS     : BRUNGER                                              
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: THE STRUCTURES ARE BASED ON A TOTAL       
REMARK   3  OF 604 RESTRAINTS, 556 ARE NOE-DERIVED DISTANCE CONSTRAINTS,        
REMARK   3  38 DIHEDRAL ANGLE RESTRAINTS, 10 DISTANCE RESTRAINTS FROM           
REMARK   3  HYDROGEN BONDS.                                                     
REMARK   4                                                                      
REMARK   4 1K36 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 04-OCT-01.                  
REMARK 100 THE RCSB ID CODE IS RCSB014502.                                      
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 303; 303                           
REMARK 210  PH                             : 3.4; 3.4                           
REMARK 210  IONIC STRENGTH                 : 0; 0                               
REMARK 210  PRESSURE                       : 1ATM; 1ATM                         
REMARK 210  SAMPLE CONTENTS                : 1.5MM EPIREGULIN, 90% H2O,         
REMARK 210                                   10% D2O; 1.5MM EPIREGULIN,         
REMARK 210                                   100% D2O                           
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D NOESY, DQF-COSY, 2D TOCSY       
REMARK 210  SPECTROMETER FIELD STRENGTH    : 500 MHZ                            
REMARK 210  SPECTROMETER MODEL             : DMX                                
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : X-PLOR 3.1                         
REMARK 210   METHOD USED                   : DISTANCE GEOMETRY SIMULATED        
REMARK 210                                   ANNEALING                          
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 50                                 
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 40                                 
REMARK 210 CONFORMERS, SELECTION CRITERIA  : STRUCTURES WITH THE LOWEST         
REMARK 210                                   ENERGY                             
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL                
REMARK 210                                                                      
REMARK 210 REMARK: THIS STRUCTURE WAS DETERMINED USING STANDARD 2D              
REMARK 210  HOMONUCLEAR TECHNIQUES.                                             
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 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 SER A   7     -151.28   -110.91                                   
REMARK 500  1 ASP A   9       24.84     45.29                                   
REMARK 500  1 ASN A  11       76.47   -103.67                                   
REMARK 500  1 TYR A  13      -60.49   -135.64                                   
REMARK 500  1 SER A  26       89.45    -29.21                                   
REMARK 500  1 VAL A  34      104.88    -52.51                                   
REMARK 500  1 VAL A  39       43.50    -85.69                                   
REMARK 500  1 ARG A  40       20.14   -156.64                                   
REMARK 500  1 CYS A  41       90.73     27.57                                   
REMARK 500  1 GLU A  42      -36.51   -154.89                                   
REMARK 500  2 SER A   2       41.53   -155.14                                   
REMARK 500  2 SER A   7       17.22   -155.96                                   
REMARK 500  2 SER A   8      -70.39   -151.79                                   
REMARK 500  2 ASN A  11       44.89   -100.69                                   
REMARK 500  2 TYR A  13      -65.04    -94.08                                   
REMARK 500  2 SER A  26       89.14    -29.15                                   
REMARK 500  2 VAL A  39       43.76    -85.04                                   
REMARK 500  2 ARG A  40       13.80   -150.29                                   
REMARK 500  2 CYS A  41       88.52     29.56                                   
REMARK 500  2 GLU A  42      -36.90   -154.85                                   
REMARK 500  3 SER A   7     -152.20   -124.96                                   
REMARK 500  3 ASP A   9       19.57     52.68                                   
REMARK 500  3 ASN A  11       76.21   -105.84                                   
REMARK 500  3 MET A  25       67.90   -151.18                                   
REMARK 500  3 SER A  26       90.10    -29.30                                   
REMARK 500  3 VAL A  34      102.07    -49.09                                   
REMARK 500  3 ARG A  40       20.31   -145.91                                   
REMARK 500  3 CYS A  41       94.56     30.55                                   
REMARK 500  3 GLU A  42      -37.00   -155.07                                   
REMARK 500  4 SER A   2       60.39   -156.32                                   
REMARK 500  4 CYS A   6     -150.62    -86.70                                   
REMARK 500  4 SER A   7     -155.35   -149.96                                   
REMARK 500  4 ASP A   9       31.42   -144.87                                   
REMARK 500  4 MET A  10       17.51   -152.39                                   
REMARK 500  4 MET A  25       71.02   -157.11                                   
REMARK 500  4 SER A  26       89.89    -29.26                                   
REMARK 500  4 VAL A  34       96.44    -43.36                                   
REMARK 500  4 GLU A  42      -28.25   -152.59                                   
REMARK 500  5 CYS A   6     -124.55    -91.91                                   
REMARK 500  5 SER A   7     -154.38   -146.77                                   
REMARK 500  5 SER A  26       92.00    -29.56                                   
REMARK 500  5 VAL A  34       29.59    -76.28                                   
REMARK 500  5 THR A  37       43.47   -108.85                                   
REMARK 500  5 VAL A  39       35.64    -87.55                                   
REMARK 500  5 CYS A  41       78.80     34.02                                   
REMARK 500  5 GLU A  42      -33.65   -142.24                                   
REMARK 500  6 SER A   2       56.43   -114.09                                   
REMARK 500  6 THR A   4     -165.14   -124.03                                   
REMARK 500  6 CYS A   6     -155.83   -105.23                                   
REMARK 500  6 SER A   7     -138.31   -147.42                                   
REMARK 500  6 ASN A  11       58.19    -96.16                                   
REMARK 500  6 TYR A  13      -57.80   -157.28                                   
REMARK 500  6 HIS A  16       76.91   -111.26                                   
REMARK 500  6 SER A  26       89.21    -29.02                                   
REMARK 500  6 VAL A  34      101.76    -40.99                                   
REMARK 500  6 GLU A  42      -30.83   -135.32                                   
REMARK 500  7 SER A   2       43.27   -148.52                                   
REMARK 500  7 CYS A   6     -144.33   -110.61                                   
REMARK 500  7 MET A  10       28.11   -144.67                                   
REMARK 500  7 SER A  26       89.76    -29.18                                   
REMARK 500  7 VAL A  34      101.63    -44.77                                   
REMARK 500  7 VAL A  39       42.33    -84.63                                   
REMARK 500  7 ARG A  40       22.93   -160.27                                   
REMARK 500  7 CYS A  41       93.03     28.33                                   
REMARK 500  7 GLU A  42      -42.10   -154.81                                   
REMARK 500  8 CYS A   6     -143.62    -90.60                                   
REMARK 500  8 SER A   7      -72.72   -158.17                                   
REMARK 500  8 SER A   8      -75.14   -154.39                                   
REMARK 500  8 TYR A  13      -55.43   -160.11                                   
REMARK 500  8 SER A  26       87.72    -29.41                                   
REMARK 500  8 VAL A  34      100.86    -47.21                                   
REMARK 500  8 VAL A  39       33.59    -88.80                                   
REMARK 500  8 ARG A  40       17.89   -142.91                                   
REMARK 500  8 CYS A  41       86.81     27.83                                   
REMARK 500  8 GLU A  42      -34.79   -151.81                                   
REMARK 500  9 CYS A   6     -145.17    -93.92                                   
REMARK 500  9 SER A   7     -150.20   -151.94                                   
REMARK 500  9 ASP A   9       27.15     42.12                                   
REMARK 500  9 ASN A  11       69.73   -116.84                                   
REMARK 500  9 TYR A  13      -57.25   -124.47                                   
REMARK 500  9 SER A  26       87.68    -29.37                                   
REMARK 500  9 VAL A  34      106.71    -48.67                                   
REMARK 500  9 VAL A  39       44.45    -84.70                                   
REMARK 500  9 ARG A  40       26.65   -160.28                                   
REMARK 500  9 CYS A  41       93.12     30.78                                   
REMARK 500  9 GLU A  42      -42.70   -160.17                                   
REMARK 500 10 SER A   2       71.08   -157.05                                   
REMARK 500 10 CYS A   6     -154.58   -106.92                                   
REMARK 500 10 SER A   7     -145.72   -136.23                                   
REMARK 500 10 SER A   8      -70.67    -79.79                                   
REMARK 500 10 TYR A  13      -57.11   -151.45                                   
REMARK 500 10 SER A  26       89.44    -29.28                                   
REMARK 500 10 VAL A  34      103.00    -47.33                                   
REMARK 500 10 VAL A  39       33.27    -87.51                                   
REMARK 500 10 ARG A  40       20.02   -148.68                                   
REMARK 500 10 CYS A  41       94.42     30.77                                   
REMARK 500 10 GLU A  42      -36.69   -153.80                                   
REMARK 500 11 SER A   7     -152.38   -102.34                                   
REMARK 500 11 ASP A   9       27.87     42.42                                   
REMARK 500 11 TYR A  13      -60.62   -154.19                                   
REMARK 500 11 SER A  26       87.68    -29.81                                   
REMARK 500 11 VAL A  34       94.97    -41.86                                   
REMARK 500 11 CYS A  41       78.83     68.45                                   
REMARK 500 11 GLU A  42      -32.56   -152.18                                   
REMARK 500 12 CYS A   6     -151.26   -110.65                                   
REMARK 500 12 SER A   7     -151.07   -152.99                                   
REMARK 500 12 TYR A  13      -55.37   -126.58                                   
REMARK 500 12 SER A  26       88.69    -29.18                                   
REMARK 500 12 VAL A  34       94.11    -40.76                                   
REMARK 500 12 CYS A  41       68.54     68.18                                   
REMARK 500 13 CYS A   6     -150.25    -93.19                                   
REMARK 500 13 SER A   7     -155.42   -147.37                                   
REMARK 500 13 ASP A   9       23.71     47.83                                   
REMARK 500 13 ASN A  11       76.84   -119.52                                   
REMARK 500 13 SER A  26       88.63    -28.97                                   
REMARK 500 13 VAL A  34      103.33    -47.54                                   
REMARK 500 13 VAL A  39       37.42    -86.98                                   
REMARK 500 13 ARG A  40       15.06   -150.70                                   
REMARK 500 13 CYS A  41       87.19     32.67                                   
REMARK 500 13 GLU A  42      -38.76   -151.20                                   
REMARK 500 14 CYS A   6     -143.76    -92.80                                   
REMARK 500 14 MET A  10       21.86   -141.67                                   
REMARK 500 14 TYR A  13      -65.75   -144.98                                   
REMARK 500 14 HIS A  16       77.21   -112.50                                   
REMARK 500 14 SER A  26       89.25    -29.68                                   
REMARK 500 14 VAL A  39       43.52    -84.84                                   
REMARK 500 14 ARG A  40       16.26   -155.85                                   
REMARK 500 14 CYS A  41       89.65     32.17                                   
REMARK 500 14 GLU A  42      -41.00   -155.95                                   
REMARK 500 15 CYS A   6     -167.98   -108.48                                   
REMARK 500 15 SER A   7     -138.97   -130.12                                   
REMARK 500 15 TYR A  13      -62.82   -107.99                                   
REMARK 500 15 SER A  26       85.53    -28.89                                   
REMARK 500 15 VAL A  34       93.49    -37.49                                   
REMARK 500 15 CYS A  41       83.76     69.79                                   
REMARK 500 15 GLU A  42      -31.11   -156.72                                   
REMARK 500 16 CYS A   6     -163.08   -107.25                                   
REMARK 500 16 SER A   7     -167.08   -126.56                                   
REMARK 500 16 MET A  10       16.03   -143.94                                   
REMARK 500 16 ASN A  11       57.87   -111.75                                   
REMARK 500 16 TYR A  13      -50.27   -160.18                                   
REMARK 500 16 HIS A  16       69.39   -103.73                                   
REMARK 500 16 SER A  26       87.55    -29.12                                   
REMARK 500 16 VAL A  34      106.20    -50.87                                   
REMARK 500 16 VAL A  39       44.22    -84.87                                   
REMARK 500 16 ARG A  40       22.58   -159.55                                   
REMARK 500 16 CYS A  41       92.05     27.78                                   
REMARK 500 16 GLU A  42      -37.90   -153.29                                   
REMARK 500 17 THR A   4     -150.59   -141.56                                   
REMARK 500 17 CYS A   6     -150.04   -109.97                                   
REMARK 500 17 MET A  10       20.03   -148.21                                   
REMARK 500 17 ASN A  11       75.02   -101.82                                   
REMARK 500 17 HIS A  16       77.03   -108.81                                   
REMARK 500 17 MET A  25       68.41   -159.81                                   
REMARK 500 17 SER A  26       91.76    -29.58                                   
REMARK 500 17 VAL A  39       43.80    -84.63                                   
REMARK 500 17 ARG A  40       20.11   -157.02                                   
REMARK 500 17 CYS A  41       91.42     29.22                                   
REMARK 500 17 GLU A  42      -36.96   -155.56                                   
REMARK 500 18 CYS A   6     -163.42   -110.97                                   
REMARK 500 18 SER A   7     -158.84   -136.55                                   
REMARK 500 18 ASP A   9       23.68     46.50                                   
REMARK 500 18 MET A  25       65.57   -157.95                                   
REMARK 500 18 SER A  26       86.93    -29.28                                   
REMARK 500 18 VAL A  34      100.89    -51.93                                   
REMARK 500 18 VAL A  39       45.43    -85.18                                   
REMARK 500 18 ARG A  40       20.01   -158.76                                   
REMARK 500 18 CYS A  41       93.56     27.12                                   
REMARK 500 18 GLU A  42      -35.65   -160.73                                   
REMARK 500 19 THR A   4     -153.85   -142.58                                   
REMARK 500 19 CYS A   6     -150.87   -105.69                                   
REMARK 500 19 ASN A  11       48.65    -86.07                                   
REMARK 500 19 HIS A  16       63.11   -110.73                                   
REMARK 500 19 SER A  26       88.76    -29.11                                   
REMARK 500 19 CYS A  32     -164.82   -111.27                                   
REMARK 500 20 CYS A   6     -145.66   -108.83                                   
REMARK 500 20 SER A   7     -158.27   -153.79                                   
REMARK 500 20 ASP A   9       22.86     47.88                                   
REMARK 500 20 ASN A  11     -142.72   -114.75                                   
REMARK 500 20 SER A  26       89.03    -28.75                                   
REMARK 500 20 VAL A  34      104.62    -48.12                                   
REMARK 500 20 VAL A  39       31.55    -87.67                                   
REMARK 500 20 ARG A  40       29.62   -160.37                                   
REMARK 500 20 CYS A  41       90.80     31.76                                   
REMARK 500 20 GLU A  42      -39.88   -154.02                                   
REMARK 500 21 CYS A   6     -144.64   -103.73                                   
REMARK 500 21 SER A   7     -154.43   -127.61                                   
REMARK 500 21 TYR A  13      -59.36   -121.79                                   
REMARK 500 21 HIS A  16       77.54   -116.99                                   
REMARK 500 21 MET A  25       69.00   -150.86                                   
REMARK 500 21 SER A  26       87.64    -29.49                                   
REMARK 500 21 VAL A  34       94.58    -41.61                                   
REMARK 500 21 CYS A  41       85.59     71.75                                   
REMARK 500 21 GLU A  42      -31.33   -152.42                                   
REMARK 500 22 CYS A   6     -141.17   -102.11                                   
REMARK 500 22 ASP A   9       30.85   -142.34                                   
REMARK 500 22 MET A  10       14.56   -145.44                                   
REMARK 500 22 ASN A  11       75.28   -109.83                                   
REMARK 500 22 TYR A  13      -60.28    -95.57                                   
REMARK 500 22 HIS A  16       77.49   -109.33                                   
REMARK 500 22 SER A  26       88.70    -29.05                                   
REMARK 500 22 VAL A  34      105.57    -47.27                                   
REMARK 500 22 VAL A  39       43.07    -84.76                                   
REMARK 500 22 ARG A  40       22.21   -160.27                                   
REMARK 500 22 CYS A  41       92.65     28.95                                   
REMARK 500 22 GLU A  42      -42.85   -154.20                                   
REMARK 500 23 CYS A   6     -146.14    -99.91                                   
REMARK 500 23 SER A   7     -164.42   -122.23                                   
REMARK 500 23 ASN A  11       66.50   -102.47                                   
REMARK 500 23 TYR A  13      -55.80   -145.86                                   
REMARK 500 23 SER A  26       88.57    -29.21                                   
REMARK 500 23 TYR A  29       86.31   -154.59                                   
REMARK 500 23 VAL A  34      105.84    -58.54                                   
REMARK 500 23 THR A  37       46.58   -109.42                                   
REMARK 500 23 VAL A  39       37.20    -87.11                                   
REMARK 500 23 ARG A  40       22.36   -160.09                                   
REMARK 500 23 CYS A  41       91.50     29.74                                   
REMARK 500 23 GLU A  42      -36.91   -144.92                                   
REMARK 500 24 THR A   4     -167.80   -119.77                                   
REMARK 500 24 CYS A   6     -161.25   -114.95                                   
REMARK 500 24 SER A   7     -144.84   -132.29                                   
REMARK 500 24 SER A  26       87.83    -29.87                                   
REMARK 500 24 VAL A  34      105.90    -52.21                                   
REMARK 500 24 VAL A  39       44.00    -84.15                                   
REMARK 500 24 ARG A  40       20.29   -160.14                                   
REMARK 500 24 CYS A  41       93.66     33.54                                   
REMARK 500 24 GLU A  42      -40.32   -151.13                                   
REMARK 500 25 CYS A   6     -147.53   -109.66                                   
REMARK 500 25 ASN A  11       54.16    -90.88                                   
REMARK 500 25 TYR A  13      -64.92   -106.92                                   
REMARK 500 25 MET A  25       68.83   -151.78                                   
REMARK 500 25 SER A  26       89.78    -29.19                                   
REMARK 500 25 VAL A  39       43.73    -84.70                                   
REMARK 500 25 ARG A  40       12.18   -148.99                                   
REMARK 500 25 CYS A  41       87.85     32.05                                   
REMARK 500 25 GLU A  42      -33.58   -160.32                                   
REMARK 500 26 SER A   2     -160.43   -160.04                                   
REMARK 500 26 CYS A   6      -93.98    -98.13                                   
REMARK 500 26 SER A   7     -167.20    172.45                                   
REMARK 500 26 ASP A   9       26.25     43.13                                   
REMARK 500 26 ASN A  11       70.42   -101.97                                   
REMARK 500 26 HIS A  16       78.63   -111.72                                   
REMARK 500 26 SER A  26       88.40    -29.12                                   
REMARK 500 26 ARG A  40      -95.62   -137.48                                   
REMARK 500 26 CYS A  41       73.04    163.62                                   
REMARK 500 27 CYS A   6     -152.86   -109.26                                   
REMARK 500 27 ASN A  11       72.47   -104.09                                   
REMARK 500 27 MET A  25       68.24   -150.55                                   
REMARK 500 27 SER A  26       89.86    -29.19                                   
REMARK 500 27 VAL A  34      101.67    -52.43                                   
REMARK 500 27 ARG A  40     -130.67   -102.15                                   
REMARK 500 27 CYS A  41       75.64   -151.72                                   
REMARK 500 28 CYS A   6     -155.59   -112.96                                   
REMARK 500 28 ASN A  11       68.30   -106.25                                   
REMARK 500 28 TYR A  13      -58.65   -156.93                                   
REMARK 500 28 HIS A  16       78.02   -111.65                                   
REMARK 500 28 SER A  26       88.56    -29.91                                   
REMARK 500 28 VAL A  34      103.19    -50.13                                   
REMARK 500 28 CYS A  41       87.63     32.62                                   
REMARK 500 28 GLU A  42      -34.81   -156.09                                   
REMARK 500 29 CYS A   6     -147.99   -104.59                                   
REMARK 500 29 SER A  26       86.20    -28.74                                   
REMARK 500 29 VAL A  34      103.86    -49.15                                   
REMARK 500 29 VAL A  39       40.65    -85.78                                   
REMARK 500 29 ARG A  40       21.07   -160.03                                   
REMARK 500 29 CYS A  41       84.85     32.32                                   
REMARK 500 29 GLU A  42      -41.53   -146.01                                   
REMARK 500 30 THR A   4     -163.61   -118.77                                   
REMARK 500 30 SER A   7     -158.41   -125.69                                   
REMARK 500 30 SER A  26       87.79    -29.21                                   
REMARK 500 30 VAL A  34      102.40    -46.08                                   
REMARK 500 30 ARG A  40       21.72   -140.23                                   
REMARK 500 30 CYS A  41       93.04     32.31                                   
REMARK 500 30 GLU A  42      -38.04   -156.61                                   
REMARK 500 31 CYS A   6     -141.15    -91.71                                   
REMARK 500 31 SER A   7     -155.20   -159.47                                   
REMARK 500 31 ASN A  11     -141.11   -118.35                                   
REMARK 500 31 TYR A  13      -70.27   -155.00                                   
REMARK 500 31 HIS A  16       77.21   -104.83                                   
REMARK 500 31 SER A  26       89.38    -29.15                                   
REMARK 500 31 VAL A  34       99.83    -49.94                                   
REMARK 500 31 CYS A  41       91.06     27.33                                   
REMARK 500 31 GLU A  42      -37.79   -156.60                                   
REMARK 500 32 SER A   7      -64.85   -133.84                                   
REMARK 500 32 SER A   8      -71.17   -153.69                                   
REMARK 500 32 TYR A  13      -58.43   -160.28                                   
REMARK 500 32 MET A  25       68.90   -151.01                                   
REMARK 500 32 SER A  26       89.52    -29.02                                   
REMARK 500 32 VAL A  34       93.17    -36.12                                   
REMARK 500 32 CYS A  41       70.26     69.51                                   
REMARK 500 32 GLU A  42      -29.25   -141.03                                   
REMARK 500 33 SER A   2       54.46   -101.80                                   
REMARK 500 33 CYS A   6     -159.86    -97.81                                   
REMARK 500 33 SER A   7     -146.47   -145.12                                   
REMARK 500 33 ASP A   9       26.93     42.08                                   
REMARK 500 33 MET A  25       70.85   -157.35                                   
REMARK 500 33 SER A  26       89.43    -29.32                                   
REMARK 500 33 VAL A  34      107.02    -47.25                                   
REMARK 500 33 VAL A  39       44.88    -84.99                                   
REMARK 500 33 ARG A  40       27.21   -160.26                                   
REMARK 500 33 CYS A  41       93.47     31.33                                   
REMARK 500 33 GLU A  42      -41.77   -159.24                                   
REMARK 500 34 THR A   4     -150.12   -160.25                                   
REMARK 500 34 SER A   7     -175.26     79.69                                   
REMARK 500 34 ASP A   9       46.13    -84.36                                   
REMARK 500 34 MET A  10       24.20   -155.17                                   
REMARK 500 34 ASN A  11     -158.24   -118.78                                   
REMARK 500 34 TYR A  13      -44.38   -159.70                                   
REMARK 500 34 HIS A  16       79.24   -113.52                                   
REMARK 500 34 SER A  26       86.24    -29.31                                   
REMARK 500 34 VAL A  39       44.96    -85.07                                   
REMARK 500 34 ARG A  40       20.92   -159.83                                   
REMARK 500 34 CYS A  41       90.94     26.71                                   
REMARK 500 34 GLU A  42      -34.62   -155.57                                   
REMARK 500 35 THR A   4     -150.67   -136.94                                   
REMARK 500 35 CYS A   6     -154.32   -111.95                                   
REMARK 500 35 SER A   7     -156.57   -137.49                                   
REMARK 500 35 ASP A   9       19.18     53.11                                   
REMARK 500 35 TYR A  13      -57.43   -148.13                                   
REMARK 500 35 SER A  26       89.80    -29.29                                   
REMARK 500 35 VAL A  39       43.47    -84.68                                   
REMARK 500 35 ARG A  40       18.71   -157.03                                   
REMARK 500 35 CYS A  41       91.40     29.76                                   
REMARK 500 35 GLU A  42      -37.74   -158.62                                   
REMARK 500 36 CYS A   6     -149.45   -102.14                                   
REMARK 500 36 MET A  10       22.31   -146.05                                   
REMARK 500 36 TYR A  13      -61.74   -122.98                                   
REMARK 500 36 SER A  26       89.64    -29.14                                   
REMARK 500 36 VAL A  34       97.33    -42.87                                   
REMARK 500 36 CYS A  41       82.53     72.79                                   
REMARK 500 36 GLU A  42      -30.70   -155.54                                   
REMARK 500 37 CYS A   6     -104.14   -108.85                                   
REMARK 500 37 SER A   7     -164.35    174.07                                   
REMARK 500 37 ASP A   9       26.41     43.17                                   
REMARK 500 37 TYR A  13      -52.74   -125.17                                   
REMARK 500 37 SER A  26       92.66    -29.52                                   
REMARK 500 37 VAL A  39       44.47    -84.67                                   
REMARK 500 37 ARG A  40       20.04   -157.32                                   
REMARK 500 37 CYS A  41       89.75     28.24                                   
REMARK 500 37 GLU A  42      -37.03   -153.63                                   
REMARK 500 38 SER A   2       42.43    -98.72                                   
REMARK 500 38 SER A   7     -153.17   -108.25                                   
REMARK 500 38 ASP A   9       25.30     45.26                                   
REMARK 500 38 ASN A  11       47.63   -101.55                                   
REMARK 500 38 SER A  26       87.93    -30.03                                   
REMARK 500 38 VAL A  39       44.27    -85.12                                   
REMARK 500 38 ARG A  40       22.26   -160.22                                   
REMARK 500 38 CYS A  41       90.28     29.63                                   
REMARK 500 38 GLU A  42      -45.04   -151.85                                   
REMARK 500 39 SER A   7     -159.62   -131.81                                   
REMARK 500 39 ASP A   9       24.02     46.50                                   
REMARK 500 39 TYR A  13      -53.32   -142.42                                   
REMARK 500 39 SER A  26       85.54    -29.21                                   
REMARK 500 39 VAL A  34      105.48    -53.65                                   
REMARK 500 39 VAL A  39       38.13    -87.09                                   
REMARK 500 39 ARG A  40       14.01   -146.31                                   
REMARK 500 39 CYS A  41       93.29     31.07                                   
REMARK 500 39 GLU A  42      -38.38   -159.50                                   
REMARK 500 40 SER A   7     -155.17   -116.85                                   
REMARK 500 40 ASP A   9       15.10     58.30                                   
REMARK 500 40 TYR A  13      -47.59   -131.02                                   
REMARK 500 40 MET A  25       68.50   -159.12                                   
REMARK 500 40 SER A  26       88.79    -29.51                                   
REMARK 500 40 VAL A  34      105.84    -52.16                                   
REMARK 500 40 VAL A  39       44.41    -84.85                                   
REMARK 500 40 ARG A  40       27.11   -159.60                                   
REMARK 500 40 CYS A  41       91.94     28.50                                   
REMARK 500 40 GLU A  42      -37.96   -157.47                                   
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  31         0.31    SIDE_CHAIN                              
REMARK 500  1 ARG A  40         0.29    SIDE_CHAIN                              
REMARK 500  2 ARG A  40         0.26    SIDE_CHAIN                              
REMARK 500  3 ARG A  31         0.25    SIDE_CHAIN                              
REMARK 500  3 ARG A  40         0.29    SIDE_CHAIN                              
REMARK 500  4 ARG A  31         0.27    SIDE_CHAIN                              
REMARK 500  5 ARG A  31         0.28    SIDE_CHAIN                              
REMARK 500  5 ARG A  40         0.32    SIDE_CHAIN                              
REMARK 500  6 ARG A  31         0.21    SIDE_CHAIN                              
REMARK 500  6 ARG A  40         0.31    SIDE_CHAIN                              
REMARK 500  7 ARG A  31         0.31    SIDE_CHAIN                              
REMARK 500  7 ARG A  40         0.27    SIDE_CHAIN                              
REMARK 500  8 ARG A  31         0.32    SIDE_CHAIN                              
REMARK 500  8 ARG A  40         0.29    SIDE_CHAIN                              
REMARK 500  9 ARG A  31         0.32    SIDE_CHAIN                              
REMARK 500  9 ARG A  40         0.17    SIDE_CHAIN                              
REMARK 500 10 ARG A  31         0.32    SIDE_CHAIN                              
REMARK 500 10 ARG A  40         0.19    SIDE_CHAIN                              
REMARK 500 11 ARG A  31         0.31    SIDE_CHAIN                              
REMARK 500 11 ARG A  40         0.21    SIDE_CHAIN                              
REMARK 500 12 ARG A  31         0.29    SIDE_CHAIN                              
REMARK 500 12 ARG A  40         0.23    SIDE_CHAIN                              
REMARK 500 13 ARG A  31         0.31    SIDE_CHAIN                              
REMARK 500 13 ARG A  40         0.11    SIDE_CHAIN                              
REMARK 500 14 ARG A  31         0.16    SIDE_CHAIN                              
REMARK 500 14 ARG A  40         0.11    SIDE_CHAIN                              
REMARK 500 15 ARG A  31         0.23    SIDE_CHAIN                              
REMARK 500 16 ARG A  31         0.31    SIDE_CHAIN                              
REMARK 500 16 ARG A  40         0.23    SIDE_CHAIN                              
REMARK 500 17 ARG A  31         0.30    SIDE_CHAIN                              
REMARK 500 17 ARG A  40         0.19    SIDE_CHAIN                              
REMARK 500 18 ARG A  31         0.32    SIDE_CHAIN                              
REMARK 500 18 ARG A  40         0.27    SIDE_CHAIN                              
REMARK 500 19 ARG A  31         0.17    SIDE_CHAIN                              
REMARK 500 19 ARG A  40         0.26    SIDE_CHAIN                              
REMARK 500 20 ARG A  31         0.32    SIDE_CHAIN                              
REMARK 500 20 ARG A  40         0.22    SIDE_CHAIN                              
REMARK 500 21 ARG A  31         0.32    SIDE_CHAIN                              
REMARK 500 21 ARG A  40         0.20    SIDE_CHAIN                              
REMARK 500 22 ARG A  31         0.32    SIDE_CHAIN                              
REMARK 500 22 ARG A  40         0.28    SIDE_CHAIN                              
REMARK 500 23 ARG A  31         0.23    SIDE_CHAIN                              
REMARK 500 23 ARG A  40         0.18    SIDE_CHAIN                              
REMARK 500 24 ARG A  31         0.26    SIDE_CHAIN                              
REMARK 500 24 ARG A  40         0.28    SIDE_CHAIN                              
REMARK 500 25 ARG A  31         0.30    SIDE_CHAIN                              
REMARK 500 25 ARG A  40         0.32    SIDE_CHAIN                              
REMARK 500 26 ARG A  31         0.31    SIDE_CHAIN                              
REMARK 500 26 ARG A  40         0.25    SIDE_CHAIN                              
REMARK 500 27 ARG A  31         0.30    SIDE_CHAIN                              
REMARK 500 27 ARG A  40         0.27    SIDE_CHAIN                              
REMARK 500 28 ARG A  31         0.24    SIDE_CHAIN                              
REMARK 500 28 ARG A  40         0.21    SIDE_CHAIN                              
REMARK 500 29 ARG A  31         0.13    SIDE_CHAIN                              
REMARK 500 29 ARG A  40         0.11    SIDE_CHAIN                              
REMARK 500 30 ARG A  31         0.31    SIDE_CHAIN                              
REMARK 500 30 ARG A  40         0.12    SIDE_CHAIN                              
REMARK 500 31 ARG A  31         0.23    SIDE_CHAIN                              
REMARK 500 31 ARG A  40         0.19    SIDE_CHAIN                              
REMARK 500 32 ARG A  31         0.30    SIDE_CHAIN                              
REMARK 500 32 ARG A  40         0.19    SIDE_CHAIN                              
REMARK 500 33 ARG A  31         0.19    SIDE_CHAIN                              
REMARK 500 33 ARG A  40         0.18    SIDE_CHAIN                              
REMARK 500 34 ARG A  31         0.29    SIDE_CHAIN                              
REMARK 500 34 ARG A  40         0.26    SIDE_CHAIN                              
REMARK 500 35 ARG A  31         0.31    SIDE_CHAIN                              
REMARK 500 35 ARG A  40         0.12    SIDE_CHAIN                              
REMARK 500 36 ARG A  31         0.31    SIDE_CHAIN                              
REMARK 500 36 ARG A  40         0.26    SIDE_CHAIN                              
REMARK 500 37 ARG A  31         0.12    SIDE_CHAIN                              
REMARK 500 37 ARG A  40         0.20    SIDE_CHAIN                              
REMARK 500 38 ARG A  31         0.31    SIDE_CHAIN                              
REMARK 500 38 ARG A  40         0.22    SIDE_CHAIN                              
REMARK 500 39 ARG A  31         0.15    SIDE_CHAIN                              
REMARK 500 39 ARG A  40         0.12    SIDE_CHAIN                              
REMARK 500 40 ARG A  31         0.32    SIDE_CHAIN                              
REMARK 500 40 ARG A  40         0.23    SIDE_CHAIN                              
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1K37   RELATED DB: PDB                                   
REMARK 900 1K37 IS MINIMIZED AVERAGE STRUCTURE                                  
DBREF  1K36 A    1    46  UNP    O14944   EREG_HUMAN      63    108             
SEQRES   1 A   46  VAL SER ILE THR LYS CYS SER SER ASP MET ASN GLY TYR          
SEQRES   2 A   46  CYS LEU HIS GLY GLN CYS ILE TYR LEU VAL ASP MET SER          
SEQRES   3 A   46  GLN ASN TYR CYS ARG CYS GLU VAL GLY TYR THR GLY VAL          
SEQRES   4 A   46  ARG CYS GLU HIS PHE PHE LEU                                  
SHEET    1   A 3 ILE A   3  THR A   4  0                                        
SHEET    2   A 3 GLY A  17  LEU A  22 -1  O  TYR A  21   N  THR A   4           
SHEET    3   A 3 GLN A  27  CYS A  32 -1  O  ARG A  31   N  GLN A  18           
SSBOND   1 CYS A    6    CYS A   19                          1555   1555  2.98  
SSBOND   2 CYS A   14    CYS A   30                          1555   1555  2.98  
SSBOND   3 CYS A   32    CYS A   41                          1555   1555  2.99  
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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