*HEADER    MEMBRANE PROTEIN                        02-JUN-03   1PJD              
*TITLE     STRUCTURE AND TOPOLOGY OF A PEPTIDE SEGMENT OF THE 6TH                
*TITLE    2 TRANSMEMBRANE DOMAIN OF THE SACCHAROMYCES CEREVISIAE ALPHA-          
*TITLE    3 FACTOR RECEPTOR IN PHOSPHOLIPID BILAYERS                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PHEROMONE ALPHA FACTOR RECEPTOR;                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN A PORTION           
*SOURCE   4 OF THE 6TH TRANSMEMBRANE DOMAIN OF THE ALPHA FACTOR                  
*SOURCE   5 RECEPTOR OF SACCHAROMYCES CEREVISIAE. 15N SELECTIVELY                
*SOURCE   6 LABELED FMOC-LEU, -ALA, -PHE, -VAL, -ILE WERE USED.                  
*KEYWDS    ALPHA HELIX                                                           
*EXPDTA    NMR, MINIMIZED AVERAGE STRUCTURE                                      
*AUTHOR    K.G.VALENTINE, S.-F.LIU, F.M.MARASSI, G.VEGLIA,                       
*AUTHOR   2 A.A.NEVZOROV, S.J.OPELLA, F.-X.DING, S.-H.WANG, B.ARSHAVA,           
*AUTHOR   3 J.M.BECKER, F.NAIDER                                                 
*REVDAT   1   16-SEP-03 1PJD    0                                                

		15N Shift/ppm	1H-15N Dipolar/kHz

Leu4	  	155.0    	1.6000
Leu5    	219.6    	8.3000
Val6    	202.1    	8.4500
Ile9    	214.6   	8.3000
Ile10    	219.4    	9.0000
Phe11    	219.5   	9.7500
Ile12    	215.3    	9.0500
Leu13    	209.8    	8.8000
Ala14   	210.2    	7.6000
Leu17    	207.0    	7.9500


  Entry H atom name         Submitted Coord H atom name
    1    H    LEU   4           H        LEU   4  -0.314  -0.487 -11.253
    2    H    LEU   5           H        LEU   5   0.657  -1.756  -9.669
    3    H    VAL   6           H        VAL   6   2.662  -0.157  -8.284
    4    H    SER   8           H        SER   8  -0.645  -0.719  -5.473
    5    H    ILE   9           H        ILE   9   1.436  -1.657  -3.588
    6    H    ILE  10           H        ILE  10   0.679   0.626  -1.913
    7    H    PHE  11           H        PHE  11  -1.791   0.485  -0.595
    8    H    ILE  12           H        ILE  12  -1.026  -2.027   1.020
    9    H    LEU  13           H        LEU  13   0.522  -0.492   2.613
   10    H    ALA  14           H        ALA  14  -1.168   0.428   4.442
   11    H    TYR  15           H        TYR  15  -0.427  -1.064   6.689
   12    H    SER  16           H        SER  16   0.833   0.551   8.238
   13    H    LEU  17           H        LEU  17  -0.415   2.179   9.596