*HEADER   PHAGE COAT PROTEIN                      10-DEC-96   1FGP    
*TITLE    MEMBRANE PENETRATION DOMAIN OF THE MINOR COAT PROTEIN G3P   
*TITLE   2 OF PHAGE FD, NMR, 15 STRUCTURES                            
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: FD GENE 3 PROTEIN;                               
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 FRAGMENT: DOMAIN 1;                                        
*COMPND  5 ENGINEERED: YES;                                           
*COMPND  6 BIOLOGICAL_UNIT: MONOMER                                   
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: BACTERIOPHAGE FD;                     
*SOURCE  3 ORGANISM_COMMON: FD PHAGE;                                 
*SOURCE  4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  5 EXPRESSION_SYSTEM_CELLULAR_LOCATION: SUPERNATANT;          
*SOURCE  6 EXPRESSION_SYSTEM_PLASMID: PUC119                          
*KEYWDS   PHAGE COAT PROTEIN, SH3 DOMAIN, PH DOMAIN, PDZ DOMAIN, FD   
*KEYWDS  2 PHAGE, FILAMENTOUS PAHGE, PHAGE INFECTION, PTB DOMAIN      
*EXPDTA   NMR, 15 STRUCTURES                                          
*AUTHOR   P.HOLLIGER,L.RIECHMANN                                      
*REVDAT  1   16-JUN-97 1FGP    0                                      


assign ( resid 37 and name HN ) ( resid 30 and name O ) 2.0 2.0 0.3
assign ( resid 37 and name N  ) ( resid 30 and name O ) 3.0 0.5 0.3
assign ( resid 30 and name HN ) ( resid 37 and name O ) 2.0 2.0 0.3
assign ( resid 30 and name N  ) ( resid 37 and name O ) 3.0 0.5 0.3
assign ( resid 32 and name HN ) ( resid 35 and name O ) 2.0 2.0 0.3
assign ( resid 32 and name N  ) ( resid 35 and name O ) 3.0 0.5 0.3
assign ( resid 35 and name HN ) ( resid 32 and name O ) 2.0 2.0 0.3
assign ( resid 35 and name N  ) ( resid 32 and name O ) 3.0 0.5 0.3
assign ( resid 38 and name HN ) ( resid 57 and name O ) 2.0 2.0 0.3
assign ( resid 38 and name N  ) ( resid 57 and name O ) 3.0 0.5 0.3
assign ( resid 57 and name HN ) ( resid 38 and name O ) 2.0 2.0 0.3
assign ( resid 57 and name N  ) ( resid 38 and name O ) 3.0 0.5 0.3
assign ( resid 56 and name HN ) ( resid 12 and name O ) 2.0 2.0 0.3
assign ( resid 56 and name N  ) ( resid 12 and name O ) 3.0 0.5 0.3
assign ( resid 29 and name HN ) ( resid 20 and name O ) 2.0 2.0 0.3
assign ( resid 29 and name N  ) ( resid 20 and name O ) 3.0 0.5 0.3
assign ( resid 20 and name HN ) ( resid 29 and name O ) 2.0 2.0 0.3
assign ( resid 20 and name N  ) ( resid 29 and name O ) 3.0 0.5 0.3
assign ( resid 54 and name HN ) ( resid 14 and name O ) 2.0 2.0 0.3
assign ( resid 54 and name N  ) ( resid 14 and name O ) 3.0 0.5 0.3
assign ( resid 60 and name HN ) ( resid 36 and name O ) 2.0 2.0 0.3
assign ( resid 60 and name N  ) ( resid 36 and name O ) 3.0 0.5 0.3
assign ( resid 36 and name HN ) ( resid 60 and name O ) 2.0 2.0 0.3
assign ( resid 36 and name N  ) ( resid 60 and name O ) 3.0 0.5 0.3
assign ( resid 39 and name HN ) ( resid 28 and name O ) 2.0 2.0 0.3
assign ( resid 39 and name N  ) ( resid 28 and name O ) 3.0 0.5 0.3
assign ( resid 28 and name HN ) ( resid 39 and name O ) 2.0 2.0 0.3
assign ( resid 28 and name N  ) ( resid 39 and name O ) 3.0 0.5 0.3
assign ( resid 7 and name HN ) ( resid 3 and name O ) 2.0 2.0 0.3
assign ( resid 7 and name N  ) ( resid 3 and name O ) 3.0 0.5 0.3
assign ( resid 9 and name HN ) ( resid 5 and name O ) 2.0 2.0 0.3
assign ( resid 9 and name N  ) ( resid 5 and name O ) 3.0 0.5 0.3
assign ( resid 16 and name HN ) ( resid 52 and name O ) 2.0 2.0 0.3
assign ( resid 16 and name N  ) ( resid 52 and name O ) 3.0 0.5 0.3
assign ( resid 52 and name HN ) ( resid 16 and name O ) 2.0 2.0 0.3
assign ( resid 52 and name N  ) ( resid 16 and name O ) 3.0 0.5 0.3
assign ( resid 51 and name HN ) ( resid 46 and name O ) 2.0 2.0 0.3
assign ( resid 51 and name N  ) ( resid 46 and name O ) 3.0 0.5 0.3
assign ( resid 53 and name HN ) ( resid 44 and name O ) 2.0 2.0 0.3
assign ( resid 53 and name N  ) ( resid 44 and name O ) 3.0 0.5 0.3
assign ( resid 44 and name HN ) ( resid 53 and name O ) 2.0 2.0 0.3
assign ( resid 44 and name N  ) ( resid 53 and name O ) 3.0 0.5 0.3
assign ( resid 27 and name HN ) ( resid 22 and name O ) 2.0 2.0 0.3
assign ( resid 27 and name N  ) ( resid 22 and name O ) 3.0 0.5 0.3
assign ( resid 6 and name HN ) ( resid 2 and name O ) 2.0 2.0 0.3
assign ( resid 6 and name N  ) ( resid 2 and name O ) 3.0 0.5 0.3
assign ( resid 1 and name HA ) ( resid 1 and name HB* ) 5.0 5.0 0.6
assign ( resid 1 and name HA ) ( resid 1 and name HB* ) 5.0 5.0 0.6
assign ( resid 1 and name HA ) ( resid 1 and name HG* ) 5.0 5.0 0.6
assign ( resid 1 and name HA ) ( resid 1 and name HG* ) 5.0 5.0 0.6
assign ( resid 1 and name HA ) ( resid 2 and name HG2* ) 6.0 6.0 1.2
assign ( resid 1 and name HA ) ( resid 34 and name HA* ) 6.0 6.0 0.72
assign ( resid 1 and name HB* ) ( resid 1 and name HA ) 5.0 5.0 0.6
assign ( resid 1 and name HB* ) ( resid 1 and name HA ) 5.0 5.0 0.6
assign ( resid 1 and name HB* ) ( resid 1 and name HB* ) 3.0 3.0 0.7632
assign ( resid 1 and name HB* ) ( resid 1 and name HG* ) 3.0 3.0 0.7632
assign ( resid 1 and name HB* ) ( resid 1 and name HG* ) 4.0 4.0 1.0176
assign ( resid 1 and name HB* ) ( resid 1 and name HG* ) 4.0 4.0 1.0176
assign ( resid 1 and name HB* ) ( resid 61 and name HD* ) 5.0 5.0 2.56
assign ( resid 1 and name HB* ) ( resid 61 and name HD* ) 5.0 5.0 2.56
assign ( resid 1 and name HG* ) ( resid 1 and name HA ) 5.0 5.0 0.6
assign ( resid 1 and name HG* ) ( resid 1 and name HA ) 5.0 5.0 0.6
assign ( resid 1 and name HG* ) ( resid 1 and name HB* ) 4.0 4.0 1.0176
assign ( resid 1 and name HG* ) ( resid 1 and name HB* ) 4.0 4.0 1.0176
assign ( resid 1 and name HG* ) ( resid 1 and name HG* ) 2.5 2.5 0.636
assign ( resid 1 and name HG* ) ( resid 1 and name HG* ) 3.0 3.0 0.7632
assign ( resid 1 and name HG* ) ( resid 7 and name HG ) 6.0 6.0 0.72
assign ( resid 10 and name HA ) ( resid 10 and name HB* ) 5.0 5.0 0.6
assign ( resid 10 and name HA ) ( resid 10 and name HB* ) 5.0 5.0 0.6
assign ( resid 10 and name HA ) ( resid 10 and name HG* ) 6.0 6.0 0.72
assign ( resid 10 and name HB* ) ( resid 10 and name HB* ) 2.5 2.5 0.636
assign ( resid 10 and name HB* ) ( resid 10 and name HB* ) 4.0 4.0 1.0176
assign ( resid 10 and name HB* ) ( resid 10 and name HD* ) 5.0 5.0 1.272
assign ( resid 10 and name HB* ) ( resid 10 and name HD* ) 5.0 5.0 1.272
assign ( resid 10 and name HB* ) ( resid 10 and name HD* ) 5.0 5.0 1.272
assign ( resid 10 and name HB* ) ( resid 10 and name HD* ) 6.0 6.0 1.5264
assign ( resid 10 and name HD* ) ( resid 10 and name HB* ) 5.0 5.0 1.272
assign ( resid 10 and name HD* ) ( resid 10 and name HB* ) 5.0 5.0 1.272
assign ( resid 10 and name HD* ) ( resid 10 and name HB* ) 5.0 5.0 1.272
assign ( resid 10 and name HD* ) ( resid 10 and name HB* ) 6.0 6.0 1.5264
assign ( resid 10 and name HD* ) ( resid 10 and name HG* ) 4.0 4.0 1.0176
assign ( resid 10 and name HD* ) ( resid 10 and name HG* ) 4.0 4.0 1.0176
assign ( resid 10 and name HD* ) ( resid 10 and name HG* ) 4.0 4.0 1.0176
assign ( resid 10 and name HD* ) ( resid 10 and name HG* ) 5.0 5.0 1.272
assign ( resid 10 and name HD* ) ( resid 9 and name HA ) 3.0 3.0 0.36
assign ( resid 10 and name HD* ) ( resid 9 and name HA ) 4.0 4.0 0.48
assign ( resid 10 and name HD* ) ( resid 9 and name HG* ) 5.0 5.0 1.272
assign ( resid 10 and name HD* ) ( resid 9 and name HG* ) 6.0 6.0 1.5264
assign ( resid 10 and name HG* ) ( resid 10 and name HB* ) 4.0 4.0 1.0176
assign ( resid 10 and name HG* ) ( resid 10 and name HB* ) 4.0 4.0 1.0176
assign ( resid 10 and name HG* ) ( resid 10 and name HB* ) 5.0 5.0 1.272
assign ( resid 10 and name HG* ) ( resid 10 and name HB* ) 5.0 5.0 1.272
assign ( resid 10 and name HG* ) ( resid 10 and name HD* ) 5.0 5.0 1.272
assign ( resid 10 and name HG* ) ( resid 10 and name HD* ) 5.0 5.0 1.272
assign ( resid 10 and name HG* ) ( resid 10 and name HD* ) 5.0 5.0 1.272
assign ( resid 10 and name HG* ) ( resid 10 and name HD* ) 5.0 5.0 1.272
assign ( resid 10 and name HG* ) ( resid 37 and name HZ2 ) 6.0 6.0 0.72
assign ( resid 10 and name HG* ) ( resid 37 and name HZ2 ) 6.0 6.0 0.72
assign ( resid 11 and name HA ) ( resid 11 and name HB* ) 4.0 4.0 0.48
assign ( resid 11 and name HA ) ( resid 11 and name HB* ) 5.0 5.0 0.6
assign ( resid 11 and name HA ) ( resid 11 and name HD* ) 5.0 5.0 0.0
assign ( resid 11 and name HA ) ( resid 12 and name HB ) 5.0 5.0 0.0
assign ( resid 11 and name HA ) ( resid 12 and name HG2* ) 5.0 5.0 1.0
assign ( resid 11 and name HA ) ( resid 37 and name HZ3 ) 5.0 5.0 0.0
assign ( resid 11 and name HA ) ( resid 57 and name HA ) 5.0 5.0 0.0
assign ( resid 11 and name HA ) ( resid 57 and name HG* ) 5.0 5.0 1.75
assign ( resid 11 and name HA ) ( resid 58 and name HD* ) 5.0 5.0 0.6
assign ( resid 11 and name HB* ) ( resid 11 and name HA ) 4.0 4.0 0.48
assign ( resid 11 and name HB* ) ( resid 11 and name HA ) 5.0 5.0 0.6
assign ( resid 11 and name HB* ) ( resid 11 and name HB* ) 2.5 2.5 0.636
assign ( resid 11 and name HB* ) ( resid 11 and name HB* ) 2.5 2.5 0.636
assign ( resid 11 and name HB* ) ( resid 11 and name HD* ) 5.0 5.0 0.6
assign ( resid 11 and name HB* ) ( resid 12 and name HG2* ) 5.0 5.0 1.72
assign ( resid 11 and name HB* ) ( resid 12 and name HG2* ) 5.0 5.0 1.72
assign ( resid 11 and name HB* ) ( resid 37 and name HE3 ) 6.0 6.0 0.72
assign ( resid 11 and name HB* ) ( resid 37 and name HE3 ) 6.0 6.0 0.72
assign ( resid 11 and name HB* ) ( resid 55 and name HG2* ) 6.0 6.0 2.064
assign ( resid 11 and name HB* ) ( resid 57 and name HG* ) 5.0 5.0 2.56
assign ( resid 11 and name HB* ) ( resid 57 and name HG* ) 5.0 5.0 2.56
assign ( resid 11 and name HB* ) ( resid 58 and name HD* ) 5.0 5.0 1.272
assign ( resid 11 and name HB* ) ( resid 58 and name HD* ) 5.0 5.0 1.272
assign ( resid 11 and name HD* ) ( resid 11 and name HA ) 5.0 5.0 0.0
assign ( resid 11 and name HD* ) ( resid 11 and name HB* ) 5.0 5.0 0.6
assign ( resid 11 and name HD* ) ( resid 11 and name HB* ) 6.0 6.0 0.72
assign ( resid 11 and name HD* ) ( resid 12 and name HG2* ) 6.0 6.0 1.2
assign ( resid 11 and name HD* ) ( resid 57 and name HA ) 5.0 5.0 0.0
assign ( resid 11 and name HD* ) ( resid 57 and name HG* ) 5.0 5.0 1.75
assign ( resid 11 and name HD* ) ( resid 58 and name HD* ) 4.0 4.0 0.48
assign ( resid 11 and name HD* ) ( resid 9 and name HB* ) 5.0 5.0 0.6
assign ( resid 11 and name HD* ) ( resid 9 and name HB* ) 6.0 6.0 0.72
assign ( resid 11 and name HN ) ( resid 10 and name HA ) 5.0 5.0 0.0
assign ( resid 11 and name HN ) ( resid 10 and name HB* ) 5.0 5.0 0.6
assign ( resid 11 and name HN ) ( resid 10 and name HB* ) 5.0 5.0 0.6
assign ( resid 11 and name HN ) ( resid 11 and name HA ) 5.0 5.0 0.0
assign ( resid 11 and name HN ) ( resid 11 and name HB* ) 4.0 4.0 0.48
assign ( resid 11 and name HN ) ( resid 11 and name HB* ) 5.0 5.0 0.6
assign ( resid 11 and name HN ) ( resid 11 and name HD* ) 5.0 5.0 0.0
assign ( resid 12 and name HA ) ( resid 12 and name HB ) 4.0 4.0 0.0
assign ( resid 12 and name HA ) ( resid 12 and name HB ) 4.0 4.0 0.0
assign ( resid 12 and name HA ) ( resid 12 and name HG2* ) 5.0 5.0 1.0
assign ( resid 12 and name HA ) ( resid 12 and name HG2* ) 5.0 5.0 1.0
assign ( resid 12 and name HB ) ( resid 11 and name HA ) 6.0 6.0 0.0
assign ( resid 12 and name HB ) ( resid 12 and name HA ) 5.0 5.0 0.0
assign ( resid 12 and name HB ) ( resid 12 and name HG2* ) 3.0 3.0 0.6
assign ( resid 12 and name HB ) ( resid 37 and name HZ3 ) 6.0 6.0 0.0
assign ( resid 12 and name HB ) ( resid 55 and name HA ) 6.0 6.0 0.0
assign ( resid 12 and name HB ) ( resid 55 and name HB ) 5.0 5.0 0.0
assign ( resid 12 and name HB ) ( resid 56 and name HB* ) 5.0 5.0 0.6
assign ( resid 12 and name HB ) ( resid 56 and name HB* ) 5.0 5.0 0.6
assign ( resid 12 and name HG2* ) ( resid 11 and name HA ) 6.0 6.0 1.2
assign ( resid 12 and name HG2* ) ( resid 11 and name HD* ) 6.0 6.0 1.2
assign ( resid 12 and name HG2* ) ( resid 12 and name HA ) 5.0 5.0 1.0
assign ( resid 12 and name HG2* ) ( resid 12 and name HB ) 5.0 5.0 1.0
assign ( resid 12 and name HG2* ) ( resid 13 and name HA ) 5.0 5.0 1.0
assign ( resid 12 and name HG2* ) ( resid 13 and name HB* ) 5.0 5.0 1.72
assign ( resid 12 and name HG2* ) ( resid 14 and name HB* ) 5.0 5.0 1.72
assign ( resid 12 and name HG2* ) ( resid 14 and name HB* ) 5.0 5.0 1.72
assign ( resid 12 and name HG2* ) ( resid 37 and name HE3 ) 6.0 6.0 1.2
assign ( resid 12 and name HG2* ) ( resid 37 and name HZ3 ) 6.0 6.0 1.2
assign ( resid 12 and name HG2* ) ( resid 56 and name HA ) 5.0 5.0 1.0
assign ( resid 12 and name HG2* ) ( resid 56 and name HB* ) 5.0 5.0 1.72
assign ( resid 12 and name HG2* ) ( resid 56 and name HB* ) 6.0 6.0 2.064
assign ( resid 12 and name HG2* ) ( resid 56 and name HD* ) 6.0 6.0 1.2
assign ( resid 12 and name HN ) ( resid 11 and name HA ) 3.0 3.0 0.0
assign ( resid 12 and name HN ) ( resid 12 and name HB ) 5.0 5.0 0.0
assign ( resid 12 and name HN ) ( resid 12 and name HG2* ) 4.0 4.0 0.8
assign ( resid 12 and name HN ) ( resid 56 and name HB* ) 5.0 5.0 0.6
assign ( resid 12 and name HN ) ( resid 56 and name HB* ) 5.0 5.0 0.6
assign ( resid 12 and name HN ) ( resid 56 and name HN ) 6.0 6.0 0.0
assign ( resid 12 and name HN ) ( resid 57 and name HA ) 6.0 6.0 0.0
assign ( resid 12 and name HN ) ( resid 57 and name HN ) 5.0 5.0 0.0
assign ( resid 13 and name HA ) ( resid 12 and name HG2* ) 5.0 5.0 1.0
assign ( resid 13 and name HA ) ( resid 13 and name HB* ) 4.0 4.0 0.48
assign ( resid 13 and name HA ) ( resid 13 and name HG* ) 4.0 4.0 0.48
assign ( resid 13 and name HA ) ( resid 55 and name HA ) 3.0 3.0 0.0
assign ( resid 13 and name HA ) ( resid 56 and name HD* ) 5.0 5.0 0.0
assign ( resid 13 and name HB* ) ( resid 13 and name HA ) 5.0 5.0 0.6
assign ( resid 13 and name HB* ) ( resid 13 and name HA ) 5.0 5.0 0.6
assign ( resid 13 and name HG* ) ( resid 12 and name HG2* ) 5.0 5.0 1.72
assign ( resid 13 and name HG* ) ( resid 13 and name HA ) 5.0 5.0 0.6
assign ( resid 13 and name HG* ) ( resid 13 and name HA ) 5.0 5.0 0.6
assign ( resid 13 and name HG* ) ( resid 13 and name HA ) 6.0 6.0 0.72
assign ( resid 13 and name HG* ) ( resid 13 and name HB ) 3.0 3.0 0.36
assign ( resid 13 and name HG* ) ( resid 13 and name HB ) 4.0 4.0 0.48
assign ( resid 13 and name HG* ) ( resid 13 and name HB* ) 3.0 3.0 0.7632
assign ( resid 13 and name HG* ) ( resid 13 and name HB* ) 5.0 5.0 1.272
assign ( resid 13 and name HG* ) ( resid 55 and name HA ) 6.0 6.0 0.72
assign ( resid 13 and name HN ) ( resid 12 and name HA ) 6.0 6.0 0.0
assign ( resid 13 and name HN ) ( resid 12 and name HG2* ) 5.0 5.0 1.0
assign ( resid 13 and name HN ) ( resid 13 and name HA ) 5.0 5.0 0.0
assign ( resid 13 and name HN ) ( resid 13 and name HB* ) 3.0 3.0 0.36
assign ( resid 13 and name HN ) ( resid 13 and name HG* ) 4.0 4.0 0.48
assign ( resid 14 and name HA ) ( resid 14 and name HB* ) 5.0 5.0 0.6
assign ( resid 14 and name HA ) ( resid 14 and name HB* ) 5.0 5.0 0.6
assign ( resid 14 and name HA ) ( resid 53 and name HD* ) 6.0 6.0 0.72
assign ( resid 14 and name HA ) ( resid 53 and name HE* ) 5.0 5.0 0.6
assign ( resid 14 and name HB* ) ( resid 12 and name HG2* ) 5.0 5.0 1.72
assign ( resid 14 and name HB* ) ( resid 12 and name HG2* ) 5.0 5.0 1.72
assign ( resid 14 and name HB* ) ( resid 12 and name HG2* ) 5.0 5.0 1.72
assign ( resid 14 and name HB* ) ( resid 12 and name HG2* ) 5.0 5.0 1.72
assign ( resid 14 and name HB* ) ( resid 14 and name HA ) 5.0 5.0 0.6
assign ( resid 14 and name HB* ) ( resid 14 and name HA ) 5.0 5.0 0.6
assign ( resid 14 and name HB* ) ( resid 14 and name HA ) 5.0 5.0 0.6
assign ( resid 14 and name HB* ) ( resid 14 and name HA ) 5.0 5.0 0.6
assign ( resid 14 and name HB* ) ( resid 14 and name HB* ) 2.5 2.5 0.636
assign ( resid 14 and name HB* ) ( resid 14 and name HB* ) 3.0 3.0 0.7632
assign ( resid 14 and name HB* ) ( resid 14 and name HB* ) 3.0 3.0 0.7632
assign ( resid 14 and name HB* ) ( resid 14 and name HB* ) 3.0 3.0 0.7632
assign ( resid 14 and name HB* ) ( resid 15 and name HA ) 5.0 5.0 0.6
assign ( resid 14 and name HB* ) ( resid 15 and name HA ) 5.0 5.0 0.6
assign ( resid 14 and name HB* ) ( resid 56 and name HD* ) 6.0 6.0 0.72
assign ( resid 14 and name HN ) ( resid 13 and name HA ) 3.0 3.0 0.0
assign ( resid 14 and name HN ) ( resid 13 and name HB* ) 6.0 6.0 0.72
assign ( resid 14 and name HN ) ( resid 13 and name HG* ) 6.0 6.0 0.72
assign ( resid 14 and name HN ) ( resid 13 and name HN ) 6.0 6.0 0.0
assign ( resid 14 and name HN ) ( resid 14 and name HB* ) 5.0 5.0 0.6
assign ( resid 14 and name HN ) ( resid 14 and name HB* ) 5.0 5.0 0.6
assign ( resid 14 and name HN ) ( resid 54 and name HN ) 5.0 5.0 0.0
assign ( resid 14 and name HN ) ( resid 55 and name HG2* ) 5.0 5.0 1.0
assign ( resid 14 and name HN ) ( resid 55 and name HN ) 6.0 6.0 0.0
assign ( resid 14 and name HN ) ( resid 56 and name HD* ) 4.0 4.0 0.0
assign ( resid 14 and name HN ) ( resid 56 and name HE1 ) 5.0 5.0 0.0
assign ( resid 15 and name HA ) ( resid 15 and name HB* ) 3.0 3.0 0.36
assign ( resid 15 and name HA ) ( resid 53 and name HD* ) 5.0 5.0 0.6
assign ( resid 15 and name HA ) ( resid 56 and name HB* ) 5.0 5.0 0.6
assign ( resid 15 and name HB ) ( resid 56 and name HA ) 5.0 5.0 0.0
assign ( resid 15 and name HB* ) ( resid 15 and name HA ) 4.0 4.0 0.48
assign ( resid 15 and name HB* ) ( resid 53 and name HA ) 5.0 5.0 0.6
assign ( resid 15 and name HB* ) ( resid 53 and name HB* ) 5.0 5.0 1.272
assign ( resid 15 and name HB* ) ( resid 53 and name HD* ) 5.0 5.0 1.272
assign ( resid 15 and name HB* ) ( resid 53 and name HE* ) 5.0 5.0 1.272
assign ( resid 15 and name HN ) ( resid 14 and name HA ) 6.0 6.0 0.0
assign ( resid 15 and name HN ) ( resid 14 and name HB* ) 4.0 4.0 0.48
assign ( resid 15 and name HN ) ( resid 14 and name HB* ) 5.0 5.0 0.6
assign ( resid 15 and name HN ) ( resid 15 and name HA ) 5.0 5.0 0.0
assign ( resid 15 and name HN ) ( resid 15 and name HB* ) 4.0 4.0 0.48
assign ( resid 15 and name HN ) ( resid 53 and name HD* ) 5.0 5.0 0.6
assign ( resid 16 and name HA ) ( resid 14 and name HB* ) 6.0 6.0 0.72
assign ( resid 16 and name HA ) ( resid 16 and name HB* ) 4.0 4.0 0.48
assign ( resid 16 and name HA ) ( resid 16 and name HB* ) 5.0 5.0 0.6
assign ( resid 16 and name HA ) ( resid 17 and name HG2* ) 6.0 6.0 1.2
assign ( resid 16 and name HA ) ( resid 53 and name HA ) 6.0 6.0 0.0
assign ( resid 16 and name HB* ) ( resid 15 and name HA ) 5.0 5.0 0.6
assign ( resid 16 and name HB* ) ( resid 15 and name HA ) 6.0 6.0 0.72
assign ( resid 16 and name HB* ) ( resid 16 and name HA ) 5.0 5.0 0.6
assign ( resid 16 and name HB* ) ( resid 16 and name HA ) 5.0 5.0 0.6
assign ( resid 16 and name HB* ) ( resid 16 and name HB* ) 3.0 3.0 0.7632
assign ( resid 16 and name HB* ) ( resid 16 and name HB* ) 3.0 3.0 0.7632
assign ( resid 16 and name HB* ) ( resid 19 and name HG* ) 4.0 4.0 2.048
assign ( resid 16 and name HB* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 16 and name HB* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 16 and name HB* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 16 and name HB* ) ( resid 56 and name HZ2 ) 6.0 6.0 0.72
assign ( resid 16 and name HB* ) ( resid 56 and name HZ2 ) 6.0 6.0 0.72
assign ( resid 16 and name HD* ) ( resid 16 and name HB* ) 5.0 5.0 1.272
assign ( resid 16 and name HD* ) ( resid 16 and name HB* ) 6.0 6.0 1.5264
assign ( resid 16 and name HE* ) ( resid 17 and name HA ) 5.0 5.0 0.6
assign ( resid 16 and name HN ) ( resid 15 and name HA ) 3.0 3.0 0.0
assign ( resid 16 and name HN ) ( resid 15 and name HB* ) 5.0 5.0 0.6
assign ( resid 16 and name HN ) ( resid 16 and name HB* ) 4.0 4.0 0.48
assign ( resid 16 and name HN ) ( resid 16 and name HB* ) 6.0 6.0 0.72
assign ( resid 16 and name HN ) ( resid 52 and name HN ) 5.0 5.0 0.0
assign ( resid 16 and name HN ) ( resid 54 and name HN ) 6.0 6.0 0.0
assign ( resid 17 and name HA ) ( resid 17 and name HB ) 4.0 4.0 0.0
assign ( resid 17 and name HA ) ( resid 17 and name HG2* ) 4.0 4.0 0.8
assign ( resid 17 and name HA ) ( resid 19 and name HG* ) 5.0 5.0 1.75
assign ( resid 17 and name HA ) ( resid 51 and name HA ) 4.0 4.0 0.0
assign ( resid 17 and name HA ) ( resid 51 and name HB* ) 5.0 5.0 0.6
assign ( resid 17 and name HA ) ( resid 51 and name HG* ) 5.0 5.0 0.0
assign ( resid 17 and name HA ) ( resid 51 and name HG* ) 6.0 6.0 0.0
assign ( resid 17 and name HB ) ( resid 17 and name HA ) 4.0 4.0 0.0
assign ( resid 17 and name HB ) ( resid 17 and name HG2* ) 3.0 3.0 0.6
assign ( resid 17 and name HB ) ( resid 51 and name HA ) 5.0 5.0 0.0
assign ( resid 17 and name HB ) ( resid 51 and name HB* ) 5.0 5.0 0.6
assign ( resid 17 and name HB ) ( resid 51 and name HG* ) 6.0 6.0 0.0
assign ( resid 17 and name HG2* ) ( resid 17 and name HA ) 5.0 5.0 1.0
assign ( resid 17 and name HG2* ) ( resid 17 and name HB ) 4.0 4.0 0.8
assign ( resid 17 and name HG2* ) ( resid 51 and name HA ) 6.0 6.0 1.2
assign ( resid 17 and name HG2* ) ( resid 51 and name HB* ) 6.0 6.0 2.064
assign ( resid 17 and name HG2* ) ( resid 51 and name HG* ) 6.0 6.0 1.2
assign ( resid 17 and name HN ) ( resid 16 and name HB* ) 5.0 5.0 0.6
assign ( resid 17 and name HN ) ( resid 17 and name HA ) 5.0 5.0 0.0
assign ( resid 17 and name HN ) ( resid 17 and name HG2* ) 4.0 4.0 0.8
assign ( resid 18 and name HA ) ( resid 18 and name HB* ) 4.0 4.0 0.48
assign ( resid 18 and name HB* ) ( resid 18 and name HA ) 5.0 5.0 0.6
assign ( resid 18 and name HB* ) ( resid 51 and name HG* ) 6.0 6.0 0.72
assign ( resid 18 and name HN ) ( resid 17 and name HA ) 5.0 5.0 0.0
assign ( resid 18 and name HN ) ( resid 17 and name HB ) 5.0 5.0 0.0
assign ( resid 18 and name HN ) ( resid 17 and name HG2* ) 5.0 5.0 1.0
assign ( resid 18 and name HN ) ( resid 18 and name HA ) 6.0 6.0 0.0
assign ( resid 18 and name HN ) ( resid 18 and name HB* ) 5.0 5.0 0.6
assign ( resid 18 and name HN ) ( resid 19 and name HB ) 5.0 5.0 0.0
assign ( resid 18 and name HN ) ( resid 19 and name HG* ) 6.0 6.0 2.1
assign ( resid 18 and name HN ) ( resid 19 and name HN ) 4.0 4.0 0.0
assign ( resid 19 and name HA ) ( resid 19 and name HB ) 5.0 5.0 0.0
assign ( resid 19 and name HA ) ( resid 19 and name HG* ) 3.0 3.0 1.05
assign ( resid 19 and name HA ) ( resid 19 and name HG* ) 5.0 5.0 1.75
assign ( resid 19 and name HB ) ( resid 19 and name HA ) 5.0 5.0 0.0
assign ( resid 19 and name HB ) ( resid 19 and name HG* ) 4.0 4.0 1.4
assign ( resid 19 and name HB ) ( resid 50 and name HG2* ) 6.0 6.0 1.2
assign ( resid 19 and name HB* ) ( resid 19 and name HG* ) 4.0 4.0 1.4
assign ( resid 19 and name HG* ) ( resid 16 and name HB* ) 4.0 4.0 2.048
assign ( resid 19 and name HG* ) ( resid 16 and name HB* ) 5.0 5.0 2.56
assign ( resid 19 and name HG* ) ( resid 17 and name HA ) 5.0 5.0 1.75
assign ( resid 19 and name HG* ) ( resid 17 and name HA ) 6.0 6.0 2.1
assign ( resid 19 and name HG* ) ( resid 19 and name HA ) 5.0 5.0 1.75
assign ( resid 19 and name HG* ) ( resid 19 and name HA ) 5.0 5.0 1.75
assign ( resid 19 and name HG* ) ( resid 19 and name HB ) 4.0 4.0 1.4
assign ( resid 19 and name HG* ) ( resid 19 and name HB ) 4.0 4.0 1.4
assign ( resid 19 and name HG* ) ( resid 19 and name HG* ) 5.0 5.0 4.1125
assign ( resid 19 and name HG* ) ( resid 19 and name HG* ) 5.0 5.0 4.1125
assign ( resid 19 and name HG* ) ( resid 28 and name HD* ) 5.0 5.0 2.56
assign ( resid 19 and name HG* ) ( resid 28 and name HG* ) 4.0 4.0 2.048
assign ( resid 19 and name HG* ) ( resid 50 and name HG2* ) 5.0 5.0 3.1
assign ( resid 19 and name HG* ) ( resid 51 and name HA ) 5.0 5.0 1.75
assign ( resid 19 and name HG* ) ( resid 51 and name HA ) 6.0 6.0 2.1
assign ( resid 19 and name HG* ) ( resid 52 and name HB* ) 5.0 5.0 2.56
assign ( resid 19 and name HG* ) ( resid 53 and name HA ) 5.0 5.0 1.75
assign ( resid 19 and name HG* ) ( resid 56 and name HH2 ) 4.0 4.0 1.4
assign ( resid 19 and name HG* ) ( resid 56 and name HH2 ) 5.0 5.0 1.75
assign ( resid 19 and name HG* ) ( resid 56 and name HZ2 ) 5.0 5.0 1.75
assign ( resid 19 and name HG* ) ( resid 56 and name HZ2 ) 6.0 6.0 2.1
assign ( resid 19 and name HN ) ( resid 17 and name HA ) 6.0 6.0 0.0
assign ( resid 19 and name HN ) ( resid 18 and name HA ) 5.0 5.0 0.0
assign ( resid 19 and name HN ) ( resid 18 and name HB* ) 6.0 6.0 0.72
assign ( resid 19 and name HN ) ( resid 18 and name HN ) 3.0 3.0 0.0
assign ( resid 19 and name HN ) ( resid 19 and name HA ) 6.0 6.0 0.0
assign ( resid 19 and name HN ) ( resid 19 and name HB ) 3.0 3.0 0.0
assign ( resid 19 and name HN ) ( resid 19 and name HG* ) 3.0 3.0 1.05
assign ( resid 19 and name HN ) ( resid 19 and name HG* ) 5.0 5.0 1.75
assign ( resid 19 and name HN ) ( resid 20 and name HN ) 6.0 6.0 0.0
assign ( resid 19 and name HN ) ( resid 52 and name HN ) 4.0 4.0 0.0
assign ( resid 2 and name HA ) ( resid 2 and name HG2* ) 4.0 4.0 0.8
assign ( resid 2 and name HA ) ( resid 3 and name HG* ) 5.0 5.0 1.75
assign ( resid 2 and name HB ) ( resid 2 and name HG2* ) 2.5 2.5 0.5
assign ( resid 2 and name HB ) ( resid 3 and name HA ) 5.0 5.0 0.0
assign ( resid 2 and name HB ) ( resid 4 and name HB* ) 5.0 5.0 0.6
assign ( resid 2 and name HG2* ) ( resid 2 and name HA ) 4.0 4.0 0.8
assign ( resid 2 and name HG2* ) ( resid 2 and name HB ) 3.0 3.0 0.6
assign ( resid 20 and name HA ) ( resid 19 and name HG* ) 5.0 5.0 1.75
assign ( resid 20 and name HA ) ( resid 20 and name HB* ) 4.0 4.0 0.48
assign ( resid 20 and name HA ) ( resid 20 and name HB* ) 4.0 4.0 0.48
assign ( resid 20 and name HA ) ( resid 20 and name HD* ) 6.0 6.0 0.0
assign ( resid 20 and name HB* ) ( resid 20 and name HA ) 4.0 4.0 0.48
assign ( resid 20 and name HB* ) ( resid 20 and name HA ) 4.0 4.0 0.48
assign ( resid 20 and name HB* ) ( resid 20 and name HB* ) 3.0 3.0 0.7632
assign ( resid 20 and name HB* ) ( resid 20 and name HB* ) 3.0 3.0 0.7632
assign ( resid 20 and name HB* ) ( resid 20 and name HD* ) 5.0 5.0 0.6
assign ( resid 20 and name HB* ) ( resid 20 and name HD* ) 5.0 5.0 0.6
assign ( resid 20 and name HB* ) ( resid 20 and name HE3 ) 5.0 5.0 0.6
assign ( resid 20 and name HD* ) ( resid 20 and name HA ) 6.0 6.0 0.0
assign ( resid 20 and name HD* ) ( resid 20 and name HB* ) 5.0 5.0 0.6
assign ( resid 20 and name HD* ) ( resid 20 and name HB* ) 5.0 5.0 0.6
assign ( resid 20 and name HE1 ) ( resid 20 and name HD* ) 3.0 3.0 0.0
assign ( resid 20 and name HE1 ) ( resid 20 and name HZ2 ) 5.0 5.0 0.0
assign ( resid 20 and name HE1 ) ( resid 21 and name HG* ) 5.0 5.0 0.6
assign ( resid 20 and name HE1 ) ( resid 21 and name HG* ) 6.0 6.0 0.72
assign ( resid 20 and name HE1 ) ( resid 29 and name HB* ) 5.0 5.0 0.6
assign ( resid 20 and name HE1 ) ( resid 29 and name HB* ) 6.0 6.0 0.72
assign ( resid 20 and name HE1 ) ( resid 29 and name HD* ) 6.0 6.0 0.72
assign ( resid 20 and name HE1 ) ( resid 63 and name HD* ) 5.0 5.0 1.0
assign ( resid 20 and name HE3 ) ( resid 20 and name HB* ) 5.0 5.0 0.6
assign ( resid 20 and name HE3 ) ( resid 20 and name HB* ) 6.0 6.0 0.72
assign ( resid 20 and name HE3 ) ( resid 20 and name HZ3 ) 4.0 4.0 0.0
assign ( resid 20 and name HH2 ) ( resid 20 and name HZ2 ) 3.0 3.0 0.0
assign ( resid 20 and name HH2 ) ( resid 20 and name HZ3 ) 2.5 2.5 0.0
assign ( resid 20 and name HH2 ) ( resid 20 and name HZ3 ) 5.0 5.0 0.0
assign ( resid 20 and name HH2 ) ( resid 36 and name HD* ) 4.0 4.0 1.4
assign ( resid 20 and name HH2 ) ( resid 63 and name HB ) 6.0 6.0 0.0
assign ( resid 20 and name HH2 ) ( resid 63 and name HD* ) 5.0 5.0 1.0
assign ( resid 20 and name HH2 ) ( resid 63 and name HG1* ) 5.0 5.0 1.0
assign ( resid 20 and name HH2 ) ( resid 63 and name HG1* ) 6.0 6.0 1.2
assign ( resid 20 and name HN ) ( resid 19 and name HB ) 6.0 6.0 0.0
assign ( resid 20 and name HN ) ( resid 19 and name HG* ) 4.0 4.0 1.4
assign ( resid 20 and name HN ) ( resid 19 and name HN ) 6.0 6.0 0.0
assign ( resid 20 and name HN ) ( resid 20 and name HA ) 5.0 5.0 0.0
assign ( resid 20 and name HN ) ( resid 20 and name HE3 ) 5.0 5.0 0.0
assign ( resid 20 and name HN ) ( resid 29 and name HN ) 5.0 5.0 0.0
assign ( resid 20 and name HZ2 ) ( resid 20 and name HH2 ) 5.0 5.0 0.0
assign ( resid 20 and name HZ2 ) ( resid 20 and name HH2 ) 5.0 5.0 0.0
assign ( resid 20 and name HZ2 ) ( resid 29 and name HB* ) 6.0 6.0 0.72
assign ( resid 20 and name HZ2 ) ( resid 63 and name HD* ) 4.0 4.0 0.8
assign ( resid 20 and name HZ2 ) ( resid 63 and name HG1* ) 4.0 4.0 0.8
assign ( resid 20 and name HZ2 ) ( resid 63 and name HG1* ) 6.0 6.0 1.2
assign ( resid 20 and name HZ3 ) ( resid 20 and name HE3 ) 5.0 5.0 0.0
assign ( resid 20 and name HZ3 ) ( resid 20 and name HH2 ) 4.0 4.0 0.0
assign ( resid 20 and name HZ3 ) ( resid 29 and name HA ) 5.0 5.0 0.0
assign ( resid 21 and name HA ) ( resid 20 and name HD* ) 6.0 6.0 0.0
assign ( resid 21 and name HA ) ( resid 21 and name HB* ) 4.0 4.0 0.48
assign ( resid 21 and name HA ) ( resid 21 and name HB* ) 5.0 5.0 0.6
assign ( resid 21 and name HA ) ( resid 21 and name HG* ) 5.0 5.0 0.6
assign ( resid 21 and name HA ) ( resid 21 and name HG* ) 5.0 5.0 0.6
assign ( resid 21 and name HA ) ( resid 28 and name HA ) 4.0 4.0 0.0
assign ( resid 21 and name HA ) ( resid 28 and name HD* ) 5.0 5.0 0.6
assign ( resid 21 and name HA ) ( resid 29 and name HD* ) 5.0 5.0 0.6
assign ( resid 21 and name HB* ) ( resid 21 and name HA ) 5.0 5.0 0.6
assign ( resid 21 and name HB* ) ( resid 21 and name HA ) 5.0 5.0 0.6
assign ( resid 21 and name HB* ) ( resid 21 and name HB* ) 2.5 2.5 0.636
assign ( resid 21 and name HB* ) ( resid 21 and name HB* ) 3.0 3.0 0.7632
assign ( resid 21 and name HB* ) ( resid 21 and name HE* ) 5.0 5.0 1.272
assign ( resid 21 and name HB* ) ( resid 21 and name HE* ) 5.0 5.0 1.272
assign ( resid 21 and name HB* ) ( resid 21 and name HG* ) 3.0 3.0 0.7632
assign ( resid 21 and name HB* ) ( resid 21 and name HG* ) 4.0 4.0 1.0176
assign ( resid 21 and name HB* ) ( resid 21 and name HG* ) 5.0 5.0 1.272
assign ( resid 21 and name HB* ) ( resid 21 and name HG* ) 5.0 5.0 1.272
assign ( resid 21 and name HB* ) ( resid 28 and name HA ) 6.0 6.0 0.72
assign ( resid 21 and name HB* ) ( resid 28 and name HG* ) 5.0 5.0 1.272
assign ( resid 21 and name HD* ) ( resid 21 and name HE* ) 4.0 4.0 1.0176
assign ( resid 21 and name HD* ) ( resid 21 and name HG* ) 3.0 3.0 0.7632
assign ( resid 21 and name HD* ) ( resid 21 and name HG* ) 3.0 3.0 0.7632
assign ( resid 21 and name HD* ) ( resid 26 and name HD* ) 5.0 5.0 2.56
assign ( resid 21 and name HE* ) ( resid 21 and name HB* ) 4.0 4.0 1.0176
assign ( resid 21 and name HE* ) ( resid 21 and name HB* ) 5.0 5.0 1.272
assign ( resid 21 and name HE* ) ( resid 21 and name HG* ) 5.0 5.0 1.272
assign ( resid 21 and name HE* ) ( resid 21 and name HG* ) 6.0 6.0 1.5264
assign ( resid 21 and name HE* ) ( resid 23 and name HB* ) 4.0 4.0 1.0176
assign ( resid 21 and name HE* ) ( resid 26 and name HA ) 6.0 6.0 0.72
assign ( resid 21 and name HE* ) ( resid 26 and name HD* ) 5.0 5.0 2.56
assign ( resid 21 and name HG* ) ( resid 20 and name HA ) 6.0 6.0 0.72
assign ( resid 21 and name HG* ) ( resid 20 and name HD* ) 6.0 6.0 0.72
assign ( resid 21 and name HG* ) ( resid 21 and name HA ) 5.0 5.0 0.6
assign ( resid 21 and name HG* ) ( resid 21 and name HA ) 6.0 6.0 0.72
assign ( resid 21 and name HG* ) ( resid 21 and name HB* ) 3.0 3.0 0.7632
assign ( resid 21 and name HG* ) ( resid 21 and name HB* ) 4.0 4.0 1.0176
assign ( resid 21 and name HG* ) ( resid 21 and name HE* ) 5.0 5.0 1.272
assign ( resid 21 and name HG* ) ( resid 21 and name HE* ) 5.0 5.0 1.272
assign ( resid 21 and name HG* ) ( resid 21 and name HG* ) 2.5 2.5 0.636
assign ( resid 21 and name HG* ) ( resid 21 and name HG* ) 4.0 4.0 1.0176
assign ( resid 21 and name HG* ) ( resid 26 and name HA ) 6.0 6.0 0.72
assign ( resid 21 and name HG* ) ( resid 26 and name HA ) 6.0 6.0 0.72
assign ( resid 21 and name HG* ) ( resid 27 and name HA ) 5.0 5.0 0.6
assign ( resid 21 and name HG* ) ( resid 29 and name HD* ) 6.0 6.0 1.5264
assign ( resid 21 and name HN ) ( resid 20 and name HA ) 4.0 4.0 0.0
assign ( resid 21 and name HN ) ( resid 20 and name HB* ) 3.0 3.0 0.36
assign ( resid 21 and name HN ) ( resid 20 and name HB* ) 4.0 4.0 0.48
assign ( resid 21 and name HN ) ( resid 20 and name HD* ) 5.0 5.0 0.0
assign ( resid 21 and name HN ) ( resid 21 and name HA ) 3.0 3.0 0.0
assign ( resid 21 and name HN ) ( resid 21 and name HB* ) 3.0 3.0 0.36
assign ( resid 21 and name HN ) ( resid 21 and name HB* ) 4.0 4.0 0.48
assign ( resid 21 and name HN ) ( resid 21 and name HG* ) 5.0 5.0 0.6
assign ( resid 21 and name HN ) ( resid 21 and name HG* ) 6.0 6.0 0.72
assign ( resid 21 and name HN ) ( resid 22 and name HN ) 5.0 5.0 0.0
assign ( resid 21 and name HN ) ( resid 63 and name HD* ) 6.0 6.0 1.2
assign ( resid 22 and name HA ) ( resid 22 and name HB* ) 5.0 5.0 0.6
assign ( resid 22 and name HA ) ( resid 22 and name HB* ) 5.0 5.0 0.6
assign ( resid 22 and name HA ) ( resid 23 and name HB* ) 5.0 5.0 0.6
assign ( resid 22 and name HB* ) ( resid 22 and name HA ) 5.0 5.0 0.6
assign ( resid 22 and name HB* ) ( resid 22 and name HA ) 5.0 5.0 0.6
assign ( resid 22 and name HB* ) ( resid 22 and name HA ) 6.0 6.0 0.72
assign ( resid 22 and name HB* ) ( resid 22 and name HA ) 6.0 6.0 0.72
assign ( resid 22 and name HB* ) ( resid 22 and name HB* ) 2.5 2.5 0.636
assign ( resid 22 and name HB* ) ( resid 22 and name HB* ) 2.5 2.5 0.636
assign ( resid 22 and name HB* ) ( resid 22 and name HB* ) 3.0 3.0 0.7632
assign ( resid 22 and name HB* ) ( resid 22 and name HB* ) 3.0 3.0 0.7632
assign ( resid 22 and name HB* ) ( resid 27 and name HB* ) 5.0 5.0 1.272
assign ( resid 22 and name HB* ) ( resid 27 and name HB* ) 5.0 5.0 1.272
assign ( resid 22 and name HB* ) ( resid 27 and name HB* ) 5.0 5.0 1.272
assign ( resid 22 and name HB* ) ( resid 27 and name HB* ) 5.0 5.0 1.272
assign ( resid 22 and name HB* ) ( resid 27 and name HB* ) 6.0 6.0 1.5264
assign ( resid 22 and name HB* ) ( resid 27 and name HB* ) 6.0 6.0 1.5264
assign ( resid 22 and name HB* ) ( resid 27 and name HB* ) 6.0 6.0 1.5264
assign ( resid 22 and name HB* ) ( resid 29 and name HB* ) 5.0 5.0 1.272
assign ( resid 22 and name HB* ) ( resid 29 and name HE* ) 5.0 5.0 1.272
assign ( resid 22 and name HB* ) ( resid 29 and name HE* ) 5.0 5.0 1.272
assign ( resid 22 and name HB* ) ( resid 29 and name HE* ) 5.0 5.0 1.272
assign ( resid 22 and name HB* ) ( resid 29 and name HE* ) 5.0 5.0 1.272
assign ( resid 22 and name HN ) ( resid 21 and name HA ) 3.0 3.0 0.0
assign ( resid 22 and name HN ) ( resid 21 and name HB* ) 4.0 4.0 0.48
assign ( resid 22 and name HN ) ( resid 21 and name HB* ) 5.0 5.0 0.6
assign ( resid 22 and name HN ) ( resid 21 and name HG* ) 5.0 5.0 0.6
assign ( resid 22 and name HN ) ( resid 21 and name HG* ) 6.0 6.0 0.72
assign ( resid 22 and name HN ) ( resid 21 and name HG* ) 6.0 6.0 0.72
assign ( resid 22 and name HN ) ( resid 21 and name HN ) 6.0 6.0 0.0
assign ( resid 22 and name HN ) ( resid 22 and name HB* ) 4.0 4.0 0.48
assign ( resid 22 and name HN ) ( resid 22 and name HB* ) 4.0 4.0 0.48
assign ( resid 22 and name HN ) ( resid 23 and name HN ) 5.0 5.0 0.0
assign ( resid 22 and name HN ) ( resid 24 and name HB* ) 6.0 6.0 0.72
assign ( resid 22 and name HN ) ( resid 25 and name HN ) 6.0 6.0 0.0
assign ( resid 22 and name HN ) ( resid 26 and name HA ) 6.0 6.0 0.0
assign ( resid 22 and name HN ) ( resid 27 and name HB* ) 6.0 6.0 0.72
assign ( resid 22 and name HN ) ( resid 27 and name HN ) 6.0 6.0 0.0
assign ( resid 22 and name HN ) ( resid 28 and name HD* ) 6.0 6.0 0.72
assign ( resid 22 and name HN ) ( resid 29 and name HD* ) 5.0 5.0 0.6
assign ( resid 22 and name HN ) ( resid 29 and name HN ) 6.0 6.0 0.0
assign ( resid 23 and name HA ) ( resid 21 and name HB* ) 6.0 6.0 0.72
assign ( resid 23 and name HA ) ( resid 21 and name HE* ) 6.0 6.0 0.72
assign ( resid 23 and name HA ) ( resid 23 and name HB* ) 3.0 3.0 0.36
assign ( resid 23 and name HA ) ( resid 26 and name HD* ) 5.0 5.0 1.75
assign ( resid 23 and name HB* ) ( resid 21 and name HE* ) 5.0 5.0 1.272
assign ( resid 23 and name HB* ) ( resid 22 and name HA ) 6.0 6.0 0.72
assign ( resid 23 and name HB* ) ( resid 23 and name HA ) 4.0 4.0 0.48
assign ( resid 23 and name HN ) ( resid 22 and name HA ) 5.0 5.0 0.0
assign ( resid 23 and name HN ) ( resid 23 and name HA ) 5.0 5.0 0.0
assign ( resid 23 and name HN ) ( resid 23 and name HB* ) 2.5 2.5 0.3
assign ( resid 23 and name HN ) ( resid 24 and name HN ) 4.0 4.0 0.0
assign ( resid 23 and name HN ) ( resid 25 and name HN ) 6.0 6.0 0.0
assign ( resid 24 and name HA ) ( resid 24 and name HB* ) 4.0 4.0 0.48
assign ( resid 24 and name HA ) ( resid 24 and name HB* ) 4.0 4.0 0.48
assign ( resid 24 and name HA ) ( resid 24 and name HD* ) 5.0 5.0 0.6
assign ( resid 24 and name HA ) ( resid 24 and name HG* ) 5.0 5.0 0.6
assign ( resid 24 and name HA ) ( resid 24 and name HG* ) 5.0 5.0 0.6
assign ( resid 24 and name HA ) ( resid 26 and name HD* ) 5.0 5.0 1.75
assign ( resid 24 and name HB* ) ( resid 24 and name HA ) 5.0 5.0 0.6
assign ( resid 24 and name HB* ) ( resid 24 and name HA ) 5.0 5.0 0.6
assign ( resid 24 and name HB* ) ( resid 24 and name HD* ) 5.0 5.0 1.272
assign ( resid 24 and name HB* ) ( resid 24 and name HD* ) 5.0 5.0 1.272
assign ( resid 24 and name HB* ) ( resid 24 and name HG* ) 5.0 5.0 1.272
assign ( resid 24 and name HB* ) ( resid 24 and name HG* ) 5.0 5.0 1.272
assign ( resid 24 and name HB* ) ( resid 24 and name HG* ) 5.0 5.0 1.272
assign ( resid 24 and name HB* ) ( resid 24 and name HG* ) 5.0 5.0 1.272
assign ( resid 24 and name HD* ) ( resid 24 and name HE* ) 5.0 5.0 1.272
assign ( resid 24 and name HD* ) ( resid 24 and name HG* ) 2.5 2.5 0.636
assign ( resid 24 and name HD* ) ( resid 24 and name HG* ) 3.0 3.0 0.7632
assign ( resid 24 and name HE* ) ( resid 24 and name HD* ) 5.0 5.0 1.272
assign ( resid 24 and name HE* ) ( resid 24 and name HG* ) 6.0 6.0 1.5264
assign ( resid 24 and name HG* ) ( resid 24 and name HB* ) 4.0 4.0 1.0176
assign ( resid 24 and name HG* ) ( resid 24 and name HB* ) 4.0 4.0 1.0176
assign ( resid 24 and name HG* ) ( resid 24 and name HD* ) 3.0 3.0 0.7632
assign ( resid 24 and name HG* ) ( resid 24 and name HD* ) 3.0 3.0 0.7632
assign ( resid 24 and name HN ) ( resid 23 and name HA ) 5.0 5.0 0.0
assign ( resid 24 and name HN ) ( resid 23 and name HB* ) 5.0 5.0 0.6
assign ( resid 24 and name HN ) ( resid 23 and name HN ) 4.0 4.0 0.0
assign ( resid 24 and name HN ) ( resid 24 and name HA ) 5.0 5.0 0.0
assign ( resid 24 and name HN ) ( resid 24 and name HB* ) 2.5 2.5 0.3
assign ( resid 24 and name HN ) ( resid 24 and name HB* ) 4.0 4.0 0.48
assign ( resid 24 and name HN ) ( resid 24 and name HG* ) 4.0 4.0 0.48
assign ( resid 24 and name HN ) ( resid 24 and name HG* ) 5.0 5.0 0.6
assign ( resid 24 and name HN ) ( resid 25 and name HG2* ) 5.0 5.0 1.0
assign ( resid 24 and name HN ) ( resid 25 and name HN ) 4.0 4.0 0.0
assign ( resid 24 and name HN ) ( resid 26 and name HN ) 5.0 5.0 0.0
assign ( resid 25 and name HA ) ( resid 24 and name HB* ) 4.0 4.0 0.48
assign ( resid 25 and name HA ) ( resid 25 and name HG2* ) 4.0 4.0 0.8
assign ( resid 25 and name HA ) ( resid 26 and name HG ) 6.0 6.0 0.0
assign ( resid 25 and name HA ) ( resid 29 and name HE* ) 6.0 6.0 0.72
assign ( resid 25 and name HB ) ( resid 24 and name HB* ) 6.0 6.0 0.72
assign ( resid 25 and name HB ) ( resid 25 and name HG2* ) 3.0 3.0 0.6
assign ( resid 25 and name HG2* ) ( resid 24 and name HB* ) 6.0 6.0 2.064
assign ( resid 25 and name HG2* ) ( resid 24 and name HB* ) 6.0 6.0 2.064
assign ( resid 25 and name HG2* ) ( resid 24 and name HG* ) 5.0 5.0 1.72
assign ( resid 25 and name HG2* ) ( resid 25 and name HB ) 3.0 3.0 0.6
assign ( resid 25 and name HN ) ( resid 22 and name HB* ) 5.0 5.0 0.6
assign ( resid 25 and name HN ) ( resid 22 and name HB* ) 6.0 6.0 0.72
assign ( resid 25 and name HN ) ( resid 23 and name HA ) 6.0 6.0 0.0
assign ( resid 25 and name HN ) ( resid 23 and name HB* ) 6.0 6.0 0.72
assign ( resid 25 and name HN ) ( resid 24 and name HB* ) 3.0 3.0 0.36
assign ( resid 25 and name HN ) ( resid 24 and name HG* ) 5.0 5.0 0.6
assign ( resid 25 and name HN ) ( resid 24 and name HN ) 2.5 2.5 0.0
assign ( resid 25 and name HN ) ( resid 25 and name HA ) 5.0 5.0 0.0
assign ( resid 25 and name HN ) ( resid 25 and name HB ) 6.0 6.0 0.0
assign ( resid 25 and name HN ) ( resid 25 and name HG2* ) 3.0 3.0 0.6
assign ( resid 25 and name HN ) ( resid 26 and name HA ) 5.0 5.0 0.0
assign ( resid 25 and name HN ) ( resid 26 and name HN ) 3.0 3.0 0.0
assign ( resid 26 and name HA ) ( resid 21 and name HG* ) 5.0 5.0 0.6
assign ( resid 26 and name HA ) ( resid 21 and name HG* ) 5.0 5.0 0.6
assign ( resid 26 and name HA ) ( resid 26 and name HB* ) 3.0 3.0 0.36
assign ( resid 26 and name HA ) ( resid 26 and name HB* ) 5.0 5.0 0.6
assign ( resid 26 and name HA ) ( resid 26 and name HD* ) 4.0 4.0 1.4
assign ( resid 26 and name HA ) ( resid 26 and name HD* ) 5.0 5.0 1.75
assign ( resid 26 and name HA ) ( resid 26 and name HD* ) 5.0 5.0 1.75
assign ( resid 26 and name HA ) ( resid 26 and name HG ) 5.0 5.0 0.0
assign ( resid 26 and name HA ) ( resid 27 and name HB* ) 6.0 6.0 0.72
assign ( resid 26 and name HA ) ( resid 65 and name HB* ) 6.0 6.0 0.72
assign ( resid 26 and name HB* ) ( resid 26 and name HA ) 4.0 4.0 0.48
assign ( resid 26 and name HB* ) ( resid 26 and name HA ) 5.0 5.0 0.6
assign ( resid 26 and name HB* ) ( resid 26 and name HB* ) 3.0 3.0 0.7632
assign ( resid 26 and name HB* ) ( resid 26 and name HB* ) 3.0 3.0 0.7632
assign ( resid 26 and name HB* ) ( resid 26 and name HD* ) 4.0 4.0 2.048
assign ( resid 26 and name HB* ) ( resid 26 and name HD* ) 4.0 4.0 2.048
assign ( resid 26 and name HB* ) ( resid 26 and name HG ) 4.0 4.0 0.48
assign ( resid 26 and name HB* ) ( resid 26 and name HG ) 5.0 5.0 0.6
assign ( resid 26 and name HD* ) ( resid 21 and name HE* ) 6.0 6.0 3.072
assign ( resid 26 and name HD* ) ( resid 23 and name HA ) 6.0 6.0 2.1
assign ( resid 26 and name HD* ) ( resid 26 and name HA ) 4.0 4.0 1.4
assign ( resid 26 and name HD* ) ( resid 26 and name HB* ) 5.0 5.0 2.56
assign ( resid 26 and name HD* ) ( resid 26 and name HB* ) 5.0 5.0 2.56
assign ( resid 26 and name HD* ) ( resid 26 and name HB* ) 6.0 6.0 3.072
assign ( resid 26 and name HD* ) ( resid 26 and name HG ) 5.0 5.0 1.75
assign ( resid 26 and name HD* ) ( resid 26 and name HG ) 5.0 5.0 1.75
assign ( resid 26 and name HG ) ( resid 26 and name HA ) 6.0 6.0 0.0
assign ( resid 26 and name HG ) ( resid 26 and name HB* ) 3.0 3.0 0.36
assign ( resid 26 and name HG ) ( resid 26 and name HB* ) 4.0 4.0 0.48
assign ( resid 26 and name HG ) ( resid 26 and name HD* ) 4.0 4.0 1.4
assign ( resid 26 and name HG ) ( resid 26 and name HD* ) 4.0 4.0 1.4
assign ( resid 26 and name HN ) ( resid 20 and name HE1 ) 6.0 6.0 0.0
assign ( resid 26 and name HN ) ( resid 22 and name HB* ) 5.0 5.0 0.6
assign ( resid 26 and name HN ) ( resid 22 and name HB* ) 6.0 6.0 0.72
assign ( resid 26 and name HN ) ( resid 24 and name HN ) 5.0 5.0 0.0
assign ( resid 26 and name HN ) ( resid 25 and name HA ) 5.0 5.0 0.0
assign ( resid 26 and name HN ) ( resid 25 and name HG2* ) 5.0 5.0 1.0
assign ( resid 26 and name HN ) ( resid 25 and name HN ) 2.5 2.5 0.0
assign ( resid 26 and name HN ) ( resid 26 and name HA ) 2.5 2.5 0.0
assign ( resid 26 and name HN ) ( resid 26 and name HB* ) 5.0 5.0 0.6
assign ( resid 26 and name HN ) ( resid 26 and name HB* ) 5.0 5.0 0.6
assign ( resid 26 and name HN ) ( resid 26 and name HD* ) 4.0 4.0 1.4
assign ( resid 26 and name HN ) ( resid 26 and name HG ) 5.0 5.0 0.0
assign ( resid 26 and name HN ) ( resid 27 and name HN ) 5.0 5.0 0.0
assign ( resid 27 and name HA ) ( resid 27 and name HB* ) 4.0 4.0 0.48
assign ( resid 27 and name HA ) ( resid 27 and name HB* ) 5.0 5.0 0.6
assign ( resid 27 and name HA ) ( resid 28 and name HB* ) 6.0 6.0 0.72
assign ( resid 27 and name HB* ) ( resid 22 and name HB* ) 5.0 5.0 1.272
assign ( resid 27 and name HB* ) ( resid 22 and name HB* ) 5.0 5.0 1.272
assign ( resid 27 and name HB* ) ( resid 22 and name HB* ) 5.0 5.0 1.272
assign ( resid 27 and name HB* ) ( resid 27 and name HA ) 5.0 5.0 0.6
assign ( resid 27 and name HB* ) ( resid 27 and name HA ) 5.0 5.0 0.6
assign ( resid 27 and name HB* ) ( resid 27 and name HA ) 5.0 5.0 0.6
assign ( resid 27 and name HB* ) ( resid 27 and name HA ) 5.0 5.0 0.6
assign ( resid 27 and name HB* ) ( resid 27 and name HB* ) 2.5 2.5 0.636
assign ( resid 27 and name HB* ) ( resid 27 and name HB* ) 2.5 2.5 0.636
assign ( resid 27 and name HB* ) ( resid 27 and name HB* ) 2.5 2.5 0.636
assign ( resid 27 and name HB* ) ( resid 27 and name HB* ) 3.0 3.0 0.7632
assign ( resid 27 and name HB* ) ( resid 28 and name HA ) 6.0 6.0 0.72
assign ( resid 27 and name HB* ) ( resid 29 and name HB* ) 5.0 5.0 1.272
assign ( resid 27 and name HB* ) ( resid 29 and name HE* ) 5.0 5.0 1.272
assign ( resid 27 and name HB* ) ( resid 29 and name HE* ) 5.0 5.0 1.272
assign ( resid 27 and name HB* ) ( resid 29 and name HE* ) 5.0 5.0 1.272
assign ( resid 27 and name HB* ) ( resid 29 and name HE* ) 5.0 5.0 1.272
assign ( resid 27 and name HB* ) ( resid 38 and name HB* ) 5.0 5.0 1.272
assign ( resid 27 and name HB* ) ( resid 66 and name HB* ) 5.0 5.0 1.272
assign ( resid 27 and name HN ) ( resid 22 and name HB* ) 5.0 5.0 0.6
assign ( resid 27 and name HN ) ( resid 22 and name HB* ) 5.0 5.0 0.6
assign ( resid 27 and name HN ) ( resid 22 and name HN ) 5.0 5.0 0.0
assign ( resid 27 and name HN ) ( resid 25 and name HG2* ) 6.0 6.0 1.2
assign ( resid 27 and name HN ) ( resid 25 and name HN ) 5.0 5.0 0.0
assign ( resid 27 and name HN ) ( resid 26 and name HA ) 5.0 5.0 0.0
assign ( resid 27 and name HN ) ( resid 26 and name HB* ) 5.0 5.0 0.6
assign ( resid 27 and name HN ) ( resid 26 and name HB* ) 6.0 6.0 0.72
assign ( resid 27 and name HN ) ( resid 26 and name HD* ) 6.0 6.0 2.1
assign ( resid 27 and name HN ) ( resid 26 and name HN ) 4.0 4.0 0.0
assign ( resid 27 and name HN ) ( resid 27 and name HA ) 5.0 5.0 0.0
assign ( resid 27 and name HN ) ( resid 27 and name HB* ) 3.0 3.0 0.36
assign ( resid 27 and name HN ) ( resid 27 and name HB* ) 5.0 5.0 0.6
assign ( resid 28 and name HA ) ( resid 19 and name HG* ) 5.0 5.0 1.75
assign ( resid 28 and name HA ) ( resid 21 and name HA ) 4.0 4.0 0.0
assign ( resid 28 and name HA ) ( resid 21 and name HB* ) 5.0 5.0 0.6
assign ( resid 28 and name HA ) ( resid 21 and name HB* ) 5.0 5.0 0.6
assign ( resid 28 and name HA ) ( resid 21 and name HG* ) 6.0 6.0 0.72
assign ( resid 28 and name HA ) ( resid 28 and name HB* ) 3.0 3.0 0.36
assign ( resid 28 and name HA ) ( resid 28 and name HB* ) 5.0 5.0 0.6
assign ( resid 28 and name HA ) ( resid 28 and name HD* ) 5.0 5.0 0.6
assign ( resid 28 and name HB* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HB* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HB* ) ( resid 28 and name HA ) 5.0 5.0 0.6
assign ( resid 28 and name HB* ) ( resid 28 and name HA ) 5.0 5.0 0.6
assign ( resid 28 and name HB* ) ( resid 28 and name HB* ) 2.5 2.5 0.636
assign ( resid 28 and name HB* ) ( resid 28 and name HB* ) 2.5 2.5 0.636
assign ( resid 28 and name HB* ) ( resid 28 and name HD* ) 5.0 5.0 1.272
assign ( resid 28 and name HB* ) ( resid 28 and name HD* ) 5.0 5.0 1.272
assign ( resid 28 and name HB* ) ( resid 39 and name HB* ) 5.0 5.0 1.72
assign ( resid 28 and name HB* ) ( resid 39 and name HB* ) 5.0 5.0 1.72
assign ( resid 28 and name HD* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HD* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HD* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HD* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HD* ) ( resid 21 and name HA ) 6.0 6.0 0.72
assign ( resid 28 and name HD* ) ( resid 28 and name HA ) 5.0 5.0 0.6
assign ( resid 28 and name HD* ) ( resid 28 and name HA ) 5.0 5.0 0.6
assign ( resid 28 and name HD* ) ( resid 28 and name HA ) 5.0 5.0 0.6
assign ( resid 28 and name HD* ) ( resid 28 and name HA ) 5.0 5.0 0.6
assign ( resid 28 and name HD* ) ( resid 28 and name HB* ) 4.0 4.0 1.0176
assign ( resid 28 and name HD* ) ( resid 28 and name HB* ) 5.0 5.0 1.272
assign ( resid 28 and name HD* ) ( resid 28 and name HB* ) 5.0 5.0 1.272
assign ( resid 28 and name HD* ) ( resid 28 and name HB* ) 5.0 5.0 1.272
assign ( resid 28 and name HD* ) ( resid 28 and name HB* ) 5.0 5.0 1.272
assign ( resid 28 and name HD* ) ( resid 28 and name HG* ) 4.0 4.0 1.0176
assign ( resid 28 and name HD* ) ( resid 28 and name HG* ) 4.0 4.0 1.0176
assign ( resid 28 and name HD* ) ( resid 28 and name HG* ) 4.0 4.0 1.0176
assign ( resid 28 and name HD* ) ( resid 39 and name HB* ) 6.0 6.0 2.064
assign ( resid 28 and name HD* ) ( resid 39 and name HB* ) 6.0 6.0 2.064
assign ( resid 28 and name HD* ) ( resid 43 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HD* ) ( resid 43 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HD* ) ( resid 43 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HD* ) ( resid 43 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HG* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 28 and name HG* ) ( resid 21 and name HA ) 5.0 5.0 0.6
assign ( resid 28 and name HG* ) ( resid 28 and name HA ) 4.0 4.0 0.48
assign ( resid 28 and name HG* ) ( resid 28 and name HB* ) 3.0 3.0 0.7632
assign ( resid 28 and name HG* ) ( resid 28 and name HD* ) 4.0 4.0 1.0176
assign ( resid 28 and name HG* ) ( resid 39 and name HB* ) 5.0 5.0 1.72
assign ( resid 28 and name HG* ) ( resid 43 and name HG* ) 6.0 6.0 3.072
assign ( resid 28 and name HG* ) ( resid 43 and name HG* ) 6.0 6.0 3.072
assign ( resid 28 and name HG* ) ( resid 56 and name HH2 ) 6.0 6.0 0.72
assign ( resid 28 and name HN ) ( resid 19 and name HG* ) 6.0 6.0 2.1
assign ( resid 28 and name HN ) ( resid 22 and name HN ) 6.0 6.0 0.0
assign ( resid 28 and name HN ) ( resid 27 and name HA ) 3.0 3.0 0.0
assign ( resid 28 and name HN ) ( resid 27 and name HB* ) 4.0 4.0 0.48
assign ( resid 28 and name HN ) ( resid 27 and name HB* ) 5.0 5.0 0.6
assign ( resid 28 and name HN ) ( resid 27 and name HB* ) 5.0 5.0 0.6
assign ( resid 28 and name HN ) ( resid 28 and name HB* ) 3.0 3.0 0.36
assign ( resid 28 and name HN ) ( resid 28 and name HB* ) 4.0 4.0 0.48
assign ( resid 28 and name HN ) ( resid 38 and name HD* ) 5.0 5.0 0.0
assign ( resid 28 and name HN ) ( resid 38 and name HD* ) 5.0 5.0 0.0
assign ( resid 28 and name HN ) ( resid 39 and name HB* ) 5.0 5.0 1.0
assign ( resid 29 and name HA ) ( resid 29 and name HB* ) 4.0 4.0 0.48
assign ( resid 29 and name HA ) ( resid 29 and name HB* ) 5.0 5.0 0.6
assign ( resid 29 and name HA ) ( resid 29 and name HD* ) 5.0 5.0 0.6
assign ( resid 29 and name HA ) ( resid 29 and name HE* ) 5.0 5.0 0.6
assign ( resid 29 and name HA ) ( resid 36 and name HD* ) 5.0 5.0 1.75
assign ( resid 29 and name HA ) ( resid 36 and name HD* ) 6.0 6.0 2.1
assign ( resid 29 and name HA ) ( resid 38 and name HA ) 4.0 4.0 0.0
assign ( resid 29 and name HA ) ( resid 38 and name HB* ) 6.0 6.0 0.72
assign ( resid 29 and name HB* ) ( resid 20 and name HD* ) 6.0 6.0 0.72
assign ( resid 29 and name HB* ) ( resid 20 and name HZ2 ) 6.0 6.0 0.72
assign ( resid 29 and name HB* ) ( resid 29 and name HA ) 5.0 5.0 0.6
assign ( resid 29 and name HB* ) ( resid 29 and name HA ) 5.0 5.0 0.6
assign ( resid 29 and name HB* ) ( resid 29 and name HA ) 5.0 5.0 0.6
assign ( resid 29 and name HB* ) ( resid 29 and name HA ) 5.0 5.0 0.6
assign ( resid 29 and name HB* ) ( resid 29 and name HB* ) 3.0 3.0 0.7632
assign ( resid 29 and name HB* ) ( resid 29 and name HB* ) 3.0 3.0 0.7632
assign ( resid 29 and name HB* ) ( resid 29 and name HB* ) 3.0 3.0 0.7632
assign ( resid 29 and name HB* ) ( resid 29 and name HB* ) 3.0 3.0 0.7632
assign ( resid 29 and name HB* ) ( resid 29 and name HD* ) 5.0 5.0 1.272
assign ( resid 29 and name HB* ) ( resid 29 and name HD* ) 5.0 5.0 1.272
assign ( resid 29 and name HB* ) ( resid 29 and name HD* ) 5.0 5.0 1.272
assign ( resid 29 and name HB* ) ( resid 29 and name HD* ) 5.0 5.0 1.272
assign ( resid 29 and name HB* ) ( resid 29 and name HE* ) 6.0 6.0 1.5264
assign ( resid 29 and name HB* ) ( resid 36 and name HD* ) 5.0 5.0 2.56
assign ( resid 29 and name HB* ) ( resid 36 and name HD* ) 5.0 5.0 2.56
assign ( resid 29 and name HB* ) ( resid 36 and name HD* ) 5.0 5.0 2.56
assign ( resid 29 and name HB* ) ( resid 36 and name HG ) 5.0 5.0 0.6
assign ( resid 29 and name HB* ) ( resid 36 and name HG ) 5.0 5.0 0.6
assign ( resid 29 and name HB* ) ( resid 36 and name HG ) 6.0 6.0 0.72
assign ( resid 29 and name HB* ) ( resid 38 and name HB* ) 6.0 6.0 1.5264
assign ( resid 29 and name HD* ) ( resid 21 and name HG* ) 5.0 5.0 1.272
assign ( resid 29 and name HD* ) ( resid 29 and name HA ) 5.0 5.0 0.6
assign ( resid 29 and name HD* ) ( resid 29 and name HB* ) 5.0 5.0 1.272
assign ( resid 29 and name HD* ) ( resid 29 and name HB* ) 5.0 5.0 1.272
assign ( resid 29 and name HD* ) ( resid 38 and name HB* ) 5.0 5.0 1.272
assign ( resid 29 and name HD* ) ( resid 59 and name HD* ) 5.0 5.0 1.72
assign ( resid 29 and name HE* ) ( resid 21 and name HG* ) 5.0 5.0 1.272
assign ( resid 29 and name HE* ) ( resid 21 and name HG* ) 5.0 5.0 1.272
assign ( resid 29 and name HE* ) ( resid 22 and name HB* ) 5.0 5.0 1.272
assign ( resid 29 and name HE* ) ( resid 27 and name HB* ) 4.0 4.0 1.0176
assign ( resid 29 and name HE* ) ( resid 27 and name HB* ) 5.0 5.0 1.272
assign ( resid 29 and name HE* ) ( resid 29 and name HB* ) 5.0 5.0 1.272
assign ( resid 29 and name HE* ) ( resid 29 and name HD* ) 3.0 3.0 0.7632
assign ( resid 29 and name HE* ) ( resid 38 and name HB* ) 3.0 3.0 0.7632
assign ( resid 29 and name HE* ) ( resid 38 and name HB* ) 6.0 6.0 1.5264
assign ( resid 29 and name HE* ) ( resid 59 and name HD* ) 3.0 3.0 1.032
assign ( resid 29 and name HN ) ( resid 19 and name HG* ) 4.0 4.0 1.4
assign ( resid 29 and name HN ) ( resid 20 and name HN ) 5.0 5.0 0.0
assign ( resid 29 and name HN ) ( resid 21 and name HA ) 6.0 6.0 0.0
assign ( resid 29 and name HN ) ( resid 22 and name HN ) 5.0 5.0 0.0
assign ( resid 29 and name HN ) ( resid 28 and name HA ) 4.0 4.0 0.0
assign ( resid 29 and name HN ) ( resid 28 and name HB* ) 5.0 5.0 0.6
assign ( resid 29 and name HN ) ( resid 28 and name HB* ) 5.0 5.0 0.6
assign ( resid 29 and name HN ) ( resid 28 and name HG* ) 6.0 6.0 0.72
assign ( resid 29 and name HN ) ( resid 29 and name HA ) 5.0 5.0 0.0
assign ( resid 29 and name HN ) ( resid 29 and name HB* ) 4.0 4.0 0.48
assign ( resid 29 and name HN ) ( resid 29 and name HB* ) 5.0 5.0 0.6
assign ( resid 29 and name HN ) ( resid 29 and name HD* ) 5.0 5.0 0.6
assign ( resid 3 and name HA ) ( resid 1 and name HB* ) 5.0 5.0 0.6
assign ( resid 3 and name HA ) ( resid 2 and name HB ) 6.0 6.0 0.0
assign ( resid 3 and name HA ) ( resid 3 and name HB ) 5.0 5.0 0.0
assign ( resid 3 and name HA ) ( resid 3 and name HG* ) 4.0 4.0 1.4
assign ( resid 3 and name HA ) ( resid 3 and name HG* ) 4.0 4.0 1.4
assign ( resid 3 and name HA ) ( resid 6 and name HB* ) 5.0 5.0 0.6
assign ( resid 3 and name HA ) ( resid 6 and name HB* ) 6.0 6.0 0.72
assign ( resid 3 and name HA ) ( resid 7 and name HA ) 6.0 6.0 0.0
assign ( resid 3 and name HA ) ( resid 7 and name HB* ) 5.0 5.0 0.6
assign ( resid 3 and name HA ) ( resid 7 and name HB* ) 6.0 6.0 0.72
assign ( resid 3 and name HA ) ( resid 7 and name HD* ) 5.0 5.0 1.75
assign ( resid 3 and name HB ) ( resid 3 and name HA ) 5.0 5.0 0.0
assign ( resid 3 and name HB ) ( resid 3 and name HG* ) 4.0 4.0 1.4
assign ( resid 3 and name HB ) ( resid 3 and name HG* ) 4.0 4.0 1.4
assign ( resid 3 and name HG* ) ( resid 3 and name HA ) 5.0 5.0 1.75
assign ( resid 3 and name HG* ) ( resid 3 and name HA ) 6.0 6.0 2.1
assign ( resid 3 and name HG* ) ( resid 3 and name HB ) 4.0 4.0 1.4
assign ( resid 3 and name HG* ) ( resid 3 and name HG* ) 2.5 2.5 2.05625
assign ( resid 3 and name HG* ) ( resid 35 and name HA ) 6.0 6.0 2.1
assign ( resid 3 and name HG* ) ( resid 60 and name HA* ) 6.0 6.0 3.072
assign ( resid 3 and name HG* ) ( resid 60 and name HA* ) 6.0 6.0 3.072
assign ( resid 3 and name HN ) ( resid 2 and name HA ) 6.0 6.0 0.0
assign ( resid 3 and name HN ) ( resid 2 and name HG2* ) 5.0 5.0 1.0
assign ( resid 3 and name HN ) ( resid 2 and name HN ) 6.0 6.0 0.0
assign ( resid 3 and name HN ) ( resid 3 and name HA ) 5.0 5.0 0.0
assign ( resid 3 and name HN ) ( resid 3 and name HB ) 3.0 3.0 0.0
assign ( resid 3 and name HN ) ( resid 3 and name HG* ) 2.5 2.5 0.875
assign ( resid 3 and name HN ) ( resid 3 and name HG* ) 4.0 4.0 1.4
assign ( resid 3 and name HN ) ( resid 4 and name HB* ) 5.0 5.0 0.6
assign ( resid 3 and name HN ) ( resid 4 and name HN ) 4.0 4.0 0.0
assign ( resid 3 and name HN ) ( resid 61 and name HG ) 5.0 5.0 0.0
assign ( resid 3 and name HN ) ( resid 7 and name HD* ) 5.0 5.0 1.75
assign ( resid 30 and name HA ) ( resid 19 and name HG* ) 6.0 6.0 2.1
assign ( resid 30 and name HA ) ( resid 20 and name HZ3 ) 5.0 5.0 0.0
assign ( resid 30 and name HA ) ( resid 30 and name HB* ) 4.0 4.0 0.8
assign ( resid 30 and name HB* ) ( resid 15 and name HA ) 5.0 5.0 1.0
assign ( resid 30 and name HB* ) ( resid 30 and name HA ) 5.0 5.0 1.0
assign ( resid 30 and name HB* ) ( resid 56 and name HZ3 ) 5.0 5.0 1.0
assign ( resid 30 and name HN ) ( resid 29 and name HA ) 3.0 3.0 0.0
assign ( resid 30 and name HN ) ( resid 29 and name HB* ) 4.0 4.0 0.48
assign ( resid 30 and name HN ) ( resid 29 and name HB* ) 5.0 5.0 0.6
assign ( resid 30 and name HN ) ( resid 29 and name HD* ) 4.0 4.0 0.48
assign ( resid 30 and name HN ) ( resid 30 and name HB* ) 4.0 4.0 0.8
assign ( resid 30 and name HN ) ( resid 36 and name HD* ) 4.0 4.0 1.4
assign ( resid 30 and name HN ) ( resid 36 and name HG ) 6.0 6.0 0.0
assign ( resid 30 and name HN ) ( resid 37 and name HB* ) 5.0 5.0 0.6
assign ( resid 30 and name HN ) ( resid 37 and name HN ) 4.0 4.0 0.0
assign ( resid 31 and name HA ) ( resid 31 and name HB* ) 4.0 4.0 0.48
assign ( resid 31 and name HA ) ( resid 31 and name HB* ) 5.0 5.0 0.6
assign ( resid 31 and name HA ) ( resid 36 and name HA ) 4.0 4.0 0.0
assign ( resid 31 and name HA ) ( resid 36 and name HD* ) 5.0 5.0 1.75
assign ( resid 31 and name HA ) ( resid 37 and name HD* ) 5.0 5.0 0.0
assign ( resid 31 and name HA ) ( resid 62 and name HA ) 6.0 6.0 0.0
assign ( resid 31 and name HA ) ( resid 62 and name HB* ) 5.0 5.0 1.0
assign ( resid 31 and name HB* ) ( resid 31 and name HA ) 4.0 4.0 0.48
assign ( resid 31 and name HB* ) ( resid 31 and name HA ) 5.0 5.0 0.6
assign ( resid 31 and name HB* ) ( resid 31 and name HB* ) 2.5 2.5 0.636
assign ( resid 31 and name HB* ) ( resid 31 and name HB* ) 2.5 2.5 0.636
assign ( resid 31 and name HB* ) ( resid 62 and name HB* ) 4.0 4.0 1.376
assign ( resid 31 and name HB* ) ( resid 62 and name HB* ) 5.0 5.0 1.72
assign ( resid 31 and name HN ) ( resid 20 and name HZ3 ) 5.0 5.0 0.0
assign ( resid 31 and name HN ) ( resid 30 and name HA ) 6.0 6.0 0.0
assign ( resid 31 and name HN ) ( resid 30 and name HB* ) 5.0 5.0 1.0
assign ( resid 31 and name HN ) ( resid 31 and name HA ) 6.0 6.0 0.0
assign ( resid 31 and name HN ) ( resid 31 and name HB* ) 4.0 4.0 0.48
assign ( resid 31 and name HN ) ( resid 31 and name HB* ) 5.0 5.0 0.6
assign ( resid 32 and name HA ) ( resid 31 and name HB* ) 6.0 6.0 0.72
assign ( resid 32 and name HA ) ( resid 32 and name HB* ) 4.0 4.0 0.48
assign ( resid 32 and name HA ) ( resid 32 and name HB* ) 5.0 5.0 0.6
assign ( resid 32 and name HA ) ( resid 32 and name HD* ) 4.0 4.0 0.48
assign ( resid 32 and name HA ) ( resid 36 and name HD* ) 6.0 6.0 2.1
assign ( resid 32 and name HB* ) ( resid 32 and name HA ) 5.0 5.0 0.6
assign ( resid 32 and name HB* ) ( resid 32 and name HA ) 5.0 5.0 0.6
assign ( resid 32 and name HB* ) ( resid 32 and name HB* ) 2.5 2.5 0.636
assign ( resid 32 and name HB* ) ( resid 32 and name HB* ) 2.5 2.5 0.636
assign ( resid 32 and name HB* ) ( resid 32 and name HD* ) 4.0 4.0 1.0176
assign ( resid 32 and name HB* ) ( resid 32 and name HD* ) 4.0 4.0 1.0176
assign ( resid 32 and name HB* ) ( resid 32 and name HE* ) 5.0 5.0 1.272
assign ( resid 32 and name HB* ) ( resid 32 and name HE* ) 6.0 6.0 1.5264
assign ( resid 32 and name HB* ) ( resid 37 and name HD* ) 5.0 5.0 0.6
assign ( resid 32 and name HB* ) ( resid 37 and name HD* ) 5.0 5.0 0.6
assign ( resid 32 and name HD* ) ( resid 32 and name HA ) 4.0 4.0 0.48
assign ( resid 32 and name HD* ) ( resid 32 and name HB* ) 3.0 3.0 0.7632
assign ( resid 32 and name HD* ) ( resid 32 and name HB* ) 3.0 3.0 0.7632
assign ( resid 32 and name HD* ) ( resid 32 and name HE* ) 2.5 2.5 0.636
assign ( resid 32 and name HD* ) ( resid 32 and name HE* ) 3.0 3.0 0.7632
assign ( resid 32 and name HD* ) ( resid 33 and name HB* ) 5.0 5.0 1.272
assign ( resid 32 and name HD* ) ( resid 33 and name HB* ) 5.0 5.0 1.272
assign ( resid 32 and name HD* ) ( resid 33 and name HG* ) 6.0 6.0 1.5264
assign ( resid 32 and name HD* ) ( resid 37 and name HZ2 ) 5.0 5.0 0.6
assign ( resid 32 and name HE* ) ( resid 32 and name HB* ) 6.0 6.0 1.5264
assign ( resid 32 and name HE* ) ( resid 32 and name HB* ) 6.0 6.0 1.5264
assign ( resid 32 and name HE* ) ( resid 32 and name HD* ) 2.5 2.5 0.636
assign ( resid 32 and name HE* ) ( resid 33 and name HB* ) 5.0 5.0 1.272
assign ( resid 32 and name HE* ) ( resid 33 and name HB* ) 6.0 6.0 1.5264
assign ( resid 32 and name HN ) ( resid 31 and name HA ) 3.0 3.0 0.0
assign ( resid 32 and name HN ) ( resid 31 and name HB* ) 5.0 5.0 0.6
assign ( resid 32 and name HN ) ( resid 31 and name HB* ) 5.0 5.0 0.6
assign ( resid 32 and name HN ) ( resid 32 and name HA ) 6.0 6.0 0.0
assign ( resid 32 and name HN ) ( resid 32 and name HB* ) 5.0 5.0 0.6
assign ( resid 32 and name HN ) ( resid 32 and name HB* ) 5.0 5.0 0.6
assign ( resid 32 and name HN ) ( resid 32 and name HD* ) 6.0 6.0 0.72
assign ( resid 32 and name HN ) ( resid 35 and name HN ) 5.0 5.0 0.0
assign ( resid 32 and name HN ) ( resid 36 and name HA ) 6.0 6.0 0.0
assign ( resid 32 and name HN ) ( resid 36 and name HD* ) 5.0 5.0 1.75
assign ( resid 32 and name HN ) ( resid 37 and name HD* ) 4.0 4.0 0.0
assign ( resid 32 and name HN ) ( resid 37 and name HE1 ) 4.0 4.0 0.0
assign ( resid 32 and name HN ) ( resid 62 and name HB* ) 5.0 5.0 1.0
assign ( resid 33 and name HA ) ( resid 33 and name HB* ) 3.0 3.0 0.36
assign ( resid 33 and name HA ) ( resid 33 and name HB* ) 4.0 4.0 0.48
assign ( resid 33 and name HA ) ( resid 33 and name HG* ) 5.0 5.0 0.6
assign ( resid 33 and name HA ) ( resid 33 and name HG* ) 6.0 6.0 0.72
assign ( resid 33 and name HA ) ( resid 62 and name HA ) 6.0 6.0 0.0
assign ( resid 33 and name HB* ) ( resid 32 and name HB* ) 5.0 5.0 1.272
assign ( resid 33 and name HB* ) ( resid 32 and name HD* ) 6.0 6.0 1.5264
assign ( resid 33 and name HB* ) ( resid 33 and name HA ) 5.0 5.0 0.6
assign ( resid 33 and name HB* ) ( resid 33 and name HA ) 5.0 5.0 0.6
assign ( resid 33 and name HB* ) ( resid 33 and name HB* ) 3.0 3.0 0.7632
assign ( resid 33 and name HB* ) ( resid 33 and name HB* ) 3.0 3.0 0.7632
assign ( resid 33 and name HB* ) ( resid 33 and name HB* ) 4.0 4.0 1.0176
assign ( resid 33 and name HB* ) ( resid 33 and name HG* ) 4.0 4.0 1.0176
assign ( resid 33 and name HB* ) ( resid 33 and name HG* ) 5.0 5.0 1.272
assign ( resid 33 and name HG* ) ( resid 33 and name HA ) 5.0 5.0 0.6
assign ( resid 33 and name HG* ) ( resid 33 and name HA ) 5.0 5.0 0.6
assign ( resid 33 and name HG* ) ( resid 33 and name HB* ) 2.5 2.5 0.636
assign ( resid 33 and name HG* ) ( resid 33 and name HB* ) 5.0 5.0 1.272
assign ( resid 33 and name HN ) ( resid 32 and name HA ) 5.0 5.0 0.0
assign ( resid 33 and name HN ) ( resid 32 and name HD* ) 6.0 6.0 0.72
assign ( resid 33 and name HN ) ( resid 33 and name HA ) 3.0 3.0 0.0
assign ( resid 33 and name HN ) ( resid 33 and name HB* ) 5.0 5.0 0.6
assign ( resid 33 and name HN ) ( resid 33 and name HB* ) 5.0 5.0 0.6
assign ( resid 33 and name HN ) ( resid 33 and name HG* ) 5.0 5.0 0.6
assign ( resid 33 and name HN ) ( resid 34 and name HN ) 5.0 5.0 0.0
assign ( resid 34 and name HA* ) ( resid 1 and name HG* ) 5.0 5.0 1.272
assign ( resid 34 and name HA* ) ( resid 1 and name HG* ) 5.0 5.0 1.272
assign ( resid 34 and name HA* ) ( resid 1 and name HG* ) 6.0 6.0 1.5264
assign ( resid 34 and name HA* ) ( resid 1 and name HG* ) 6.0 6.0 1.5264
assign ( resid 34 and name HA* ) ( resid 34 and name HA* ) 2.5 2.5 0.636
assign ( resid 34 and name HA* ) ( resid 34 and name HA* ) 2.5 2.5 0.636
assign ( resid 34 and name HA* ) ( resid 62 and name HB* ) 5.0 5.0 1.72
assign ( resid 34 and name HA* ) ( resid 62 and name HB* ) 5.0 5.0 1.72
assign ( resid 34 and name HN ) ( resid 32 and name HN ) 6.0 6.0 0.0
assign ( resid 34 and name HN ) ( resid 33 and name HA ) 4.0 4.0 0.0
assign ( resid 34 and name HN ) ( resid 33 and name HB* ) 5.0 5.0 0.6
assign ( resid 34 and name HN ) ( resid 33 and name HB* ) 6.0 6.0 0.72
assign ( resid 34 and name HN ) ( resid 33 and name HN ) 6.0 6.0 0.0
assign ( resid 34 and name HN ) ( resid 34 and name HA* ) 4.0 4.0 0.48
assign ( resid 34 and name HN ) ( resid 34 and name HA* ) 5.0 5.0 0.6
assign ( resid 34 and name HN ) ( resid 35 and name HN ) 5.0 5.0 0.0
assign ( resid 34 and name HN ) ( resid 62 and name HB* ) 5.0 5.0 1.0
assign ( resid 35 and name HA ) ( resid 35 and name HB* ) 4.0 4.0 0.48
assign ( resid 35 and name HA ) ( resid 35 and name HB* ) 5.0 5.0 0.6
assign ( resid 35 and name HA ) ( resid 61 and name HA ) 4.0 4.0 0.0
assign ( resid 35 and name HA ) ( resid 61 and name HD* ) 5.0 5.0 1.75
assign ( resid 35 and name HA ) ( resid 62 and name HA ) 5.0 5.0 0.0
assign ( resid 35 and name HA ) ( resid 62 and name HB* ) 5.0 5.0 1.0
assign ( resid 35 and name HB* ) ( resid 31 and name HA ) 6.0 6.0 0.72
assign ( resid 35 and name HB* ) ( resid 35 and name HA ) 4.0 4.0 0.48
assign ( resid 35 and name HB* ) ( resid 35 and name HA ) 5.0 5.0 0.6
assign ( resid 35 and name HB* ) ( resid 35 and name HB* ) 2.5 2.5 0.636
assign ( resid 35 and name HB* ) ( resid 35 and name HB* ) 2.5 2.5 0.636
assign ( resid 35 and name HB* ) ( resid 37 and name HZ2 ) 5.0 5.0 0.6
assign ( resid 35 and name HB* ) ( resid 6 and name HB* ) 5.0 5.0 1.272
assign ( resid 35 and name HB* ) ( resid 6 and name HB* ) 5.0 5.0 1.272
assign ( resid 35 and name HB* ) ( resid 61 and name HA ) 6.0 6.0 0.72
assign ( resid 35 and name HB* ) ( resid 61 and name HD* ) 5.0 5.0 2.56
assign ( resid 35 and name HB* ) ( resid 9 and name HD* ) 5.0 5.0 1.272
assign ( resid 35 and name HB* ) ( resid 9 and name HD* ) 6.0 6.0 1.5264
assign ( resid 35 and name HN ) ( resid 32 and name HN ) 5.0 5.0 0.0
assign ( resid 35 and name HN ) ( resid 34 and name HA* ) 5.0 5.0 0.6
assign ( resid 35 and name HN ) ( resid 34 and name HA* ) 6.0 6.0 0.72
assign ( resid 35 and name HN ) ( resid 34 and name HN ) 4.0 4.0 0.0
assign ( resid 35 and name HN ) ( resid 35 and name HA ) 5.0 5.0 0.0
assign ( resid 35 and name HN ) ( resid 35 and name HB* ) 5.0 5.0 0.6
assign ( resid 35 and name HN ) ( resid 35 and name HB* ) 5.0 5.0 0.6
assign ( resid 35 and name HN ) ( resid 37 and name HE1 ) 5.0 5.0 0.0
assign ( resid 35 and name HN ) ( resid 62 and name HA ) 6.0 6.0 0.0
assign ( resid 35 and name HN ) ( resid 62 and name HB* ) 4.0 4.0 0.8
assign ( resid 36 and name HA ) ( resid 31 and name HA ) 4.0 4.0 0.0
assign ( resid 36 and name HA ) ( resid 36 and name HB* ) 4.0 4.0 0.48
assign ( resid 36 and name HA ) ( resid 36 and name HB* ) 5.0 5.0 0.6
assign ( resid 36 and name HA ) ( resid 36 and name HD* ) 4.0 4.0 1.4
assign ( resid 36 and name HA ) ( resid 36 and name HD* ) 6.0 6.0 2.1
assign ( resid 36 and name HA ) ( resid 36 and name HG ) 5.0 5.0 0.0
assign ( resid 36 and name HA ) ( resid 37 and name HD* ) 5.0 5.0 0.0
assign ( resid 36 and name HA ) ( resid 59 and name HG1* ) 5.0 5.0 1.0
assign ( resid 36 and name HA ) ( resid 62 and name HA ) 5.0 5.0 0.0
assign ( resid 36 and name HB* ) ( resid 32 and name HB* ) 6.0 6.0 1.5264
assign ( resid 36 and name HB* ) ( resid 36 and name HA ) 5.0 5.0 0.6
assign ( resid 36 and name HB* ) ( resid 36 and name HA ) 5.0 5.0 0.6
assign ( resid 36 and name HB* ) ( resid 36 and name HA ) 5.0 5.0 0.6
assign ( resid 36 and name HB* ) ( resid 36 and name HA ) 5.0 5.0 0.6
assign ( resid 36 and name HB* ) ( resid 36 and name HB* ) 3.0 3.0 0.7632
assign ( resid 36 and name HB* ) ( resid 36 and name HB* ) 3.0 3.0 0.7632
assign ( resid 36 and name HB* ) ( resid 36 and name HB* ) 3.0 3.0 0.7632
assign ( resid 36 and name HB* ) ( resid 36 and name HB* ) 3.0 3.0 0.7632
assign ( resid 36 and name HB* ) ( resid 36 and name HD* ) 4.0 4.0 2.048
assign ( resid 36 and name HB* ) ( resid 36 and name HD* ) 4.0 4.0 2.048
assign ( resid 36 and name HB* ) ( resid 36 and name HD* ) 4.0 4.0 2.048
assign ( resid 36 and name HB* ) ( resid 36 and name HG ) 3.0 3.0 0.36
assign ( resid 36 and name HB* ) ( resid 36 and name HG ) 3.0 3.0 0.36
assign ( resid 36 and name HB* ) ( resid 61 and name HA ) 5.0 5.0 0.6
assign ( resid 36 and name HB* ) ( resid 61 and name HA ) 6.0 6.0 0.72
assign ( resid 36 and name HB* ) ( resid 62 and name HA ) 5.0 5.0 0.6
assign ( resid 36 and name HB* ) ( resid 62 and name HA ) 5.0 5.0 0.6
assign ( resid 36 and name HB* ) ( resid 62 and name HA ) 5.0 5.0 0.6
assign ( resid 36 and name HB* ) ( resid 62 and name HA ) 5.0 5.0 0.6
assign ( resid 36 and name HB* ) ( resid 64 and name HG* ) 6.0 6.0 1.5264
assign ( resid 36 and name HD* ) ( resid 20 and name HH2 ) 5.0 5.0 1.75
assign ( resid 36 and name HD* ) ( resid 20 and name HZ2 ) 5.0 5.0 1.75
assign ( resid 36 and name HD* ) ( resid 29 and name HB* ) 4.0 4.0 2.048
assign ( resid 36 and name HD* ) ( resid 29 and name HD* ) 5.0 5.0 2.56
assign ( resid 36 and name HD* ) ( resid 29 and name HD* ) 6.0 6.0 3.072
assign ( resid 36 and name HD* ) ( resid 31 and name HA ) 6.0 6.0 2.1
assign ( resid 36 and name HD* ) ( resid 36 and name HA ) 4.0 4.0 1.4
assign ( resid 36 and name HD* ) ( resid 36 and name HB* ) 4.0 4.0 2.048
assign ( resid 36 and name HD* ) ( resid 36 and name HB* ) 4.0 4.0 2.048
assign ( resid 36 and name HD* ) ( resid 36 and name HB* ) 5.0 5.0 2.56
assign ( resid 36 and name HD* ) ( resid 36 and name HD* ) 3.0 3.0 2.4675
assign ( resid 36 and name HD* ) ( resid 36 and name HG ) 3.0 3.0 1.05
assign ( resid 36 and name HD* ) ( resid 36 and name HG ) 5.0 5.0 1.75
assign ( resid 36 and name HD* ) ( resid 59 and name HB ) 6.0 6.0 2.1
assign ( resid 36 and name HD* ) ( resid 62 and name HA ) 6.0 6.0 2.1
assign ( resid 36 and name HG ) ( resid 36 and name HA ) 5.0 5.0 0.0
assign ( resid 36 and name HG ) ( resid 36 and name HB* ) 3.0 3.0 0.36
assign ( resid 36 and name HG ) ( resid 36 and name HD* ) 4.0 4.0 1.4
assign ( resid 36 and name HG ) ( resid 62 and name HA ) 6.0 6.0 0.0
assign ( resid 36 and name HG* ) ( resid 36 and name HB ) 3.0 3.0 0.0
assign ( resid 36 and name HN ) ( resid 35 and name HA ) 4.0 4.0 0.0
assign ( resid 36 and name HN ) ( resid 35 and name HB* ) 4.0 4.0 0.48
assign ( resid 36 and name HN ) ( resid 35 and name HB* ) 5.0 5.0 0.6
assign ( resid 36 and name HN ) ( resid 36 and name HA ) 6.0 6.0 0.0
assign ( resid 36 and name HN ) ( resid 36 and name HB* ) 3.0 3.0 0.36
assign ( resid 36 and name HN ) ( resid 36 and name HB* ) 4.0 4.0 0.48
assign ( resid 36 and name HN ) ( resid 36 and name HD* ) 5.0 5.0 1.75
assign ( resid 36 and name HN ) ( resid 36 and name HD* ) 5.0 5.0 1.75
assign ( resid 36 and name HN ) ( resid 36 and name HG ) 5.0 5.0 0.0
assign ( resid 36 and name HN ) ( resid 60 and name HN ) 6.0 6.0 0.0
assign ( resid 36 and name HN ) ( resid 62 and name HA ) 5.0 5.0 0.0
assign ( resid 36 and name HN ) ( resid 62 and name HB* ) 5.0 5.0 1.0
assign ( resid 36 and name HN ) ( resid 62 and name HN ) 6.0 6.0 0.0
assign ( resid 37 and name HA ) ( resid 37 and name HB* ) 4.0 4.0 0.48
assign ( resid 37 and name HA ) ( resid 37 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HA ) ( resid 57 and name HG* ) 6.0 6.0 2.1
assign ( resid 37 and name HA ) ( resid 58 and name HA ) 3.0 3.0 0.0
assign ( resid 37 and name HA ) ( resid 58 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HA ) ( resid 58 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HA ) ( resid 59 and name HG1* ) 5.0 5.0 1.0
assign ( resid 37 and name HB* ) ( resid 15 and name HA ) 5.0 5.0 0.6
assign ( resid 37 and name HB* ) ( resid 15 and name HA ) 5.0 5.0 0.6
assign ( resid 37 and name HB* ) ( resid 16 and name HB* ) 5.0 5.0 1.272
assign ( resid 37 and name HB* ) ( resid 30 and name HB* ) 5.0 5.0 1.72
assign ( resid 37 and name HB* ) ( resid 37 and name HA ) 5.0 5.0 0.6
assign ( resid 37 and name HB* ) ( resid 37 and name HA ) 5.0 5.0 0.6
assign ( resid 37 and name HB* ) ( resid 37 and name HB* ) 3.0 3.0 0.7632
assign ( resid 37 and name HB* ) ( resid 37 and name HB* ) 3.0 3.0 0.7632
assign ( resid 37 and name HB* ) ( resid 37 and name HD* ) 5.0 5.0 0.6
assign ( resid 37 and name HB* ) ( resid 37 and name HD* ) 5.0 5.0 0.6
assign ( resid 37 and name HB* ) ( resid 37 and name HE3 ) 5.0 5.0 0.6
assign ( resid 37 and name HB* ) ( resid 37 and name HE3 ) 5.0 5.0 0.6
assign ( resid 37 and name HB* ) ( resid 55 and name HA ) 6.0 6.0 0.72
assign ( resid 37 and name HB* ) ( resid 55 and name HA ) 6.0 6.0 0.72
assign ( resid 37 and name HB* ) ( resid 56 and name HB* ) 5.0 5.0 1.272
assign ( resid 37 and name HB* ) ( resid 56 and name HB* ) 5.0 5.0 1.272
assign ( resid 37 and name HB* ) ( resid 56 and name HE3 ) 4.0 4.0 0.48
assign ( resid 37 and name HB* ) ( resid 56 and name HE3 ) 5.0 5.0 0.6
assign ( resid 37 and name HB* ) ( resid 59 and name HD* ) 5.0 5.0 1.72
assign ( resid 37 and name HD* ) ( resid 31 and name HA ) 5.0 5.0 0.0
assign ( resid 37 and name HD* ) ( resid 32 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HD* ) ( resid 32 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HD* ) ( resid 35 and name HB* ) 6.0 6.0 0.72
assign ( resid 37 and name HD* ) ( resid 36 and name HA ) 4.0 4.0 0.0
assign ( resid 37 and name HD* ) ( resid 37 and name HA ) 5.0 5.0 0.0
assign ( resid 37 and name HD* ) ( resid 37 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HD* ) ( resid 37 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HE1 ) ( resid 32 and name HB* ) 4.0 4.0 0.48
assign ( resid 37 and name HE1 ) ( resid 32 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HE1 ) ( resid 32 and name HD* ) 6.0 6.0 0.72
assign ( resid 37 and name HE1 ) ( resid 32 and name HN ) 6.0 6.0 0.0
assign ( resid 37 and name HE1 ) ( resid 35 and name HB* ) 4.0 4.0 0.48
assign ( resid 37 and name HE1 ) ( resid 35 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HE1 ) ( resid 35 and name HN ) 6.0 6.0 0.0
assign ( resid 37 and name HE1 ) ( resid 37 and name HD* ) 3.0 3.0 0.0
assign ( resid 37 and name HE1 ) ( resid 9 and name HB* ) 6.0 6.0 0.72
assign ( resid 37 and name HE3 ) ( resid 12 and name HG2* ) 5.0 5.0 1.0
assign ( resid 37 and name HE3 ) ( resid 37 and name HB* ) 3.0 3.0 0.36
assign ( resid 37 and name HE3 ) ( resid 37 and name HB* ) 4.0 4.0 0.48
assign ( resid 37 and name HE3 ) ( resid 37 and name HZ3 ) 3.0 3.0 0.0
assign ( resid 37 and name HE3 ) ( resid 56 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HE3 ) ( resid 57 and name HA ) 5.0 5.0 0.0
assign ( resid 37 and name HE3 ) ( resid 58 and name HA ) 5.0 5.0 0.0
assign ( resid 37 and name HE3 ) ( resid 58 and name HD* ) 5.0 5.0 0.6
assign ( resid 37 and name HH2 ) ( resid 10 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HH2 ) ( resid 37 and name HZ2 ) 3.0 3.0 0.0
assign ( resid 37 and name HH2 ) ( resid 9 and name HD* ) 3.0 3.0 0.36
assign ( resid 37 and name HN ) ( resid 30 and name HN ) 5.0 5.0 0.0
assign ( resid 37 and name HN ) ( resid 31 and name HA ) 5.0 5.0 0.0
assign ( resid 37 and name HN ) ( resid 36 and name HA ) 3.0 3.0 0.0
assign ( resid 37 and name HN ) ( resid 36 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HN ) ( resid 36 and name HD* ) 4.0 4.0 1.4
assign ( resid 37 and name HN ) ( resid 36 and name HD* ) 5.0 5.0 1.75
assign ( resid 37 and name HN ) ( resid 36 and name HG ) 5.0 5.0 0.0
assign ( resid 37 and name HN ) ( resid 37 and name HA ) 5.0 5.0 0.0
assign ( resid 37 and name HN ) ( resid 37 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HN ) ( resid 37 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HN ) ( resid 37 and name HD* ) 4.0 4.0 0.0
assign ( resid 37 and name HZ2 ) ( resid 10 and name HG* ) 5.0 5.0 0.6
assign ( resid 37 and name HZ2 ) ( resid 32 and name HD* ) 5.0 5.0 0.6
assign ( resid 37 and name HZ2 ) ( resid 35 and name HB* ) 5.0 5.0 0.6
assign ( resid 37 and name HZ2 ) ( resid 9 and name HD* ) 4.0 4.0 0.48
assign ( resid 37 and name HZ3 ) ( resid 11 and name HA ) 4.0 4.0 0.0
assign ( resid 37 and name HZ3 ) ( resid 12 and name HB ) 6.0 6.0 0.0
assign ( resid 37 and name HZ3 ) ( resid 12 and name HG2* ) 5.0 5.0 1.0
assign ( resid 37 and name HZ3 ) ( resid 37 and name HE3 ) 4.0 4.0 0.0
assign ( resid 37 and name HZ3 ) ( resid 56 and name HB* ) 6.0 6.0 0.72
assign ( resid 37 and name HZ3 ) ( resid 57 and name HA ) 5.0 5.0 0.0
assign ( resid 37 and name HZ3 ) ( resid 58 and name HD* ) 4.0 4.0 0.48
assign ( resid 38 and name HA ) ( resid 29 and name HA ) 4.0 4.0 0.0
assign ( resid 38 and name HA ) ( resid 29 and name HD* ) 5.0 5.0 0.6
assign ( resid 38 and name HA ) ( resid 29 and name HE* ) 6.0 6.0 0.72
assign ( resid 38 and name HA ) ( resid 38 and name HB* ) 5.0 5.0 0.6
assign ( resid 38 and name HA ) ( resid 38 and name HB* ) 5.0 5.0 0.6
assign ( resid 38 and name HA ) ( resid 39 and name HB* ) 5.0 5.0 1.0
assign ( resid 38 and name HA ) ( resid 56 and name HZ3 ) 5.0 5.0 0.0
assign ( resid 38 and name HA ) ( resid 59 and name HG1* ) 5.0 5.0 1.0
assign ( resid 38 and name HB* ) ( resid 27 and name HB* ) 5.0 5.0 1.272
assign ( resid 38 and name HB* ) ( resid 27 and name HB* ) 6.0 6.0 1.5264
assign ( resid 38 and name HB* ) ( resid 29 and name HD* ) 5.0 5.0 1.272
assign ( resid 38 and name HB* ) ( resid 29 and name HD* ) 5.0 5.0 1.272
assign ( resid 38 and name HB* ) ( resid 29 and name HE* ) 4.0 4.0 1.0176
assign ( resid 38 and name HB* ) ( resid 29 and name HE* ) 4.0 4.0 1.0176
assign ( resid 38 and name HB* ) ( resid 29 and name HE* ) 5.0 5.0 1.272
assign ( resid 38 and name HB* ) ( resid 29 and name HE* ) 5.0 5.0 1.272
assign ( resid 38 and name HB* ) ( resid 38 and name HA ) 5.0 5.0 0.6
assign ( resid 38 and name HB* ) ( resid 38 and name HA ) 5.0 5.0 0.6
assign ( resid 38 and name HB* ) ( resid 38 and name HA ) 5.0 5.0 0.6
assign ( resid 38 and name HB* ) ( resid 38 and name HA ) 5.0 5.0 0.6
assign ( resid 38 and name HB* ) ( resid 38 and name HB* ) 2.5 2.5 0.636
assign ( resid 38 and name HB* ) ( resid 38 and name HB* ) 3.0 3.0 0.7632
assign ( resid 38 and name HB* ) ( resid 39 and name HA ) 6.0 6.0 0.72
assign ( resid 38 and name HB* ) ( resid 56 and name HB* ) 6.0 6.0 1.5264
assign ( resid 38 and name HB* ) ( resid 57 and name HB ) 6.0 6.0 0.72
assign ( resid 38 and name HB* ) ( resid 57 and name HB ) 6.0 6.0 0.72
assign ( resid 38 and name HB* ) ( resid 57 and name HG* ) 5.0 5.0 2.56
assign ( resid 38 and name HB* ) ( resid 57 and name HG* ) 5.0 5.0 2.56
assign ( resid 38 and name HB* ) ( resid 57 and name HG* ) 5.0 5.0 2.56
assign ( resid 38 and name HB* ) ( resid 57 and name HG* ) 6.0 6.0 3.072
assign ( resid 38 and name HB* ) ( resid 59 and name HG1* ) 4.0 4.0 1.376
assign ( resid 38 and name HB* ) ( resid 59 and name HG1* ) 4.0 4.0 1.376
assign ( resid 38 and name HB* ) ( resid 59 and name HG1* ) 4.0 4.0 1.376
assign ( resid 38 and name HB* ) ( resid 59 and name HG1* ) 4.0 4.0 1.376
assign ( resid 38 and name HD* ) ( resid 28 and name HN ) 5.0 5.0 0.0
assign ( resid 38 and name HD* ) ( resid 38 and name HA ) 5.0 5.0 0.0
assign ( resid 38 and name HD* ) ( resid 38 and name HB* ) 5.0 5.0 0.6
assign ( resid 38 and name HD* ) ( resid 38 and name HD* ) 2.5 2.5 0.0
assign ( resid 38 and name HD* ) ( resid 39 and name HN ) 5.0 5.0 0.0
assign ( resid 38 and name HD* ) ( resid 57 and name HB ) 5.0 5.0 0.0
assign ( resid 38 and name HD* ) ( resid 59 and name HD* ) 5.0 5.0 1.0
assign ( resid 38 and name HN ) ( resid 37 and name HA ) 3.0 3.0 0.0
assign ( resid 38 and name HN ) ( resid 37 and name HB* ) 5.0 5.0 0.6
assign ( resid 38 and name HN ) ( resid 37 and name HB* ) 5.0 5.0 0.6
assign ( resid 38 and name HN ) ( resid 38 and name HA ) 5.0 5.0 0.0
assign ( resid 38 and name HN ) ( resid 38 and name HB* ) 4.0 4.0 0.48
assign ( resid 38 and name HN ) ( resid 38 and name HB* ) 4.0 4.0 0.48
assign ( resid 38 and name HN ) ( resid 57 and name HG* ) 5.0 5.0 1.75
assign ( resid 38 and name HN ) ( resid 57 and name HN ) 5.0 5.0 0.0
assign ( resid 38 and name HN ) ( resid 59 and name HD* ) 4.0 4.0 0.8
assign ( resid 39 and name HA ) ( resid 39 and name HB* ) 3.0 3.0 0.6
assign ( resid 39 and name HA ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 39 and name HA ) ( resid 56 and name HA ) 5.0 5.0 0.0
assign ( resid 39 and name HA ) ( resid 56 and name HE3 ) 6.0 6.0 0.0
assign ( resid 39 and name HB* ) ( resid 28 and name HB* ) 5.0 5.0 1.72
assign ( resid 39 and name HB* ) ( resid 28 and name HB* ) 6.0 6.0 2.064
assign ( resid 39 and name HB* ) ( resid 39 and name HA ) 4.0 4.0 0.8
assign ( resid 39 and name HB* ) ( resid 43 and name HG* ) 5.0 5.0 3.1
assign ( resid 39 and name HB* ) ( resid 43 and name HG* ) 5.0 5.0 3.1
assign ( resid 39 and name HB* ) ( resid 56 and name HE3 ) 6.0 6.0 1.2
assign ( resid 39 and name HB* ) ( resid 56 and name HH2 ) 5.0 5.0 1.0
assign ( resid 39 and name HB* ) ( resid 56 and name HZ2 ) 5.0 5.0 1.0
assign ( resid 39 and name HN ) ( resid 28 and name HB* ) 5.0 5.0 0.6
assign ( resid 39 and name HN ) ( resid 28 and name HB* ) 5.0 5.0 0.6
assign ( resid 39 and name HN ) ( resid 28 and name HN ) 5.0 5.0 0.0
assign ( resid 39 and name HN ) ( resid 29 and name HA ) 6.0 6.0 0.0
assign ( resid 39 and name HN ) ( resid 29 and name HA ) 6.0 6.0 0.0
assign ( resid 39 and name HN ) ( resid 29 and name HD* ) 5.0 5.0 0.6
assign ( resid 39 and name HN ) ( resid 38 and name HA ) 2.5 2.5 0.0
assign ( resid 39 and name HN ) ( resid 38 and name HD* ) 4.0 4.0 0.0
assign ( resid 39 and name HN ) ( resid 38 and name HD* ) 5.0 5.0 0.0
assign ( resid 39 and name HN ) ( resid 39 and name HA ) 5.0 5.0 0.0
assign ( resid 39 and name HN ) ( resid 39 and name HB* ) 2.5 2.5 0.5
assign ( resid 4 and name HA ) ( resid 2 and name HG2* ) 6.0 6.0 1.2
assign ( resid 4 and name HA ) ( resid 3 and name HG* ) 6.0 6.0 2.1
assign ( resid 4 and name HA ) ( resid 4 and name HB* ) 3.0 3.0 0.36
assign ( resid 4 and name HA ) ( resid 4 and name HB* ) 4.0 4.0 0.48
assign ( resid 4 and name HA ) ( resid 4 and name HG* ) 5.0 5.0 0.6
assign ( resid 4 and name HA ) ( resid 4 and name HG* ) 5.0 5.0 0.6
assign ( resid 4 and name HA ) ( resid 7 and name HB* ) 4.0 4.0 0.48
assign ( resid 4 and name HA ) ( resid 7 and name HB* ) 5.0 5.0 0.6
assign ( resid 4 and name HA ) ( resid 7 and name HD* ) 5.0 5.0 1.75
assign ( resid 4 and name HA ) ( resid 8 and name HA ) 6.0 6.0 0.0
assign ( resid 4 and name HB* ) ( resid 2 and name HB ) 6.0 6.0 0.72
assign ( resid 4 and name HB* ) ( resid 2 and name HG2* ) 5.0 5.0 1.72
assign ( resid 4 and name HB* ) ( resid 2 and name HG2* ) 5.0 5.0 1.72
assign ( resid 4 and name HB* ) ( resid 4 and name HA ) 4.0 4.0 0.48
assign ( resid 4 and name HB* ) ( resid 4 and name HA ) 5.0 5.0 0.6
assign ( resid 4 and name HB* ) ( resid 4 and name HG* ) 4.0 4.0 1.0176
assign ( resid 4 and name HB* ) ( resid 4 and name HG* ) 4.0 4.0 1.0176
assign ( resid 4 and name HB* ) ( resid 5 and name HA ) 5.0 5.0 0.6
assign ( resid 4 and name HG* ) ( resid 4 and name HA ) 5.0 5.0 0.6
assign ( resid 4 and name HG* ) ( resid 4 and name HA ) 5.0 5.0 0.6
assign ( resid 4 and name HG* ) ( resid 4 and name HB* ) 3.0 3.0 0.7632
assign ( resid 4 and name HG* ) ( resid 4 and name HB* ) 4.0 4.0 1.0176
assign ( resid 4 and name HG* ) ( resid 4 and name HB* ) 4.0 4.0 1.0176
assign ( resid 4 and name HG* ) ( resid 4 and name HB* ) 4.0 4.0 1.0176
assign ( resid 4 and name HG* ) ( resid 4 and name HG* ) 2.5 2.5 0.636
assign ( resid 4 and name HG* ) ( resid 4 and name HG* ) 2.5 2.5 0.636
assign ( resid 4 and name HG* ) ( resid 7 and name HD* ) 6.0 6.0 3.072
assign ( resid 4 and name HN ) ( resid 2 and name HA ) 5.0 5.0 0.0
assign ( resid 4 and name HN ) ( resid 3 and name HA ) 5.0 5.0 0.0
assign ( resid 4 and name HN ) ( resid 3 and name HG* ) 4.0 4.0 1.4
assign ( resid 4 and name HN ) ( resid 3 and name HG* ) 5.0 5.0 1.75
assign ( resid 4 and name HN ) ( resid 3 and name HN ) 4.0 4.0 0.0
assign ( resid 4 and name HN ) ( resid 4 and name HA ) 4.0 4.0 0.0
assign ( resid 4 and name HN ) ( resid 4 and name HB* ) 2.5 2.5 0.3
assign ( resid 4 and name HN ) ( resid 4 and name HB* ) 4.0 4.0 0.48
assign ( resid 4 and name HN ) ( resid 4 and name HB* ) 4.0 4.0 0.48
assign ( resid 4 and name HN ) ( resid 4 and name HG* ) 5.0 5.0 0.6
assign ( resid 4 and name HN ) ( resid 4 and name HG* ) 5.0 5.0 0.6
assign ( resid 4 and name HN ) ( resid 5 and name HN ) 4.0 4.0 0.0
assign ( resid 4 and name HN ) ( resid 5 and name HN ) 5.0 5.0 0.0
assign ( resid 40 and name HA ) ( resid 39 and name HB* ) 5.0 5.0 1.0
assign ( resid 40 and name HA ) ( resid 40 and name HB ) 4.0 4.0 0.0
assign ( resid 40 and name HA ) ( resid 40 and name HG2* ) 4.0 4.0 0.8
assign ( resid 40 and name HA ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 40 and name HB ) ( resid 40 and name HA ) 4.0 4.0 0.0
assign ( resid 40 and name HB ) ( resid 40 and name HG2* ) 3.0 3.0 0.6
assign ( resid 40 and name HB ) ( resid 43 and name HG* ) 6.0 6.0 2.1
assign ( resid 40 and name HG2* ) ( resid 40 and name HB ) 5.0 5.0 1.0
assign ( resid 40 and name HG2* ) ( resid 55 and name HB ) 4.0 4.0 0.8
assign ( resid 40 and name HG2* ) ( resid 55 and name HB ) 5.0 5.0 1.0
assign ( resid 40 and name HN ) ( resid 39 and name HA ) 2.5 2.5 0.0
assign ( resid 40 and name HN ) ( resid 39 and name HB* ) 4.0 4.0 0.8
assign ( resid 40 and name HN ) ( resid 40 and name HG2* ) 4.0 4.0 0.8
assign ( resid 40 and name HN ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 41 and name HA* ) ( resid 40 and name HG2* ) 6.0 6.0 2.064
assign ( resid 41 and name HA* ) ( resid 40 and name HG2* ) 6.0 6.0 2.064
assign ( resid 41 and name HA* ) ( resid 41 and name HA* ) 2.5 2.5 0.636
assign ( resid 41 and name HA* ) ( resid 41 and name HA* ) 2.5 2.5 0.636
assign ( resid 41 and name HN ) ( resid 40 and name HA ) 5.0 5.0 0.0
assign ( resid 41 and name HN ) ( resid 40 and name HB ) 4.0 4.0 0.0
assign ( resid 41 and name HN ) ( resid 40 and name HG2* ) 5.0 5.0 1.0
assign ( resid 41 and name HN ) ( resid 41 and name HA* ) 3.0 3.0 0.36
assign ( resid 41 and name HN ) ( resid 41 and name HA* ) 5.0 5.0 0.6
assign ( resid 41 and name HN ) ( resid 42 and name HA ) 6.0 6.0 0.0
assign ( resid 41 and name HN ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 42 and name HA ) ( resid 42 and name HB ) 5.0 5.0 0.0
assign ( resid 42 and name HA ) ( resid 42 and name HG* ) 3.0 3.0 1.05
assign ( resid 42 and name HA ) ( resid 42 and name HG* ) 4.0 4.0 1.4
assign ( resid 42 and name HA ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 42 and name HB ) ( resid 42 and name HA ) 5.0 5.0 0.0
assign ( resid 42 and name HG* ) ( resid 42 and name HA ) 5.0 5.0 1.75
assign ( resid 42 and name HG* ) ( resid 42 and name HA ) 5.0 5.0 1.75
assign ( resid 42 and name HG* ) ( resid 42 and name HB ) 4.0 4.0 1.4
assign ( resid 42 and name HG* ) ( resid 42 and name HB ) 4.0 4.0 1.4
assign ( resid 42 and name HG* ) ( resid 42 and name HB ) 5.0 5.0 1.75
assign ( resid 42 and name HN ) ( resid 41 and name HA* ) 3.0 3.0 0.36
assign ( resid 42 and name HN ) ( resid 41 and name HA* ) 4.0 4.0 0.48
assign ( resid 42 and name HN ) ( resid 42 and name HA ) 3.0 3.0 0.0
assign ( resid 42 and name HN ) ( resid 42 and name HB ) 2.5 2.5 0.0
assign ( resid 42 and name HN ) ( resid 42 and name HG* ) 3.0 3.0 1.05
assign ( resid 42 and name HN ) ( resid 42 and name HG* ) 5.0 5.0 1.75
assign ( resid 42 and name HN ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 43 and name HA ) ( resid 42 and name HG* ) 5.0 5.0 1.75
assign ( resid 43 and name HA ) ( resid 42 and name HG* ) 6.0 6.0 2.1
assign ( resid 43 and name HA ) ( resid 43 and name HB ) 5.0 5.0 0.0
assign ( resid 43 and name HA ) ( resid 43 and name HB ) 6.0 6.0 0.0
assign ( resid 43 and name HA ) ( resid 43 and name HG* ) 4.0 4.0 1.4
assign ( resid 43 and name HA ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 43 and name HA ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 43 and name HA ) ( resid 54 and name HA* ) 5.0 5.0 0.6
assign ( resid 43 and name HA ) ( resid 54 and name HA* ) 5.0 5.0 0.6
assign ( resid 43 and name HB ) ( resid 43 and name HG* ) 4.0 4.0 1.4
assign ( resid 43 and name HB ) ( resid 43 and name HG* ) 4.0 4.0 1.4
assign ( resid 43 and name HG* ) ( resid 28 and name HD* ) 5.0 5.0 2.56
assign ( resid 43 and name HG* ) ( resid 28 and name HD* ) 6.0 6.0 3.072
assign ( resid 43 and name HG* ) ( resid 28 and name HG* ) 6.0 6.0 3.072
assign ( resid 43 and name HG* ) ( resid 39 and name HB* ) 4.0 4.0 2.48
assign ( resid 43 and name HG* ) ( resid 39 and name HB* ) 4.0 4.0 2.48
assign ( resid 43 and name HG* ) ( resid 43 and name HB ) 5.0 5.0 1.75
assign ( resid 43 and name HG* ) ( resid 43 and name HB ) 5.0 5.0 1.75
assign ( resid 43 and name HG* ) ( resid 43 and name HG* ) 4.0 4.0 3.29
assign ( resid 43 and name HG* ) ( resid 52 and name HB* ) 5.0 5.0 2.56
assign ( resid 43 and name HG* ) ( resid 54 and name HA* ) 6.0 6.0 3.072
assign ( resid 43 and name HG* ) ( resid 54 and name HA* ) 6.0 6.0 3.072
assign ( resid 43 and name HN ) ( resid 42 and name HA ) 2.5 2.5 0.0
assign ( resid 43 and name HN ) ( resid 42 and name HG* ) 4.0 4.0 1.4
assign ( resid 43 and name HN ) ( resid 42 and name HG* ) 5.0 5.0 1.75
assign ( resid 43 and name HN ) ( resid 42 and name HN ) 6.0 6.0 0.0
assign ( resid 43 and name HN ) ( resid 43 and name HB ) 3.0 3.0 0.0
assign ( resid 43 and name HN ) ( resid 43 and name HG* ) 4.0 4.0 1.4
assign ( resid 43 and name HN ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 44 and name HA ) ( resid 43 and name HA ) 6.0 6.0 0.0
assign ( resid 44 and name HA ) ( resid 43 and name HG* ) 6.0 6.0 2.1
assign ( resid 44 and name HA ) ( resid 44 and name HB ) 5.0 5.0 0.0
assign ( resid 44 and name HA ) ( resid 44 and name HG* ) 3.0 3.0 0.0
assign ( resid 44 and name HA ) ( resid 45 and name HA ) 5.0 5.0 0.0
assign ( resid 44 and name HA ) ( resid 52 and name HA ) 6.0 6.0 0.0
assign ( resid 44 and name HB ) ( resid 44 and name HA ) 5.0 5.0 0.0
assign ( resid 44 and name HB ) ( resid 44 and name HG* ) 3.0 3.0 0.0
assign ( resid 44 and name HB ) ( resid 44 and name HG* ) 5.0 5.0 0.0
assign ( resid 44 and name HB ) ( resid 53 and name HB* ) 5.0 5.0 0.6
assign ( resid 44 and name HB ) ( resid 53 and name HD* ) 5.0 5.0 0.6
assign ( resid 44 and name HG* ) ( resid 44 and name HA ) 5.0 5.0 0.0
assign ( resid 44 and name HG* ) ( resid 44 and name HB ) 4.0 4.0 0.0
assign ( resid 44 and name HG* ) ( resid 53 and name HB* ) 6.0 6.0 0.72
assign ( resid 44 and name HG* ) ( resid 53 and name HD* ) 5.0 5.0 0.6
assign ( resid 44 and name HN ) ( resid 43 and name HB ) 6.0 6.0 0.0
assign ( resid 44 and name HN ) ( resid 43 and name HG* ) 4.0 4.0 1.4
assign ( resid 44 and name HN ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 44 and name HN ) ( resid 44 and name HA ) 5.0 5.0 0.0
assign ( resid 44 and name HN ) ( resid 44 and name HB ) 4.0 4.0 0.0
assign ( resid 44 and name HN ) ( resid 44 and name HG* ) 3.0 3.0 0.0
assign ( resid 44 and name HN ) ( resid 52 and name HB* ) 6.0 6.0 0.72
assign ( resid 44 and name HN ) ( resid 53 and name HB* ) 5.0 5.0 0.6
assign ( resid 44 and name HN ) ( resid 53 and name HN ) 5.0 5.0 0.0
assign ( resid 45 and name HA ) ( resid 44 and name HG* ) 5.0 5.0 0.0
assign ( resid 45 and name HA ) ( resid 45 and name HB* ) 4.0 4.0 0.48
assign ( resid 45 and name HA ) ( resid 45 and name HB* ) 4.0 4.0 0.48
assign ( resid 45 and name HA ) ( resid 46 and name HB ) 5.0 5.0 0.0
assign ( resid 45 and name HA ) ( resid 52 and name HA ) 3.0 3.0 0.0
assign ( resid 45 and name HA ) ( resid 52 and name HB* ) 5.0 5.0 0.6
assign ( resid 45 and name HB* ) ( resid 45 and name HA ) 4.0 4.0 0.48
assign ( resid 45 and name HB* ) ( resid 45 and name HA ) 5.0 5.0 0.6
assign ( resid 45 and name HB* ) ( resid 45 and name HB* ) 2.5 2.5 0.636
assign ( resid 45 and name HB* ) ( resid 45 and name HB* ) 3.0 3.0 0.7632
assign ( resid 45 and name HB* ) ( resid 48 and name HB* ) 6.0 6.0 1.5264
assign ( resid 45 and name HB* ) ( resid 49 and name HA ) 4.0 4.0 0.48
assign ( resid 45 and name HB* ) ( resid 49 and name HA ) 5.0 5.0 0.6
assign ( resid 45 and name HB* ) ( resid 49 and name HB* ) 5.0 5.0 1.272
assign ( resid 45 and name HB* ) ( resid 49 and name HB* ) 5.0 5.0 1.272
assign ( resid 45 and name HB* ) ( resid 49 and name HG* ) 5.0 5.0 0.6
assign ( resid 45 and name HB* ) ( resid 49 and name HG* ) 5.0 5.0 0.6
assign ( resid 45 and name HB* ) ( resid 52 and name HA ) 5.0 5.0 0.6
assign ( resid 45 and name HB* ) ( resid 52 and name HA ) 5.0 5.0 0.6
assign ( resid 45 and name HN ) ( resid 44 and name HA ) 5.0 5.0 0.0
assign ( resid 45 and name HN ) ( resid 44 and name HG* ) 5.0 5.0 0.0
assign ( resid 45 and name HN ) ( resid 45 and name HA ) 5.0 5.0 0.0
assign ( resid 45 and name HN ) ( resid 45 and name HB* ) 5.0 5.0 0.6
assign ( resid 45 and name HN ) ( resid 45 and name HB* ) 6.0 6.0 0.72
assign ( resid 46 and name HA ) ( resid 46 and name HG2* ) 4.0 4.0 0.8
assign ( resid 46 and name HB ) ( resid 51 and name HB* ) 6.0 6.0 0.72
assign ( resid 46 and name HG2* ) ( resid 46 and name HB ) 4.0 4.0 0.8
assign ( resid 46 and name HN ) ( resid 44 and name HG* ) 6.0 6.0 0.0
assign ( resid 46 and name HN ) ( resid 44 and name HG* ) 6.0 6.0 0.0
assign ( resid 46 and name HN ) ( resid 45 and name HA ) 3.0 3.0 0.0
assign ( resid 46 and name HN ) ( resid 45 and name HB* ) 4.0 4.0 0.48
assign ( resid 46 and name HN ) ( resid 45 and name HB* ) 5.0 5.0 0.6
assign ( resid 46 and name HN ) ( resid 46 and name HA ) 6.0 6.0 0.0
assign ( resid 46 and name HN ) ( resid 46 and name HG2* ) 3.0 3.0 0.6
assign ( resid 46 and name HN ) ( resid 49 and name HG* ) 5.0 5.0 0.0
assign ( resid 46 and name HN ) ( resid 51 and name HN ) 5.0 5.0 0.0
assign ( resid 46 and name HN ) ( resid 52 and name HA ) 5.0 5.0 0.0
assign ( resid 46 and name NH ) ( resid 49 and name HA ) 5.0 5.0 0.0
assign ( resid 47 and name HA* ) ( resid 47 and name HA* ) 2.5 2.5 0.636
assign ( resid 47 and name HA* ) ( resid 47 and name HA* ) 2.5 2.5 0.636
assign ( resid 47 and name HA* ) ( resid 48 and name HA ) 6.0 6.0 0.72
assign ( resid 47 and name HA* ) ( resid 48 and name HA ) 6.0 6.0 0.72
assign ( resid 47 and name HN ) ( resid 46 and name HA ) 6.0 6.0 0.0
assign ( resid 47 and name HN ) ( resid 47 and name HA* ) 5.0 5.0 0.6
assign ( resid 47 and name HN ) ( resid 47 and name HA* ) 5.0 5.0 0.6
assign ( resid 48 and name HA ) ( resid 47 and name HA* ) 5.0 5.0 0.6
assign ( resid 48 and name HA ) ( resid 47 and name HA* ) 6.0 6.0 0.72
assign ( resid 48 and name HA ) ( resid 48 and name HB* ) 5.0 5.0 0.6
assign ( resid 48 and name HA ) ( resid 48 and name HB* ) 5.0 5.0 0.6
assign ( resid 48 and name HA ) ( resid 48 and name HB* ) 5.0 5.0 0.6
assign ( resid 48 and name HA ) ( resid 48 and name HB* ) 6.0 6.0 0.72
assign ( resid 48 and name HA ) ( resid 49 and name HB* ) 6.0 6.0 0.72
assign ( resid 48 and name HA ) ( resid 50 and name HG2* ) 6.0 6.0 1.2
assign ( resid 48 and name HB* ) ( resid 48 and name HA ) 5.0 5.0 0.6
assign ( resid 48 and name HB* ) ( resid 48 and name HA ) 5.0 5.0 0.6
assign ( resid 48 and name HB* ) ( resid 48 and name HB* ) 3.0 3.0 0.7632
assign ( resid 48 and name HB* ) ( resid 48 and name HB* ) 3.0 3.0 0.7632
assign ( resid 48 and name HB* ) ( resid 50 and name HG2* ) 5.0 5.0 1.72
assign ( resid 48 and name HN ) ( resid 47 and name HA* ) 6.0 6.0 0.72
assign ( resid 48 and name HN ) ( resid 47 and name HA* ) 6.0 6.0 0.72
assign ( resid 48 and name HN ) ( resid 48 and name HA ) 6.0 6.0 0.0
assign ( resid 48 and name HN ) ( resid 48 and name HB* ) 5.0 5.0 0.6
assign ( resid 48 and name HN ) ( resid 48 and name HB* ) 6.0 6.0 0.72
assign ( resid 48 and name HN ) ( resid 49 and name HN ) 4.0 4.0 0.0
assign ( resid 49 and name HA ) ( resid 45 and name HB* ) 4.0 4.0 0.48
assign ( resid 49 and name HA ) ( resid 45 and name HB* ) 5.0 5.0 0.6
assign ( resid 49 and name HA ) ( resid 47 and name HA* ) 5.0 5.0 0.6
assign ( resid 49 and name HA ) ( resid 47 and name HA* ) 6.0 6.0 0.72
assign ( resid 49 and name HA ) ( resid 49 and name HB* ) 3.0 3.0 0.36
assign ( resid 49 and name HA ) ( resid 49 and name HG* ) 5.0 5.0 0.0
assign ( resid 49 and name HB* ) ( resid 19 and name HG* ) 6.0 6.0 3.072
assign ( resid 49 and name HB* ) ( resid 28 and name HD* ) 5.0 5.0 1.272
assign ( resid 49 and name HB* ) ( resid 45 and name HB* ) 6.0 6.0 1.5264
assign ( resid 49 and name HB* ) ( resid 45 and name HB* ) 6.0 6.0 1.5264
assign ( resid 49 and name HB* ) ( resid 49 and name HA ) 4.0 4.0 0.48
assign ( resid 49 and name HB* ) ( resid 49 and name HG* ) 2.5 2.5 0.3
assign ( resid 49 and name HG* ) ( resid 45 and name HB* ) 5.0 5.0 0.6
assign ( resid 49 and name HG* ) ( resid 45 and name HB* ) 6.0 6.0 0.72
assign ( resid 49 and name HG* ) ( resid 49 and name HA ) 5.0 5.0 0.0
assign ( resid 49 and name HG* ) ( resid 49 and name HA ) 5.0 5.0 0.0
assign ( resid 49 and name HG* ) ( resid 49 and name HB* ) 2.5 2.5 0.3
assign ( resid 49 and name HG* ) ( resid 49 and name HG* ) 2.5 2.5 0.0
assign ( resid 49 and name HN ) ( resid 46 and name HG2* ) 5.0 5.0 1.0
assign ( resid 49 and name HN ) ( resid 46 and name HN ) 5.0 5.0 0.0
assign ( resid 49 and name HN ) ( resid 48 and name HB* ) 5.0 5.0 0.6
assign ( resid 49 and name HN ) ( resid 49 and name HA ) 2.5 2.5 0.0
assign ( resid 49 and name HN ) ( resid 49 and name HB* ) 4.0 4.0 0.48
assign ( resid 49 and name HN ) ( resid 49 and name HG* ) 5.0 5.0 0.0
assign ( resid 49 and name HN ) ( resid 50 and name HA ) 6.0 6.0 0.0
assign ( resid 49 and name HN ) ( resid 50 and name HN ) 5.0 5.0 0.0
assign ( resid 5 and name HA ) ( resid 4 and name HB* ) 6.0 6.0 0.72
assign ( resid 5 and name HA ) ( resid 4 and name HB* ) 6.0 6.0 0.72
assign ( resid 5 and name HA ) ( resid 5 and name HB* ) 3.0 3.0 0.36
assign ( resid 5 and name HA ) ( resid 5 and name HB* ) 3.0 3.0 0.36
assign ( resid 5 and name HA ) ( resid 7 and name HA ) 6.0 6.0 0.0
assign ( resid 5 and name HA ) ( resid 8 and name HB* ) 5.0 5.0 1.0
assign ( resid 5 and name HB* ) ( resid 5 and name HA ) 5.0 5.0 0.6
assign ( resid 5 and name HB* ) ( resid 5 and name HB* ) 2.5 2.5 0.636
assign ( resid 5 and name HB* ) ( resid 5 and name HB* ) 3.0 3.0 0.7632
assign ( resid 5 and name HN ) ( resid 2 and name HB ) 6.0 6.0 0.0
assign ( resid 5 and name HN ) ( resid 2 and name HG2* ) 6.0 6.0 1.2
assign ( resid 5 and name HN ) ( resid 3 and name HG* ) 6.0 6.0 2.1
assign ( resid 5 and name HN ) ( resid 3 and name HN ) 6.0 6.0 0.0
assign ( resid 5 and name HN ) ( resid 4 and name HB* ) 2.5 2.5 0.3
assign ( resid 5 and name HN ) ( resid 4 and name HB* ) 5.0 5.0 0.6
assign ( resid 5 and name HN ) ( resid 4 and name HN ) 3.0 3.0 0.0
assign ( resid 5 and name HN ) ( resid 5 and name HA ) 5.0 5.0 0.0
assign ( resid 5 and name HN ) ( resid 5 and name HB* ) 4.0 4.0 0.48
assign ( resid 5 and name HN ) ( resid 6 and name HN ) 2.5 2.5 0.0
assign ( resid 50 and name HA ) ( resid 19 and name HB ) 4.0 4.0 0.0
assign ( resid 50 and name HA ) ( resid 50 and name HB ) 5.0 5.0 0.0
assign ( resid 50 and name HA ) ( resid 50 and name HB ) 5.0 5.0 0.0
assign ( resid 50 and name HA ) ( resid 50 and name HG2* ) 4.0 4.0 0.8
assign ( resid 50 and name HB ) ( resid 50 and name HA ) 5.0 5.0 0.0
assign ( resid 50 and name HB ) ( resid 50 and name HG2* ) 3.0 3.0 0.6
assign ( resid 50 and name HG2* ) ( resid 50 and name HA ) 5.0 5.0 1.0
assign ( resid 50 and name HN ) ( resid 46 and name HN ) 6.0 6.0 0.0
assign ( resid 50 and name HN ) ( resid 48 and name HB* ) 5.0 5.0 0.6
assign ( resid 50 and name HN ) ( resid 49 and name HA ) 5.0 5.0 0.0
assign ( resid 50 and name HN ) ( resid 49 and name HB* ) 5.0 5.0 0.6
assign ( resid 50 and name HN ) ( resid 49 and name HN ) 4.0 4.0 0.0
assign ( resid 50 and name HN ) ( resid 50 and name HA ) 6.0 6.0 0.0
assign ( resid 50 and name HN ) ( resid 50 and name HG2* ) 3.0 3.0 0.6
assign ( resid 50 and name HN ) ( resid 51 and name HN ) 3.0 3.0 0.0
assign ( resid 51 and name HA ) ( resid 17 and name HA ) 4.0 4.0 0.0
assign ( resid 51 and name HA ) ( resid 17 and name HG2* ) 5.0 5.0 1.0
assign ( resid 51 and name HA ) ( resid 19 and name HG* ) 5.0 5.0 1.75
assign ( resid 51 and name HA ) ( resid 51 and name HB* ) 3.0 3.0 0.36
assign ( resid 51 and name HA ) ( resid 51 and name HG* ) 5.0 5.0 0.0
assign ( resid 51 and name HA ) ( resid 51 and name HG* ) 5.0 5.0 0.0
assign ( resid 51 and name HB* ) ( resid 46 and name HG2* ) 5.0 5.0 1.72
assign ( resid 51 and name HB* ) ( resid 46 and name HG2* ) 5.0 5.0 1.72
assign ( resid 51 and name HB* ) ( resid 51 and name HA ) 5.0 5.0 0.6
assign ( resid 51 and name HB* ) ( resid 51 and name HA ) 5.0 5.0 0.6
assign ( resid 51 and name HB* ) ( resid 51 and name HG* ) 3.0 3.0 0.36
assign ( resid 51 and name HB* ) ( resid 51 and name HG* ) 4.0 4.0 0.48
assign ( resid 51 and name HG* ) ( resid 17 and name HA ) 6.0 6.0 0.0
assign ( resid 51 and name HG* ) ( resid 17 and name HG2* ) 5.0 5.0 1.0
assign ( resid 51 and name HG* ) ( resid 17 and name HG2* ) 6.0 6.0 1.2
assign ( resid 51 and name HG* ) ( resid 51 and name HA ) 3.0 3.0 0.0
assign ( resid 51 and name HG* ) ( resid 51 and name HA ) 5.0 5.0 0.0
assign ( resid 51 and name HG* ) ( resid 51 and name HA ) 5.0 5.0 0.0
assign ( resid 51 and name HG* ) ( resid 51 and name HB* ) 3.0 3.0 0.36
assign ( resid 51 and name HN ) ( resid 19 and name HG* ) 5.0 5.0 1.75
assign ( resid 51 and name HN ) ( resid 46 and name HN ) 5.0 5.0 0.0
assign ( resid 51 and name HN ) ( resid 49 and name HA ) 5.0 5.0 0.0
assign ( resid 51 and name HN ) ( resid 50 and name HA ) 5.0 5.0 0.0
assign ( resid 51 and name HN ) ( resid 50 and name HG2* ) 5.0 5.0 1.0
assign ( resid 51 and name HN ) ( resid 50 and name HN ) 4.0 4.0 0.0
assign ( resid 51 and name HN ) ( resid 51 and name HA ) 5.0 5.0 0.0
assign ( resid 51 and name HN ) ( resid 51 and name HB* ) 3.0 3.0 0.36
assign ( resid 51 and name HN ) ( resid 51 and name HG* ) 5.0 5.0 0.0
assign ( resid 51 and name HN ) ( resid 51 and name HG* ) 6.0 6.0 0.0
assign ( resid 51 and name HN ) ( resid 52 and name HA ) 5.0 5.0 0.0
assign ( resid 52 and name HA ) ( resid 17 and name HB ) 6.0 6.0 0.0
assign ( resid 52 and name HA ) ( resid 45 and name HA ) 3.0 3.0 0.0
assign ( resid 52 and name HA ) ( resid 52 and name HB* ) 4.0 4.0 0.48
assign ( resid 52 and name HA ) ( resid 52 and name HB* ) 4.0 4.0 0.48
assign ( resid 52 and name HB* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 52 and name HB* ) ( resid 19 and name HG* ) 5.0 5.0 2.56
assign ( resid 52 and name HB* ) ( resid 19 and name HG* ) 6.0 6.0 3.072
assign ( resid 52 and name HB* ) ( resid 28 and name HG* ) 6.0 6.0 1.5264
assign ( resid 52 and name HB* ) ( resid 43 and name HG* ) 4.0 4.0 2.048
assign ( resid 52 and name HB* ) ( resid 43 and name HG* ) 5.0 5.0 2.56
assign ( resid 52 and name HB* ) ( resid 44 and name HB ) 6.0 6.0 0.72
assign ( resid 52 and name HB* ) ( resid 45 and name HA ) 5.0 5.0 0.6
assign ( resid 52 and name HB* ) ( resid 45 and name HB* ) 5.0 5.0 1.272
assign ( resid 52 and name HB* ) ( resid 52 and name HA ) 5.0 5.0 0.6
assign ( resid 52 and name HB* ) ( resid 52 and name HA ) 5.0 5.0 0.6
assign ( resid 52 and name HB* ) ( resid 52 and name HB* ) 2.5 2.5 0.636
assign ( resid 52 and name HB* ) ( resid 52 and name HB* ) 2.5 2.5 0.636
assign ( resid 52 and name HB* ) ( resid 56 and name HH2 ) 5.0 5.0 0.6
assign ( resid 52 and name HB* ) ( resid 56 and name HH2 ) 6.0 6.0 0.72
assign ( resid 52 and name HB* ) ( resid 56 and name HZ2 ) 4.0 4.0 0.48
assign ( resid 52 and name HB* ) ( resid 56 and name HZ2 ) 5.0 5.0 0.6
assign ( resid 52 and name HB* ) ( resid 56 and name HZ3 ) 6.0 6.0 0.72
assign ( resid 52 and name HN ) ( resid 16 and name HN ) 5.0 5.0 0.0
assign ( resid 52 and name HN ) ( resid 17 and name HG2* ) 5.0 5.0 1.0
assign ( resid 52 and name HN ) ( resid 19 and name HB ) 5.0 5.0 0.0
assign ( resid 52 and name HN ) ( resid 19 and name HG* ) 4.0 4.0 1.4
assign ( resid 52 and name HN ) ( resid 51 and name HA ) 3.0 3.0 0.0
assign ( resid 52 and name HN ) ( resid 51 and name HB* ) 3.0 3.0 0.36
assign ( resid 52 and name HN ) ( resid 51 and name HG* ) 5.0 5.0 0.0
assign ( resid 52 and name HN ) ( resid 52 and name HA ) 3.0 3.0 0.0
assign ( resid 52 and name HN ) ( resid 52 and name HB* ) 5.0 5.0 0.6
assign ( resid 52 and name HN ) ( resid 52 and name HB* ) 6.0 6.0 0.72
assign ( resid 53 and name HA ) ( resid 15 and name HB* ) 5.0 5.0 0.6
assign ( resid 53 and name HA ) ( resid 16 and name HA ) 6.0 6.0 0.0
assign ( resid 53 and name HA ) ( resid 19 and name HG* ) 6.0 6.0 2.1
assign ( resid 53 and name HA ) ( resid 53 and name HB* ) 3.0 3.0 0.36
assign ( resid 53 and name HA ) ( resid 53 and name HD* ) 5.0 5.0 0.6
assign ( resid 53 and name HB* ) ( resid 15 and name HA ) 5.0 5.0 0.6
assign ( resid 53 and name HB* ) ( resid 15 and name HA ) 6.0 6.0 0.72
assign ( resid 53 and name HB* ) ( resid 15 and name HB* ) 6.0 6.0 1.5264
assign ( resid 53 and name HB* ) ( resid 44 and name HB ) 5.0 5.0 0.6
assign ( resid 53 and name HB* ) ( resid 44 and name HB ) 5.0 5.0 0.6
assign ( resid 53 and name HB* ) ( resid 44 and name HG* ) 5.0 5.0 0.6
assign ( resid 53 and name HB* ) ( resid 53 and name HA ) 4.0 4.0 0.48
assign ( resid 53 and name HB* ) ( resid 53 and name HA ) 5.0 5.0 0.6
assign ( resid 53 and name HB* ) ( resid 53 and name HD* ) 4.0 4.0 1.0176
assign ( resid 53 and name HB* ) ( resid 53 and name HD* ) 4.0 4.0 1.0176
assign ( resid 53 and name HB* ) ( resid 53 and name HE* ) 6.0 6.0 1.5264
assign ( resid 53 and name HD* ) ( resid 14 and name HA ) 5.0 5.0 0.6
assign ( resid 53 and name HD* ) ( resid 15 and name HA ) 6.0 6.0 0.72
assign ( resid 53 and name HD* ) ( resid 15 and name HB* ) 4.0 4.0 1.0176
assign ( resid 53 and name HD* ) ( resid 44 and name HB ) 5.0 5.0 0.6
assign ( resid 53 and name HD* ) ( resid 44 and name HG* ) 5.0 5.0 0.6
assign ( resid 53 and name HD* ) ( resid 53 and name HA ) 4.0 4.0 0.48
assign ( resid 53 and name HD* ) ( resid 53 and name HB* ) 2.5 2.5 0.636
assign ( resid 53 and name HD* ) ( resid 53 and name HE* ) 2.5 2.5 0.636
assign ( resid 53 and name HD* ) ( resid 54 and name HA* ) 5.0 5.0 1.272
assign ( resid 53 and name HD* ) ( resid 54 and name HA* ) 5.0 5.0 1.272
assign ( resid 53 and name HD* ) ( resid 56 and name HZ2 ) 6.0 6.0 0.72
assign ( resid 53 and name HE* ) ( resid 13 and name HG* ) 4.0 4.0 1.0176
assign ( resid 53 and name HE* ) ( resid 14 and name HA ) 5.0 5.0 0.6
assign ( resid 53 and name HE* ) ( resid 44 and name HG* ) 6.0 6.0 0.72
assign ( resid 53 and name HE* ) ( resid 53 and name HB* ) 5.0 5.0 1.272
assign ( resid 53 and name HE* ) ( resid 53 and name HD* ) 2.5 2.5 0.636
assign ( resid 53 and name HE* ) ( resid 54 and name HA* ) 6.0 6.0 1.5264
assign ( resid 53 and name HN ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 53 and name HN ) ( resid 44 and name HB ) 5.0 5.0 0.0
assign ( resid 53 and name HN ) ( resid 44 and name HG* ) 5.0 5.0 0.0
assign ( resid 53 and name HN ) ( resid 44 and name HN ) 5.0 5.0 0.0
assign ( resid 53 and name HN ) ( resid 45 and name HA ) 5.0 5.0 0.0
assign ( resid 53 and name HN ) ( resid 52 and name HA ) 2.5 2.5 0.0
assign ( resid 53 and name HN ) ( resid 52 and name HB* ) 5.0 5.0 0.6
assign ( resid 53 and name HN ) ( resid 52 and name HB* ) 6.0 6.0 0.72
assign ( resid 53 and name HN ) ( resid 53 and name HA ) 6.0 6.0 0.0
assign ( resid 53 and name HN ) ( resid 53 and name HB* ) 3.0 3.0 0.36
assign ( resid 53 and name HN ) ( resid 53 and name HB* ) 3.0 3.0 0.36
assign ( resid 54 and name HA* ) ( resid 43 and name HG* ) 5.0 5.0 2.56
assign ( resid 54 and name HA* ) ( resid 43 and name HG* ) 5.0 5.0 2.56
assign ( resid 54 and name HA* ) ( resid 53 and name HD* ) 6.0 6.0 1.5264
assign ( resid 54 and name HA* ) ( resid 54 and name HA* ) 2.5 2.5 0.636
assign ( resid 54 and name HA* ) ( resid 54 and name HA* ) 2.5 2.5 0.636
assign ( resid 54 and name HN ) ( resid 13 and name HG* ) 6.0 6.0 0.72
assign ( resid 54 and name HN ) ( resid 14 and name HN ) 5.0 5.0 0.0
assign ( resid 54 and name HN ) ( resid 15 and name HA ) 6.0 6.0 0.0
assign ( resid 54 and name HN ) ( resid 53 and name HA ) 3.0 3.0 0.0
assign ( resid 54 and name HN ) ( resid 53 and name HB* ) 5.0 5.0 0.6
assign ( resid 54 and name HN ) ( resid 53 and name HD* ) 5.0 5.0 0.6
assign ( resid 54 and name HN ) ( resid 54 and name HA* ) 5.0 5.0 0.6
assign ( resid 54 and name HN ) ( resid 54 and name HA* ) 5.0 5.0 0.6
assign ( resid 54 and name HN ) ( resid 56 and name HD* ) 5.0 5.0 0.0
assign ( resid 54 and name HN ) ( resid 56 and name HE1 ) 4.0 4.0 0.0
assign ( resid 55 and name HA ) ( resid 12 and name HG2* ) 4.0 4.0 0.8
assign ( resid 55 and name HA ) ( resid 13 and name HA ) 3.0 3.0 0.0
assign ( resid 55 and name HA ) ( resid 13 and name HB* ) 5.0 5.0 0.6
assign ( resid 55 and name HA ) ( resid 13 and name HG* ) 5.0 5.0 0.6
assign ( resid 55 and name HA ) ( resid 13 and name HG* ) 5.0 5.0 0.6
assign ( resid 55 and name HA ) ( resid 55 and name HB ) 5.0 5.0 0.0
assign ( resid 55 and name HA ) ( resid 55 and name HG2* ) 4.0 4.0 0.8
assign ( resid 55 and name HA ) ( resid 56 and name HD* ) 6.0 6.0 0.0
assign ( resid 55 and name HB ) ( resid 11 and name HB* ) 6.0 6.0 0.72
assign ( resid 55 and name HB ) ( resid 12 and name HB ) 5.0 5.0 0.0
assign ( resid 55 and name HB ) ( resid 40 and name HG2* ) 4.0 4.0 0.8
assign ( resid 55 and name HB ) ( resid 55 and name HA ) 5.0 5.0 0.0
assign ( resid 55 and name HB ) ( resid 55 and name HG2* ) 3.0 3.0 0.6
assign ( resid 55 and name HG2* ) ( resid 11 and name HB* ) 6.0 6.0 2.064
assign ( resid 55 and name HG2* ) ( resid 13 and name HG* ) 5.0 5.0 1.72
assign ( resid 55 and name HG2* ) ( resid 55 and name HA ) 5.0 5.0 1.0
assign ( resid 55 and name HG2* ) ( resid 55 and name HB ) 5.0 5.0 1.0
assign ( resid 55 and name HG2* ) ( resid 57 and name HG* ) 5.0 5.0 3.1
assign ( resid 55 and name HN ) ( resid 14 and name HN ) 6.0 6.0 0.0
assign ( resid 55 and name HN ) ( resid 39 and name HB* ) 6.0 6.0 1.2
assign ( resid 55 and name HN ) ( resid 43 and name HG* ) 5.0 5.0 1.75
assign ( resid 55 and name HN ) ( resid 54 and name HA* ) 3.0 3.0 0.36
assign ( resid 55 and name HN ) ( resid 54 and name HA* ) 4.0 4.0 0.48
assign ( resid 55 and name HN ) ( resid 55 and name HB ) 4.0 4.0 0.0
assign ( resid 55 and name HN ) ( resid 55 and name HG2* ) 5.0 5.0 1.0
assign ( resid 56 and name HA ) ( resid 12 and name HG2* ) 5.0 5.0 1.0
assign ( resid 56 and name HA ) ( resid 39 and name HA ) 5.0 5.0 0.0
assign ( resid 56 and name HA ) ( resid 39 and name HB* ) 6.0 6.0 1.2
assign ( resid 56 and name HA ) ( resid 56 and name HB* ) 5.0 5.0 0.6
assign ( resid 56 and name HA ) ( resid 56 and name HB* ) 5.0 5.0 0.6
assign ( resid 56 and name HA ) ( resid 56 and name HE3 ) 6.0 6.0 0.0
assign ( resid 56 and name HB* ) ( resid 12 and name HB ) 5.0 5.0 0.6
assign ( resid 56 and name HB* ) ( resid 12 and name HG2* ) 5.0 5.0 1.72
assign ( resid 56 and name HB* ) ( resid 12 and name HG2* ) 5.0 5.0 1.72
assign ( resid 56 and name HB* ) ( resid 15 and name HA ) 4.0 4.0 0.48
assign ( resid 56 and name HB* ) ( resid 15 and name HA ) 6.0 6.0 0.72
assign ( resid 56 and name HB* ) ( resid 37 and name HB* ) 4.0 4.0 1.0176
assign ( resid 56 and name HB* ) ( resid 37 and name HB* ) 5.0 5.0 1.272
assign ( resid 56 and name HB* ) ( resid 37 and name HE3 ) 5.0 5.0 0.6
assign ( resid 56 and name HB* ) ( resid 37 and name HE3 ) 5.0 5.0 0.6
assign ( resid 56 and name HB* ) ( resid 56 and name HB* ) 3.0 3.0 0.7632
assign ( resid 56 and name HB* ) ( resid 56 and name HB* ) 3.0 3.0 0.7632
assign ( resid 56 and name HB* ) ( resid 56 and name HD* ) 5.0 5.0 0.6
assign ( resid 56 and name HB* ) ( resid 56 and name HE3 ) 5.0 5.0 0.6
assign ( resid 56 and name HB* ) ( resid 56 and name HE3 ) 6.0 6.0 0.72
assign ( resid 56 and name HD* ) ( resid 12 and name HG2* ) 5.0 5.0 1.0
assign ( resid 56 and name HD* ) ( resid 13 and name HA ) 5.0 5.0 0.0
assign ( resid 56 and name HD* ) ( resid 14 and name HB* ) 5.0 5.0 0.6
assign ( resid 56 and name HD* ) ( resid 56 and name HB* ) 4.0 4.0 0.48
assign ( resid 56 and name HD* ) ( resid 56 and name HB* ) 5.0 5.0 0.6
assign ( resid 56 and name HE1 ) ( resid 13 and name HA ) 6.0 6.0 0.0
assign ( resid 56 and name HE1 ) ( resid 14 and name HB* ) 5.0 5.0 0.6
assign ( resid 56 and name HE1 ) ( resid 15 and name HA ) 5.0 5.0 0.0
assign ( resid 56 and name HE1 ) ( resid 16 and name HN ) 5.0 5.0 0.0
assign ( resid 56 and name HE1 ) ( resid 54 and name HN ) 3.0 3.0 0.0
assign ( resid 56 and name HE1 ) ( resid 56 and name HD* ) 4.0 4.0 0.0
assign ( resid 56 and name HE3 ) ( resid 37 and name HB* ) 3.0 3.0 0.36
assign ( resid 56 and name HE3 ) ( resid 37 and name HB* ) 4.0 4.0 0.48
assign ( resid 56 and name HE3 ) ( resid 38 and name HA ) 6.0 6.0 0.0
assign ( resid 56 and name HE3 ) ( resid 39 and name HA ) 6.0 6.0 0.0
assign ( resid 56 and name HE3 ) ( resid 56 and name HB* ) 6.0 6.0 0.72
assign ( resid 56 and name HE3 ) ( resid 56 and name HZ3 ) 4.0 4.0 0.0
assign ( resid 56 and name HH2 ) ( resid 19 and name HB ) 6.0 6.0 0.0
assign ( resid 56 and name HH2 ) ( resid 19 and name HG* ) 4.0 4.0 1.4
assign ( resid 56 and name HH2 ) ( resid 19 and name HG* ) 4.0 4.0 1.4
assign ( resid 56 and name HH2 ) ( resid 28 and name HD* ) 6.0 6.0 0.72
assign ( resid 56 and name HH2 ) ( resid 39 and name HB* ) 5.0 5.0 1.0
assign ( resid 56 and name HH2 ) ( resid 52 and name HB* ) 4.0 4.0 0.48
assign ( resid 56 and name HH2 ) ( resid 52 and name HB* ) 6.0 6.0 0.72
assign ( resid 56 and name HH2 ) ( resid 56 and name HZ2 ) 4.0 4.0 0.0
assign ( resid 56 and name HN ) ( resid 12 and name HN ) 5.0 5.0 0.0
assign ( resid 56 and name HN ) ( resid 13 and name HA ) 5.0 5.0 0.0
assign ( resid 56 and name HN ) ( resid 55 and name HA ) 5.0 5.0 0.0
assign ( resid 56 and name HN ) ( resid 55 and name HG2* ) 5.0 5.0 1.0
assign ( resid 56 and name HN ) ( resid 56 and name HB* ) 4.0 4.0 0.48
assign ( resid 56 and name HN ) ( resid 56 and name HD* ) 5.0 5.0 0.0
assign ( resid 56 and name HZ2 ) ( resid 16 and name HB* ) 5.0 5.0 0.6
assign ( resid 56 and name HZ2 ) ( resid 16 and name HB* ) 5.0 5.0 0.6
assign ( resid 56 and name HZ2 ) ( resid 19 and name HG* ) 5.0 5.0 1.75
assign ( resid 56 and name HZ2 ) ( resid 19 and name HG* ) 5.0 5.0 1.75
assign ( resid 56 and name HZ2 ) ( resid 39 and name HB* ) 6.0 6.0 1.2
assign ( resid 56 and name HZ2 ) ( resid 52 and name HB* ) 5.0 5.0 0.6
assign ( resid 56 and name HZ2 ) ( resid 53 and name HA ) 5.0 5.0 0.0
assign ( resid 56 and name HZ2 ) ( resid 56 and name HH2 ) 3.0 3.0 0.0
assign ( resid 56 and name HZ3 ) ( resid 28 and name HB* ) 6.0 6.0 0.72
assign ( resid 56 and name HZ3 ) ( resid 28 and name HG* ) 5.0 5.0 0.6
assign ( resid 56 and name HZ3 ) ( resid 29 and name HA ) 4.0 4.0 0.0
assign ( resid 56 and name HZ3 ) ( resid 52 and name HB* ) 5.0 5.0 0.6
assign ( resid 56 and name HZ3 ) ( resid 56 and name HE3 ) 4.0 4.0 0.0
assign ( resid 57 and name HA ) ( resid 11 and name HD* ) 5.0 5.0 0.0
assign ( resid 57 and name HA ) ( resid 37 and name HE3 ) 6.0 6.0 0.0
assign ( resid 57 and name HA ) ( resid 57 and name HB ) 5.0 5.0 0.0
assign ( resid 57 and name HA ) ( resid 57 and name HG* ) 4.0 4.0 1.4
assign ( resid 57 and name HA ) ( resid 58 and name HD* ) 2.5 2.5 0.3
assign ( resid 57 and name HB ) ( resid 38 and name HB* ) 5.0 5.0 0.6
assign ( resid 57 and name HB ) ( resid 57 and name HA ) 5.0 5.0 0.0
assign ( resid 57 and name HB ) ( resid 57 and name HG* ) 3.0 3.0 1.05
assign ( resid 57 and name HB ) ( resid 57 and name HG* ) 4.0 4.0 1.4
assign ( resid 57 and name HB ) ( resid 58 and name HD* ) 5.0 5.0 0.6
assign ( resid 57 and name HG* ) ( resid 11 and name HD* ) 5.0 5.0 1.75
assign ( resid 57 and name HG* ) ( resid 11 and name HD* ) 6.0 6.0 2.1
assign ( resid 57 and name HG* ) ( resid 12 and name HG2* ) 4.0 4.0 2.48
assign ( resid 57 and name HG* ) ( resid 38 and name HB* ) 6.0 6.0 3.072
assign ( resid 57 and name HG* ) ( resid 57 and name HA ) 5.0 5.0 1.75
assign ( resid 57 and name HG* ) ( resid 57 and name HA ) 5.0 5.0 1.75
assign ( resid 57 and name HG* ) ( resid 57 and name HB ) 4.0 4.0 1.4
assign ( resid 57 and name HG* ) ( resid 57 and name HB ) 4.0 4.0 1.4
assign ( resid 57 and name HG* ) ( resid 58 and name HB* ) 5.0 5.0 2.56
assign ( resid 57 and name HG* ) ( resid 58 and name HD* ) 5.0 5.0 2.56
assign ( resid 57 and name HG* ) ( resid 58 and name HD* ) 6.0 6.0 3.072
assign ( resid 57 and name HG* ) ( resid 58 and name HD* ) 6.0 6.0 3.072
assign ( resid 57 and name HN ) ( resid 12 and name HN ) 5.0 5.0 0.0
assign ( resid 57 and name HN ) ( resid 37 and name HE3 ) 5.0 5.0 0.0
assign ( resid 57 and name HN ) ( resid 38 and name HB* ) 6.0 6.0 0.72
assign ( resid 57 and name HN ) ( resid 38 and name HN ) 4.0 4.0 0.0
assign ( resid 57 and name HN ) ( resid 55 and name HG2* ) 5.0 5.0 1.0
assign ( resid 57 and name HN ) ( resid 56 and name HA ) 5.0 5.0 0.0
assign ( resid 57 and name HN ) ( resid 56 and name HB* ) 5.0 5.0 0.6
assign ( resid 57 and name HN ) ( resid 57 and name HA ) 5.0 5.0 0.0
assign ( resid 57 and name HN ) ( resid 57 and name HB ) 4.0 4.0 0.0
assign ( resid 57 and name HN ) ( resid 57 and name HG* ) 3.0 3.0 1.05
assign ( resid 57 and name HN ) ( resid 57 and name HG* ) 5.0 5.0 1.75
assign ( resid 58 and name HA ) ( resid 37 and name HA ) 3.0 3.0 0.0
assign ( resid 58 and name HA ) ( resid 37 and name HE3 ) 5.0 5.0 0.0
assign ( resid 58 and name HA ) ( resid 58 and name HB* ) 4.0 4.0 0.48
assign ( resid 58 and name HA ) ( resid 58 and name HB* ) 4.0 4.0 0.48
assign ( resid 58 and name HA ) ( resid 58 and name HG* ) 6.0 6.0 0.72
assign ( resid 58 and name HA ) ( resid 58 and name HG* ) 6.0 6.0 0.72
assign ( resid 58 and name HA ) ( resid 58 and name HG* ) 6.0 6.0 0.72
assign ( resid 58 and name HA ) ( resid 59 and name HG1* ) 5.0 5.0 1.0
assign ( resid 58 and name HB* ) ( resid 37 and name HZ2 ) 5.0 5.0 0.6
assign ( resid 58 and name HB* ) ( resid 37 and name HZ3 ) 5.0 5.0 0.6
assign ( resid 58 and name HB* ) ( resid 58 and name HA ) 5.0 5.0 0.6
assign ( resid 58 and name HB* ) ( resid 58 and name HA ) 5.0 5.0 0.6
assign ( resid 58 and name HB* ) ( resid 58 and name HB* ) 3.0 3.0 0.7632
assign ( resid 58 and name HB* ) ( resid 58 and name HB* ) 3.0 3.0 0.7632
assign ( resid 58 and name HB* ) ( resid 58 and name HD* ) 5.0 5.0 1.272
assign ( resid 58 and name HB* ) ( resid 58 and name HD* ) 5.0 5.0 1.272
assign ( resid 58 and name HB* ) ( resid 58 and name HG* ) 4.0 4.0 1.0176
assign ( resid 58 and name HB* ) ( resid 58 and name HG* ) 5.0 5.0 1.272
assign ( resid 58 and name HB* ) ( resid 58 and name HG* ) 5.0 5.0 1.272
assign ( resid 58 and name HB* ) ( resid 58 and name HG* ) 5.0 5.0 1.272
assign ( resid 58 and name HB* ) ( resid 7 and name HB* ) 4.0 4.0 1.0176
assign ( resid 58 and name HB* ) ( resid 7 and name HB* ) 6.0 6.0 1.5264
assign ( resid 58 and name HD* ) ( resid 11 and name HA ) 5.0 5.0 0.6
assign ( resid 58 and name HD* ) ( resid 11 and name HB* ) 6.0 6.0 1.5264
assign ( resid 58 and name HD* ) ( resid 11 and name HB* ) 6.0 6.0 1.5264
assign ( resid 58 and name HD* ) ( resid 11 and name HD* ) 4.0 4.0 0.48
assign ( resid 58 and name HD* ) ( resid 37 and name HB* ) 5.0 5.0 1.272
assign ( resid 58 and name HD* ) ( resid 37 and name HE3 ) 4.0 4.0 0.48
assign ( resid 58 and name HD* ) ( resid 37 and name HZ3 ) 4.0 4.0 0.48
assign ( resid 58 and name HD* ) ( resid 57 and name HA ) 3.0 3.0 0.36
assign ( resid 58 and name HD* ) ( resid 57 and name HG* ) 4.0 4.0 2.048
assign ( resid 58 and name HD* ) ( resid 58 and name HB* ) 5.0 5.0 1.272
assign ( resid 58 and name HD* ) ( resid 58 and name HB* ) 5.0 5.0 1.272
assign ( resid 58 and name HD* ) ( resid 58 and name HG* ) 3.0 3.0 0.7632
assign ( resid 58 and name HD* ) ( resid 58 and name HG* ) 4.0 4.0 1.0176
assign ( resid 58 and name HG* ) ( resid 10 and name HD* ) 4.0 4.0 1.0176
assign ( resid 58 and name HG* ) ( resid 11 and name HB* ) 5.0 5.0 1.272
assign ( resid 58 and name HG* ) ( resid 11 and name HD* ) 5.0 5.0 0.6
assign ( resid 58 and name HG* ) ( resid 11 and name HD* ) 6.0 6.0 0.72
assign ( resid 58 and name HG* ) ( resid 57 and name HG* ) 5.0 5.0 2.56
assign ( resid 58 and name HG* ) ( resid 57 and name HG* ) 6.0 6.0 3.072
assign ( resid 58 and name HG* ) ( resid 58 and name HB* ) 5.0 5.0 1.272
assign ( resid 58 and name HG* ) ( resid 58 and name HB* ) 5.0 5.0 1.272
assign ( resid 58 and name HG* ) ( resid 58 and name HB* ) 5.0 5.0 1.272
assign ( resid 58 and name HG* ) ( resid 58 and name HB* ) 5.0 5.0 1.272
assign ( resid 58 and name HG* ) ( resid 58 and name HD* ) 4.0 4.0 1.0176
assign ( resid 58 and name HG* ) ( resid 58 and name HD* ) 4.0 4.0 1.0176
assign ( resid 58 and name HG* ) ( resid 58 and name HG* ) 2.5 2.5 0.636
assign ( resid 59 and name HA ) ( resid 59 and name HB ) 5.0 5.0 0.0
assign ( resid 59 and name HA ) ( resid 59 and name HG2* ) 4.0 4.0 0.8
assign ( resid 59 and name HA ) ( resid 7 and name HD* ) 5.0 5.0 1.75
assign ( resid 59 and name HB ) ( resid 59 and name HA ) 5.0 5.0 0.0
assign ( resid 59 and name HB ) ( resid 59 and name HG1* ) 5.0 5.0 1.0
assign ( resid 59 and name HB ) ( resid 59 and name HG2* ) 3.0 3.0 0.6
assign ( resid 59 and name HB ) ( resid 64 and name HB* ) 5.0 5.0 0.6
assign ( resid 59 and name HB ) ( resid 65 and name HG* ) 6.0 6.0 0.0
assign ( resid 59 and name HD* ) ( resid 29 and name HD* ) 4.0 4.0 1.376
assign ( resid 59 and name HD* ) ( resid 29 and name HE* ) 4.0 4.0 1.376
assign ( resid 59 and name HD* ) ( resid 37 and name HB* ) 5.0 5.0 1.72
assign ( resid 59 and name HD* ) ( resid 38 and name HB* ) 5.0 5.0 1.72
assign ( resid 59 and name HD* ) ( resid 59 and name HB ) 5.0 5.0 1.0
assign ( resid 59 and name HG1* ) ( resid 27 and name HB* ) 5.0 5.0 1.72
assign ( resid 59 and name HG1* ) ( resid 29 and name HD* ) 6.0 6.0 2.064
assign ( resid 59 and name HG1* ) ( resid 29 and name HE* ) 6.0 6.0 2.064
assign ( resid 59 and name HG1* ) ( resid 36 and name HB* ) 5.0 5.0 1.72
assign ( resid 59 and name HG1* ) ( resid 36 and name HB* ) 6.0 6.0 2.064
assign ( resid 59 and name HG1* ) ( resid 36 and name HG ) 5.0 5.0 1.0
assign ( resid 59 and name HG1* ) ( resid 36 and name HG ) 6.0 6.0 1.2
assign ( resid 59 and name HG1* ) ( resid 37 and name HA ) 6.0 6.0 1.2
assign ( resid 59 and name HG1* ) ( resid 38 and name HB* ) 6.0 6.0 2.064
assign ( resid 59 and name HG1* ) ( resid 57 and name HG* ) 5.0 5.0 3.1
assign ( resid 59 and name HG1* ) ( resid 59 and name HB ) 5.0 5.0 1.0
assign ( resid 59 and name HG1* ) ( resid 59 and name HB ) 5.0 5.0 1.0
assign ( resid 59 and name HG1* ) ( resid 59 and name HB ) 6.0 6.0 1.2
assign ( resid 59 and name HG1* ) ( resid 59 and name HG1* ) 2.5 2.5 1.1
assign ( resid 59 and name HG1* ) ( resid 60 and name HA* ) 6.0 6.0 2.064
assign ( resid 59 and name HG1* ) ( resid 60 and name HA* ) 6.0 6.0 2.064
assign ( resid 59 and name HG1* ) ( resid 62 and name HA ) 6.0 6.0 1.2
assign ( resid 59 and name HG2* ) ( resid 29 and name HD* ) 5.0 5.0 1.72
assign ( resid 59 and name HG2* ) ( resid 59 and name HA ) 5.0 5.0 1.0
assign ( resid 59 and name HG2* ) ( resid 59 and name HB ) 4.0 4.0 0.8
assign ( resid 59 and name HG2* ) ( resid 66 and name HB* ) 6.0 6.0 2.064
assign ( resid 59 and name HG2* ) ( resid 66 and name HB* ) 6.0 6.0 2.064
assign ( resid 59 and name HN ) ( resid 36 and name HG ) 6.0 6.0 0.0
assign ( resid 59 and name HN ) ( resid 37 and name HA ) 5.0 5.0 0.0
assign ( resid 59 and name HN ) ( resid 58 and name HA ) 3.0 3.0 0.0
assign ( resid 59 and name HN ) ( resid 58 and name HB* ) 5.0 5.0 0.6
assign ( resid 59 and name HN ) ( resid 59 and name HD* ) 2.5 2.5 0.5
assign ( resid 59 and name HN ) ( resid 59 and name HG1* ) 4.0 4.0 0.8
assign ( resid 59 and name HN ) ( resid 59 and name HG1* ) 4.0 4.0 0.8
assign ( resid 59 and name HN ) ( resid 60 and name HN ) 3.0 3.0 0.0
assign ( resid 59 and name HN ) ( resid 7 and name HA ) 6.0 6.0 0.0
assign ( resid 6 and name HA ) ( resid 2 and name HB ) 6.0 6.0 0.0
assign ( resid 6 and name HA ) ( resid 6 and name HB* ) 4.0 4.0 0.48
assign ( resid 6 and name HA ) ( resid 6 and name HB* ) 4.0 4.0 0.48
assign ( resid 6 and name HA ) ( resid 9 and name HB* ) 4.0 4.0 0.48
assign ( resid 6 and name HA ) ( resid 9 and name HD* ) 4.0 4.0 0.48
assign ( resid 6 and name HA ) ( resid 9 and name HE* ) 5.0 5.0 0.6
assign ( resid 6 and name HA ) ( resid 9 and name HE* ) 5.0 5.0 0.6
assign ( resid 6 and name HA ) ( resid 9 and name HG* ) 6.0 6.0 0.72
assign ( resid 6 and name HB* ) ( resid 3 and name HA ) 6.0 6.0 0.72
assign ( resid 6 and name HB* ) ( resid 3 and name HA ) 6.0 6.0 0.72
assign ( resid 6 and name HB* ) ( resid 3 and name HG* ) 5.0 5.0 2.56
assign ( resid 6 and name HB* ) ( resid 35 and name HB* ) 5.0 5.0 1.272
assign ( resid 6 and name HB* ) ( resid 35 and name HB* ) 5.0 5.0 1.272
assign ( resid 6 and name HB* ) ( resid 35 and name HB* ) 6.0 6.0 1.5264
assign ( resid 6 and name HB* ) ( resid 6 and name HA ) 5.0 5.0 0.6
assign ( resid 6 and name HB* ) ( resid 6 and name HA ) 5.0 5.0 0.6
assign ( resid 6 and name HB* ) ( resid 6 and name HB* ) 2.5 2.5 0.636
assign ( resid 6 and name HB* ) ( resid 6 and name HB* ) 3.0 3.0 0.7632
assign ( resid 6 and name HB* ) ( resid 61 and name HA ) 6.0 6.0 0.72
assign ( resid 6 and name HB* ) ( resid 7 and name HA ) 5.0 5.0 0.6
assign ( resid 6 and name HB* ) ( resid 7 and name HA ) 5.0 5.0 0.6
assign ( resid 6 and name HB* ) ( resid 9 and name HD* ) 5.0 5.0 1.272
assign ( resid 6 and name HB* ) ( resid 9 and name HE* ) 5.0 5.0 1.272
assign ( resid 6 and name HN ) ( resid 2 and name HA ) 5.0 5.0 0.0
assign ( resid 6 and name HN ) ( resid 3 and name HA ) 5.0 5.0 0.0
assign ( resid 6 and name HN ) ( resid 3 and name HB ) 6.0 6.0 0.0
assign ( resid 6 and name HN ) ( resid 3 and name HG* ) 6.0 6.0 2.1
assign ( resid 6 and name HN ) ( resid 3 and name HN ) 6.0 6.0 0.0
assign ( resid 6 and name HN ) ( resid 4 and name HN ) 5.0 5.0 0.0
assign ( resid 6 and name HN ) ( resid 5 and name HA ) 6.0 6.0 0.0
assign ( resid 6 and name HN ) ( resid 5 and name HB* ) 5.0 5.0 0.6
assign ( resid 6 and name HN ) ( resid 5 and name HN ) 4.0 4.0 0.0
assign ( resid 6 and name HN ) ( resid 5 and name HN ) 4.0 4.0 0.0
assign ( resid 6 and name HN ) ( resid 6 and name HA ) 5.0 5.0 0.0
assign ( resid 6 and name HN ) ( resid 6 and name HB* ) 3.0 3.0 0.36
assign ( resid 6 and name HN ) ( resid 6 and name HB* ) 4.0 4.0 0.48
assign ( resid 6 and name HN ) ( resid 7 and name HB* ) 5.0 5.0 0.6
assign ( resid 6 and name HN ) ( resid 7 and name HB* ) 6.0 6.0 0.72
assign ( resid 6 and name HN ) ( resid 7 and name HD* ) 6.0 6.0 2.1
assign ( resid 6 and name HN ) ( resid 7 and name HN ) 4.0 4.0 0.0
assign ( resid 6 and name HN ) ( resid 9 and name HG* ) 6.0 6.0 0.72
assign ( resid 60 and name HA* ) ( resid 3 and name HG* ) 5.0 5.0 2.56
assign ( resid 60 and name HA* ) ( resid 3 and name HG* ) 5.0 5.0 2.56
assign ( resid 60 and name HA* ) ( resid 3 and name HG* ) 5.0 5.0 2.56
assign ( resid 60 and name HA* ) ( resid 3 and name HG* ) 5.0 5.0 2.56
assign ( resid 60 and name HA* ) ( resid 60 and name HA* ) 2.5 2.5 0.636
assign ( resid 60 and name HA* ) ( resid 60 and name HA* ) 2.5 2.5 0.636
assign ( resid 60 and name HA* ) ( resid 7 and name HD* ) 6.0 6.0 3.072
assign ( resid 60 and name HA* ) ( resid 7 and name HD* ) 6.0 6.0 3.072
assign ( resid 60 and name HN ) ( resid 36 and name HB* ) 4.0 4.0 0.48
assign ( resid 60 and name HN ) ( resid 36 and name HB* ) 5.0 5.0 0.6
assign ( resid 60 and name HN ) ( resid 36 and name HN ) 5.0 5.0 0.0
assign ( resid 60 and name HN ) ( resid 37 and name HA ) 6.0 6.0 0.0
assign ( resid 60 and name HN ) ( resid 58 and name HA ) 5.0 5.0 0.0
assign ( resid 60 and name HN ) ( resid 59 and name HB ) 5.0 5.0 0.0
assign ( resid 60 and name HN ) ( resid 59 and name HG1* ) 5.0 5.0 1.0
assign ( resid 60 and name HN ) ( resid 59 and name HG1* ) 5.0 5.0 1.0
assign ( resid 60 and name HN ) ( resid 59 and name HN ) 2.5 2.5 0.0
assign ( resid 60 and name HN ) ( resid 6 and name HB* ) 5.0 5.0 0.6
assign ( resid 60 and name HN ) ( resid 6 and name HB* ) 6.0 6.0 0.72
assign ( resid 60 and name HN ) ( resid 60 and name HA* ) 5.0 5.0 0.6
assign ( resid 60 and name HN ) ( resid 60 and name HA* ) 5.0 5.0 0.6
assign ( resid 60 and name HN ) ( resid 61 and name HN ) 6.0 6.0 0.0
assign ( resid 60 and name HN ) ( resid 7 and name HD* ) 5.0 5.0 1.75
assign ( resid 61 and name HA ) ( resid 1 and name HA ) 6.0 6.0 0.0
assign ( resid 61 and name HA ) ( resid 35 and name HA ) 4.0 4.0 0.0
assign ( resid 61 and name HA ) ( resid 6 and name HA ) 6.0 6.0 0.0
assign ( resid 61 and name HA ) ( resid 61 and name HB ) 3.0 3.0 0.0
assign ( resid 61 and name HA ) ( resid 61 and name HD* ) 3.0 3.0 1.05
assign ( resid 61 and name HA ) ( resid 61 and name HD* ) 6.0 6.0 2.1
assign ( resid 61 and name HB* ) ( resid 61 and name HA ) 4.0 4.0 0.48
assign ( resid 61 and name HB* ) ( resid 61 and name HA ) 4.0 4.0 0.48
assign ( resid 61 and name HB* ) ( resid 61 and name HD* ) 3.0 3.0 1.536
assign ( resid 61 and name HB* ) ( resid 61 and name HD* ) 4.0 4.0 2.048
assign ( resid 61 and name HB* ) ( resid 61 and name HD* ) 4.0 4.0 2.048
assign ( resid 61 and name HB* ) ( resid 61 and name HD* ) 4.0 4.0 2.048
assign ( resid 61 and name HB* ) ( resid 64 and name HB* ) 6.0 6.0 1.5264
assign ( resid 61 and name HB* ) ( resid 64 and name HG* ) 6.0 6.0 1.5264
assign ( resid 61 and name HB* ) ( resid 64 and name HG* ) 6.0 6.0 1.5264
assign ( resid 61 and name HD* ) ( resid 1 and name HB* ) 6.0 6.0 3.072
assign ( resid 61 and name HD* ) ( resid 61 and name HA ) 4.0 4.0 1.4
assign ( resid 61 and name HD* ) ( resid 61 and name HB* ) 5.0 5.0 2.56
assign ( resid 61 and name HD* ) ( resid 61 and name HG ) 4.0 4.0 1.4
assign ( resid 61 and name HN ) ( resid 3 and name HA ) 6.0 6.0 0.0
assign ( resid 61 and name HN ) ( resid 3 and name HG* ) 4.0 4.0 1.4
assign ( resid 61 and name HN ) ( resid 60 and name HA* ) 5.0 5.0 0.6
assign ( resid 61 and name HN ) ( resid 60 and name HA* ) 5.0 5.0 0.6
assign ( resid 61 and name HN ) ( resid 61 and name HA ) 6.0 6.0 0.0
assign ( resid 61 and name HN ) ( resid 61 and name HB* ) 4.0 4.0 0.48
assign ( resid 61 and name HN ) ( resid 61 and name HD* ) 5.0 5.0 1.75
assign ( resid 61 and name HN ) ( resid 61 and name HD* ) 5.0 5.0 1.75
assign ( resid 61 and name HN ) ( resid 61 and name HG ) 2.5 2.5 0.0
assign ( resid 62 and name HA ) ( resid 34 and name HA* ) 6.0 6.0 0.72
assign ( resid 62 and name HA ) ( resid 35 and name HA ) 5.0 5.0 0.0
assign ( resid 62 and name HA ) ( resid 36 and name HA ) 5.0 5.0 0.0
assign ( resid 62 and name HA ) ( resid 36 and name HB* ) 4.0 4.0 0.48
assign ( resid 62 and name HA ) ( resid 36 and name HB* ) 5.0 5.0 0.6
assign ( resid 62 and name HA ) ( resid 36 and name HG ) 6.0 6.0 0.0
assign ( resid 62 and name HA ) ( resid 61 and name HD* ) 6.0 6.0 2.1
assign ( resid 62 and name HA ) ( resid 62 and name HB* ) 3.0 3.0 0.6
assign ( resid 62 and name HB* ) ( resid 31 and name HA ) 6.0 6.0 1.2
assign ( resid 62 and name HB* ) ( resid 31 and name HB* ) 5.0 5.0 1.72
assign ( resid 62 and name HB* ) ( resid 34 and name HA* ) 6.0 6.0 2.064
assign ( resid 62 and name HB* ) ( resid 34 and name HA* ) 6.0 6.0 2.064
assign ( resid 62 and name HB* ) ( resid 36 and name HB* ) 6.0 6.0 2.064
assign ( resid 62 and name HB* ) ( resid 36 and name HD* ) 5.0 5.0 3.1
assign ( resid 62 and name HB* ) ( resid 62 and name HA ) 4.0 4.0 0.8
assign ( resid 62 and name HN ) ( resid 35 and name HA ) 5.0 5.0 0.0
assign ( resid 62 and name HN ) ( resid 36 and name HN ) 6.0 6.0 0.0
assign ( resid 62 and name HN ) ( resid 60 and name HN ) 5.0 5.0 0.0
assign ( resid 62 and name HN ) ( resid 61 and name HA ) 5.0 5.0 0.0
assign ( resid 62 and name HN ) ( resid 61 and name HB* ) 4.0 4.0 0.48
assign ( resid 62 and name HN ) ( resid 61 and name HD* ) 5.0 5.0 1.75
assign ( resid 62 and name HN ) ( resid 61 and name HG ) 4.0 4.0 0.0
assign ( resid 62 and name HN ) ( resid 62 and name HA ) 5.0 5.0 0.0
assign ( resid 62 and name HN ) ( resid 62 and name HB* ) 3.0 3.0 0.6
assign ( resid 62 and name HN ) ( resid 63 and name HN ) 6.0 6.0 0.0
assign ( resid 63 and name HA ) ( resid 31 and name HB* ) 6.0 6.0 0.72
assign ( resid 63 and name HA ) ( resid 63 and name HB ) 5.0 5.0 0.0
assign ( resid 63 and name HA ) ( resid 63 and name HG1* ) 5.0 5.0 1.0
assign ( resid 63 and name HA ) ( resid 63 and name HG1* ) 6.0 6.0 1.2
assign ( resid 63 and name HA ) ( resid 63 and name HG2* ) 5.0 5.0 1.0
assign ( resid 63 and name HA ) ( resid 64 and name HD* ) 4.0 4.0 0.48
assign ( resid 63 and name HA ) ( resid 64 and name HD* ) 5.0 5.0 0.6
assign ( resid 63 and name HB ) ( resid 36 and name HD* ) 5.0 5.0 1.75
assign ( resid 63 and name HB ) ( resid 63 and name HA ) 6.0 6.0 0.0
assign ( resid 63 and name HB ) ( resid 63 and name HG1* ) 2.5 2.5 0.5
assign ( resid 63 and name HB ) ( resid 63 and name HG1* ) 5.0 5.0 1.0
assign ( resid 63 and name HB ) ( resid 64 and name HD* ) 5.0 5.0 0.6
assign ( resid 63 and name HB ) ( resid 64 and name HD* ) 5.0 5.0 0.6
assign ( resid 63 and name HB* ) ( resid 63 and name HD* ) 4.0 4.0 0.8
assign ( resid 63 and name HD* ) ( resid 20 and name HH2 ) 6.0 6.0 1.2
assign ( resid 63 and name HD* ) ( resid 20 and name HZ2 ) 5.0 5.0 1.0
assign ( resid 63 and name HD* ) ( resid 63 and name HB ) 6.0 6.0 1.2
assign ( resid 63 and name HD* ) ( resid 63 and name HG1* ) 3.0 3.0 1.32
assign ( resid 63 and name HD* ) ( resid 63 and name HG1* ) 5.0 5.0 2.2
assign ( resid 63 and name HG1* ) ( resid 31 and name HB* ) 6.0 6.0 2.064
assign ( resid 63 and name HG1* ) ( resid 36 and name HB* ) 5.0 5.0 1.72
assign ( resid 63 and name HG1* ) ( resid 63 and name HA ) 5.0 5.0 1.0
assign ( resid 63 and name HG1* ) ( resid 63 and name HB ) 4.0 4.0 0.8
assign ( resid 63 and name HG1* ) ( resid 63 and name HB ) 5.0 5.0 1.0
assign ( resid 63 and name HG1* ) ( resid 63 and name HD* ) 4.0 4.0 1.76
assign ( resid 63 and name HG1* ) ( resid 63 and name HD* ) 4.0 4.0 1.76
assign ( resid 63 and name HG1* ) ( resid 63 and name HG1* ) 3.0 3.0 1.32
assign ( resid 63 and name HG1* ) ( resid 63 and name HG1* ) 4.0 4.0 1.76
assign ( resid 63 and name HG1* ) ( resid 63 and name HG2* ) 5.0 5.0 2.2
assign ( resid 63 and name HG2* ) ( resid 63 and name HA ) 6.0 6.0 1.2
assign ( resid 63 and name HG2* ) ( resid 63 and name HB ) 5.0 5.0 1.0
assign ( resid 63 and name HG2* ) ( resid 63 and name HB ) 6.0 6.0 1.2
assign ( resid 63 and name HG2* ) ( resid 63 and name HD* ) 2.5 2.5 1.1
assign ( resid 63 and name HG2* ) ( resid 63 and name HG1* ) 4.0 4.0 1.76
assign ( resid 63 and name HG2* ) ( resid 64 and name HB* ) 5.0 5.0 1.72
assign ( resid 63 and name HG2* ) ( resid 65 and name HB* ) 6.0 6.0 2.064
assign ( resid 63 and name HN ) ( resid 20 and name HH2 ) 5.0 5.0 0.0
assign ( resid 63 and name HN ) ( resid 36 and name HD* ) 5.0 5.0 1.75
assign ( resid 63 and name HN ) ( resid 36 and name HG ) 5.0 5.0 0.0
assign ( resid 63 and name HN ) ( resid 62 and name HA ) 4.0 4.0 0.0
assign ( resid 63 and name HN ) ( resid 63 and name HB ) 5.0 5.0 0.0
assign ( resid 63 and name HN ) ( resid 63 and name HD* ) 5.0 5.0 1.0
assign ( resid 63 and name HN ) ( resid 63 and name HG1* ) 4.0 4.0 0.8
assign ( resid 63 and name HN ) ( resid 63 and name HG1* ) 5.0 5.0 1.0
assign ( resid 63 and name HN ) ( resid 63 and name HG2* ) 5.0 5.0 1.0
assign ( resid 64 and name HA ) ( resid 25 and name HB ) 5.0 5.0 0.0
assign ( resid 64 and name HA ) ( resid 64 and name HB* ) 4.0 4.0 0.48
assign ( resid 64 and name HA ) ( resid 64 and name HB* ) 4.0 4.0 0.48
assign ( resid 64 and name HA ) ( resid 64 and name HG* ) 5.0 5.0 0.6
assign ( resid 64 and name HB* ) ( resid 64 and name HA ) 4.0 4.0 0.48
assign ( resid 64 and name HB* ) ( resid 64 and name HA ) 5.0 5.0 0.6
assign ( resid 64 and name HB* ) ( resid 64 and name HB* ) 3.0 3.0 0.7632
assign ( resid 64 and name HB* ) ( resid 64 and name HB* ) 3.0 3.0 0.7632
assign ( resid 64 and name HB* ) ( resid 64 and name HD* ) 5.0 5.0 1.272
assign ( resid 64 and name HB* ) ( resid 64 and name HD* ) 5.0 5.0 1.272
assign ( resid 64 and name HB* ) ( resid 64 and name HD* ) 6.0 6.0 1.5264
assign ( resid 64 and name HB* ) ( resid 64 and name HD* ) 6.0 6.0 1.5264
assign ( resid 64 and name HB* ) ( resid 64 and name HG* ) 4.0 4.0 1.0176
assign ( resid 64 and name HD* ) ( resid 61 and name HA ) 6.0 6.0 0.72
assign ( resid 64 and name HD* ) ( resid 63 and name HA ) 4.0 4.0 0.48
assign ( resid 64 and name HD* ) ( resid 63 and name HA ) 5.0 5.0 0.6
assign ( resid 64 and name HD* ) ( resid 63 and name HG2* ) 5.0 5.0 1.72
assign ( resid 64 and name HD* ) ( resid 63 and name HG2* ) 5.0 5.0 1.72
assign ( resid 64 and name HD* ) ( resid 64 and name HA ) 5.0 5.0 0.6
assign ( resid 64 and name HD* ) ( resid 64 and name HA ) 6.0 6.0 0.72
assign ( resid 64 and name HD* ) ( resid 64 and name HB* ) 5.0 5.0 1.272
assign ( resid 64 and name HD* ) ( resid 64 and name HB* ) 6.0 6.0 1.5264
assign ( resid 64 and name HD* ) ( resid 64 and name HD* ) 2.5 2.5 0.636
assign ( resid 64 and name HD* ) ( resid 64 and name HD* ) 3.0 3.0 0.7632
assign ( resid 64 and name HD* ) ( resid 64 and name HG* ) 3.0 3.0 0.7632
assign ( resid 64 and name HD* ) ( resid 64 and name HG* ) 4.0 4.0 1.0176
assign ( resid 64 and name HD* ) ( resid 64 and name HG* ) 4.0 4.0 1.0176
assign ( resid 64 and name HD* ) ( resid 64 and name HG* ) 4.0 4.0 1.0176
assign ( resid 64 and name HG* ) ( resid 61 and name HB* ) 5.0 5.0 1.272
assign ( resid 64 and name HG* ) ( resid 61 and name HB* ) 5.0 5.0 1.272
assign ( resid 64 and name HG* ) ( resid 64 and name HA ) 5.0 5.0 0.6
assign ( resid 64 and name HG* ) ( resid 64 and name HA ) 6.0 6.0 0.72
assign ( resid 64 and name HG* ) ( resid 64 and name HB* ) 3.0 3.0 0.7632
assign ( resid 64 and name HG* ) ( resid 64 and name HB* ) 3.0 3.0 0.7632
assign ( resid 64 and name HG* ) ( resid 64 and name HD* ) 4.0 4.0 1.0176
assign ( resid 64 and name HG* ) ( resid 64 and name HD* ) 4.0 4.0 1.0176
assign ( resid 64 and name HG* ) ( resid 64 and name HD* ) 4.0 4.0 1.0176
assign ( resid 64 and name HG* ) ( resid 64 and name HD* ) 5.0 5.0 1.272
assign ( resid 65 and name HA ) ( resid 65 and name HB* ) 5.0 5.0 0.6
assign ( resid 65 and name HA ) ( resid 65 and name HG* ) 5.0 5.0 0.0
assign ( resid 65 and name HB* ) ( resid 26 and name HB* ) 4.0 4.0 1.0176
assign ( resid 65 and name HB* ) ( resid 65 and name HA ) 5.0 5.0 0.6
assign ( resid 65 and name HB* ) ( resid 65 and name HA ) 5.0 5.0 0.6
assign ( resid 65 and name HB* ) ( resid 65 and name HG* ) 3.0 3.0 0.36
assign ( resid 65 and name HB* ) ( resid 65 and name HG* ) 4.0 4.0 0.48
assign ( resid 65 and name HB* ) ( resid 67 and name HB* ) 5.0 5.0 1.72
assign ( resid 65 and name HG* ) ( resid 59 and name HG1* ) 6.0 6.0 1.2
assign ( resid 65 and name HG* ) ( resid 65 and name HA ) 5.0 5.0 0.0
assign ( resid 65 and name HG* ) ( resid 65 and name HB* ) 3.0 3.0 0.36
assign ( resid 65 and name HN ) ( resid 63 and name HG2* ) 5.0 5.0 1.0
assign ( resid 65 and name HN ) ( resid 64 and name HA ) 4.0 4.0 0.0
assign ( resid 65 and name HN ) ( resid 64 and name HB* ) 5.0 5.0 0.6
assign ( resid 65 and name HN ) ( resid 64 and name HD* ) 5.0 5.0 0.6
assign ( resid 65 and name HN ) ( resid 64 and name HG* ) 5.0 5.0 0.6
assign ( resid 65 and name HN ) ( resid 65 and name HA ) 4.0 4.0 0.0
assign ( resid 65 and name HN ) ( resid 65 and name HB* ) 4.0 4.0 0.48
assign ( resid 65 and name HN ) ( resid 65 and name HG* ) 5.0 5.0 0.0
assign ( resid 66 and name HA ) ( resid 66 and name HB* ) 5.0 5.0 0.6
assign ( resid 66 and name HA ) ( resid 66 and name HB* ) 6.0 6.0 0.72
assign ( resid 66 and name HB* ) ( resid 27 and name HB* ) 5.0 5.0 1.272
assign ( resid 66 and name HB* ) ( resid 27 and name HB* ) 5.0 5.0 1.272
assign ( resid 66 and name HB* ) ( resid 27 and name HB* ) 5.0 5.0 1.272
assign ( resid 66 and name HB* ) ( resid 27 and name HB* ) 5.0 5.0 1.272
assign ( resid 66 and name HB* ) ( resid 59 and name HG2* ) 5.0 5.0 1.72
assign ( resid 66 and name HB* ) ( resid 59 and name HG2* ) 6.0 6.0 2.064
assign ( resid 66 and name HB* ) ( resid 65 and name HB* ) 6.0 6.0 1.5264
assign ( resid 66 and name HB* ) ( resid 66 and name HA ) 5.0 5.0 0.6
assign ( resid 66 and name HB* ) ( resid 66 and name HA ) 6.0 6.0 0.72
assign ( resid 66 and name HN ) ( resid 65 and name HA ) 5.0 5.0 0.0
assign ( resid 66 and name HN ) ( resid 66 and name HB* ) 5.0 5.0 0.6
assign ( resid 67 and name HA ) ( resid 67 and name HB* ) 6.0 6.0 1.2
assign ( resid 67 and name HN ) ( resid 65 and name HA ) 5.0 5.0 0.0
assign ( resid 67 and name HN ) ( resid 65 and name HN ) 5.0 5.0 0.0
assign ( resid 68 and name HN ) ( resid 68 and name HA ) 4.0 4.0 0.0
assign ( resid 68 and name HN ) ( resid 68 and name HB* ) 4.0 4.0 0.8
assign ( resid 69 and name HB* ) ( resid 69 and name HA ) 5.0 5.0 1.0
assign ( resid 69 and name HN ) ( resid 65 and name HN ) 5.0 5.0 0.0
assign ( resid 69 and name HN ) ( resid 69 and name HB* ) 4.0 4.0 0.8
assign ( resid 69 and name HN ) ( resid 69 and name HB* ) 4.0 4.0 0.8
assign ( resid 69 and name HN ) ( resid 70 and name HN ) 5.0 5.0 0.0
assign ( resid 7 and name HA ) ( resid 5 and name HA ) 6.0 6.0 0.0
assign ( resid 7 and name HA ) ( resid 58 and name HB* ) 5.0 5.0 0.6
assign ( resid 7 and name HA ) ( resid 58 and name HB* ) 5.0 5.0 0.6
assign ( resid 7 and name HA ) ( resid 58 and name HG* ) 5.0 5.0 0.6
assign ( resid 7 and name HA ) ( resid 7 and name HB* ) 4.0 4.0 0.48
assign ( resid 7 and name HA ) ( resid 7 and name HB* ) 4.0 4.0 0.48
assign ( resid 7 and name HA ) ( resid 7 and name HD* ) 3.0 3.0 1.05
assign ( resid 7 and name HA ) ( resid 7 and name HD* ) 6.0 6.0 2.1
assign ( resid 7 and name HA ) ( resid 9 and name HB* ) 6.0 6.0 0.72
assign ( resid 7 and name HA ) ( resid 9 and name HB* ) 6.0 6.0 0.72
assign ( resid 7 and name HA ) ( resid 9 and name HD* ) 6.0 6.0 0.72
assign ( resid 7 and name HB* ) ( resid 3 and name HG* ) 5.0 5.0 2.56
assign ( resid 7 and name HB* ) ( resid 3 and name HG* ) 5.0 5.0 2.56
assign ( resid 7 and name HB* ) ( resid 3 and name HG* ) 5.0 5.0 2.56
assign ( resid 7 and name HB* ) ( resid 3 and name HG* ) 5.0 5.0 2.56
assign ( resid 7 and name HB* ) ( resid 3 and name HG* ) 6.0 6.0 3.072
assign ( resid 7 and name HB* ) ( resid 4 and name HA ) 5.0 5.0 0.6
assign ( resid 7 and name HB* ) ( resid 7 and name HA ) 4.0 4.0 0.48
assign ( resid 7 and name HB* ) ( resid 7 and name HA ) 5.0 5.0 0.6
assign ( resid 7 and name HB* ) ( resid 7 and name HA ) 5.0 5.0 0.6
assign ( resid 7 and name HB* ) ( resid 7 and name HA ) 5.0 5.0 0.6
assign ( resid 7 and name HB* ) ( resid 7 and name HB* ) 2.5 2.5 0.636
assign ( resid 7 and name HB* ) ( resid 7 and name HB* ) 2.5 2.5 0.636
assign ( resid 7 and name HB* ) ( resid 7 and name HB* ) 3.0 3.0 0.7632
assign ( resid 7 and name HB* ) ( resid 7 and name HB* ) 3.0 3.0 0.7632
assign ( resid 7 and name HB* ) ( resid 7 and name HD* ) 4.0 4.0 2.048
assign ( resid 7 and name HB* ) ( resid 7 and name HD* ) 4.0 4.0 2.048
assign ( resid 7 and name HB* ) ( resid 7 and name HD* ) 5.0 5.0 2.56
assign ( resid 7 and name HB* ) ( resid 7 and name HD* ) 5.0 5.0 2.56
assign ( resid 7 and name HB* ) ( resid 7 and name HD* ) 5.0 5.0 2.56
assign ( resid 7 and name HB* ) ( resid 7 and name HD* ) 5.0 5.0 2.56
assign ( resid 7 and name HB* ) ( resid 7 and name HD* ) 5.0 5.0 2.56
assign ( resid 7 and name HB* ) ( resid 7 and name HD* ) 6.0 6.0 3.072
assign ( resid 7 and name HB* ) ( resid 9 and name HB* ) 5.0 5.0 1.272
assign ( resid 7 and name HD* ) ( resid 3 and name HG* ) 3.0 3.0 2.4675
assign ( resid 7 and name HD* ) ( resid 4 and name HA ) 5.0 5.0 1.75
assign ( resid 7 and name HD* ) ( resid 59 and name HA ) 6.0 6.0 2.1
assign ( resid 7 and name HD* ) ( resid 7 and name HA ) 4.0 4.0 1.4
assign ( resid 7 and name HD* ) ( resid 7 and name HA ) 6.0 6.0 2.1
assign ( resid 7 and name HD* ) ( resid 7 and name HB* ) 4.0 4.0 2.048
assign ( resid 7 and name HD* ) ( resid 7 and name HB* ) 5.0 5.0 2.56
assign ( resid 7 and name HD* ) ( resid 7 and name HD* ) 2.5 2.5 2.05625
assign ( resid 7 and name HD* ) ( resid 7 and name HG ) 4.0 4.0 1.4
assign ( resid 7 and name HD* ) ( resid 7 and name HG ) 4.0 4.0 1.4
assign ( resid 7 and name HG ) ( resid 3 and name HG* ) 5.0 5.0 1.75
assign ( resid 7 and name HG ) ( resid 7 and name HA ) 5.0 5.0 0.0
assign ( resid 7 and name HG ) ( resid 7 and name HB* ) 4.0 4.0 0.48
assign ( resid 7 and name HG ) ( resid 7 and name HD* ) 4.0 4.0 1.4
assign ( resid 7 and name HG ) ( resid 7 and name HD* ) 4.0 4.0 1.4
assign ( resid 7 and name HN ) ( resid 3 and name HA ) 6.0 6.0 0.0
assign ( resid 7 and name HN ) ( resid 3 and name HG* ) 6.0 6.0 2.1
assign ( resid 7 and name HN ) ( resid 3 and name HG* ) 6.0 6.0 2.1
assign ( resid 7 and name HN ) ( resid 4 and name HA ) 5.0 5.0 0.0
assign ( resid 7 and name HN ) ( resid 4 and name HB* ) 6.0 6.0 0.72
assign ( resid 7 and name HN ) ( resid 5 and name HN ) 5.0 5.0 0.0
assign ( resid 7 and name HN ) ( resid 6 and name HB* ) 4.0 4.0 0.48
assign ( resid 7 and name HN ) ( resid 6 and name HB* ) 5.0 5.0 0.6
assign ( resid 7 and name HN ) ( resid 6 and name HN ) 4.0 4.0 0.0
assign ( resid 7 and name HN ) ( resid 7 and name HA ) 3.0 3.0 0.0
assign ( resid 7 and name HN ) ( resid 7 and name HB* ) 2.5 2.5 0.3
assign ( resid 7 and name HN ) ( resid 7 and name HB* ) 4.0 4.0 0.48
assign ( resid 7 and name HN ) ( resid 7 and name HD* ) 5.0 5.0 1.75
assign ( resid 7 and name HN ) ( resid 7 and name HD* ) 5.0 5.0 1.75
assign ( resid 7 and name HN ) ( resid 7 and name HG ) 3.0 3.0 0.0
assign ( resid 7 and name HN ) ( resid 8 and name HN ) 4.0 4.0 0.0
assign ( resid 70 and name HA ) ( resid 70 and name HB* ) 5.0 5.0 0.6
assign ( resid 70 and name HA ) ( resid 70 and name HB* ) 5.0 5.0 0.6
assign ( resid 70 and name HB* ) ( resid 70 and name HB* ) 4.0 4.0 1.0176
assign ( resid 8 and name HA ) ( resid 7 and name HB* ) 6.0 6.0 0.72
assign ( resid 8 and name HA ) ( resid 8 and name HB* ) 3.0 3.0 0.6
assign ( resid 8 and name HB* ) ( resid 5 and name HA ) 5.0 5.0 1.0
assign ( resid 8 and name HB* ) ( resid 8 and name HA ) 4.0 4.0 0.8
assign ( resid 8 and name HN ) ( resid 11 and name HD* ) 6.0 6.0 0.0
assign ( resid 8 and name HN ) ( resid 5 and name HA ) 5.0 5.0 0.0
assign ( resid 8 and name HN ) ( resid 58 and name HB* ) 5.0 5.0 0.6
assign ( resid 8 and name HN ) ( resid 6 and name HA ) 5.0 5.0 0.0
assign ( resid 8 and name HN ) ( resid 7 and name HA ) 5.0 5.0 0.0
assign ( resid 8 and name HN ) ( resid 7 and name HB* ) 4.0 4.0 0.48
assign ( resid 8 and name HN ) ( resid 7 and name HD* ) 6.0 6.0 2.1
assign ( resid 8 and name HN ) ( resid 7 and name HD* ) 6.0 6.0 2.1
assign ( resid 8 and name HN ) ( resid 7 and name HN ) 4.0 4.0 0.0
assign ( resid 8 and name HN ) ( resid 8 and name HA ) 5.0 5.0 0.0
assign ( resid 8 and name HN ) ( resid 8 and name HB* ) 2.5 2.5 0.5
assign ( resid 8 and name HN ) ( resid 9 and name HB* ) 6.0 6.0 0.72
assign ( resid 8 and name HN ) ( resid 9 and name HB* ) 6.0 6.0 0.72
assign ( resid 8 and name HN ) ( resid 9 and name HN ) 3.0 3.0 0.0
assign ( resid 9 and name HA ) ( resid 10 and name HD* ) 3.0 3.0 0.36
assign ( resid 9 and name HA ) ( resid 10 and name HD* ) 4.0 4.0 0.48
assign ( resid 9 and name HA ) ( resid 9 and name HB* ) 4.0 4.0 0.48
assign ( resid 9 and name HA ) ( resid 9 and name HB* ) 5.0 5.0 0.6
assign ( resid 9 and name HA ) ( resid 9 and name HG* ) 5.0 5.0 0.6
assign ( resid 9 and name HB* ) ( resid 10 and name HD* ) 5.0 5.0 1.272
assign ( resid 9 and name HB* ) ( resid 10 and name HD* ) 5.0 5.0 1.272
assign ( resid 9 and name HB* ) ( resid 10 and name HD* ) 6.0 6.0 1.5264
assign ( resid 9 and name HB* ) ( resid 10 and name HD* ) 6.0 6.0 1.5264
assign ( resid 9 and name HB* ) ( resid 11 and name HD* ) 5.0 5.0 0.6
assign ( resid 9 and name HB* ) ( resid 11 and name HD* ) 5.0 5.0 0.6
assign ( resid 9 and name HB* ) ( resid 57 and name HA ) 6.0 6.0 0.72
assign ( resid 9 and name HB* ) ( resid 7 and name HB* ) 5.0 5.0 1.272
assign ( resid 9 and name HB* ) ( resid 9 and name HA ) 5.0 5.0 0.6
assign ( resid 9 and name HB* ) ( resid 9 and name HA ) 5.0 5.0 0.6
assign ( resid 9 and name HB* ) ( resid 9 and name HE* ) 5.0 5.0 1.272
assign ( resid 9 and name HB* ) ( resid 9 and name HE* ) 6.0 6.0 1.5264
assign ( resid 9 and name HB* ) ( resid 9 and name HE* ) 6.0 6.0 1.5264
assign ( resid 9 and name HB* ) ( resid 9 and name HG* ) 4.0 4.0 1.0176
assign ( resid 9 and name HB* ) ( resid 9 and name HG* ) 4.0 4.0 1.0176
assign ( resid 9 and name HB* ) ( resid 9 and name HG* ) 5.0 5.0 1.272
assign ( resid 9 and name HD* ) ( resid 35 and name HB* ) 5.0 5.0 1.272
assign ( resid 9 and name HD* ) ( resid 37 and name HH2 ) 5.0 5.0 0.6
assign ( resid 9 and name HD* ) ( resid 37 and name HZ2 ) 5.0 5.0 0.6
assign ( resid 9 and name HD* ) ( resid 6 and name HA ) 5.0 5.0 0.6
assign ( resid 9 and name HD* ) ( resid 6 and name HB* ) 4.0 4.0 1.0176
assign ( resid 9 and name HD* ) ( resid 9 and name HA ) 6.0 6.0 0.72
assign ( resid 9 and name HD* ) ( resid 9 and name HE* ) 4.0 4.0 1.0176
assign ( resid 9 and name HD* ) ( resid 9 and name HE* ) 5.0 5.0 1.272
assign ( resid 9 and name HD* ) ( resid 9 and name HG* ) 3.0 3.0 0.7632
assign ( resid 9 and name HE* ) ( resid 37 and name HH2 ) 5.0 5.0 0.6
assign ( resid 9 and name HE* ) ( resid 37 and name HH2 ) 6.0 6.0 0.72
assign ( resid 9 and name HE* ) ( resid 6 and name HA ) 5.0 5.0 0.6
assign ( resid 9 and name HE* ) ( resid 6 and name HA ) 5.0 5.0 0.6
assign ( resid 9 and name HE* ) ( resid 6 and name HA ) 5.0 5.0 0.6
assign ( resid 9 and name HE* ) ( resid 6 and name HA ) 5.0 5.0 0.6
assign ( resid 9 and name HE* ) ( resid 6 and name HB* ) 5.0 5.0 1.272
assign ( resid 9 and name HE* ) ( resid 9 and name HA ) 5.0 5.0 0.6
assign ( resid 9 and name HE* ) ( resid 9 and name HD* ) 4.0 4.0 1.0176
assign ( resid 9 and name HE* ) ( resid 9 and name HD* ) 4.0 4.0 1.0176
assign ( resid 9 and name HE* ) ( resid 9 and name HD* ) 4.0 4.0 1.0176
assign ( resid 9 and name HE* ) ( resid 9 and name HD* ) 4.0 4.0 1.0176
assign ( resid 9 and name HE* ) ( resid 9 and name HE* ) 2.5 2.5 0.636
assign ( resid 9 and name HE* ) ( resid 9 and name HE* ) 3.0 3.0 0.7632
assign ( resid 9 and name HE* ) ( resid 9 and name HE* ) 3.0 3.0 0.7632
assign ( resid 9 and name HE* ) ( resid 9 and name HE* ) 3.0 3.0 0.7632
assign ( resid 9 and name HE* ) ( resid 9 and name HG* ) 4.0 4.0 1.0176
assign ( resid 9 and name HE* ) ( resid 9 and name HG* ) 5.0 5.0 1.272
assign ( resid 9 and name HE* ) ( resid 9 and name HG* ) 5.0 5.0 1.272
assign ( resid 9 and name HE* ) ( resid 9 and name HG* ) 5.0 5.0 1.272
assign ( resid 9 and name HE* ) ( resid 9 and name HG* ) 6.0 6.0 1.5264
assign ( resid 9 and name HG* ) ( resid 10 and name HD* ) 6.0 6.0 1.5264
assign ( resid 9 and name HG* ) ( resid 6 and name HA ) 5.0 5.0 0.6
assign ( resid 9 and name HG* ) ( resid 6 and name HA ) 6.0 6.0 0.72
assign ( resid 9 and name HG* ) ( resid 7 and name HD* ) 5.0 5.0 2.56
assign ( resid 9 and name HG* ) ( resid 7 and name HD* ) 6.0 6.0 3.072
assign ( resid 9 and name HG* ) ( resid 9 and name HA ) 5.0 5.0 0.6
assign ( resid 9 and name HG* ) ( resid 9 and name HA ) 6.0 6.0 0.72
assign ( resid 9 and name HG* ) ( resid 9 and name HB* ) 3.0 3.0 0.7632
assign ( resid 9 and name HG* ) ( resid 9 and name HB* ) 3.0 3.0 0.7632
assign ( resid 9 and name HG* ) ( resid 9 and name HE* ) 5.0 5.0 1.272
assign ( resid 9 and name HG* ) ( resid 9 and name HE* ) 5.0 5.0 1.272
assign ( resid 9 and name HG* ) ( resid 9 and name HE* ) 6.0 6.0 1.5264
assign ( resid 9 and name HG* ) ( resid 9 and name HE* ) 6.0 6.0 1.5264
assign ( resid 9 and name HN ) ( resid 7 and name HA ) 5.0 5.0 0.0
assign ( resid 9 and name HN ) ( resid 8 and name HA ) 5.0 5.0 0.0
assign ( resid 9 and name HN ) ( resid 8 and name HB* ) 4.0 4.0 0.8
assign ( resid 9 and name HN ) ( resid 8 and name HN ) 4.0 4.0 0.0
assign ( resid 9 and name HN ) ( resid 9 and name HA ) 6.0 6.0 0.0
assign ( resid 9 and name HN ) ( resid 9 and name HB* ) 3.0 3.0 0.36
assign ( resid 9 and name HN ) ( resid 9 and name HB* ) 4.0 4.0 0.48
assign ( resid 9 and name HN ) ( resid 9 and name HG* ) 5.0 5.0 0.6
assign ( resid 9 and name HN ) ( resid 9 and name HG* ) 5.0 5.0 0.6


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLU   1          2H        GLU   1  12.856  -9.134  -2.275
    2   2H    GLU   1          1H        GLU   1  12.043  -7.987  -3.230
    3   3H    GLU   1          3H        GLU   1  13.588  -7.640  -2.621
    4    HA   GLU   1           HA       GLU   1  12.828  -7.027  -0.622
    5   1HB   GLU   1          2HB       GLU   1  11.431  -5.696  -2.097
    6   2HB   GLU   1          1HB       GLU   1  10.282  -7.023  -2.262
    7   1HG   GLU   1          2HG       GLU   1   9.374  -5.491  -0.635
    8   2HG   GLU   1          1HG       GLU   1   9.933  -6.919   0.238
    9    H    THR   2           H        THR   2  11.671  -7.611   1.315
   10    HA   THR   2           HA       THR   2  11.022 -10.474   1.430
   11    HB   THR   2           HB       THR   2  10.680  -8.595   3.741
   12    HG1  THR   2           HG1      THR   2  13.192  -9.680   3.155
   13   1HG2  THR   2          2HG2      THR   2  10.888 -11.441   3.274
   14   2HG2  THR   2          1HG2      THR   2  12.145 -10.910   4.393
   15   3HG2  THR   2          3HG2      THR   2  10.449 -10.587   4.755
   16    H    VAL   3           H        VAL   3   9.028 -10.550   0.228
   17    HA   VAL   3           HA       VAL   3   6.818  -8.873   0.528
   18    HB   VAL   3           HB       VAL   3   7.105 -10.918  -1.015
   19   1HG1  VAL   3          1HG1      VAL   3   7.439 -12.453   1.026
   20   2HG1  VAL   3          3HG1      VAL   3   5.693 -12.343   1.245
   21   3HG1  VAL   3          2HG1      VAL   3   6.353 -13.035  -0.237
   22   1HG2  VAL   3          1HG2      VAL   3   4.678  -9.831   0.276
   23   2HG2  VAL   3          3HG2      VAL   3   5.067  -9.995  -1.437
   24   3HG2  VAL   3          2HG2      VAL   3   4.453 -11.381  -0.536
   25    H    GLU   4           H        GLU   4   8.081 -11.203   2.804
   26    HA   GLU   4           HA       GLU   4   5.722 -11.479   4.422
   27   1HB   GLU   4          2HB       GLU   4   7.946 -12.835   4.489
   28   2HB   GLU   4          1HB       GLU   4   8.513 -11.549   5.556
   29   1HG   GLU   4          2HG       GLU   4   6.960 -12.061   7.219
   30   2HG   GLU   4          1HG       GLU   4   5.853 -12.839   6.086
   31    H    SER   5           H        SER   5   8.486  -9.225   4.587
   32    HA   SER   5           HA       SER   5   7.365  -7.803   6.873
   33   1HB   SER   5          2HB       SER   5   9.474  -6.736   4.990
   34   2HB   SER   5          1HB       SER   5   9.256  -6.375   6.701
   35    HG   SER   5           HG       SER   5  10.927  -8.018   5.918
   36    H    CYS   6           H        CYS   6   7.687  -7.129   3.382
   37    HA   CYS   6           HA       CYS   6   6.472  -4.601   3.290
   38   1HB   CYS   6          2HB       CYS   6   6.855  -6.838   1.426
   39   2HB   CYS   6          1HB       CYS   6   5.414  -5.884   1.076
   40    H    LEU   7           H        LEU   7   5.081  -7.735   3.912
   41    HA   LEU   7           HA       LEU   7   2.332  -6.637   3.770
   42   1HB   LEU   7          2HB       LEU   7   3.304  -9.443   4.380
   43   2HB   LEU   7          1HB       LEU   7   1.624  -8.962   4.127
   44    HG   LEU   7           HG       LEU   7   3.781  -8.499   2.058
   45   1HD1  LEU   7          3HD1      LEU   7   2.207 -10.936   2.720
   46   2HD1  LEU   7          2HD1      LEU   7   2.320 -10.511   1.012
   47   3HD1  LEU   7          1HD1      LEU   7   3.786 -10.792   1.949
   48   1HD2  LEU   7          1HD2      LEU   7   1.036  -7.737   2.364
   49   2HD2  LEU   7          3HD2      LEU   7   2.125  -7.387   1.023
   50   3HD2  LEU   7          2HD2      LEU   7   1.156  -8.860   1.009
   51    H    ALA   8           H        ALA   8   4.789  -7.601   6.034
   52    HA   ALA   8           HA       ALA   8   3.128  -7.770   8.387
   53   1HB   ALA   8          2HB       ALA   8   5.671  -8.428   7.992
   54   2HB   ALA   8          1HB       ALA   8   5.955  -6.774   8.532
   55   3HB   ALA   8          3HB       ALA   8   5.121  -7.914   9.587
   56    H    LYS   9           H        LYS   9   4.047  -5.252   6.359
   57    HA   LYS   9           HA       LYS   9   4.401  -2.956   7.857
   58   1HB   LYS   9          2HB       LYS   9   2.865  -3.573   5.323
   59   2HB   LYS   9          1HB       LYS   9   3.101  -1.922   5.870
   60   1HG   LYS   9          2HG       LYS   9   5.574  -2.365   5.942
   61   2HG   LYS   9          1HG       LYS   9   5.251  -3.939   5.211
   62   1HD   LYS   9          2HD       LYS   9   4.890  -3.047   3.159
   63   2HD   LYS   9          1HD       LYS   9   3.981  -1.685   3.810
   64   1HE   LYS   9          2HE       LYS   9   6.985  -1.985   3.630
   65   2HE   LYS   9          1HE       LYS   9   5.977  -0.756   2.865
   66   1HZ   LYS   9          1HZ       LYS   9   5.317  -0.292   5.341
   67   2HZ   LYS   9          3HZ       LYS   9   6.827  -0.995   5.659
   68   3HZ   LYS   9          2HZ       LYS   9   6.725   0.384   4.673
   69    HA   PRO  10           HA       PRO  10   0.616  -2.129   9.974
   70   1HB   PRO  10          2HB       PRO  10  -0.160   0.409   9.213
   71   2HB   PRO  10          1HB       PRO  10   1.163   0.066  10.343
   72   1HG   PRO  10          2HG       PRO  10   1.303   0.936   7.496
   73   2HG   PRO  10          1HG       PRO  10   2.475   1.176   8.802
   74   1HD   PRO  10          2HD       PRO  10   2.669  -0.732   6.746
   75   2HD   PRO  10          1HD       PRO  10   3.635  -0.726   8.234
   76    H    HIS  11           H        HIS  11   0.589  -2.490   6.693
   77    HA   HIS  11           HA       HIS  11  -1.017  -3.291   5.247
   78   1HB   HIS  11          2HB       HIS  11  -2.280  -3.620   7.881
   79   2HB   HIS  11          1HB       HIS  11  -3.388  -3.570   6.508
   80    HD1  HIS  11           HD1      HIS  11  -3.796  -5.842   5.590
   81    HD2  HIS  11           HD2      HIS  11   0.085  -5.482   7.069
   82    HE1  HIS  11           HE1      HIS  11  -2.671  -8.077   5.198
   83    H    THR  12           H        THR  12  -0.966  -1.170   4.173
   84    HA   THR  12           HA       THR  12  -2.316   0.284   2.954
   85    HB   THR  12           HB       THR  12  -4.137  -1.345   4.131
   86    HG1  THR  12           HG1      THR  12  -5.300  -0.786   2.485
   87   1HG2  THR  12          2HG2      THR  12  -4.790   1.490   4.933
   88   2HG2  THR  12          1HG2      THR  12  -6.011   0.227   4.814
   89   3HG2  THR  12          3HG2      THR  12  -4.705   0.079   5.981
   90    H    GLU  13           H        GLU  13  -3.115   0.864   6.418
   91    HA   GLU  13           HA       GLU  13  -3.526   3.582   6.203
   92   1HB   GLU  13          2HB       GLU  13  -3.572   2.185   8.344
   93   2HB   GLU  13          1HB       GLU  13  -1.826   2.436   8.439
   94   1HG   GLU  13          2HG       GLU  13  -2.648   4.988   8.008
   95   2HG   GLU  13          1HG       GLU  13  -4.040   4.359   8.892
   96    H    ASN  14           H        ASN  14  -2.330   4.665   4.724
   97    HA   ASN  14           HA       ASN  14   0.062   5.952   5.368
   98   1HB   ASN  14          2HB       ASN  14   0.595   3.248   4.814
   99   2HB   ASN  14          1HB       ASN  14   1.026   4.101   3.331
  100   1HD2  ASN  14          2HD2      ASN  14   2.924   5.542   6.681
  101   2HD2  ASN  14          1HD2      ASN  14   1.246   5.288   6.719
  102    H    SER  15           H        SER  15   1.209   5.726   2.607
  103    HA   SER  15           HA       SER  15  -0.794   6.075   0.641
  104   1HB   SER  15          2HB       SER  15  -0.654   8.614   0.470
  105   2HB   SER  15          1HB       SER  15  -1.585   7.997   1.832
  106    HG   SER  15           HG       SER  15   1.126   8.854   1.860
  107    H    PHE  16           H        PHE  16   0.209   7.838  -1.076
  108    HA   PHE  16           HA       PHE  16   3.068   7.963  -1.204
  109   1HB   PHE  16          2HB       PHE  16   2.640   5.474  -1.515
  110   2HB   PHE  16          1HB       PHE  16   1.821   5.885  -3.022
  111    HD1  PHE  16           HD2      PHE  16   3.051   6.912  -4.884
  112    HD2  PHE  16           HD1      PHE  16   5.048   5.637  -1.307
  113    HE1  PHE  16           HE2      PHE  16   5.227   7.051  -6.055
  114    HE2  PHE  16           HE1      PHE  16   7.232   5.770  -2.478
  115    HZ   PHE  16           HZ       PHE  16   7.323   6.477  -4.855
  116    H    THR  17           H        THR  17   3.731   8.901  -3.360
  117    HA   THR  17           HA       THR  17   1.367  10.136  -4.710
  118    HB   THR  17           HB       THR  17   2.348  12.041  -3.941
  119    HG1  THR  17           HG1      THR  17   2.685  12.108  -6.189
  120   1HG2  THR  17          1HG2      THR  17   4.002  10.753  -2.595
  121   2HG2  THR  17          3HG2      THR  17   5.050  10.662  -4.011
  122   3HG2  THR  17          2HG2      THR  17   4.694  12.226  -3.277
  123    H    ASN  18           H        ASN  18   1.790  10.720  -7.056
  124    HA   ASN  18           HA       ASN  18   2.479  10.063  -9.214
  125   1HB   ASN  18          2HB       ASN  18   4.805   9.990  -7.744
  126   2HB   ASN  18          1HB       ASN  18   4.682   8.323  -8.308
  127   1HD2  ASN  18          2HD2      ASN  18   5.835   9.208 -11.504
  128   2HD2  ASN  18          1HD2      ASN  18   5.737   8.045 -10.273
  129    H    VAL  19           H        VAL  19   0.985   8.403  -7.055
  130    HA   VAL  19           HA       VAL  19   1.273   5.666  -7.315
  131    HB   VAL  19           HB       VAL  19  -1.348   7.191  -7.352
  132   1HG1  VAL  19          3HG1      VAL  19  -1.438   4.716  -7.841
  133   2HG1  VAL  19          2HG1      VAL  19  -0.701   4.433  -6.264
  134   3HG1  VAL  19          1HG1      VAL  19  -2.292   5.187  -6.371
  135   1HG2  VAL  19          2HG2      VAL  19   0.645   7.434  -5.488
  136   2HG2  VAL  19          1HG2      VAL  19  -1.070   7.631  -5.130
  137   3HG2  VAL  19          3HG2      VAL  19  -0.277   6.086  -4.825
  138    H    TRP  20           H        TRP  20   0.238   4.090  -8.692
  139    HA   TRP  20           HA       TRP  20  -0.563   5.130 -11.369
  140   1HB   TRP  20          2HB       TRP  20   0.965   3.835 -12.485
  141   2HB   TRP  20          1HB       TRP  20   1.850   3.923 -10.967
  142    HD1  TRP  20           HD1      TRP  20  -0.210   1.562 -13.120
  143    HE1  TRP  20           HE1      TRP  20  -0.013  -0.832 -12.195
  144    HE3  TRP  20           HE3      TRP  20   2.304   2.507  -8.777
  145    HZ2  TRP  20           HZ2      TRP  20   1.096  -2.175  -9.924
  146    HZ3  TRP  20           HZ3      TRP  20   2.926   0.652  -7.259
  147    HH2  TRP  20           HH2      TRP  20   2.326  -1.686  -7.826
  148    H    LYS  21           H        LYS  21  -1.395   2.873 -12.573
  149    HA   LYS  21           HA       LYS  21  -3.028   1.307 -10.680
  150   1HB   LYS  21          2HB       LYS  21  -4.399   3.333 -11.317
  151   2HB   LYS  21          1HB       LYS  21  -4.332   2.771 -12.990
  152   1HG   LYS  21          2HG       LYS  21  -5.086   0.482 -11.733
  153   2HG   LYS  21          1HG       LYS  21  -5.857   1.684 -10.696
  154   1HD   LYS  21          2HD       LYS  21  -7.523   1.571 -12.255
  155   2HD   LYS  21          1HD       LYS  21  -6.484   2.691 -13.139
  156   1HE   LYS  21          2HE       LYS  21  -5.891  -0.207 -13.456
  157   2HE   LYS  21          1HE       LYS  21  -7.367   0.386 -14.218
  158   1HZ   LYS  21          3HZ       LYS  21  -4.691   1.622 -14.564
  159   2HZ   LYS  21          2HZ       LYS  21  -5.388   0.528 -15.660
  160   3HZ   LYS  21          1HZ       LYS  21  -6.116   2.038 -15.384
  161    H    ASP  22           H        ASP  22  -2.530  -0.729 -11.311
  162    HA   ASP  22           HA       ASP  22  -1.799  -1.233 -14.112
  163   1HB   ASP  22          2HB       ASP  22  -1.009  -2.306 -11.655
  164   2HB   ASP  22          1HB       ASP  22  -1.970  -3.581 -12.401
  165    H    ASP  23           H        ASP  23  -3.143  -2.109 -15.570
  166    HA   ASP  23           HA       ASP  23  -5.906  -2.740 -14.843
  167   1HB   ASP  23          2HB       ASP  23  -4.863  -1.766 -17.112
  168   2HB   ASP  23          1HB       ASP  23  -4.750  -3.482 -17.505
  169    H    LYS  24           H        LYS  24  -2.890  -4.348 -15.159
  170    HA   LYS  24           HA       LYS  24  -3.941  -7.042 -15.558
  171   1HB   LYS  24          2HB       LYS  24  -1.360  -5.721 -15.416
  172   2HB   LYS  24          1HB       LYS  24  -1.374  -7.155 -14.390
  173   1HG   LYS  24          2HG       LYS  24  -0.718  -7.981 -16.511
  174   2HG   LYS  24          1HG       LYS  24  -2.438  -8.365 -16.413
  175   1HD   LYS  24          2HD       LYS  24  -1.917  -5.683 -17.482
  176   2HD   LYS  24          1HD       LYS  24  -1.233  -6.971 -18.475
  177   1HE   LYS  24          2HE       LYS  24  -3.324  -7.965 -18.853
  178   2HE   LYS  24          1HE       LYS  24  -4.054  -7.188 -17.448
  179   1HZ   LYS  24          2HZ       LYS  24  -3.012  -5.483 -19.586
  180   2HZ   LYS  24          1HZ       LYS  24  -4.474  -6.303 -19.865
  181   3HZ   LYS  24          3HZ       LYS  24  -4.337  -5.237 -18.552
  182    H    THR  25           H        THR  25  -2.304  -5.348 -12.882
  183    HA   THR  25           HA       THR  25  -2.904  -7.295 -10.879
  184    HB   THR  25           HB       THR  25  -2.295  -5.577  -9.281
  185    HG1  THR  25           HG1      THR  25  -2.037  -3.383 -10.222
  186   1HG2  THR  25          2HG2      THR  25  -0.520  -6.447 -10.871
  187   2HG2  THR  25          1HG2      THR  25  -0.738  -4.964 -11.800
  188   3HG2  THR  25          3HG2      THR  25  -0.163  -4.884 -10.135
  189    H    LEU  26           H        LEU  26  -4.674  -4.668 -12.317
  190    HA   LEU  26           HA       LEU  26  -6.973  -4.187 -12.251
  191   1HB   LEU  26          2HB       LEU  26  -6.753  -6.918 -11.415
  192   2HB   LEU  26          1HB       LEU  26  -7.955  -6.118 -10.400
  193    HG   LEU  26           HG       LEU  26  -7.906  -6.215 -13.430
  194   1HD1  LEU  26          1HD1      LEU  26  -9.349  -7.636 -11.284
  195   2HD1  LEU  26          3HD1      LEU  26 -10.384  -7.008 -12.566
  196   3HD1  LEU  26          2HD1      LEU  26  -9.066  -8.112 -12.958
  197   1HD2  LEU  26          3HD2      LEU  26  -9.441  -4.507 -11.483
  198   2HD2  LEU  26          2HD2      LEU  26  -8.696  -4.047 -13.014
  199   3HD2  LEU  26          1HD2      LEU  26 -10.188  -4.987 -13.006
  200    H    ASP  27           H        ASP  27  -5.602  -2.516 -10.697
  201    HA   ASP  27           HA       ASP  27  -7.389  -1.711  -8.667
  202   1HB   ASP  27          2HB       ASP  27  -5.988  -4.023  -7.891
  203   2HB   ASP  27          1HB       ASP  27  -5.227  -2.695  -7.017
  204    H    ARG  28           H        ARG  28  -6.188  -0.275  -6.920
  205    HA   ARG  28           HA       ARG  28  -4.290   1.411  -8.432
  206   1HB   ARG  28          2HB       ARG  28  -6.310   2.022  -6.678
  207   2HB   ARG  28          1HB       ARG  28  -4.898   2.104  -5.623
  208   1HG   ARG  28          2HG       ARG  28  -4.485   4.153  -6.466
  209   2HG   ARG  28          1HG       ARG  28  -4.111   3.372  -8.003
  210   1HD   ARG  28          2HD       ARG  28  -6.088   3.985  -8.943
  211   2HD   ARG  28          1HD       ARG  28  -6.993   3.692  -7.458
  212    HE   ARG  28           HE       ARG  28  -5.441   5.992  -6.988
  213   1HH1  ARG  28          1HH2      ARG  28  -6.084   6.438  -9.914
  214   2HH1  ARG  28          2HH2      ARG  28  -7.566   7.329  -9.812
  215   1HH2  ARG  28          2HH1      ARG  28  -8.145   6.495  -6.495
  216   2HH2  ARG  28          1HH1      ARG  28  -8.732   7.364  -7.873
  217    H    TYR  29           H        TYR  29  -2.126   1.809  -7.668
  218    HA   TYR  29           HA       TYR  29  -1.230   0.273  -5.314
  219   1HB   TYR  29          2HB       TYR  29  -0.178  -0.249  -8.106
  220   2HB   TYR  29          1HB       TYR  29   0.538  -0.883  -6.627
  221    HD1  TYR  29           HD2      TYR  29  -0.671  -2.547  -5.249
  222    HD2  TYR  29           HD1      TYR  29  -2.275  -1.111  -8.967
  223    HE1  TYR  29           HE2      TYR  29  -2.286  -4.427  -5.279
  224    HE2  TYR  29           HE1      TYR  29  -3.891  -2.991  -8.995
  225    HH   TYR  29           HH       TYR  29  -4.440  -4.981  -6.266
  226    H    ALA  30           H        ALA  30   0.697   1.039  -4.445
  227    HA   ALA  30           HA       ALA  30   1.855   3.451  -5.790
  228   1HB   ALA  30          3HB       ALA  30   1.278   2.869  -2.886
  229   2HB   ALA  30          2HB       ALA  30   2.488   4.067  -3.348
  230   3HB   ALA  30          1HB       ALA  30   0.807   4.276  -3.837
  231    H    ASN  31           H        ASN  31   3.904   3.026  -6.476
  232    HA   ASN  31           HA       ASN  31   5.358   0.693  -5.521
  233   1HB   ASN  31          2HB       ASN  31   5.512   1.538  -7.865
  234   2HB   ASN  31          1HB       ASN  31   6.342   2.971  -7.261
  235   1HD2  ASN  31          2HD2      ASN  31   8.643  -0.052  -8.154
  236   2HD2  ASN  31          1HD2      ASN  31   7.184   0.389  -8.901
  237    H    TYR  32           H        TYR  32   5.854   0.980  -3.321
  238    HA   TYR  32           HA       TYR  32   7.221   3.448  -2.469
  239   1HB   TYR  32          2HB       TYR  32   5.502   1.923  -1.127
  240   2HB   TYR  32          1HB       TYR  32   6.975   1.055  -0.692
  241    HD1  TYR  32           HD2      TYR  32   8.968   3.224  -0.615
  242    HD2  TYR  32           HD1      TYR  32   4.916   3.143   0.810
  243    HE1  TYR  32           HE2      TYR  32   9.517   4.984   1.043
  244    HE2  TYR  32           HE1      TYR  32   5.466   4.903   2.470
  245    HH   TYR  32           HH       TYR  32   8.057   5.604   3.614
  246    H    GLU  33           H        GLU  33   8.779   2.341  -4.359
  247    HA   GLU  33           HA       GLU  33  10.806   1.191  -4.814
  248   1HB   GLU  33          2HB       GLU  33  11.499   2.662  -2.255
  249   2HB   GLU  33          1HB       GLU  33  12.632   2.149  -3.506
  250   1HG   GLU  33          2HG       GLU  33  10.766   3.571  -4.955
  251   2HG   GLU  33          1HG       GLU  33  10.846   4.480  -3.445
  252    H    GLY  34           H        GLY  34  10.457  -1.035  -4.497
  253   1HA   GLY  34          2HA       GLY  34  11.345  -3.015  -3.447
  254   2HA   GLY  34          1HA       GLY  34  11.573  -2.091  -1.961
  255    H    CYS  35           H        CYS  35   8.842  -0.943  -2.078
  256    HA   CYS  35           HA       CYS  35   7.331  -3.424  -1.355
  257   1HB   CYS  35          2HB       CYS  35   8.037  -1.426   0.364
  258   2HB   CYS  35          1HB       CYS  35   6.464  -0.846  -0.182
  259    H    LEU  36           H        LEU  36   4.968  -3.268  -1.695
  260    HA   LEU  36           HA       LEU  36   4.150  -1.183  -3.646
  261   1HB   LEU  36          2HB       LEU  36   4.890  -3.424  -4.737
  262   2HB   LEU  36          1HB       LEU  36   3.378  -4.059  -4.092
  263    HG   LEU  36           HG       LEU  36   3.150  -3.194  -6.420
  264   1HD1  LEU  36          1HD1      LEU  36   1.436  -2.908  -4.316
  265   2HD1  LEU  36          3HD1      LEU  36   1.556  -1.248  -4.903
  266   3HD1  LEU  36          2HD1      LEU  36   1.033  -2.535  -5.989
  267   1HD2  LEU  36          3HD2      LEU  36   4.732  -1.107  -5.430
  268   2HD2  LEU  36          2HD2      LEU  36   3.961  -1.174  -7.015
  269   3HD2  LEU  36          1HD2      LEU  36   3.139  -0.386  -5.668
  270    H    TRP  37           H        TRP  37   2.501  -0.211  -2.594
  271    HA   TRP  37           HA       TRP  37   0.711  -1.808  -0.862
  272   1HB   TRP  37          2HB       TRP  37   0.636   1.185  -1.391
  273   2HB   TRP  37          1HB       TRP  37  -0.133   0.309  -0.074
  274    HD1  TRP  37           HD1      TRP  37   3.464   0.830  -1.412
  275    HE1  TRP  37           HE1      TRP  37   5.049   0.942   0.617
  276    HE3  TRP  37           HE3      TRP  37   0.112   0.026   2.363
  277    HZ2  TRP  37           HZ2      TRP  37   4.905   0.721   3.474
  278    HZ3  TRP  37           HZ3      TRP  37   0.856  -0.021   4.715
  279    HH2  TRP  37           HH2      TRP  37   3.249   0.328   5.281
  280    H    ASN  38           H        ASN  38  -1.751  -1.097  -1.135
  281    HA   ASN  38           HA       ASN  38  -2.412  -0.779  -4.016
  282   1HB   ASN  38          2HB       ASN  38  -2.440  -3.149  -3.813
  283   2HB   ASN  38          1HB       ASN  38  -3.227  -3.081  -2.235
  284   1HD2  ASN  38          2HD2      ASN  38  -6.490  -2.457  -3.633
  285   2HD2  ASN  38          1HD2      ASN  38  -5.537  -2.164  -2.261
  286    H    ALA  39           H        ALA  39  -3.906   0.773  -4.190
  287    HA   ALA  39           HA       ALA  39  -5.583   1.448  -1.837
  288   1HB   ALA  39          2HB       ALA  39  -4.394   2.941  -4.005
  289   2HB   ALA  39          1HB       ALA  39  -6.139   3.196  -3.992
  290   3HB   ALA  39          3HB       ALA  39  -5.185   3.549  -2.552
  291    H    THR  40           H        THR  40  -7.845   1.406  -1.953
  292    HA   THR  40           HA       THR  40  -8.936  -0.260  -4.167
  293    HB   THR  40           HB       THR  40  -9.616  -1.325  -2.231
  294    HG1  THR  40           HG1      THR  40 -11.587  -1.026  -2.924
  295   1HG2  THR  40          1HG2      THR  40  -9.492   1.423  -1.026
  296   2HG2  THR  40          3HG2      THR  40 -10.411   0.156  -0.213
  297   3HG2  THR  40          2HG2      THR  40  -8.684  -0.057  -0.507
  298    H    GLY  41           H        GLY  41 -10.930   1.823  -2.170
  299   1HA   GLY  41          2HA       GLY  41 -11.514   3.451  -4.613
  300   2HA   GLY  41          1HA       GLY  41 -12.765   2.963  -3.470
  301    H    VAL  42           H        VAL  42 -12.478   3.789  -1.192
  302    HA   VAL  42           HA       VAL  42 -12.311   6.580  -1.085
  303    HB   VAL  42           HB       VAL  42 -11.815   4.520   1.076
  304   1HG1  VAL  42          1HG1      VAL  42 -11.447   7.427   1.087
  305   2HG1  VAL  42          3HG1      VAL  42 -12.601   6.882   2.304
  306   3HG1  VAL  42          2HG1      VAL  42 -10.962   6.231   2.290
  307   1HG2  VAL  42          1HG2      VAL  42 -14.100   4.946  -0.180
  308   2HG2  VAL  42          3HG2      VAL  42 -14.081   4.758   1.574
  309   3HG2  VAL  42          2HG2      VAL  42 -14.170   6.369   0.860
  310    H    VAL  43           H        VAL  43 -10.439   7.274  -2.252
  311    HA   VAL  43           HA       VAL  43  -7.957   7.179  -0.616
  312    HB   VAL  43           HB       VAL  43  -8.060   6.605  -3.597
  313   1HG1  VAL  43          2HG1      VAL  43  -6.090   7.954  -2.455
  314   2HG1  VAL  43          1HG1      VAL  43  -5.615   6.356  -1.879
  315   3HG1  VAL  43          3HG1      VAL  43  -5.735   6.670  -3.610
  316   1HG2  VAL  43          2HG2      VAL  43  -8.600   4.820  -1.631
  317   2HG2  VAL  43          1HG2      VAL  43  -7.764   4.380  -3.118
  318   3HG2  VAL  43          3HG2      VAL  43  -6.841   4.711  -1.653
  319    H    VAL  44           H        VAL  44  -7.731   9.334  -0.166
  320    HA   VAL  44           HA       VAL  44  -8.777  11.485  -1.669
  321    HB   VAL  44           HB       VAL  44  -6.302  11.410   0.089
  322   1HG1  VAL  44          1HG1      VAL  44  -6.611  13.372  -1.592
  323   2HG1  VAL  44          3HG1      VAL  44  -7.955  13.848  -0.553
  324   3HG1  VAL  44          2HG1      VAL  44  -6.320  13.767   0.102
  325   1HG2  VAL  44          3HG2      VAL  44  -9.242  11.891   0.570
  326   2HG2  VAL  44          2HG2      VAL  44  -8.145  10.817   1.439
  327   3HG2  VAL  44          1HG2      VAL  44  -8.026  12.564   1.658
  328    H    CYS  45           H        CYS  45  -8.291  11.996  -3.765
  329    HA   CYS  45           HA       CYS  45  -5.466  11.562  -4.638
  330   1HB   CYS  45          2HB       CYS  45  -8.068  10.985  -5.984
  331   2HB   CYS  45          1HB       CYS  45  -6.724  11.505  -6.995
  332    H    THR  46           H        THR  46  -4.490  13.170  -5.845
  333    HA   THR  46           HA       THR  46  -6.047  15.591  -6.536
  334    HB   THR  46           HB       THR  46  -5.136  15.964  -4.242
  335    HG1  THR  46           HG1      THR  46  -5.305  17.693  -5.740
  336   1HG2  THR  46          1HG2      THR  46  -2.925  14.588  -5.267
  337   2HG2  THR  46          3HG2      THR  46  -2.365  16.248  -5.069
  338   3HG2  THR  46          2HG2      THR  46  -3.033  15.373  -3.692
  339    H    GLY  47           H        GLY  47  -4.999  16.852  -8.176
  340   1HA   GLY  47          2HA       GLY  47  -3.536  17.234  -9.982
  341   2HA   GLY  47          1HA       GLY  47  -2.377  16.159  -9.197
  342    H    ASP  48           H        ASP  48  -5.633  15.814 -10.655
  343    HA   ASP  48           HA       ASP  48  -6.407  14.239 -12.224
  344   1HB   ASP  48          2HB       ASP  48  -3.582  13.410 -12.791
  345   2HB   ASP  48          1HB       ASP  48  -4.942  13.557 -13.904
  346    H    GLU  49           H        GLU  49  -5.130  13.636  -9.389
  347    HA   GLU  49           HA       GLU  49  -5.282  11.772  -8.000
  348   1HB   GLU  49          2HB       GLU  49  -5.936  10.110 -10.443
  349   2HB   GLU  49          1HB       GLU  49  -6.315   9.756  -8.759
  350   1HG   GLU  49          2HG       GLU  49  -7.966  11.455  -8.652
  351   2HG   GLU  49          1HG       GLU  49  -7.389  12.224 -10.128
  352    H    THR  50           H        THR  50  -2.895  12.650  -9.545
  353    HA   THR  50           HA       THR  50  -1.412  10.183 -10.107
  354    HB   THR  50           HB       THR  50  -0.966  12.407 -11.260
  355    HG1  THR  50           HG1      THR  50   1.128  11.152  -9.826
  356   1HG2  THR  50          1HG2      THR  50  -1.050  13.502  -8.811
  357   2HG2  THR  50          3HG2      THR  50   0.686  13.211  -8.914
  358   3HG2  THR  50          2HG2      THR  50  -0.114  14.213 -10.124
  359    H    GLN  51           H        GLN  51  -1.832  12.467  -7.473
  360    HA   GLN  51           HA       GLN  51  -0.087  10.700  -5.794
  361   1HB   GLN  51          2HB       GLN  51  -0.721  13.517  -4.991
  362   2HB   GLN  51          1HB       GLN  51   0.689  12.533  -4.604
  363   1HG   GLN  51          2HG       GLN  51   1.159  12.642  -7.173
  364   2HG   GLN  51          1HG       GLN  51   0.077  14.035  -7.139
  365   1HE2  GLN  51          2HE2      GLN  51   2.372  15.726  -4.729
  366   2HE2  GLN  51          1HE2      GLN  51   0.743  15.246  -4.710
  367    H    CYS  52           H        CYS  52  -1.103   9.857  -3.972
  368    HA   CYS  52           HA       CYS  52  -3.629  11.083  -3.085
  369   1HB   CYS  52          2HB       CYS  52  -3.626   8.173  -3.912
  370   2HB   CYS  52          1HB       CYS  52  -5.009   9.149  -3.428
  371    H    TYR  53           H        TYR  53  -4.601   9.690  -1.250
  372    HA   TYR  53           HA       TYR  53  -2.598   8.172   0.278
  373   1HB   TYR  53          2HB       TYR  53  -2.012  10.178   1.297
  374   2HB   TYR  53          1HB       TYR  53  -3.593  10.900   1.012
  375    HD1  TYR  53           HD2      TYR  53  -5.560  10.161   2.407
  376    HD2  TYR  53           HD1      TYR  53  -1.521   9.039   3.351
  377    HE1  TYR  53           HE2      TYR  53  -6.265   9.553   4.704
  378    HE2  TYR  53           HE1      TYR  53  -2.230   8.425   5.650
  379    HH   TYR  53           HH       TYR  53  -4.144   9.098   7.222
  380    H    GLY  54           H        GLY  54  -3.686   7.291   2.331
  381   1HA   GLY  54          2HA       GLY  54  -6.120   7.087   3.269
  382   2HA   GLY  54          1HA       GLY  54  -6.482   6.525   1.634
  383    H    THR  55           H        THR  55  -6.762   4.328   1.789
  384    HA   THR  55           HA       THR  55  -4.815   2.806   3.482
  385    HB   THR  55           HB       THR  55  -6.474   0.907   3.161
  386    HG1  THR  55           HG1      THR  55  -7.425   1.878   1.270
  387   1HG2  THR  55          2HG2      THR  55  -7.307   3.498   4.466
  388   2HG2  THR  55          1HG2      THR  55  -8.246   2.014   4.629
  389   3HG2  THR  55          3HG2      THR  55  -6.587   2.077   5.222
  390    H    TRP  56           H        TRP  56  -3.264   1.782   2.441
  391    HA   TRP  56           HA       TRP  56  -3.661   0.980  -0.403
  392   1HB   TRP  56          2HB       TRP  56  -1.110   1.792   0.978
  393   2HB   TRP  56          1HB       TRP  56  -1.316   1.450  -0.743
  394    HD1  TRP  56           HD1      TRP  56  -2.576   3.943   1.911
  395    HE1  TRP  56           HE1      TRP  56  -3.107   6.164   0.727
  396    HE3  TRP  56           HE3      TRP  56  -1.700   2.568  -2.914
  397    HZ2  TRP  56           HZ2      TRP  56  -3.159   7.221  -1.954
  398    HZ3  TRP  56           HZ3      TRP  56  -1.996   4.181  -4.766
  399    HH2  TRP  56           HH2      TRP  56  -2.723   6.510  -4.295
  400    H    VAL  57           H        VAL  57  -4.430  -1.084   0.849
  401    HA   VAL  57           HA       VAL  57  -2.913  -2.624   2.556
  402    HB   VAL  57           HB       VAL  57  -3.796  -4.640   1.078
  403   1HG1  VAL  57          3HG1      VAL  57  -4.675  -3.565   3.285
  404   2HG1  VAL  57          2HG1      VAL  57  -5.881  -2.807   2.245
  405   3HG1  VAL  57          1HG1      VAL  57  -5.776  -4.566   2.338
  406   1HG2  VAL  57          2HG2      VAL  57  -4.333  -2.497  -0.617
  407   2HG2  VAL  57          1HG2      VAL  57  -5.053  -4.103  -0.731
  408   3HG2  VAL  57          3HG2      VAL  57  -5.891  -2.820   0.143
  409    HA   PRO  58           HA       PRO  58   0.849  -3.421   0.326
  410   1HB   PRO  58          2HB       PRO  58   1.938  -5.111   2.229
  411   2HB   PRO  58          1HB       PRO  58   1.943  -3.343   2.358
  412   1HG   PRO  58          2HG       PRO  58   0.284  -5.322   3.830
  413   2HG   PRO  58          1HG       PRO  58   0.735  -3.667   4.292
  414   1HD   PRO  58          2HD       PRO  58  -1.779  -4.499   3.242
  415   2HD   PRO  58          1HD       PRO  58  -1.229  -2.829   3.460
  416    H    ILE  59           H        ILE  59   1.439  -5.052  -1.149
  417    HA   ILE  59           HA       ILE  59   0.449  -7.800  -0.716
  418    HB   ILE  59           HB       ILE  59  -0.659  -7.773  -2.983
  419   1HG1  ILE  59          2HG1      ILE  59   0.578  -5.493  -3.475
  420   2HG1  ILE  59          1HG1      ILE  59  -1.022  -5.788  -4.144
  421   1HG2  ILE  59          2HG2      ILE  59  -1.793  -5.965  -0.825
  422   2HG2  ILE  59          1HG2      ILE  59  -2.729  -6.685  -2.135
  423   3HG2  ILE  59          3HG2      ILE  59  -1.978  -7.716  -0.916
  424   1HD1  ILE  59          1HD1      ILE  59  -0.526  -4.320  -1.540
  425   2HD1  ILE  59          3HD1      ILE  59  -0.778  -3.525  -3.090
  426   3HD1  ILE  59          2HD1      ILE  59  -2.062  -4.500  -2.376
  427    H    GLY  60           H        GLY  60   2.260  -5.517  -2.764
  428   1HA   GLY  60          2HA       GLY  60   3.819  -7.897  -3.690
  429   2HA   GLY  60          1HA       GLY  60   3.349  -6.622  -4.811
  430    H    LEU  61           H        LEU  61   5.998  -7.295  -4.525
  431    HA   LEU  61           HA       LEU  61   7.345  -5.568  -2.617
  432   1HB   LEU  61          2HB       LEU  61   8.514  -6.704  -5.169
  433   2HB   LEU  61          1HB       LEU  61   9.367  -6.272  -3.686
  434    HG   LEU  61           HG       LEU  61   7.411  -8.551  -4.074
  435   1HD1  LEU  61          2HD1      LEU  61   9.979  -8.615  -4.689
  436   2HD1  LEU  61          1HD1      LEU  61  10.178  -8.765  -2.942
  437   3HD1  LEU  61          3HD1      LEU  61   9.239  -9.965  -3.830
  438   1HD2  LEU  61          2HD2      LEU  61   8.182  -7.046  -1.677
  439   2HD2  LEU  61          1HD2      LEU  61   6.869  -8.202  -1.902
  440   3HD2  LEU  61          3HD2      LEU  61   8.496  -8.777  -1.536
  441    H    ALA  62           H        ALA  62   6.081  -5.226  -5.875
  442    HA   ALA  62           HA       ALA  62   6.100  -2.415  -5.819
  443   1HB   ALA  62          3HB       ALA  62   8.639  -3.643  -6.852
  444   2HB   ALA  62          2HB       ALA  62   8.063  -2.116  -7.517
  445   3HB   ALA  62          1HB       ALA  62   8.427  -2.246  -5.797
  446    H    ILE  63           H        ILE  63   4.344  -4.386  -6.916
  447    HA   ILE  63           HA       ILE  63   3.462  -3.257  -9.233
  448    HB   ILE  63           HB       ILE  63   5.945  -4.634  -9.795
  449   1HG1  ILE  63          2HG1      ILE  63   5.477  -2.372 -10.527
  450   2HG1  ILE  63          1HG1      ILE  63   5.613  -3.386 -11.961
  451   1HG2  ILE  63          1HG2      ILE  63   3.477  -5.561 -11.272
  452   2HG2  ILE  63          3HG2      ILE  63   5.083  -5.610 -12.001
  453   3HG2  ILE  63          2HG2      ILE  63   4.745  -6.549 -10.547
  454   1HD1  ILE  63          3HD1      ILE  63   2.911  -3.556 -11.247
  455   2HD1  ILE  63          2HD1      ILE  63   3.325  -1.860 -10.993
  456   3HD1  ILE  63          1HD1      ILE  63   3.582  -2.604 -12.571
  457    HA   PRO  64           HA       PRO  64   1.855  -7.765  -9.283
  458   1HB   PRO  64          2HB       PRO  64   2.287  -9.227  -6.984
  459   2HB   PRO  64          1HB       PRO  64   3.279  -9.336  -8.451
  460   1HG   PRO  64          2HG       PRO  64   3.893  -8.003  -5.861
  461   2HG   PRO  64          1HG       PRO  64   5.001  -8.675  -7.064
  462   1HD   PRO  64          2HD       PRO  64   4.442  -5.953  -6.708
  463   2HD   PRO  64          1HD       PRO  64   5.222  -6.652  -8.137
  464    H    GLU  65           H        GLU  65  -0.245  -8.200  -8.692
  465    HA   GLU  65           HA       GLU  65  -1.591  -6.276  -7.007
  466   1HB   GLU  65          2HB       GLU  65  -3.624  -7.419  -7.649
  467   2HB   GLU  65          1HB       GLU  65  -2.575  -7.374  -9.063
  468   1HG   GLU  65          2HG       GLU  65  -1.963  -9.722  -7.519
  469   2HG   GLU  65          1HG       GLU  65  -3.699  -9.663  -7.827
  470    H    ASN  66           H        ASN  66  -3.574  -7.996  -5.851
  471    HA   ASN  66           HA       ASN  66  -2.111  -8.780  -3.422
  472   1HB   ASN  66          2HB       ASN  66  -4.202  -7.501  -3.212
  473   2HB   ASN  66          1HB       ASN  66  -5.075  -8.784  -4.054
  474   1HD2  ASN  66          2HD2      ASN  66  -4.597  -9.118  -0.115
  475   2HD2  ASN  66          1HD2      ASN  66  -4.424  -7.668  -0.978
  476    H    ALA  67           H        ALA  67  -3.832 -10.311  -6.084
  477    HA   ALA  67           HA       ALA  67  -4.097 -12.910  -4.917
  478   1HB   ALA  67          2HB       ALA  67  -4.547 -11.700  -7.469
  479   2HB   ALA  67          1HB       ALA  67  -3.588 -13.159  -7.718
  480   3HB   ALA  67          3HB       ALA  67  -5.137 -13.255  -6.882
  481    H    ALA  68           H        ALA  68  -1.339 -11.151  -5.837
  482    HA   ALA  68           HA       ALA  68   0.930 -11.769  -5.676
  483   1HB   ALA  68          2HB       ALA  68  -0.157 -13.551  -4.029
  484   2HB   ALA  68          1HB       ALA  68   0.231 -14.662  -5.342
  485   3HB   ALA  68          3HB       ALA  68   1.511 -13.723  -4.573
  486    H    ALA  69           H        ALA  69  -0.250 -11.503  -8.148
  487    HA   ALA  69           HA       ALA  69  -0.137 -12.215 -10.392
  488   1HB   ALA  69          2HB       ALA  69   2.405 -12.036  -9.260
  489   2HB   ALA  69          1HB       ALA  69   2.416 -13.596 -10.081
  490   3HB   ALA  69          3HB       ALA  69   2.042 -12.127 -10.983
  491    H    HIS  70           HN       HIS  70  -1.829 -13.927  -9.408
  492    HA   HIS  70           HA       HIS  70  -0.730 -16.663  -9.916
  493   1HB   HIS  70          2HB       HIS  70  -2.255 -15.716  -7.771
  494   2HB   HIS  70          1HB       HIS  70  -3.413 -16.583  -8.778
  495    HD1  HIS  70           HD1      HIS  70  -2.267 -17.604  -5.974
  496    HD2  HIS  70           HD2      HIS  70  -0.999 -18.867  -9.739
  497    HE1  HIS  70           HE1      HIS  70  -1.220 -19.888  -5.648
   
  No H/Q in entry =         497
  Start of MODEL    2
    1   1H    GLU   1          2H        GLU   1  12.925  -7.651  -0.370
    2   2H    GLU   1          1H        GLU   1  12.260  -6.759  -1.655
    3   3H    GLU   1          3H        GLU   1  13.442  -6.058  -0.661
    4    HA   GLU   1           HA       GLU   1  11.997  -5.533   0.958
    5   1HB   GLU   1          2HB       GLU   1  10.980  -4.570  -1.058
    6   2HB   GLU   1          1HB       GLU   1  10.114  -6.079  -1.356
    7   1HG   GLU   1          2HG       GLU   1   8.673  -4.389  -0.242
    8   2HG   GLU   1          1HG       GLU   1   8.893  -5.830   0.751
    9    H    THR   2           H        THR   2  11.265  -8.588  -0.588
   10    HA   THR   2           HA       THR   2  10.378 -10.557   0.338
   11    HB   THR   2           HB       THR   2  10.333  -9.143   3.004
   12    HG1  THR   2           HG1      THR   2  12.513 -10.108   3.136
   13   1HG2  THR   2          2HG2      THR   2  10.727 -12.019   2.138
   14   2HG2  THR   2          1HG2      THR   2  10.840 -11.450   3.804
   15   3HG2  THR   2          3HG2      THR   2   9.306 -11.350   2.940
   16    H    VAL   3           H        VAL   3   8.273 -11.093   0.020
   17    HA   VAL   3           HA       VAL   3   6.193  -9.093   0.190
   18    HB   VAL   3           HB       VAL   3   5.525 -12.014   0.172
   19   1HG1  VAL   3          3HG1      VAL   3   3.820 -10.191  -0.049
   20   2HG1  VAL   3          2HG1      VAL   3   4.618  -9.679  -1.536
   21   3HG1  VAL   3          1HG1      VAL   3   3.866 -11.271  -1.443
   22   1HG2  VAL   3          1HG2      VAL   3   7.088 -10.535  -1.946
   23   2HG2  VAL   3          3HG2      VAL   3   7.389 -12.140  -1.280
   24   3HG2  VAL   3          2HG2      VAL   3   6.028 -11.879  -2.371
   25    H    GLU   4           H        GLU   4   7.485 -11.482   2.377
   26    HA   GLU   4           HA       GLU   4   5.262 -11.660   4.185
   27   1HB   GLU   4          2HB       GLU   4   8.206 -12.199   4.367
   28   2HB   GLU   4          1HB       GLU   4   7.252 -12.161   5.851
   29   1HG   GLU   4          2HG       GLU   4   6.036 -13.702   3.642
   30   2HG   GLU   4          1HG       GLU   4   7.535 -14.380   4.278
   31    H    SER   5           H        SER   5   8.143  -9.552   4.159
   32    HA   SER   5           HA       SER   5   7.251  -8.098   6.525
   33   1HB   SER   5          2HB       SER   5   9.539  -7.888   6.373
   34   2HB   SER   5          1HB       SER   5   9.528  -7.928   4.611
   35    HG   SER   5           HG       SER   5   9.622  -5.839   4.708
   36    H    CYS   6           H        CYS   6   7.341  -7.429   3.025
   37    HA   CYS   6           HA       CYS   6   6.268  -4.820   3.070
   38   1HB   CYS   6          2HB       CYS   6   6.994  -6.381   1.057
   39   2HB   CYS   6          1HB       CYS   6   5.278  -6.787   1.025
   40    H    LEU   7           H        LEU   7   4.774  -7.895   3.730
   41    HA   LEU   7           HA       LEU   7   2.080  -6.662   3.775
   42   1HB   LEU   7          2HB       LEU   7   2.948  -9.521   4.287
   43   2HB   LEU   7          1HB       LEU   7   1.279  -8.954   4.189
   44    HG   LEU   7           HG       LEU   7   3.265  -8.573   1.939
   45   1HD1  LEU   7          3HD1      LEU   7   1.461 -10.890   2.606
   46   2HD1  LEU   7          2HD1      LEU   7   1.819 -10.501   0.924
   47   3HD1  LEU   7          1HD1      LEU   7   3.128 -10.915   2.031
   48   1HD2  LEU   7          2HD2      LEU   7   0.732  -7.510   2.452
   49   2HD2  LEU   7          1HD2      LEU   7   1.553  -7.533   0.892
   50   3HD2  LEU   7          3HD2      LEU   7   0.425  -8.822   1.314
   51    H    ALA   8           H        ALA   8   4.643  -7.737   5.875
   52    HA   ALA   8           HA       ALA   8   3.124  -7.852   8.324
   53   1HB   ALA   8          3HB       ALA   8   5.769  -8.336   7.613
   54   2HB   ALA   8          2HB       ALA   8   5.879  -6.891   8.620
   55   3HB   ALA   8          1HB       ALA   8   5.131  -8.356   9.257
   56    H    LYS   9           H        LYS   9   4.013  -5.367   6.230
   57    HA   LYS   9           HA       LYS   9   4.494  -3.076   7.711
   58   1HB   LYS   9          2HB       LYS   9   2.805  -3.624   5.251
   59   2HB   LYS   9          1HB       LYS   9   3.166  -1.992   5.785
   60   1HG   LYS   9          2HG       LYS   9   5.612  -2.584   5.730
   61   2HG   LYS   9          1HG       LYS   9   5.155  -4.121   4.994
   62   1HD   LYS   9          2HD       LYS   9   4.873  -3.168   2.973
   63   2HD   LYS   9          1HD       LYS   9   3.888  -1.873   3.648
   64   1HE   LYS   9          2HE       LYS   9   6.907  -2.002   3.500
   65   2HE   LYS   9          1HE       LYS   9   5.841  -0.831   2.722
   66   1HZ   LYS   9          3HZ       LYS   9   5.123  -0.483   5.232
   67   2HZ   LYS   9          2HZ       LYS   9   6.721  -0.996   5.499
   68   3HZ   LYS   9          1HZ       LYS   9   6.412   0.369   4.534
   69    HA   PRO  10           HA       PRO  10   0.820  -2.191   9.987
   70   1HB   PRO  10          2HB       PRO  10   0.036   0.351   9.260
   71   2HB   PRO  10          1HB       PRO  10   1.407   0.001  10.326
   72   1HG   PRO  10          2HG       PRO  10   1.417   0.857   7.471
   73   2HG   PRO  10          1HG       PRO  10   2.648   1.101   8.722
   74   1HD   PRO  10          2HD       PRO  10   2.743  -0.818   6.674
   75   2HD   PRO  10          1HD       PRO  10   3.771  -0.816   8.119
   76    H    HIS  11           H        HIS  11   0.654  -2.524   6.698
   77    HA   HIS  11           HA       HIS  11  -1.024  -3.335   5.330
   78   1HB   HIS  11          2HB       HIS  11  -2.122  -3.671   8.007
   79   2HB   HIS  11          1HB       HIS  11  -3.369  -3.396   6.784
   80    HD1  HIS  11           HD1      HIS  11  -0.114  -5.418   6.842
   81    HD2  HIS  11           HD2      HIS  11  -4.115  -5.830   5.743
   82    HE1  HIS  11           HE1      HIS  11  -0.363  -7.760   5.911
   83    H    THR  12           H        THR  12  -0.912  -1.233   4.231
   84    HA   THR  12           HA       THR  12  -2.232   0.270   3.036
   85    HB   THR  12           HB       THR  12  -4.096  -1.252   4.309
   86    HG1  THR  12           HG1      THR  12  -5.389  -0.560   2.753
   87   1HG2  THR  12          3HG2      THR  12  -4.589   1.637   5.032
   88   2HG2  THR  12          2HG2      THR  12  -5.862   0.419   5.008
   89   3HG2  THR  12          1HG2      THR  12  -4.520   0.263   6.130
   90    H    GLU  13           H        GLU  13  -2.874   0.916   6.531
   91    HA   GLU  13           HA       GLU  13  -3.108   3.660   6.296
   92   1HB   GLU  13          2HB       GLU  13  -3.040   2.139   8.454
   93   2HB   GLU  13          1HB       GLU  13  -1.343   2.621   8.505
   94   1HG   GLU  13          2HG       GLU  13  -1.837   4.772   9.070
   95   2HG   GLU  13          1HG       GLU  13  -3.236   4.834   7.997
   96    H    ASN  14           H        ASN  14  -1.909   4.670   4.808
   97    HA   ASN  14           HA       ASN  14   0.607   5.750   5.314
   98   1HB   ASN  14          2HB       ASN  14   0.738   2.971   4.405
   99   2HB   ASN  14          1HB       ASN  14   1.593   4.057   3.312
  100   1HD2  ASN  14          2HD2      ASN  14   4.142   3.277   5.811
  101   2HD2  ASN  14          1HD2      ASN  14   3.414   2.570   4.451
  102    H    SER  15           H        SER  15   1.647   5.692   2.598
  103    HA   SER  15           HA       SER  15  -0.407   6.033   0.665
  104   1HB   SER  15          2HB       SER  15  -1.259   7.896   1.821
  105   2HB   SER  15          1HB       SER  15   0.338   8.453   2.300
  106    HG   SER  15           HG       SER  15   0.439   9.534   0.510
  107    H    PHE  16           H        PHE  16   0.453   7.556  -1.179
  108    HA   PHE  16           HA       PHE  16   3.323   7.938  -1.304
  109   1HB   PHE  16          2HB       PHE  16   3.157   5.462  -1.552
  110   2HB   PHE  16          1HB       PHE  16   2.117   5.699  -2.958
  111    HD1  PHE  16           HD1      PHE  16   5.493   6.564  -1.596
  112    HD2  PHE  16           HD2      PHE  16   3.038   6.060  -5.078
  113    HE1  PHE  16           HE1      PHE  16   7.484   6.866  -3.043
  114    HE2  PHE  16           HE2      PHE  16   5.019   6.367  -6.524
  115    HZ   PHE  16           HZ       PHE  16   7.250   6.766  -5.511
  116    H    THR  17           H        THR  17   3.899   8.607  -3.691
  117    HA   THR  17           HA       THR  17   1.466   9.853  -4.887
  118    HB   THR  17           HB       THR  17   2.473  11.811  -4.386
  119    HG1  THR  17           HG1      THR  17   3.057  12.304  -6.326
  120   1HG2  THR  17          1HG2      THR  17   4.962  10.137  -4.065
  121   2HG2  THR  17          3HG2      THR  17   5.030  11.899  -4.002
  122   3HG2  THR  17          2HG2      THR  17   4.056  11.011  -2.830
  123    H    ASN  18           H        ASN  18   2.198  10.655  -7.310
  124    HA   ASN  18           HA       ASN  18   2.605   9.827  -9.477
  125   1HB   ASN  18          2HB       ASN  18   4.838   8.680  -7.831
  126   2HB   ASN  18          1HB       ASN  18   4.602   8.071  -9.470
  127   1HD2  ASN  18          2HD2      ASN  18   6.814  11.182  -9.427
  128   2HD2  ASN  18          1HD2      ASN  18   6.855   9.771  -8.484
  129    H    VAL  19           H        VAL  19   0.940   8.413  -7.325
  130    HA   VAL  19           HA       VAL  19   0.868   5.677  -7.404
  131    HB   VAL  19           HB       VAL  19  -1.580   7.391  -7.870
  132   1HG1  VAL  19          1HG1      VAL  19  -1.030   4.684  -6.667
  133   2HG1  VAL  19          3HG1      VAL  19  -2.455   5.605  -6.186
  134   3HG1  VAL  19          2HG1      VAL  19  -2.237   5.133  -7.871
  135   1HG2  VAL  19          1HG2      VAL  19   0.143   6.988  -5.424
  136   2HG2  VAL  19          3HG2      VAL  19  -0.451   8.499  -6.111
  137   3HG2  VAL  19          2HG2      VAL  19  -1.562   7.412  -5.284
  138    H    TRP  20           H        TRP  20  -0.135   4.097  -8.755
  139    HA   TRP  20           HA       TRP  20  -0.776   4.959 -11.527
  140   1HB   TRP  20          2HB       TRP  20   0.829   3.663 -12.522
  141   2HB   TRP  20          1HB       TRP  20   1.656   3.854 -10.981
  142    HD1  TRP  20           HD1      TRP  20  -0.573   1.363 -12.884
  143    HE1  TRP  20           HE1      TRP  20  -0.197  -0.990 -11.913
  144    HE3  TRP  20           HE3      TRP  20   2.519   2.511  -8.981
  145    HZ2  TRP  20           HZ2      TRP  20   1.250  -2.230  -9.779
  146    HZ3  TRP  20           HZ3      TRP  20   3.383   0.722  -7.501
  147    HH2  TRP  20           HH2      TRP  20   2.755  -1.644  -7.894
  148    H    LYS  21           H        LYS  21  -1.699   2.818 -12.690
  149    HA   LYS  21           HA       LYS  21  -3.243   1.200 -10.744
  150   1HB   LYS  21          2HB       LYS  21  -4.722   3.097 -11.292
  151   2HB   LYS  21          1HB       LYS  21  -4.532   2.749 -13.012
  152   1HG   LYS  21          2HG       LYS  21  -5.241   0.304 -11.782
  153   2HG   LYS  21          1HG       LYS  21  -6.327   1.524 -11.117
  154   1HD   LYS  21          2HD       LYS  21  -7.529   1.214 -13.017
  155   2HD   LYS  21          1HD       LYS  21  -6.280   2.193 -13.788
  156   1HE   LYS  21          2HE       LYS  21  -5.486  -0.609 -13.498
  157   2HE   LYS  21          1HE       LYS  21  -6.943  -0.417 -14.474
  158   1HZ   LYS  21          3HZ       LYS  21  -4.792   1.460 -15.007
  159   2HZ   LYS  21          2HZ       LYS  21  -4.488  -0.153 -15.446
  160   3HZ   LYS  21          1HZ       LYS  21  -5.833   0.667 -16.084
  161    H    ASP  22           H        ASP  22  -2.771  -0.856 -11.348
  162    HA   ASP  22           HA       ASP  22  -2.122  -1.399 -14.172
  163   1HB   ASP  22          2HB       ASP  22  -1.410  -2.528 -11.599
  164   2HB   ASP  22          1HB       ASP  22  -2.015  -3.779 -12.681
  165    H    ASP  23           H        ASP  23  -3.523  -2.379 -15.521
  166    HA   ASP  23           HA       ASP  23  -6.218  -3.051 -14.601
  167   1HB   ASP  23          2HB       ASP  23  -5.822  -2.038 -16.841
  168   2HB   ASP  23          1HB       ASP  23  -4.896  -3.464 -17.307
  169    H    LYS  24           H        LYS  24  -3.197  -4.613 -15.081
  170    HA   LYS  24           HA       LYS  24  -4.224  -7.330 -15.344
  171   1HB   LYS  24          2HB       LYS  24  -1.592  -5.971 -15.118
  172   2HB   LYS  24          1HB       LYS  24  -1.659  -7.614 -14.476
  173   1HG   LYS  24          2HG       LYS  24  -1.026  -7.596 -16.880
  174   2HG   LYS  24          1HG       LYS  24  -2.552  -8.440 -16.611
  175   1HD   LYS  24          2HD       LYS  24  -3.761  -6.318 -17.184
  176   2HD   LYS  24          1HD       LYS  24  -2.207  -5.596 -17.601
  177   1HE   LYS  24          2HE       LYS  24  -3.045  -6.387 -19.668
  178   2HE   LYS  24          1HE       LYS  24  -1.895  -7.627 -19.165
  179   1HZ   LYS  24          1HZ       LYS  24  -4.363  -8.232 -18.017
  180   2HZ   LYS  24          3HZ       LYS  24  -4.644  -7.895 -19.657
  181   3HZ   LYS  24          2HZ       LYS  24  -3.526  -9.097 -19.216
  182    H    THR  25           H        THR  25  -2.479  -5.538 -12.804
  183    HA   THR  25           HA       THR  25  -2.927  -7.440 -10.719
  184    HB   THR  25           HB       THR  25  -2.480  -5.493  -9.191
  185    HG1  THR  25           HG1      THR  25  -3.523  -4.084 -10.939
  186   1HG2  THR  25          1HG2      THR  25  -0.728  -6.818 -10.697
  187   2HG2  THR  25          3HG2      THR  25  -0.515  -5.224 -11.423
  188   3HG2  THR  25          2HG2      THR  25  -0.229  -5.453  -9.698
  189    H    LEU  26           H        LEU  26  -4.821  -4.873 -12.123
  190    HA   LEU  26           HA       LEU  26  -7.125  -4.443 -11.955
  191   1HB   LEU  26          2HB       LEU  26  -6.812  -7.151 -11.136
  192   2HB   LEU  26          1HB       LEU  26  -7.922  -6.384 -10.001
  193    HG   LEU  26           HG       LEU  26  -8.166  -6.422 -13.022
  194   1HD1  LEU  26          3HD1      LEU  26  -9.678  -7.714 -10.748
  195   2HD1  LEU  26          2HD1      LEU  26 -10.403  -7.504 -12.342
  196   3HD1  LEU  26          1HD1      LEU  26  -8.951  -8.489 -12.155
  197   1HD2  LEU  26          3HD2      LEU  26  -9.425  -4.745 -10.904
  198   2HD2  LEU  26          2HD2      LEU  26  -9.094  -4.359 -12.593
  199   3HD2  LEU  26          1HD2      LEU  26 -10.488  -5.355 -12.172
  200    H    ASP  27           H        ASP  27  -5.787  -2.675 -10.547
  201    HA   ASP  27           HA       ASP  27  -7.439  -1.880  -8.417
  202   1HB   ASP  27          2HB       ASP  27  -5.818  -4.126  -7.718
  203   2HB   ASP  27          1HB       ASP  27  -5.252  -2.729  -6.802
  204    H    ARG  28           H        ARG  28  -6.292  -0.277  -6.868
  205    HA   ARG  28           HA       ARG  28  -4.441   1.347  -8.472
  206   1HB   ARG  28          2HB       ARG  28  -6.326   2.124  -6.779
  207   2HB   ARG  28          1HB       ARG  28  -5.050   1.898  -5.582
  208   1HG   ARG  28          2HG       ARG  28  -4.694   4.116  -6.185
  209   2HG   ARG  28          1HG       ARG  28  -3.609   3.288  -7.303
  210   1HD   ARG  28          2HD       ARG  28  -5.170   3.463  -9.101
  211   2HD   ARG  28          1HD       ARG  28  -6.473   3.946  -8.015
  212    HE   ARG  28           HE       ARG  28  -4.520   5.911  -7.700
  213   1HH1  ARG  28          1HH2      ARG  28  -7.267   5.365  -9.453
  214   2HH1  ARG  28          2HH2      ARG  28  -6.888   6.433 -10.763
  215   1HH2  ARG  28          1HH1      ARG  28  -4.820   7.325 -10.930
  216   2HH2  ARG  28          2HH1      ARG  28  -3.612   6.943  -9.749
  217    H    TYR  29           H        TYR  29  -2.220   1.792  -7.769
  218    HA   TYR  29           HA       TYR  29  -1.214   0.128  -5.548
  219   1HB   TYR  29          2HB       TYR  29  -0.414  -0.251  -8.438
  220   2HB   TYR  29          1HB       TYR  29   0.553  -0.847  -7.094
  221    HD1  TYR  29           HD2      TYR  29  -0.609  -2.378  -5.361
  222    HD2  TYR  29           HD1      TYR  29  -2.258  -1.488  -9.228
  223    HE1  TYR  29           HE2      TYR  29  -2.082  -4.368  -5.192
  224    HE2  TYR  29           HE1      TYR  29  -3.730  -3.475  -9.057
  225    HH   TYR  29           HH       TYR  29  -4.096  -5.248  -6.107
  226    H    ALA  30           H        ALA  30   0.709   0.857  -4.685
  227    HA   ALA  30           HA       ALA  30   1.862   3.318  -5.945
  228   1HB   ALA  30          1HB       ALA  30   0.756   2.900  -3.297
  229   2HB   ALA  30          3HB       ALA  30   2.453   3.367  -3.191
  230   3HB   ALA  30          2HB       ALA  30   1.306   4.400  -4.045
  231    H    ASN  31           H        ASN  31   3.920   2.903  -6.613
  232    HA   ASN  31           HA       ASN  31   5.372   0.571  -5.607
  233   1HB   ASN  31          2HB       ASN  31   7.209   1.533  -7.127
  234   2HB   ASN  31          1HB       ASN  31   5.708   1.049  -7.918
  235   1HD2  ASN  31          2HD2      ASN  31   4.883   4.328  -8.944
  236   2HD2  ASN  31          1HD2      ASN  31   4.415   2.697  -8.892
  237    H    TYR  32           H        TYR  32   5.774   1.032  -3.389
  238    HA   TYR  32           HA       TYR  32   7.158   3.525  -2.673
  239   1HB   TYR  32          2HB       TYR  32   5.517   2.606  -1.108
  240   2HB   TYR  32          1HB       TYR  32   6.422   1.094  -1.017
  241    HD1  TYR  32           HD1      TYR  32   7.396   4.721  -0.920
  242    HD2  TYR  32           HD2      TYR  32   7.530   0.892   1.017
  243    HE1  TYR  32           HE1      TYR  32   8.829   5.676   0.867
  244    HE2  TYR  32           HE2      TYR  32   8.962   1.844   2.803
  245    HH   TYR  32           HH       TYR  32   9.456   5.226   3.156
  246    H    GLU  33           H        GLU  33   8.773   2.394  -4.458
  247    HA   GLU  33           HA       GLU  33  10.813   1.236  -4.833
  248   1HB   GLU  33          2HB       GLU  33  11.534   2.682  -2.277
  249   2HB   GLU  33          1HB       GLU  33  12.584   2.317  -3.647
  250   1HG   GLU  33          2HG       GLU  33  10.168   3.855  -4.347
  251   2HG   GLU  33          1HG       GLU  33  11.291   4.707  -3.285
  252    H    GLY  34           H        GLY  34  10.385  -0.981  -4.430
  253   1HA   GLY  34          2HA       GLY  34  11.341  -2.900  -3.292
  254   2HA   GLY  34          1HA       GLY  34  11.449  -1.935  -1.822
  255    H    CYS  35           H        CYS  35   8.798  -0.899  -1.774
  256    HA   CYS  35           HA       CYS  35   7.294  -3.438  -1.277
  257   1HB   CYS  35          2HB       CYS  35   7.770  -1.109   0.352
  258   2HB   CYS  35          1HB       CYS  35   6.037  -1.298   0.075
  259    H    LEU  36           H        LEU  36   4.977  -3.386  -1.696
  260    HA   LEU  36           HA       LEU  36   4.127  -1.230  -3.566
  261   1HB   LEU  36          2HB       LEU  36   4.686  -3.077  -4.999
  262   2HB   LEU  36          1HB       LEU  36   3.840  -4.216  -3.966
  263    HG   LEU  36           HG       LEU  36   2.663  -3.397  -6.137
  264   1HD1  LEU  36          1HD1      LEU  36   1.773  -4.286  -3.669
  265   2HD1  LEU  36          3HD1      LEU  36   0.729  -2.919  -4.032
  266   3HD1  LEU  36          2HD1      LEU  36   0.846  -4.266  -5.164
  267   1HD2  LEU  36          3HD2      LEU  36   2.502  -0.960  -4.373
  268   2HD2  LEU  36          2HD2      LEU  36   2.823  -1.059  -6.100
  269   3HD2  LEU  36          1HD2      LEU  36   1.197  -1.341  -5.484
  270    H    TRP  37           H        TRP  37   2.412  -0.279  -2.629
  271    HA   TRP  37           HA       TRP  37   0.688  -1.887  -0.832
  272   1HB   TRP  37          2HB       TRP  37   0.558   1.096  -1.351
  273   2HB   TRP  37          1HB       TRP  37  -0.154   0.197  -0.017
  274    HD1  TRP  37           HD1      TRP  37   3.382   0.869  -1.436
  275    HE1  TRP  37           HE1      TRP  37   5.008   0.991   0.563
  276    HE3  TRP  37           HE3      TRP  37   0.158  -0.175   2.374
  277    HZ2  TRP  37           HZ2      TRP  37   4.935   0.679   3.414
  278    HZ3  TRP  37           HZ3      TRP  37   0.943  -0.267   4.709
  279    HH2  TRP  37           HH2      TRP  37   3.336   0.166   5.240
  280    H    ASN  38           H        ASN  38  -1.770  -1.134  -1.058
  281    HA   ASN  38           HA       ASN  38  -2.450  -0.939  -3.953
  282   1HB   ASN  38          2HB       ASN  38  -2.572  -3.304  -3.407
  283   2HB   ASN  38          1HB       ASN  38  -3.542  -2.961  -1.976
  284   1HD2  ASN  38          2HD2      ASN  38  -6.505  -2.198  -3.917
  285   2HD2  ASN  38          1HD2      ASN  38  -5.696  -1.728  -2.501
  286    H    ALA  39           H        ALA  39  -3.730   0.801  -4.174
  287    HA   ALA  39           HA       ALA  39  -5.341   1.741  -1.879
  288   1HB   ALA  39          2HB       ALA  39  -4.150   2.951  -4.254
  289   2HB   ALA  39          1HB       ALA  39  -5.836   3.424  -4.050
  290   3HB   ALA  39          3HB       ALA  39  -4.675   3.716  -2.754
  291    H    THR  40           H        THR  40  -7.564   1.706  -1.863
  292    HA   THR  40           HA       THR  40  -8.873  -0.061  -3.816
  293    HB   THR  40           HB       THR  40 -10.690  -0.122  -2.292
  294    HG1  THR  40           HG1      THR  40 -10.586   1.514  -0.503
  295   1HG2  THR  40          1HG2      THR  40  -8.170  -0.718  -1.443
  296   2HG2  THR  40          3HG2      THR  40  -8.677   0.420  -0.193
  297   3HG2  THR  40          2HG2      THR  40  -9.625  -1.037  -0.499
  298    H    GLY  41           H        GLY  41 -11.480   1.321  -3.499
  299   1HA   GLY  41          2HA       GLY  41 -11.059   3.336  -5.635
  300   2HA   GLY  41          1HA       GLY  41 -12.609   2.624  -5.185
  301    H    VAL  42           H        VAL  42 -11.476   3.231  -2.268
  302    HA   VAL  42           HA       VAL  42 -12.549   6.020  -2.247
  303    HB   VAL  42           HB       VAL  42 -12.564   3.853  -0.127
  304   1HG1  VAL  42          3HG1      VAL  42 -13.072   6.814   0.027
  305   2HG1  VAL  42          2HG1      VAL  42 -13.963   5.714   1.079
  306   3HG1  VAL  42          1HG1      VAL  42 -12.202   5.777   1.158
  307   1HG2  VAL  42          3HG2      VAL  42 -14.286   4.018  -2.095
  308   2HG2  VAL  42          2HG2      VAL  42 -14.888   3.793  -0.453
  309   3HG2  VAL  42          1HG2      VAL  42 -14.922   5.393  -1.194
  310    H    VAL  43           H        VAL  43 -10.455   6.965  -2.656
  311    HA   VAL  43           HA       VAL  43  -8.794   7.120  -0.212
  312    HB   VAL  43           HB       VAL  43  -7.776   6.224  -2.920
  313   1HG1  VAL  43          2HG1      VAL  43  -6.393   8.098  -1.937
  314   2HG1  VAL  43          1HG1      VAL  43  -6.115   7.070  -0.533
  315   3HG1  VAL  43          3HG1      VAL  43  -5.523   6.575  -2.117
  316   1HG2  VAL  43          3HG2      VAL  43  -8.544   4.474  -1.343
  317   2HG2  VAL  43          2HG2      VAL  43  -6.798   4.400  -1.579
  318   3HG2  VAL  43          1HG2      VAL  43  -7.460   5.118  -0.110
  319    H    VAL  44           H        VAL  44  -7.538   9.076  -0.140
  320    HA   VAL  44           HA       VAL  44  -8.728  11.282  -1.600
  321    HB   VAL  44           HB       VAL  44  -6.278  11.140   0.180
  322   1HG1  VAL  44          3HG1      VAL  44  -7.768  13.511  -0.987
  323   2HG1  VAL  44          2HG1      VAL  44  -6.554  13.626   0.287
  324   3HG1  VAL  44          1HG1      VAL  44  -6.096  13.054  -1.316
  325   1HG2  VAL  44          2HG2      VAL  44  -9.132  12.060   0.652
  326   2HG2  VAL  44          1HG2      VAL  44  -8.373  10.623   1.338
  327   3HG2  VAL  44          3HG2      VAL  44  -7.815  12.227   1.815
  328    H    CYS  45           H        CYS  45  -7.956  12.312  -3.424
  329    HA   CYS  45           HA       CYS  45  -5.248  11.574  -4.401
  330   1HB   CYS  45          2HB       CYS  45  -7.859  11.031  -5.739
  331   2HB   CYS  45          1HB       CYS  45  -6.524  11.568  -6.757
  332    H    THR  46           H        THR  46  -4.320  13.156  -5.778
  333    HA   THR  46           HA       THR  46  -5.865  15.631  -6.287
  334    HB   THR  46           HB       THR  46  -4.759  15.905  -4.047
  335    HG1  THR  46           HG1      THR  46  -4.815  17.858  -4.796
  336   1HG2  THR  46          3HG2      THR  46  -2.716  14.484  -5.107
  337   2HG2  THR  46          2HG2      THR  46  -2.101  16.120  -5.347
  338   3HG2  THR  46          1HG2      THR  46  -2.521  15.564  -3.726
  339    H    GLY  47           H        GLY  47  -5.077  16.754  -8.105
  340   1HA   GLY  47          2HA       GLY  47  -3.696  17.167  -9.983
  341   2HA   GLY  47          1HA       GLY  47  -2.476  16.116  -9.258
  342    H    ASP  48           H        ASP  48  -5.832  15.661 -10.441
  343    HA   ASP  48           HA       ASP  48  -6.702  14.006 -11.862
  344   1HB   ASP  48          2HB       ASP  48  -3.824  14.086 -12.790
  345   2HB   ASP  48          1HB       ASP  48  -5.015  13.007 -13.512
  346    H    GLU  49           H        GLU  49  -5.145  13.491  -9.223
  347    HA   GLU  49           HA       GLU  49  -5.065  11.588  -7.860
  348   1HB   GLU  49          2HB       GLU  49  -5.413   9.862 -10.314
  349   2HB   GLU  49          1HB       GLU  49  -5.791   9.466  -8.638
  350   1HG   GLU  49          2HG       GLU  49  -7.439  11.472  -8.766
  351   2HG   GLU  49          1HG       GLU  49  -7.276  11.296 -10.514
  352    H    THR  50           H        THR  50  -2.821  12.851  -9.362
  353    HA   THR  50           HA       THR  50  -0.979  10.711 -10.061
  354    HB   THR  50           HB       THR  50   0.644  12.832  -9.510
  355    HG1  THR  50           HG1      THR  50  -0.734  14.356  -8.966
  356   1HG2  THR  50          3HG2      THR  50   0.327  11.574 -11.663
  357   2HG2  THR  50          2HG2      THR  50  -1.062  12.610 -12.000
  358   3HG2  THR  50          1HG2      THR  50   0.553  13.311 -11.878
  359    H    GLN  51           H        GLN  51  -1.442  12.856  -7.262
  360    HA   GLN  51           HA       GLN  51   0.237  10.967  -5.663
  361   1HB   GLN  51          2HB       GLN  51  -0.546  13.706  -4.702
  362   2HB   GLN  51          1HB       GLN  51   0.856  12.732  -4.259
  363   1HG   GLN  51          2HG       GLN  51   1.387  13.010  -6.867
  364   2HG   GLN  51          1HG       GLN  51   0.435  14.477  -6.642
  365   1HE2  GLN  51          2HE2      GLN  51   4.024  15.241  -5.846
  366   2HE2  GLN  51          1HE2      GLN  51   3.217  14.645  -7.216
  367    H    CYS  52           H        CYS  52  -0.776   9.944  -3.931
  368    HA   CYS  52           HA       CYS  52  -3.408  10.981  -3.065
  369   1HB   CYS  52          2HB       CYS  52  -3.071   8.162  -4.115
  370   2HB   CYS  52          1HB       CYS  52  -4.550   8.843  -3.439
  371    H    TYR  53           H        TYR  53  -4.164  10.061  -1.064
  372    HA   TYR  53           HA       TYR  53  -2.224   8.344   0.374
  373   1HB   TYR  53          2HB       TYR  53  -1.492  10.227   1.453
  374   2HB   TYR  53          1HB       TYR  53  -2.917  11.155   1.002
  375    HD1  TYR  53           HD1      TYR  53  -1.570   8.683   3.442
  376    HD2  TYR  53           HD2      TYR  53  -4.812  11.330   2.464
  377    HE1  TYR  53           HE1      TYR  53  -2.503   8.383   5.722
  378    HE2  TYR  53           HE2      TYR  53  -5.738  11.034   4.742
  379    HH   TYR  53           HH       TYR  53  -4.168   8.876   7.104
  380    H    GLY  54           H        GLY  54  -3.197   7.232   2.227
  381   1HA   GLY  54          2HA       GLY  54  -5.618   7.233   3.372
  382   2HA   GLY  54          1HA       GLY  54  -6.075   6.705   1.751
  383    H    THR  55           H        THR  55  -6.607   4.543   2.230
  384    HA   THR  55           HA       THR  55  -4.577   2.925   3.683
  385    HB   THR  55           HB       THR  55  -6.355   1.080   3.348
  386    HG1  THR  55           HG1      THR  55  -8.481   2.289   3.107
  387   1HG2  THR  55          1HG2      THR  55  -5.967   2.870   5.327
  388   2HG2  THR  55          3HG2      THR  55  -7.621   3.283   4.879
  389   3HG2  THR  55          2HG2      THR  55  -7.227   1.639   5.377
  390    H    TRP  56           H        TRP  56  -3.122   1.832   2.570
  391    HA   TRP  56           HA       TRP  56  -3.687   1.059  -0.256
  392   1HB   TRP  56          2HB       TRP  56  -1.039   1.714   1.034
  393   2HB   TRP  56          1HB       TRP  56  -1.321   1.365  -0.673
  394    HD1  TRP  56           HD1      TRP  56  -2.185   4.001   1.983
  395    HE1  TRP  56           HE1      TRP  56  -2.641   6.224   0.769
  396    HE3  TRP  56           HE3      TRP  56  -1.872   2.404  -2.836
  397    HZ2  TRP  56           HZ2      TRP  56  -2.842   7.195  -1.944
  398    HZ3  TRP  56           HZ3      TRP  56  -2.200   3.975  -4.722
  399    HH2  TRP  56           HH2      TRP  56  -2.688   6.365  -4.280
  400    H    VAL  57           H        VAL  57  -4.514  -1.016   0.896
  401    HA   VAL  57           HA       VAL  57  -3.073  -2.651   2.593
  402    HB   VAL  57           HB       VAL  57  -4.632  -3.503   0.132
  403   1HG1  VAL  57          3HG1      VAL  57  -2.903  -5.119   1.530
  404   2HG1  VAL  57          2HG1      VAL  57  -4.410  -5.363   2.410
  405   3HG1  VAL  57          1HG1      VAL  57  -4.337  -5.691   0.679
  406   1HG2  VAL  57          3HG2      VAL  57  -5.346  -2.451   2.717
  407   2HG2  VAL  57          2HG2      VAL  57  -6.408  -2.908   1.384
  408   3HG2  VAL  57          1HG2      VAL  57  -5.930  -4.110   2.583
  409    HA   PRO  58           HA       PRO  58   0.698  -3.413   0.375
  410   1HB   PRO  58          2HB       PRO  58   1.797  -5.089   2.276
  411   2HB   PRO  58          1HB       PRO  58   1.784  -3.319   2.408
  412   1HG   PRO  58          2HG       PRO  58   0.132  -5.319   3.868
  413   2HG   PRO  58          1HG       PRO  58   0.586  -3.672   4.345
  414   1HD   PRO  58          2HD       PRO  58  -1.931  -4.480   3.299
  415   2HD   PRO  58          1HD       PRO  58  -1.369  -2.812   3.507
  416    H    ILE  59           H        ILE  59   1.514  -5.144  -0.926
  417    HA   ILE  59           HA       ILE  59   0.431  -7.851  -0.569
  418    HB   ILE  59           HB       ILE  59  -0.547  -7.872  -2.877
  419   1HG1  ILE  59          2HG1      ILE  59   0.757  -5.731  -3.492
  420   2HG1  ILE  59          1HG1      ILE  59  -0.888  -5.885  -4.095
  421   1HG2  ILE  59          3HG2      ILE  59  -1.898  -7.582  -0.761
  422   2HG2  ILE  59          2HG2      ILE  59  -1.852  -5.842  -1.044
  423   3HG2  ILE  59          1HG2      ILE  59  -2.653  -6.903  -2.202
  424   1HD1  ILE  59          2HD1      ILE  59  -1.593  -4.578  -1.977
  425   2HD1  ILE  59          1HD1      ILE  59   0.114  -4.174  -1.814
  426   3HD1  ILE  59          3HD1      ILE  59  -0.775  -3.678  -3.248
  427    H    GLY  60           H        GLY  60   2.366  -5.589  -2.521
  428   1HA   GLY  60          2HA       GLY  60   4.024  -7.959  -3.271
  429   2HA   GLY  60          1HA       GLY  60   3.570  -6.765  -4.481
  430    H    LEU  61           H        LEU  61   5.927  -6.605  -4.747
  431    HA   LEU  61           HA       LEU  61   7.266  -5.039  -2.602
  432   1HB   LEU  61          2HB       LEU  61   8.531  -6.193  -5.097
  433   2HB   LEU  61          1HB       LEU  61   9.338  -5.666  -3.619
  434    HG   LEU  61           HG       LEU  61   7.523  -8.065  -3.968
  435   1HD1  LEU  61          2HD1      LEU  61  10.181  -7.889  -4.403
  436   2HD1  LEU  61          1HD1      LEU  61  10.194  -8.180  -2.664
  437   3HD1  LEU  61          3HD1      LEU  61   9.420  -9.338  -3.745
  438   1HD2  LEU  61          2HD2      LEU  61   8.135  -6.433  -1.598
  439   2HD2  LEU  61          1HD2      LEU  61   6.870  -7.637  -1.837
  440   3HD2  LEU  61          3HD2      LEU  61   8.496  -8.146  -1.387
  441    H    ALA  62           H        ALA  62   6.035  -4.821  -5.887
  442    HA   ALA  62           HA       ALA  62   5.907  -2.017  -5.876
  443   1HB   ALA  62          3HB       ALA  62   8.594  -3.057  -6.430
  444   2HB   ALA  62          2HB       ALA  62   8.010  -1.914  -7.640
  445   3HB   ALA  62          1HB       ALA  62   8.086  -1.440  -5.943
  446    H    ILE  63           H        ILE  63   4.180  -3.826  -6.985
  447    HA   ILE  63           HA       ILE  63   3.410  -2.852  -9.385
  448    HB   ILE  63           HB       ILE  63   5.884  -4.329  -9.807
  449   1HG1  ILE  63          2HG1      ILE  63   5.452  -2.017 -10.542
  450   2HG1  ILE  63          1HG1      ILE  63   5.786  -3.048 -11.931
  451   1HG2  ILE  63          2HG2      ILE  63   3.413  -5.172 -11.317
  452   2HG2  ILE  63          1HG2      ILE  63   5.009  -5.237 -12.067
  453   3HG2  ILE  63          3HG2      ILE  63   4.675  -6.188 -10.619
  454   1HD1  ILE  63          3HD1      ILE  63   3.097  -3.338 -11.787
  455   2HD1  ILE  63          2HD1      ILE  63   3.252  -1.709 -11.127
  456   3HD1  ILE  63          1HD1      ILE  63   3.873  -2.072 -12.738
  457    HA   PRO  64           HA       PRO  64   1.837  -7.377  -9.329
  458   1HB   PRO  64          2HB       PRO  64   2.399  -8.835  -7.055
  459   2HB   PRO  64          1HB       PRO  64   3.320  -8.922  -8.569
  460   1HG   PRO  64          2HG       PRO  64   4.039  -7.588  -6.009
  461   2HG   PRO  64          1HG       PRO  64   5.097  -8.224  -7.273
  462   1HD   PRO  64          2HD       PRO  64   4.491  -5.514  -6.862
  463   2HD   PRO  64          1HD       PRO  64   5.219  -6.188  -8.332
  464    H    GLU  65           H        GLU  65  -0.144  -8.112  -8.500
  465    HA   GLU  65           HA       GLU  65  -1.542  -6.192  -6.795
  466   1HB   GLU  65          2HB       GLU  65  -3.538  -7.366  -7.458
  467   2HB   GLU  65          1HB       GLU  65  -2.502  -7.289  -8.882
  468   1HG   GLU  65          2HG       GLU  65  -1.685  -9.559  -8.447
  469   2HG   GLU  65          1HG       GLU  65  -2.677  -9.651  -6.993
  470    H    ASN  66           H        ASN  66  -3.438  -8.082  -5.722
  471    HA   ASN  66           HA       ASN  66  -1.915  -8.945  -3.342
  472   1HB   ASN  66          2HB       ASN  66  -4.244  -7.679  -3.458
  473   2HB   ASN  66          1HB       ASN  66  -4.870  -9.319  -3.630
  474   1HD2  ASN  66          2HD2      ASN  66  -4.747  -8.675   0.014
  475   2HD2  ASN  66          1HD2      ASN  66  -5.631  -8.094  -1.313
  476    H    ALA  67           H        ALA  67  -1.208 -10.521  -5.461
  477    HA   ALA  67           HA       ALA  67  -1.788 -13.151  -4.555
  478   1HB   ALA  67          1HB       ALA  67  -4.030 -12.385  -5.651
  479   2HB   ALA  67          3HB       ALA  67  -3.178 -12.631  -7.176
  480   3HB   ALA  67          2HB       ALA  67  -3.393 -13.978  -6.058
  481    H    ALA  68           H        ALA  68   0.234 -13.889  -5.014
  482    HA   ALA  68           HA       ALA  68   2.053 -13.020  -6.902
  483   1HB   ALA  68          3HB       ALA  68   1.533 -15.831  -5.909
  484   2HB   ALA  68          2HB       ALA  68   2.917 -15.419  -6.924
  485   3HB   ALA  68          1HB       ALA  68   2.743 -14.687  -5.329
  486    H    ALA  69           H        ALA  69   1.280 -12.493  -8.949
  487    HA   ALA  69           HA       ALA  69  -0.549 -14.088 -10.463
  488   1HB   ALA  69          1HB       ALA  69   0.588 -11.602 -10.773
  489   2HB   ALA  69          3HB       ALA  69   1.396 -12.531 -12.036
  490   3HB   ALA  69          2HB       ALA  69  -0.364 -12.429 -12.005
  491    H    HIS  70           HN       HIS  70  -0.169 -15.672 -12.044
  492    HA   HIS  70           HA       HIS  70   2.345 -17.144 -11.770
  493   1HB   HIS  70          2HB       HIS  70  -0.295 -17.783 -12.503
  494   2HB   HIS  70          1HB       HIS  70   0.668 -18.044 -13.957
  495    HD1  HIS  70           HD1      HIS  70   0.141 -19.318 -10.485
  496    HD2  HIS  70           HD2      HIS  70   2.698 -20.061 -13.693
  497    HE1  HIS  70           HE1      HIS  70   1.339 -21.486  -9.959
   
  No H/Q in entry =         497
  Start of MODEL    3
    1   1H    GLU   1          1H        GLU   1  13.170  -7.196  -0.138
    2   2H    GLU   1          3H        GLU   1  13.432  -5.538  -0.370
    3   3H    GLU   1          2H        GLU   1  13.763  -6.246   1.137
    4    HA   GLU   1           HA       GLU   1  11.750  -5.152   1.455
    5   1HB   GLU   1          2HB       GLU   1   9.980  -5.088  -0.113
    6   2HB   GLU   1          1HB       GLU   1  11.439  -4.901  -1.083
    7   1HG   GLU   1          2HG       GLU   1  10.078  -7.566  -0.613
    8   2HG   GLU   1          1HG       GLU   1   9.769  -6.545  -2.013
    9    H    THR   2           H        THR   2  11.887  -8.459   0.099
   10    HA   THR   2           HA       THR   2  11.050 -10.470   0.975
   11    HB   THR   2           HB       THR   2  10.788  -9.242   3.675
   12    HG1  THR   2           HG1      THR   2  13.224  -9.623   3.667
   13   1HG2  THR   2          2HG2      THR   2  11.271 -11.840   2.467
   14   2HG2  THR   2          1HG2      THR   2  12.488 -11.467   3.688
   15   3HG2  THR   2          3HG2      THR   2  10.777 -11.450   4.114
   16    H    VAL   3           H        VAL   3   8.969 -10.577   0.074
   17    HA   VAL   3           HA       VAL   3   6.751  -9.015   0.596
   18    HB   VAL   3           HB       VAL   3   6.607 -12.036   0.409
   19   1HG1  VAL   3          3HG1      VAL   3   4.700  -9.852   0.303
   20   2HG1  VAL   3          2HG1      VAL   3   4.679 -10.777  -1.196
   21   3HG1  VAL   3          1HG1      VAL   3   4.402 -11.589   0.342
   22   1HG2  VAL   3          3HG2      VAL   3   7.897 -10.259  -1.386
   23   2HG2  VAL   3          2HG2      VAL   3   7.496 -11.953  -1.660
   24   3HG2  VAL   3          1HG2      VAL   3   6.358 -10.690  -2.129
   25    H    GLU   4           H        GLU   4   8.275 -11.299   2.752
   26    HA   GLU   4           HA       GLU   4   6.146 -11.766   4.569
   27   1HB   GLU   4          2HB       GLU   4   8.812 -12.458   4.445
   28   2HB   GLU   4          1HB       GLU   4   8.774 -11.367   5.831
   29   1HG   GLU   4          2HG       GLU   4   6.565 -13.335   5.713
   30   2HG   GLU   4          1HG       GLU   4   8.169 -14.016   5.989
   31    H    SER   5           H        SER   5   8.729  -9.275   4.832
   32    HA   SER   5           HA       SER   5   7.250  -7.885   6.932
   33   1HB   SER   5          2HB       SER   5   9.748  -7.890   6.807
   34   2HB   SER   5          1HB       SER   5   9.644  -6.937   5.329
   35    HG   SER   5           HG       SER   5   9.450  -5.266   6.571
   36    H    CYS   6           H        CYS   6   7.934  -7.305   3.485
   37    HA   CYS   6           HA       CYS   6   6.781  -4.777   3.180
   38   1HB   CYS   6          2HB       CYS   6   7.402  -7.010   1.456
   39   2HB   CYS   6          1HB       CYS   6   5.854  -6.307   0.984
   40    H    LEU   7           H        LEU   7   5.228  -7.896   3.643
   41    HA   LEU   7           HA       LEU   7   2.555  -6.643   3.374
   42   1HB   LEU   7          2HB       LEU   7   3.312  -9.539   3.855
   43   2HB   LEU   7          1HB       LEU   7   1.698  -8.932   3.469
   44    HG   LEU   7           HG       LEU   7   4.160  -8.782   1.710
   45   1HD1  LEU   7          3HD1      LEU   7   1.534 -10.273   1.547
   46   2HD1  LEU   7          2HD1      LEU   7   2.595 -10.057   0.154
   47   3HD1  LEU   7          1HD1      LEU   7   3.162 -10.949   1.566
   48   1HD2  LEU   7          2HD2      LEU   7   1.389  -7.613   1.339
   49   2HD2  LEU   7          1HD2      LEU   7   2.894  -6.710   1.520
   50   3HD2  LEU   7          3HD2      LEU   7   2.619  -7.690   0.078
   51    H    ALA   8           H        ALA   8   4.840  -7.687   5.723
   52    HA   ALA   8           HA       ALA   8   2.976  -7.925   7.947
   53   1HB   ALA   8          2HB       ALA   8   5.476  -8.773   7.719
   54   2HB   ALA   8          1HB       ALA   8   5.858  -7.161   8.324
   55   3HB   ALA   8          3HB       ALA   8   4.862  -8.251   9.288
   56    H    LYS   9           H        LYS   9   4.023  -5.416   6.043
   57    HA   LYS   9           HA       LYS   9   4.576  -3.185   7.563
   58   1HB   LYS   9          2HB       LYS   9   3.216  -3.811   5.014
   59   2HB   LYS   9          1HB       LYS   9   2.844  -2.224   5.661
   60   1HG   LYS   9          2HG       LYS   9   5.208  -1.666   5.780
   61   2HG   LYS   9          1HG       LYS   9   5.649  -3.310   5.326
   62   1HD   LYS   9          2HD       LYS   9   4.873  -3.047   3.119
   63   2HD   LYS   9          1HD       LYS   9   3.917  -1.626   3.529
   64   1HE   LYS   9          2HE       LYS   9   6.880  -1.862   3.101
   65   2HE   LYS   9          1HE       LYS   9   5.760  -0.649   2.482
   66   1HZ   LYS   9          3HZ       LYS   9   5.492  -0.049   4.961
   67   2HZ   LYS   9          2HZ       LYS   9   6.972  -0.864   5.156
   68   3HZ   LYS   9          1HZ       LYS   9   6.869   0.485   4.129
   69    HA   PRO  10           HA       PRO  10   0.982  -2.077   9.860
   70   1HB   PRO  10          2HB       PRO  10   0.254   0.445   9.004
   71   2HB   PRO  10          1HB       PRO  10   1.620   0.116  10.084
   72   1HG   PRO  10          2HG       PRO  10   1.644   0.777   7.167
   73   2HG   PRO  10          1HG       PRO  10   2.857   1.130   8.409
   74   1HD   PRO  10          2HD       PRO  10   3.069  -0.913   6.535
   75   2HD   PRO  10          1HD       PRO  10   3.961  -0.866   8.065
   76    H    HIS  11           H        HIS  11   0.788  -2.465   6.550
   77    HA   HIS  11           HA       HIS  11  -0.903  -3.306   5.213
   78   1HB   HIS  11          2HB       HIS  11  -1.937  -3.664   7.911
   79   2HB   HIS  11          1HB       HIS  11  -3.214  -3.413   6.716
   80    HD1  HIS  11           HD1      HIS  11   0.077  -5.379   6.709
   81    HD2  HIS  11           HD2      HIS  11  -3.933  -5.856   5.675
   82    HE1  HIS  11           HE1      HIS  11  -0.147  -7.720   5.769
   83    H    THR  12           H        THR  12  -0.864  -1.223   4.099
   84    HA   THR  12           HA       THR  12  -2.229   0.260   2.933
   85    HB   THR  12           HB       THR  12  -4.033  -1.312   4.236
   86    HG1  THR  12           HG1      THR  12  -5.392  -0.623   2.708
   87   1HG2  THR  12          3HG2      THR  12  -4.587   1.566   4.972
   88   2HG2  THR  12          2HG2      THR  12  -5.842   0.329   4.939
   89   3HG2  THR  12          1HG2      THR  12  -4.496   0.183   6.057
   90    H    GLU  13           H        GLU  13  -2.846   0.872   6.430
   91    HA   GLU  13           HA       GLU  13  -3.163   3.605   6.222
   92   1HB   GLU  13          2HB       GLU  13  -3.105   2.148   8.367
   93   2HB   GLU  13          1HB       GLU  13  -1.373   2.486   8.391
   94   1HG   GLU  13          2HG       GLU  13  -2.300   4.990   7.991
   95   2HG   GLU  13          1HG       GLU  13  -3.665   4.316   8.884
   96    H    ASN  14           H        ASN  14  -1.998   4.675   4.726
   97    HA   ASN  14           HA       ASN  14   0.460   5.857   5.227
   98   1HB   ASN  14          2HB       ASN  14   0.809   3.087   4.543
   99   2HB   ASN  14          1HB       ASN  14   1.437   4.072   3.220
  100   1HD2  ASN  14          2HD2      ASN  14   3.616   5.855   5.718
  101   2HD2  ASN  14          1HD2      ASN  14   2.330   6.341   4.724
  102    H    SER  15           H        SER  15   1.551   5.701   2.501
  103    HA   SER  15           HA       SER  15  -0.505   6.004   0.557
  104   1HB   SER  15          2HB       SER  15  -0.419   8.523   0.378
  105   2HB   SER  15          1HB       SER  15  -1.244   7.921   1.812
  106    HG   SER  15           HG       SER  15   1.517   8.403   1.911
  107    H    PHE  16           H        PHE  16   0.472   7.850  -1.127
  108    HA   PHE  16           HA       PHE  16   3.303   8.003  -1.361
  109   1HB   PHE  16          2HB       PHE  16   3.351   5.638  -1.710
  110   2HB   PHE  16          1HB       PHE  16   1.942   5.697  -2.769
  111    HD1  PHE  16           HD1      PHE  16   5.231   7.507  -2.554
  112    HD2  PHE  16           HD2      PHE  16   2.440   5.359  -5.011
  113    HE1  PHE  16           HE1      PHE  16   6.708   7.835  -4.517
  114    HE2  PHE  16           HE2      PHE  16   3.918   5.685  -6.972
  115    HZ   PHE  16           HZ       PHE  16   6.056   6.918  -6.728
  116    H    THR  17           H        THR  17   3.852   9.193  -3.328
  117    HA   THR  17           HA       THR  17   1.424  10.219  -4.711
  118    HB   THR  17           HB       THR  17   2.382  12.157  -3.955
  119    HG1  THR  17           HG1      THR  17   4.276  11.976  -5.980
  120   1HG2  THR  17          2HG2      THR  17   5.084  10.801  -4.220
  121   2HG2  THR  17          1HG2      THR  17   4.825  12.428  -3.589
  122   3HG2  THR  17          3HG2      THR  17   4.181  11.033  -2.722
  123    H    ASN  18           H        ASN  18   1.621  10.638  -7.060
  124    HA   ASN  18           HA       ASN  18   2.329  10.033  -9.234
  125   1HB   ASN  18          2HB       ASN  18   4.684  10.237  -8.061
  126   2HB   ASN  18          1HB       ASN  18   4.630   8.474  -8.088
  127   1HD2  ASN  18          2HD2      ASN  18   5.538  10.438 -11.466
  128   2HD2  ASN  18          1HD2      ASN  18   5.470  11.194  -9.948
  129    H    VAL  19           H        VAL  19   1.013   8.290  -6.957
  130    HA   VAL  19           HA       VAL  19   1.413   5.565  -7.339
  131    HB   VAL  19           HB       VAL  19  -1.282   6.932  -7.092
  132   1HG1  VAL  19          1HG1      VAL  19  -0.855   4.311  -7.513
  133   2HG1  VAL  19          3HG1      VAL  19  -0.589   4.348  -5.771
  134   3HG1  VAL  19          2HG1      VAL  19  -2.128   4.889  -6.441
  135   1HG2  VAL  19          2HG2      VAL  19   1.001   6.578  -5.221
  136   2HG2  VAL  19          1HG2      VAL  19  -0.262   7.808  -5.234
  137   3HG2  VAL  19          3HG2      VAL  19  -0.595   6.210  -4.569
  138    H    TRP  20           H        TRP  20   0.488   3.989  -8.760
  139    HA   TRP  20           HA       TRP  20  -0.581   5.128 -11.308
  140   1HB   TRP  20          2HB       TRP  20   0.905   3.913 -12.529
  141   2HB   TRP  20          1HB       TRP  20   1.808   3.768 -11.027
  142    HD1  TRP  20           HD1      TRP  20  -0.380   1.805 -13.427
  143    HE1  TRP  20           HE1      TRP  20  -0.338  -0.692 -12.779
  144    HE3  TRP  20           HE3      TRP  20   2.110   2.097  -8.979
  145    HZ2  TRP  20           HZ2      TRP  20   0.658  -2.343 -10.670
  146    HZ3  TRP  20           HZ3      TRP  20   2.593   0.046  -7.674
  147    HH2  TRP  20           HH2      TRP  20   1.866  -2.171  -8.516
  148    H    LYS  21           H        LYS  21  -1.579   2.986 -12.541
  149    HA   LYS  21           HA       LYS  21  -3.175   1.406 -10.612
  150   1HB   LYS  21          2HB       LYS  21  -4.543   3.428 -11.105
  151   2HB   LYS  21          1HB       LYS  21  -4.447   3.047 -12.826
  152   1HG   LYS  21          2HG       LYS  21  -5.261   0.648 -11.739
  153   2HG   LYS  21          1HG       LYS  21  -6.111   1.825 -10.737
  154   1HD   LYS  21          2HD       LYS  21  -7.596   1.509 -12.527
  155   2HD   LYS  21          1HD       LYS  21  -6.719   2.964 -13.003
  156   1HE   LYS  21          2HE       LYS  21  -5.530   1.872 -14.657
  157   2HE   LYS  21          1HE       LYS  21  -5.584   0.322 -13.818
  158   1HZ   LYS  21          3HZ       LYS  21  -8.199   0.912 -14.347
  159   2HZ   LYS  21          2HZ       LYS  21  -7.382   1.394 -15.757
  160   3HZ   LYS  21          1HZ       LYS  21  -7.233  -0.201 -15.187
  161    H    ASP  22           H        ASP  22  -2.792  -0.645 -11.304
  162    HA   ASP  22           HA       ASP  22  -2.204  -1.105 -14.153
  163   1HB   ASP  22          2HB       ASP  22  -1.244  -2.205 -11.783
  164   2HB   ASP  22          1HB       ASP  22  -2.288  -3.465 -12.442
  165    H    ASP  23           H        ASP  23  -3.684  -1.913 -15.536
  166    HA   ASP  23           HA       ASP  23  -6.375  -2.567 -14.603
  167   1HB   ASP  23          2HB       ASP  23  -6.916  -2.847 -16.932
  168   2HB   ASP  23          1HB       ASP  23  -5.812  -1.473 -16.848
  169    H    LYS  24           H        LYS  24  -3.400  -4.177 -15.173
  170    HA   LYS  24           HA       LYS  24  -4.502  -6.859 -15.529
  171   1HB   LYS  24          2HB       LYS  24  -1.782  -5.639 -15.148
  172   2HB   LYS  24          1HB       LYS  24  -1.987  -7.368 -14.856
  173   1HG   LYS  24          2HG       LYS  24  -3.325  -7.084 -17.221
  174   2HG   LYS  24          1HG       LYS  24  -2.059  -5.868 -17.403
  175   1HD   LYS  24          2HD       LYS  24  -0.564  -7.878 -16.427
  176   2HD   LYS  24          1HD       LYS  24  -1.829  -8.830 -17.206
  177   1HE   LYS  24          2HE       LYS  24  -0.998  -8.382 -19.249
  178   2HE   LYS  24          1HE       LYS  24  -1.003  -6.650 -18.922
  179   1HZ   LYS  24          1HZ       LYS  24   1.054  -7.999 -17.481
  180   2HZ   LYS  24          3HZ       LYS  24   1.202  -8.251 -19.151
  181   3HZ   LYS  24          2HZ       LYS  24   1.167  -6.670 -18.532
  182    H    THR  25           H        THR  25  -2.630  -5.219 -12.966
  183    HA   THR  25           HA       THR  25  -3.076  -7.182 -10.947
  184    HB   THR  25           HB       THR  25  -2.419  -5.471  -9.362
  185    HG1  THR  25           HG1      THR  25  -2.239  -3.256 -10.484
  186   1HG2  THR  25          1HG2      THR  25  -0.691  -6.250 -11.012
  187   2HG2  THR  25          3HG2      THR  25  -1.045  -4.819 -11.979
  188   3HG2  THR  25          2HG2      THR  25  -0.377  -4.643 -10.356
  189    H    LEU  26           H        LEU  26  -4.979  -4.592 -12.269
  190    HA   LEU  26           HA       LEU  26  -7.286  -4.168 -12.077
  191   1HB   LEU  26          2HB       LEU  26  -6.951  -6.899 -11.263
  192   2HB   LEU  26          1HB       LEU  26  -8.126  -6.132 -10.195
  193    HG   LEU  26           HG       LEU  26  -8.213  -6.245 -13.221
  194   1HD1  LEU  26          1HD1      LEU  26  -9.371  -7.799 -11.070
  195   2HD1  LEU  26          3HD1      LEU  26 -10.641  -7.033 -12.024
  196   3HD1  LEU  26          2HD1      LEU  26  -9.457  -8.078 -12.809
  197   1HD2  LEU  26          3HD2      LEU  26  -9.652  -4.524 -11.225
  198   2HD2  LEU  26          2HD2      LEU  26  -9.041  -4.100 -12.824
  199   3HD2  LEU  26          1HD2      LEU  26 -10.511  -5.063 -12.668
  200    H    ASP  27           H        ASP  27  -5.869  -2.488 -10.594
  201    HA   ASP  27           HA       ASP  27  -7.528  -1.710  -8.463
  202   1HB   ASP  27          2HB       ASP  27  -6.036  -4.031  -7.810
  203   2HB   ASP  27          1HB       ASP  27  -5.331  -2.696  -6.906
  204    H    ARG  28           H        ARG  28  -6.276  -0.271  -6.797
  205    HA   ARG  28           HA       ARG  28  -4.384   1.378  -8.356
  206   1HB   ARG  28          2HB       ARG  28  -6.269   2.329  -6.908
  207   2HB   ARG  28          1HB       ARG  28  -5.327   1.817  -5.510
  208   1HG   ARG  28          2HG       ARG  28  -4.702   4.082  -5.875
  209   2HG   ARG  28          1HG       ARG  28  -3.378   3.130  -6.547
  210   1HD   ARG  28          2HD       ARG  28  -3.897   4.794  -8.185
  211   2HD   ARG  28          1HD       ARG  28  -4.568   3.280  -8.790
  212    HE   ARG  28           HE       ARG  28  -6.325   5.170  -7.295
  213   1HH1  ARG  28          1HH2      ARG  28  -7.038   2.540  -8.823
  214   2HH1  ARG  28          2HH2      ARG  28  -7.825   3.213 -10.213
  215   1HH2  ARG  28          2HH1      ARG  28  -6.655   6.429  -9.649
  216   2HH2  ARG  28          1HH1      ARG  28  -7.608   5.415 -10.680
  217    H    TYR  29           H        TYR  29  -2.194   1.731  -7.636
  218    HA   TYR  29           HA       TYR  29  -1.272   0.148  -5.319
  219   1HB   TYR  29          2HB       TYR  29  -0.278  -0.320  -8.143
  220   2HB   TYR  29          1HB       TYR  29   0.492  -0.966  -6.695
  221    HD1  TYR  29           HD1      TYR  29  -2.484  -1.114  -8.863
  222    HD2  TYR  29           HD2      TYR  29  -0.548  -2.747  -5.392
  223    HE1  TYR  29           HE1      TYR  29  -4.075  -3.016  -8.870
  224    HE2  TYR  29           HE2      TYR  29  -2.141  -4.649  -5.400
  225    HH   TYR  29           HH       TYR  29  -4.416  -5.137  -6.245
  226    H    ALA  30           H        ALA  30   0.685   0.895  -4.475
  227    HA   ALA  30           HA       ALA  30   1.834   3.298  -5.838
  228   1HB   ALA  30          1HB       ALA  30   0.908   2.894  -3.040
  229   2HB   ALA  30          3HB       ALA  30   2.410   3.794  -3.247
  230   3HB   ALA  30          2HB       ALA  30   0.928   4.361  -4.017
  231    H    ASN  31           H        ASN  31   3.716   2.454  -6.653
  232    HA   ASN  31           HA       ASN  31   5.225   0.348  -5.447
  233   1HB   ASN  31          2HB       ASN  31   7.124   1.410  -6.919
  234   2HB   ASN  31          1HB       ASN  31   5.737   0.657  -7.705
  235   1HD2  ASN  31          2HD2      ASN  31   4.818   3.636  -9.315
  236   2HD2  ASN  31          1HD2      ASN  31   4.748   1.941  -9.257
  237    H    TYR  32           H        TYR  32   5.836   0.665  -3.333
  238    HA   TYR  32           HA       TYR  32   7.016   3.239  -2.508
  239   1HB   TYR  32          2HB       TYR  32   5.510   2.119  -0.946
  240   2HB   TYR  32          1HB       TYR  32   6.504   0.663  -0.991
  241    HD1  TYR  32           HD1      TYR  32   6.771   4.337  -0.276
  242    HD2  TYR  32           HD2      TYR  32   8.179   0.378   0.613
  243    HE1  TYR  32           HE1      TYR  32   8.191   5.249   1.541
  244    HE2  TYR  32           HE2      TYR  32   9.598   1.290   2.432
  245    HH   TYR  32           HH       TYR  32   9.496   4.739   3.284
  246    H    GLU  33           H        GLU  33   8.607   2.242  -4.441
  247    HA   GLU  33           HA       GLU  33  10.705   1.249  -4.937
  248   1HB   GLU  33          2HB       GLU  33  11.065   3.050  -2.547
  249   2HB   GLU  33          1HB       GLU  33  12.446   2.230  -3.277
  250   1HG   GLU  33          2HG       GLU  33  12.247   3.393  -5.289
  251   2HG   GLU  33          1HG       GLU  33  10.537   3.743  -5.031
  252    H    GLY  34           H        GLY  34  10.294  -0.997  -4.525
  253   1HA   GLY  34          2HA       GLY  34  11.441  -2.893  -3.487
  254   2HA   GLY  34          1HA       GLY  34  11.559  -1.952  -1.999
  255    H    CYS  35           H        CYS  35   8.784  -1.002  -2.118
  256    HA   CYS  35           HA       CYS  35   7.416  -3.587  -1.469
  257   1HB   CYS  35          2HB       CYS  35   7.957  -1.539   0.269
  258   2HB   CYS  35          1HB       CYS  35   6.337  -1.110  -0.278
  259    H    LEU  36           H        LEU  36   4.943  -3.349  -1.630
  260    HA   LEU  36           HA       LEU  36   4.125  -1.412  -3.730
  261   1HB   LEU  36          2HB       LEU  36   4.698  -3.464  -4.953
  262   2HB   LEU  36          1HB       LEU  36   3.634  -4.396  -3.904
  263    HG   LEU  36           HG       LEU  36   1.803  -2.702  -4.622
  264   1HD1  LEU  36          1HD1      LEU  36   3.964  -1.556  -5.916
  265   2HD1  LEU  36          3HD1      LEU  36   3.137  -2.418  -7.212
  266   3HD1  LEU  36          2HD1      LEU  36   2.270  -1.217  -6.258
  267   1HD2  LEU  36          1HD2      LEU  36   2.829  -5.124  -5.844
  268   2HD2  LEU  36          3HD2      LEU  36   1.156  -4.604  -5.646
  269   3HD2  LEU  36          2HD2      LEU  36   2.078  -4.089  -7.058
  270    H    TRP  37           H        TRP  37   2.539  -0.345  -2.632
  271    HA   TRP  37           HA       TRP  37   0.725  -1.880  -0.870
  272   1HB   TRP  37          2HB       TRP  37   0.637   1.088  -1.483
  273   2HB   TRP  37          1HB       TRP  37  -0.116   0.238  -0.141
  274    HD1  TRP  37           HD1      TRP  37   3.474   0.813  -1.481
  275    HE1  TRP  37           HE1      TRP  37   5.035   1.003   0.564
  276    HE3  TRP  37           HE3      TRP  37   0.121  -0.022   2.269
  277    HZ2  TRP  37           HZ2      TRP  37   4.872   0.830   3.418
  278    HZ3  TRP  37           HZ3      TRP  37   0.833  -0.014   4.628
  279    HH2  TRP  37           HH2      TRP  37   3.210   0.414   5.217
  280    H    ASN  38           H        ASN  38  -1.714  -1.031  -1.164
  281    HA   ASN  38           HA       ASN  38  -2.386  -0.785  -4.039
  282   1HB   ASN  38          2HB       ASN  38  -2.406  -3.148  -3.841
  283   2HB   ASN  38          1HB       ASN  38  -3.160  -3.090  -2.248
  284   1HD2  ASN  38          2HD2      ASN  38  -6.452  -2.470  -3.584
  285   2HD2  ASN  38          1HD2      ASN  38  -5.474  -2.158  -2.233
  286    H    ALA  39           H        ALA  39  -3.883   0.786  -4.190
  287    HA   ALA  39           HA       ALA  39  -5.469   1.515  -1.803
  288   1HB   ALA  39          3HB       ALA  39  -4.429   2.914  -4.109
  289   2HB   ALA  39          2HB       ALA  39  -6.170   3.169  -3.981
  290   3HB   ALA  39          1HB       ALA  39  -5.117   3.581  -2.628
  291    H    THR  40           H        THR  40  -7.658   1.211  -1.664
  292    HA   THR  40           HA       THR  40  -9.047   0.039  -4.039
  293    HB   THR  40           HB       THR  40  -8.651  -1.766  -2.474
  294    HG1  THR  40           HG1      THR  40 -10.944  -1.992  -1.691
  295   1HG2  THR  40          1HG2      THR  40  -9.853   0.081  -0.391
  296   2HG2  THR  40          3HG2      THR  40  -9.382  -1.596  -0.118
  297   3HG2  THR  40          2HG2      THR  40  -8.156  -0.387  -0.497
  298    H    GLY  41           H        GLY  41 -11.312   0.596  -4.185
  299   1HA   GLY  41          2HA       GLY  41 -13.200   1.960  -3.851
  300   2HA   GLY  41          1HA       GLY  41 -12.626   2.234  -2.205
  301    H    VAL  42           H        VAL  42 -13.300   4.503  -2.554
  302    HA   VAL  42           HA       VAL  42 -11.583   6.035  -4.429
  303    HB   VAL  42           HB       VAL  42 -13.923   6.911  -2.709
  304   1HG1  VAL  42          3HG1      VAL  42 -12.041   8.351  -4.551
  305   2HG1  VAL  42          2HG1      VAL  42 -13.723   8.872  -4.473
  306   3HG1  VAL  42          1HG1      VAL  42 -12.728   8.886  -3.017
  307   1HG2  VAL  42          2HG2      VAL  42 -14.501   5.378  -4.580
  308   2HG2  VAL  42          1HG2      VAL  42 -15.132   7.003  -4.843
  309   3HG2  VAL  42          3HG2      VAL  42 -13.688   6.468  -5.704
  310    H    VAL  43           H        VAL  43  -9.780   7.025  -3.684
  311    HA   VAL  43           HA       VAL  43  -9.556   7.479  -0.738
  312    HB   VAL  43           HB       VAL  43  -7.075   7.432  -2.336
  313   1HG1  VAL  43          1HG1      VAL  43  -7.476   7.475   0.241
  314   2HG1  VAL  43          3HG1      VAL  43  -7.761   5.743   0.058
  315   3HG1  VAL  43          2HG1      VAL  43  -6.204   6.433  -0.400
  316   1HG2  VAL  43          3HG2      VAL  43  -8.990   5.142  -2.323
  317   2HG2  VAL  43          2HG2      VAL  43  -7.794   5.597  -3.537
  318   3HG2  VAL  43          1HG2      VAL  43  -7.285   4.771  -2.064
  319    H    VAL  44           H        VAL  44  -7.360   9.203  -0.732
  320    HA   VAL  44           HA       VAL  44  -8.587  11.609  -1.978
  321    HB   VAL  44           HB       VAL  44  -7.067  12.887  -0.554
  322   1HG1  VAL  44          1HG1      VAL  44  -9.255  11.724   0.293
  323   2HG1  VAL  44          3HG1      VAL  44  -8.149  10.705   1.212
  324   3HG1  VAL  44          2HG1      VAL  44  -8.163  12.449   1.473
  325   1HG2  VAL  44          1HG2      VAL  44  -5.851  10.199  -0.226
  326   2HG2  VAL  44          3HG2      VAL  44  -5.073  11.776  -0.330
  327   3HG2  VAL  44          2HG2      VAL  44  -5.830  11.261   1.181
  328    H    CYS  45           H        CYS  45  -7.879  11.081  -4.173
  329    HA   CYS  45           HA       CYS  45  -4.928  11.328  -4.527
  330   1HB   CYS  45          2HB       CYS  45  -6.839  10.455  -6.689
  331   2HB   CYS  45          1HB       CYS  45  -5.118  10.102  -6.529
  332    H    THR  46           H        THR  46  -4.390  13.406  -4.917
  333    HA   THR  46           HA       THR  46  -6.248  15.075  -6.556
  334    HB   THR  46           HB       THR  46  -5.851  16.062  -4.391
  335    HG1  THR  46           HG1      THR  46  -5.691  17.828  -5.486
  336   1HG2  THR  46          2HG2      THR  46  -3.020  15.284  -4.984
  337   2HG2  THR  46          1HG2      THR  46  -3.319  16.675  -3.943
  338   3HG2  THR  46          3HG2      THR  46  -3.944  15.089  -3.496
  339    H    GLY  47           H        GLY  47  -4.967  16.834  -7.833
  340   1HA   GLY  47          2HA       GLY  47  -3.479  17.303  -9.586
  341   2HA   GLY  47          1HA       GLY  47  -2.295  16.338  -8.701
  342    H    ASP  48           H        ASP  48  -5.275  15.813 -10.624
  343    HA   ASP  48           HA       ASP  48  -5.686  14.212 -12.306
  344   1HB   ASP  48          2HB       ASP  48  -2.723  13.598 -12.217
  345   2HB   ASP  48          1HB       ASP  48  -3.838  13.369 -13.565
  346    H    GLU  49           H        GLU  49  -5.142  13.699  -9.278
  347    HA   GLU  49           HA       GLU  49  -5.343  11.876  -7.851
  348   1HB   GLU  49          2HB       GLU  49  -6.194  10.656 -10.475
  349   2HB   GLU  49          1HB       GLU  49  -6.073   9.674  -9.015
  350   1HG   GLU  49          2HG       GLU  49  -7.464  11.667  -7.959
  351   2HG   GLU  49          1HG       GLU  49  -7.951  11.921  -9.636
  352    H    THR  50           H        THR  50  -2.874  12.447  -9.714
  353    HA   THR  50           HA       THR  50  -1.484   9.904  -9.845
  354    HB   THR  50           HB       THR  50  -0.973  12.053 -11.197
  355    HG1  THR  50           HG1      THR  50   0.436  10.047 -10.600
  356   1HG2  THR  50          3HG2      THR  50   0.415  12.693  -8.580
  357   2HG2  THR  50          2HG2      THR  50   0.714  13.534 -10.100
  358   3HG2  THR  50          1HG2      THR  50  -0.874  13.625  -9.341
  359    H    GLN  51           H        GLN  51  -1.646  12.591  -7.538
  360    HA   GLN  51           HA       GLN  51   0.123  11.065  -5.693
  361   1HB   GLN  51          2HB       GLN  51  -1.043  13.816  -5.213
  362   2HB   GLN  51          1HB       GLN  51   0.350  13.072  -4.426
  363   1HG   GLN  51          2HG       GLN  51   1.288  12.969  -6.899
  364   2HG   GLN  51          1HG       GLN  51   0.141  14.283  -7.161
  365   1HE2  GLN  51          2HE2      GLN  51   2.138  16.666  -5.503
  366   2HE2  GLN  51          1HE2      GLN  51   0.765  16.355  -6.452
  367    H    CYS  52           H        CYS  52  -0.806  10.148  -3.825
  368    HA   CYS  52           HA       CYS  52  -3.522  10.959  -3.092
  369   1HB   CYS  52          2HB       CYS  52  -3.719   9.436  -5.101
  370   2HB   CYS  52          1HB       CYS  52  -3.084   8.146  -4.089
  371    H    TYR  53           H        TYR  53  -4.321   9.823  -1.176
  372    HA   TYR  53           HA       TYR  53  -2.329   8.185   0.281
  373   1HB   TYR  53          2HB       TYR  53  -1.703  10.201   1.273
  374   2HB   TYR  53          1HB       TYR  53  -3.307  10.905   1.091
  375    HD1  TYR  53           HD2      TYR  53  -5.192  10.085   2.570
  376    HD2  TYR  53           HD1      TYR  53  -1.084   9.042   3.278
  377    HE1  TYR  53           HE2      TYR  53  -5.759   9.417   4.889
  378    HE2  TYR  53           HE1      TYR  53  -1.653   8.371   5.598
  379    HH   TYR  53           HH       TYR  53  -4.350   9.265   7.155
  380    H    GLY  54           H        GLY  54  -3.363   7.272   2.327
  381   1HA   GLY  54          2HA       GLY  54  -5.771   7.096   3.337
  382   2HA   GLY  54          1HA       GLY  54  -6.192   6.569   1.705
  383    H    THR  55           H        THR  55  -6.660   4.394   2.119
  384    HA   THR  55           HA       THR  55  -4.606   2.815   3.591
  385    HB   THR  55           HB       THR  55  -6.349   0.946   3.288
  386    HG1  THR  55           HG1      THR  55  -7.408   2.227   1.571
  387   1HG2  THR  55          3HG2      THR  55  -6.014   2.732   5.248
  388   2HG2  THR  55          2HG2      THR  55  -7.640   3.196   4.749
  389   3HG2  THR  55          1HG2      THR  55  -7.317   1.544   5.275
  390    H    TRP  56           H        TRP  56  -3.127   1.803   2.467
  391    HA   TRP  56           HA       TRP  56  -3.656   1.023  -0.363
  392   1HB   TRP  56          2HB       TRP  56  -1.044   1.724   0.971
  393   2HB   TRP  56          1HB       TRP  56  -1.291   1.388  -0.744
  394    HD1  TRP  56           HD1      TRP  56  -2.268   3.977   1.929
  395    HE1  TRP  56           HE1      TRP  56  -2.777   6.197   0.728
  396    HE3  TRP  56           HE3      TRP  56  -1.848   2.435  -2.898
  397    HZ2  TRP  56           HZ2      TRP  56  -2.977   7.186  -1.979
  398    HZ3  TRP  56           HZ3      TRP  56  -2.208   4.010  -4.772
  399    HH2  TRP  56           HH2      TRP  56  -2.768   6.379  -4.324
  400    H    VAL  57           H        VAL  57  -4.461  -1.054   0.846
  401    HA   VAL  57           HA       VAL  57  -2.978  -2.676   2.497
  402    HB   VAL  57           HB       VAL  57  -4.614  -3.465   0.077
  403   1HG1  VAL  57          1HG1      VAL  57  -2.929  -5.229   0.590
  404   2HG1  VAL  57          3HG1      VAL  57  -3.523  -5.280   2.250
  405   3HG1  VAL  57          2HG1      VAL  57  -4.578  -5.761   0.921
  406   1HG2  VAL  57          2HG2      VAL  57  -5.102  -2.852   2.912
  407   2HG2  VAL  57          1HG2      VAL  57  -6.229  -2.859   1.556
  408   3HG2  VAL  57          3HG2      VAL  57  -5.838  -4.365   2.384
  409    HA   PRO  58           HA       PRO  58   0.769  -3.423   0.208
  410   1HB   PRO  58          2HB       PRO  58   1.941  -5.004   2.145
  411   2HB   PRO  58          1HB       PRO  58   1.881  -3.233   2.231
  412   1HG   PRO  58          2HG       PRO  58   0.320  -5.233   3.779
  413   2HG   PRO  58          1HG       PRO  58   0.711  -3.552   4.188
  414   1HD   PRO  58          2HD       PRO  58  -1.779  -4.520   3.185
  415   2HD   PRO  58          1HD       PRO  58  -1.305  -2.823   3.382
  416    H    ILE  59           H        ILE  59   1.322  -5.093  -1.235
  417    HA   ILE  59           HA       ILE  59   0.427  -7.849  -0.621
  418    HB   ILE  59           HB       ILE  59  -0.595  -7.976  -2.948
  419   1HG1  ILE  59          2HG1      ILE  59   0.505  -5.620  -3.441
  420   2HG1  ILE  59          1HG1      ILE  59  -1.046  -6.043  -4.163
  421   1HG2  ILE  59          2HG2      ILE  59  -1.809  -6.357  -0.704
  422   2HG2  ILE  59          1HG2      ILE  59  -2.730  -6.785  -2.140
  423   3HG2  ILE  59          3HG2      ILE  59  -2.086  -8.052  -1.098
  424   1HD1  ILE  59          1HD1      ILE  59  -0.923  -4.637  -1.500
  425   2HD1  ILE  59          3HD1      ILE  59  -0.829  -3.728  -3.008
  426   3HD1  ILE  59          2HD1      ILE  59  -2.254  -4.703  -2.651
  427    H    GLY  60           H        GLY  60   2.287  -5.651  -2.696
  428   1HA   GLY  60          2HA       GLY  60   3.874  -8.060  -3.490
  429   2HA   GLY  60          1HA       GLY  60   3.432  -6.835  -4.673
  430    H    LEU  61           H        LEU  61   5.966  -7.161  -4.694
  431    HA   LEU  61           HA       LEU  61   7.362  -5.554  -2.671
  432   1HB   LEU  61          2HB       LEU  61   8.501  -6.579  -5.280
  433   2HB   LEU  61          1HB       LEU  61   9.365  -6.203  -3.791
  434    HG   LEU  61           HG       LEU  61   7.431  -8.495  -4.247
  435   1HD1  LEU  61          1HD1      LEU  61  10.367  -8.170  -4.172
  436   2HD1  LEU  61          3HD1      LEU  61   9.749  -9.520  -3.221
  437   3HD1  LEU  61          2HD1      LEU  61   9.391  -9.419  -4.945
  438   1HD2  LEU  61          2HD2      LEU  61   8.000  -7.065  -1.840
  439   2HD2  LEU  61          1HD2      LEU  61   7.058  -8.542  -2.027
  440   3HD2  LEU  61          3HD2      LEU  61   8.794  -8.635  -1.729
  441    H    ALA  62           H        ALA  62   6.069  -5.164  -5.930
  442    HA   ALA  62           HA       ALA  62   5.957  -2.360  -5.782
  443   1HB   ALA  62          1HB       ALA  62   8.620  -3.333  -6.265
  444   2HB   ALA  62          3HB       ALA  62   8.061  -2.421  -7.668
  445   3HB   ALA  62          2HB       ALA  62   8.068  -1.670  -6.072
  446    H    ILE  63           H        ILE  63   4.244  -4.255  -6.907
  447    HA   ILE  63           HA       ILE  63   3.356  -3.155  -9.222
  448    HB   ILE  63           HB       ILE  63   5.852  -4.500  -9.801
  449   1HG1  ILE  63          2HG1      ILE  63   5.328  -2.243 -10.520
  450   2HG1  ILE  63          1HG1      ILE  63   5.489  -3.249 -11.957
  451   1HG2  ILE  63          1HG2      ILE  63   3.389  -5.467 -11.266
  452   2HG2  ILE  63          3HG2      ILE  63   4.995  -5.501 -11.993
  453   3HG2  ILE  63          2HG2      ILE  63   4.667  -6.437 -10.535
  454   1HD1  ILE  63          2HD1      ILE  63   2.763  -3.357 -11.037
  455   2HD1  ILE  63          1HD1      ILE  63   3.252  -1.670 -11.192
  456   3HD1  ILE  63          3HD1      ILE  63   3.379  -2.756 -12.575
  457    HA   PRO  64           HA       PRO  64   1.818  -7.685  -9.281
  458   1HB   PRO  64          2HB       PRO  64   2.357  -9.176  -7.018
  459   2HB   PRO  64          1HB       PRO  64   3.280  -9.253  -8.531
  460   1HG   PRO  64          2HG       PRO  64   4.011  -7.962  -5.953
  461   2HG   PRO  64          1HG       PRO  64   5.061  -8.582  -7.231
  462   1HD   PRO  64          2HD       PRO  64   4.469  -5.876  -6.775
  463   2HD   PRO  64          1HD       PRO  64   5.200  -6.528  -8.252
  464    H    GLU  65           H        GLU  65  -0.287  -7.847  -8.841
  465    HA   GLU  65           HA       GLU  65  -1.623  -6.092  -7.055
  466   1HB   GLU  65          2HB       GLU  65  -3.632  -7.134  -7.780
  467   2HB   GLU  65          1HB       GLU  65  -2.531  -7.288  -9.149
  468   1HG   GLU  65          2HG       GLU  65  -1.914  -9.561  -7.815
  469   2HG   GLU  65          1HG       GLU  65  -3.607  -9.386  -7.347
  470    H    ASN  66           H        ASN  66  -3.597  -7.883  -5.943
  471    HA   ASN  66           HA       ASN  66  -2.077  -8.795  -3.557
  472   1HB   ASN  66          2HB       ASN  66  -4.121  -8.561  -2.341
  473   2HB   ASN  66          1HB       ASN  66  -4.034  -7.154  -3.405
  474   1HD2  ASN  66          2HD2      ASN  66  -7.160  -9.636  -3.759
  475   2HD2  ASN  66          1HD2      ASN  66  -6.079  -9.688  -2.450
  476    H    ALA  67           H        ALA  67  -2.366 -10.326  -6.143
  477    HA   ALA  67           HA       ALA  67  -2.954 -12.902  -4.921
  478   1HB   ALA  67          3HB       ALA  67  -4.968 -11.528  -6.607
  479   2HB   ALA  67          2HB       ALA  67  -4.657 -13.214  -7.020
  480   3HB   ALA  67          1HB       ALA  67  -5.188 -12.789  -5.394
  481    H    ALA  68           H        ALA  68  -3.250 -14.438  -7.206
  482    HA   ALA  68           HA       ALA  68  -1.968 -15.378  -8.931
  483   1HB   ALA  68          1HB       ALA  68  -1.544 -12.420  -9.399
  484   2HB   ALA  68          3HB       ALA  68  -0.845 -13.647 -10.456
  485   3HB   ALA  68          2HB       ALA  68  -2.595 -13.521 -10.288
  486    H    ALA  69           H        ALA  69   0.262 -12.674  -8.598
  487    HA   ALA  69           HA       ALA  69   2.530 -14.371  -8.234
  488   1HB   ALA  69          3HB       ALA  69   2.424 -11.886  -8.993
  489   2HB   ALA  69          2HB       ALA  69   2.442 -11.516  -7.269
  490   3HB   ALA  69          1HB       ALA  69   3.789 -12.391  -7.997
  491    H    HIS  70           HN       HIS  70   3.448 -15.213  -6.396
  492    HA   HIS  70           HA       HIS  70   2.072 -14.602  -3.819
  493   1HB   HIS  70          2HB       HIS  70   1.984 -16.958  -4.403
  494   2HB   HIS  70          1HB       HIS  70   3.726 -16.992  -4.684
  495    HD1  HIS  70           HD1      HIS  70   1.756 -15.530  -1.759
  496    HD2  HIS  70           HD2      HIS  70   4.727 -18.360  -2.499
  497    HE1  HIS  70           HE1      HIS  70   2.516 -16.380   0.503
   
  No H/Q in entry =         497
  Start of MODEL    4
    1   1H    GLU   1          1H        GLU   1  11.355  -4.417  -1.818
    2   2H    GLU   1          3H        GLU   1  12.325  -3.361  -0.912
    3   3H    GLU   1          2H        GLU   1  12.839  -4.957  -1.187
    4    HA   GLU   1           HA       GLU   1  12.015  -4.730   1.062
    5   1HB   GLU   1          2HB       GLU   1  10.386  -2.854   0.307
    6   2HB   GLU   1          1HB       GLU   1   9.300  -4.176  -0.127
    7   1HG   GLU   1          2HG       GLU   1   8.646  -4.255   2.025
    8   2HG   GLU   1          1HG       GLU   1  10.262  -4.836   2.428
    9    H    THR   2           H        THR   2  11.492  -6.727   1.868
   10    HA   THR   2           HA       THR   2  10.960  -8.906   0.076
   11    HB   THR   2           HB       THR   2  10.313  -9.014   3.014
   12    HG1  THR   2           HG1      THR   2  12.937  -9.380   2.137
   13   1HG2  THR   2          2HG2      THR   2  10.614 -10.875   0.903
   14   2HG2  THR   2          1HG2      THR   2  12.012 -11.090   1.957
   15   3HG2  THR   2          3HG2      THR   2  10.382 -11.226   2.615
   16    H    VAL   3           H        VAL   3   8.947 -10.304   0.266
   17    HA   VAL   3           HA       VAL   3   6.586  -8.567   0.122
   18    HB   VAL   3           HB       VAL   3   7.106 -10.559  -1.435
   19   1HG1  VAL   3          3HG1      VAL   3   7.499 -12.011   0.730
   20   2HG1  VAL   3          2HG1      VAL   3   5.748 -12.214   0.669
   21   3HG1  VAL   3          1HG1      VAL   3   6.745 -12.737  -0.689
   22   1HG2  VAL   3          2HG2      VAL   3   4.748  -9.362  -0.651
   23   2HG2  VAL   3          1HG2      VAL   3   4.906 -10.495  -1.993
   24   3HG2  VAL   3          3HG2      VAL   3   4.400 -11.072  -0.405
   25    H    GLU   4           H        GLU   4   7.958 -10.998   2.265
   26    HA   GLU   4           HA       GLU   4   5.655 -11.369   3.942
   27   1HB   GLU   4          2HB       GLU   4   8.575 -11.559   4.726
   28   2HB   GLU   4          1HB       GLU   4   7.214 -12.368   5.508
   29   1HG   GLU   4          2HG       GLU   4   7.482 -12.864   2.600
   30   2HG   GLU   4          1HG       GLU   4   8.771 -13.535   3.600
   31    H    SER   5           H        SER   5   8.392  -9.108   4.032
   32    HA   SER   5           HA       SER   5   7.450  -7.850   6.501
   33   1HB   SER   5          2HB       SER   5   9.841  -7.849   6.054
   34   2HB   SER   5          1HB       SER   5   9.588  -7.072   4.494
   35    HG   SER   5           HG       SER   5   9.458  -6.026   7.079
   36    H    CYS   6           H        CYS   6   7.612  -6.906   3.055
   37    HA   CYS   6           HA       CYS   6   6.389  -4.384   3.287
   38   1HB   CYS   6          2HB       CYS   6   7.161  -4.913   1.120
   39   2HB   CYS   6          1HB       CYS   6   6.362  -6.478   1.116
   40    H    LEU   7           H        LEU   7   5.077  -7.571   3.677
   41    HA   LEU   7           HA       LEU   7   2.301  -6.548   3.650
   42   1HB   LEU   7          2HB       LEU   7   3.385  -9.341   4.093
   43   2HB   LEU   7          1HB       LEU   7   1.677  -8.918   3.974
   44    HG   LEU   7           HG       LEU   7   3.655  -8.237   1.790
   45   1HD1  LEU   7          3HD1      LEU   7   1.958 -10.729   2.139
   46   2HD1  LEU   7          2HD1      LEU   7   2.710 -10.258   0.616
   47   3HD1  LEU   7          1HD1      LEU   7   3.715 -10.653   2.010
   48   1HD2  LEU   7          1HD2      LEU   7   0.899  -7.671   2.311
   49   2HD2  LEU   7          3HD2      LEU   7   1.849  -7.232   0.891
   50   3HD2  LEU   7          2HD2      LEU   7   0.975  -8.763   0.929
   51    H    ALA   8           H        ALA   8   4.814  -7.594   5.840
   52    HA   ALA   8           HA       ALA   8   3.206  -7.873   8.206
   53   1HB   ALA   8          2HB       ALA   8   5.909  -8.144   7.594
   54   2HB   ALA   8          1HB       ALA   8   5.872  -6.743   8.665
   55   3HB   ALA   8          3HB       ALA   8   5.204  -8.284   9.205
   56    H    LYS   9           H        LYS   9   4.054  -5.251   6.261
   57    HA   LYS   9           HA       LYS   9   4.335  -2.995   7.818
   58   1HB   LYS   9          2HB       LYS   9   2.709  -3.520   5.307
   59   2HB   LYS   9          1HB       LYS   9   3.093  -1.903   5.880
   60   1HG   LYS   9          2HG       LYS   9   5.528  -2.557   5.871
   61   2HG   LYS   9          1HG       LYS   9   5.051  -4.054   5.072
   62   1HD   LYS   9          2HD       LYS   9   4.924  -3.020   3.087
   63   2HD   LYS   9          1HD       LYS   9   3.847  -1.790   3.745
   64   1HE   LYS   9          2HE       LYS   9   5.978  -0.826   2.862
   65   2HE   LYS   9          1HE       LYS   9   5.751  -0.513   4.583
   66   1HZ   LYS   9          1HZ       LYS   9   7.025  -2.934   4.465
   67   2HZ   LYS   9          3HZ       LYS   9   7.797  -2.004   3.274
   68   3HZ   LYS   9          2HZ       LYS   9   7.728  -1.443   4.878
   69    HA   PRO  10           HA       PRO  10   0.573  -2.320  10.011
   70   1HB   PRO  10          2HB       PRO  10  -0.271   0.216   9.330
   71   2HB   PRO  10          1HB       PRO  10   1.083  -0.121  10.424
   72   1HG   PRO  10          2HG       PRO  10   1.142   0.811   7.592
   73   2HG   PRO  10          1HG       PRO  10   2.330   1.062   8.883
   74   1HD   PRO  10          2HD       PRO  10   2.545  -0.798   6.791
   75   2HD   PRO  10          1HD       PRO  10   3.529  -0.802   8.267
   76    H    HIS  11           H        HIS  11   0.501  -2.569   6.710
   77    HA   HIS  11           HA       HIS  11  -1.127  -3.405   5.292
   78   1HB   HIS  11          2HB       HIS  11  -2.224  -3.858   7.925
   79   2HB   HIS  11          1HB       HIS  11  -3.498  -3.473   6.760
   80    HD1  HIS  11           HD1      HIS  11  -4.398  -5.634   5.907
   81    HD2  HIS  11           HD2      HIS  11  -0.242  -5.746   6.255
   82    HE1  HIS  11           HE1      HIS  11  -3.662  -7.876   4.988
   83    H    THR  12           H        THR  12  -1.027  -1.302   4.216
   84    HA   THR  12           HA       THR  12  -2.341   0.186   2.999
   85    HB   THR  12           HB       THR  12  -4.211  -1.365   4.225
   86    HG1  THR  12           HG1      THR  12  -5.549  -0.584   2.695
   87   1HG2  THR  12          1HG2      THR  12  -4.778   1.516   4.932
   88   2HG2  THR  12          3HG2      THR  12  -6.008   0.255   4.922
   89   3HG2  THR  12          2HG2      THR  12  -4.661   0.159   6.047
   90    H    GLU  13           H        GLU  13  -3.031   0.807   6.494
   91    HA   GLU  13           HA       GLU  13  -3.336   3.547   6.274
   92   1HB   GLU  13          2HB       GLU  13  -3.277   2.061   8.423
   93   2HB   GLU  13          1HB       GLU  13  -1.562   2.477   8.468
   94   1HG   GLU  13          2HG       GLU  13  -1.966   4.654   9.021
   95   2HG   GLU  13          1HG       GLU  13  -3.400   4.754   7.997
   96    H    ASN  14           H        ASN  14  -2.145   4.602   4.788
   97    HA   ASN  14           HA       ASN  14   0.317   5.766   5.316
   98   1HB   ASN  14          2HB       ASN  14   0.616   2.979   4.597
   99   2HB   ASN  14          1HB       ASN  14   1.349   3.994   3.355
  100   1HD2  ASN  14          2HD2      ASN  14   3.555   3.374   6.509
  101   2HD2  ASN  14          1HD2      ASN  14   2.450   2.305   5.789
  102    H    SER  15           H        SER  15   1.438   5.606   2.604
  103    HA   SER  15           HA       SER  15  -0.610   5.900   0.643
  104   1HB   SER  15          2HB       SER  15  -0.412   8.446   0.445
  105   2HB   SER  15          1HB       SER  15  -1.360   7.842   1.800
  106    HG   SER  15           HG       SER  15   0.991   9.236   1.772
  107    H    PHE  16           H        PHE  16   0.394   7.683  -1.085
  108    HA   PHE  16           HA       PHE  16   3.237   7.778  -1.301
  109   1HB   PHE  16          2HB       PHE  16   2.811   5.279  -1.524
  110   2HB   PHE  16          1HB       PHE  16   1.953   5.640  -3.023
  111    HD1  PHE  16           HD2      PHE  16   3.148   6.790  -4.884
  112    HD2  PHE  16           HD1      PHE  16   5.204   5.285  -1.435
  113    HE1  PHE  16           HE2      PHE  16   5.288   6.925  -6.113
  114    HE2  PHE  16           HE1      PHE  16   7.357   5.408  -2.664
  115    HZ   PHE  16           HZ       PHE  16   7.401   6.228  -5.006
  116    H    THR  17           H        THR  17   3.819   8.971  -3.242
  117    HA   THR  17           HA       THR  17   1.433  10.000  -4.701
  118    HB   THR  17           HB       THR  17   2.370  11.954  -4.025
  119    HG1  THR  17           HG1      THR  17   3.911  12.693  -5.585
  120   1HG2  THR  17          2HG2      THR  17   5.048  10.526  -3.973
  121   2HG2  THR  17          1HG2      THR  17   4.794  12.201  -3.483
  122   3HG2  THR  17          3HG2      THR  17   4.029  10.893  -2.580
  123    H    ASN  18           H        ASN  18   1.815  10.543  -7.057
  124    HA   ASN  18           HA       ASN  18   2.560   9.910  -9.215
  125   1HB   ASN  18          2HB       ASN  18   4.853   9.669  -7.776
  126   2HB   ASN  18          1HB       ASN  18   4.574   7.977  -8.187
  127   1HD2  ASN  18          2HD2      ASN  18   5.552  10.639 -11.136
  128   2HD2  ASN  18          1HD2      ASN  18   5.153  11.198  -9.585
  129    H    VAL  19           H        VAL  19   0.843   8.427  -7.147
  130    HA   VAL  19           HA       VAL  19   0.766   5.712  -7.221
  131    HB   VAL  19           HB       VAL  19  -1.695   7.313  -7.930
  132   1HG1  VAL  19          3HG1      VAL  19  -1.074   4.721  -6.553
  133   2HG1  VAL  19          2HG1      VAL  19  -2.518   5.616  -6.081
  134   3HG1  VAL  19          1HG1      VAL  19  -2.319   5.081  -7.749
  135   1HG2  VAL  19          2HG2      VAL  19  -0.104   7.228  -5.367
  136   2HG2  VAL  19          1HG2      VAL  19  -0.769   8.630  -6.204
  137   3HG2  VAL  19          3HG2      VAL  19  -1.842   7.525  -5.344
  138    H    TRP  20           H        TRP  20  -0.118   4.093  -8.596
  139    HA   TRP  20           HA       TRP  20  -0.600   4.887 -11.424
  140   1HB   TRP  20          2HB       TRP  20   1.151   3.696 -12.254
  141   2HB   TRP  20          1HB       TRP  20   1.775   3.662 -10.610
  142    HD1  TRP  20           HD1      TRP  20  -0.398   1.537 -12.999
  143    HE1  TRP  20           HE1      TRP  20  -0.253  -0.927 -12.261
  144    HE3  TRP  20           HE3      TRP  20   2.433   2.059  -8.788
  145    HZ2  TRP  20           HZ2      TRP  20   0.949  -2.475 -10.180
  146    HZ3  TRP  20           HZ3      TRP  20   3.075   0.078  -7.457
  147    HH2  TRP  20           HH2      TRP  20   2.332  -2.188  -8.145
  148    H    LYS  21           H        LYS  21  -1.580   2.855 -12.595
  149    HA   LYS  21           HA       LYS  21  -3.151   1.183 -10.715
  150   1HB   LYS  21          2HB       LYS  21  -4.600   3.120 -11.238
  151   2HB   LYS  21          1HB       LYS  21  -4.404   2.793 -12.962
  152   1HG   LYS  21          2HG       LYS  21  -5.205   0.419 -11.457
  153   2HG   LYS  21          1HG       LYS  21  -6.385   1.726 -11.334
  154   1HD   LYS  21          2HD       LYS  21  -5.658   1.751 -14.020
  155   2HD   LYS  21          1HD       LYS  21  -5.727   0.034 -13.623
  156   1HE   LYS  21          2HE       LYS  21  -7.934   0.793 -14.353
  157   2HE   LYS  21          1HE       LYS  21  -7.986   0.376 -12.641
  158   1HZ   LYS  21          1HZ       LYS  21  -7.309   2.946 -12.511
  159   2HZ   LYS  21          3HZ       LYS  21  -8.245   2.963 -13.925
  160   3HZ   LYS  21          2HZ       LYS  21  -8.916   2.397 -12.471
  161    H    ASP  22           H        ASP  22  -3.128  -0.896 -11.431
  162    HA   ASP  22           HA       ASP  22  -2.295  -1.344 -14.253
  163   1HB   ASP  22          2HB       ASP  22  -1.384  -2.402 -11.778
  164   2HB   ASP  22          1HB       ASP  22  -2.199  -3.712 -12.629
  165    H    ASP  23           H        ASP  23  -3.690  -2.365 -15.605
  166    HA   ASP  23           HA       ASP  23  -6.369  -3.049 -14.657
  167   1HB   ASP  23          2HB       ASP  23  -6.129  -2.109 -16.899
  168   2HB   ASP  23          1HB       ASP  23  -5.013  -3.400 -17.356
  169    H    LYS  24           H        LYS  24  -3.339  -4.604 -15.160
  170    HA   LYS  24           HA       LYS  24  -4.357  -7.336 -15.310
  171   1HB   LYS  24          2HB       LYS  24  -1.676  -6.008 -15.009
  172   2HB   LYS  24          1HB       LYS  24  -1.830  -7.721 -14.605
  173   1HG   LYS  24          2HG       LYS  24  -2.574  -8.275 -16.812
  174   2HG   LYS  24          1HG       LYS  24  -2.804  -6.576 -17.231
  175   1HD   LYS  24          2HD       LYS  24  -0.336  -6.228 -16.916
  176   2HD   LYS  24          1HD       LYS  24  -0.166  -7.970 -16.693
  177   1HE   LYS  24          2HE       LYS  24  -1.422  -6.715 -19.148
  178   2HE   LYS  24          1HE       LYS  24   0.276  -7.178 -19.051
  179   1HZ   LYS  24          2HZ       LYS  24  -1.289  -9.313 -18.132
  180   2HZ   LYS  24          1HZ       LYS  24  -1.920  -8.804 -19.624
  181   3HZ   LYS  24          3HZ       LYS  24  -0.289  -9.254 -19.505
  182    H    THR  25           H        THR  25  -2.521  -5.478 -12.891
  183    HA   THR  25           HA       THR  25  -2.909  -7.284 -10.723
  184    HB   THR  25           HB       THR  25  -2.325  -5.387  -9.279
  185    HG1  THR  25           HG1      THR  25  -3.726  -3.909 -10.439
  186   1HG2  THR  25          3HG2      THR  25  -0.724  -6.406 -11.203
  187   2HG2  THR  25          2HG2      THR  25  -0.712  -4.705 -11.674
  188   3HG2  THR  25          1HG2      THR  25  -0.189  -5.177 -10.058
  189    H    LEU  26           H        LEU  26  -4.888  -4.872 -12.241
  190    HA   LEU  26           HA       LEU  26  -7.174  -4.389 -12.001
  191   1HB   LEU  26          2HB       LEU  26  -6.825  -7.092 -10.878
  192   2HB   LEU  26          1HB       LEU  26  -8.232  -6.227 -10.257
  193    HG   LEU  26           HG       LEU  26  -7.584  -6.520 -13.204
  194   1HD1  LEU  26          1HD1      LEU  26  -8.639  -8.436 -11.391
  195   2HD1  LEU  26          3HD1      LEU  26  -9.988  -7.858 -12.368
  196   3HD1  LEU  26          2HD1      LEU  26  -8.564  -8.545 -13.149
  197   1HD2  LEU  26          3HD2      LEU  26  -9.927  -5.404 -11.643
  198   2HD2  LEU  26          2HD2      LEU  26  -8.913  -4.563 -12.816
  199   3HD2  LEU  26          1HD2      LEU  26 -10.032  -5.814 -13.355
  200    H    ASP  27           H        ASP  27  -5.750  -2.702 -10.554
  201    HA   ASP  27           HA       ASP  27  -7.371  -1.884  -8.409
  202   1HB   ASP  27          2HB       ASP  27  -5.855  -4.207  -7.750
  203   2HB   ASP  27          1HB       ASP  27  -5.181  -2.857  -6.839
  204    H    ARG  28           H        ARG  28  -6.281  -0.215  -7.000
  205    HA   ARG  28           HA       ARG  28  -4.252   1.222  -8.570
  206   1HB   ARG  28          2HB       ARG  28  -6.246   2.154  -7.048
  207   2HB   ARG  28          1HB       ARG  28  -5.012   2.053  -5.793
  208   1HG   ARG  28          2HG       ARG  28  -4.543   4.171  -6.580
  209   2HG   ARG  28          1HG       ARG  28  -3.537   3.239  -7.689
  210   1HD   ARG  28          2HD       ARG  28  -5.432   3.197  -9.313
  211   2HD   ARG  28          1HD       ARG  28  -6.351   4.233  -8.221
  212    HE   ARG  28           HE       ARG  28  -3.917   5.560  -8.663
  213   1HH1  ARG  28          1HH2      ARG  28  -6.697   6.575  -9.396
  214   2HH1  ARG  28          2HH2      ARG  28  -6.526   6.813 -11.104
  215   1HH2  ARG  28          2HH1      ARG  28  -3.631   4.921 -11.346
  216   2HH2  ARG  28          1HH1      ARG  28  -4.790   5.877 -12.207
  217    H    TYR  29           H        TYR  29  -2.092   1.692  -7.685
  218    HA   TYR  29           HA       TYR  29  -1.322   0.113  -5.307
  219   1HB   TYR  29          2HB       TYR  29  -0.202  -0.362  -8.077
  220   2HB   TYR  29          1HB       TYR  29   0.571  -0.934  -6.602
  221    HD1  TYR  29           HD1      TYR  29  -2.417  -1.232  -8.750
  222    HD2  TYR  29           HD2      TYR  29  -0.348  -2.760  -5.313
  223    HE1  TYR  29           HE1      TYR  29  -3.929  -3.201  -8.716
  224    HE2  TYR  29           HE2      TYR  29  -1.855  -4.729  -5.278
  225    HH   TYR  29           HH       TYR  29  -3.950  -5.483  -7.881
  226    H    ALA  30           H        ALA  30   0.666   0.764  -4.393
  227    HA   ALA  30           HA       ALA  30   1.816   3.274  -5.555
  228   1HB   ALA  30          2HB       ALA  30   1.040   2.573  -2.737
  229   2HB   ALA  30          1HB       ALA  30   2.368   3.701  -3.014
  230   3HB   ALA  30          3HB       ALA  30   0.757   4.068  -3.629
  231    H    ASN  31           H        ASN  31   3.725   2.543  -6.420
  232    HA   ASN  31           HA       ASN  31   5.245   0.349  -5.341
  233   1HB   ASN  31          2HB       ASN  31   7.054   1.223  -6.874
  234   2HB   ASN  31          1HB       ASN  31   5.511   0.920  -7.671
  235   1HD2  ASN  31          2HD2      ASN  31   6.468   4.266  -8.846
  236   2HD2  ASN  31          1HD2      ASN  31   6.923   2.652  -9.108
  237    H    TYR  32           H        TYR  32   5.756   0.694  -3.176
  238    HA   TYR  32           HA       TYR  32   7.068   3.198  -2.355
  239   1HB   TYR  32          2HB       TYR  32   5.470   2.070  -0.836
  240   2HB   TYR  32          1HB       TYR  32   6.519   0.653  -0.794
  241    HD1  TYR  32           HD1      TYR  32   7.627   4.201  -0.869
  242    HD2  TYR  32           HD2      TYR  32   7.157   0.654   1.508
  243    HE1  TYR  32           HE1      TYR  32   8.963   5.240   0.944
  244    HE2  TYR  32           HE2      TYR  32   8.493   1.692   3.322
  245    HH   TYR  32           HH       TYR  32  10.168   4.733   2.856
  246    H    GLU  33           H        GLU  33   8.664   2.256  -4.232
  247    HA   GLU  33           HA       GLU  33  10.690   1.103  -4.751
  248   1HB   GLU  33          2HB       GLU  33  10.939   3.310  -2.920
  249   2HB   GLU  33          1HB       GLU  33  12.212   2.132  -2.601
  250   1HG   GLU  33          2HG       GLU  33  13.074   3.596  -4.287
  251   2HG   GLU  33          1HG       GLU  33  12.640   2.098  -5.112
  252    H    GLY  34           H        GLY  34  10.003  -1.108  -4.150
  253   1HA   GLY  34          2HA       GLY  34  11.371  -2.937  -3.085
  254   2HA   GLY  34          1HA       GLY  34  11.296  -1.986  -1.601
  255    H    CYS  35           H        CYS  35   8.658  -1.251  -1.473
  256    HA   CYS  35           HA       CYS  35   7.280  -3.905  -1.313
  257   1HB   CYS  35          2HB       CYS  35   7.499  -3.108   0.904
  258   2HB   CYS  35          1HB       CYS  35   7.180  -1.444   0.428
  259    H    LEU  36           H        LEU  36   4.908  -3.810  -1.715
  260    HA   LEU  36           HA       LEU  36   4.149  -1.509  -3.453
  261   1HB   LEU  36          2HB       LEU  36   4.659  -3.464  -4.853
  262   2HB   LEU  36          1HB       LEU  36   3.508  -4.431  -3.932
  263    HG   LEU  36           HG       LEU  36   1.813  -2.556  -4.519
  264   1HD1  LEU  36          3HD1      LEU  36   3.833  -1.179  -5.418
  265   2HD1  LEU  36          2HD1      LEU  36   3.646  -2.160  -6.869
  266   3HD1  LEU  36          1HD1      LEU  36   2.319  -1.146  -6.312
  267   1HD2  LEU  36          3HD2      LEU  36   2.693  -4.923  -5.912
  268   2HD2  LEU  36          2HD2      LEU  36   1.063  -4.261  -5.788
  269   3HD2  LEU  36          1HD2      LEU  36   2.135  -3.727  -7.083
  270    H    TRP  37           H        TRP  37   2.467  -0.491  -2.527
  271    HA   TRP  37           HA       TRP  37   0.638  -2.004  -0.759
  272   1HB   TRP  37          2HB       TRP  37   0.561   0.961  -1.402
  273   2HB   TRP  37          1HB       TRP  37  -0.214   0.124  -0.065
  274    HD1  TRP  37           HD1      TRP  37   3.371   0.785  -1.348
  275    HE1  TRP  37           HE1      TRP  37   4.916   0.965   0.711
  276    HE3  TRP  37           HE3      TRP  37   0.024  -0.249   2.366
  277    HZ2  TRP  37           HZ2      TRP  37   4.745   0.703   3.555
  278    HZ3  TRP  37           HZ3      TRP  37   0.730  -0.287   4.729
  279    HH2  TRP  37           HH2      TRP  37   3.093   0.194   5.334
  280    H    ASN  38           H        ASN  38  -1.799  -1.196  -1.093
  281    HA   ASN  38           HA       ASN  38  -2.424  -1.015  -3.990
  282   1HB   ASN  38          2HB       ASN  38  -2.723  -3.294  -3.924
  283   2HB   ASN  38          1HB       ASN  38  -2.967  -3.313  -2.184
  284   1HD2  ASN  38          2HD2      ASN  38  -6.266  -2.267  -4.407
  285   2HD2  ASN  38          1HD2      ASN  38  -4.750  -1.649  -4.846
  286    H    ALA  39           H        ALA  39  -3.821   0.630  -4.223
  287    HA   ALA  39           HA       ALA  39  -5.477   1.486  -1.921
  288   1HB   ALA  39          1HB       ALA  39  -4.264   2.790  -4.195
  289   2HB   ALA  39          3HB       ALA  39  -5.999   3.108  -4.181
  290   3HB   ALA  39          2HB       ALA  39  -5.015   3.519  -2.776
  291    H    THR  40           H        THR  40  -7.636   1.066  -1.829
  292    HA   THR  40           HA       THR  40  -8.837  -0.681  -3.812
  293    HB   THR  40           HB       THR  40 -10.642  -0.854  -2.322
  294    HG1  THR  40           HG1      THR  40 -11.166   0.809  -0.885
  295   1HG2  THR  40          1HG2      THR  40  -8.053  -0.923  -1.296
  296   2HG2  THR  40          3HG2      THR  40  -8.950   0.034  -0.115
  297   3HG2  THR  40          2HG2      THR  40  -9.491  -1.594  -0.526
  298    H    GLY  41           H        GLY  41  -9.699   2.618  -2.689
  299   1HA   GLY  41          2HA       GLY  41 -10.090   3.648  -5.323
  300   2HA   GLY  41          1HA       GLY  41 -11.647   3.117  -4.686
  301    H    VAL  42           H        VAL  42 -11.847   3.857  -2.202
  302    HA   VAL  42           HA       VAL  42 -12.032   6.712  -2.241
  303    HB   VAL  42           HB       VAL  42 -12.052   4.776   0.097
  304   1HG1  VAL  42          1HG1      VAL  42 -12.317   7.732  -0.104
  305   2HG1  VAL  42          3HG1      VAL  42 -13.469   6.908   0.946
  306   3HG1  VAL  42          2HG1      VAL  42 -11.738   6.742   1.235
  307   1HG2  VAL  42          3HG2      VAL  42 -13.861   5.014  -1.953
  308   2HG2  VAL  42          2HG2      VAL  42 -14.267   4.463  -0.327
  309   3HG2  VAL  42          1HG2      VAL  42 -14.515   6.151  -0.775
  310    H    VAL  43           H        VAL  43  -9.919   7.499  -2.787
  311    HA   VAL  43           HA       VAL  43  -8.057   7.520  -0.468
  312    HB   VAL  43           HB       VAL  43  -7.150   7.060  -3.326
  313   1HG1  VAL  43          2HG1      VAL  43  -5.649   8.249  -1.604
  314   2HG1  VAL  43          1HG1      VAL  43  -5.591   6.699  -0.765
  315   3HG1  VAL  43          3HG1      VAL  43  -4.972   6.836  -2.410
  316   1HG2  VAL  43          1HG2      VAL  43  -7.524   5.143  -1.006
  317   2HG2  VAL  43          3HG2      VAL  43  -8.271   5.051  -2.601
  318   3HG2  VAL  43          2HG2      VAL  43  -6.540   4.766  -2.421
  319    H    VAL  44           H        VAL  44  -7.521   9.613  -0.023
  320    HA   VAL  44           HA       VAL  44  -8.452  11.845  -1.452
  321    HB   VAL  44           HB       VAL  44  -6.017  11.537   0.324
  322   1HG1  VAL  44          1HG1      VAL  44  -6.670  13.683  -1.455
  323   2HG1  VAL  44          3HG1      VAL  44  -6.939  14.236   0.199
  324   3HG1  VAL  44          2HG1      VAL  44  -5.361  13.603  -0.275
  325   1HG2  VAL  44          1HG2      VAL  44  -8.573  11.344   1.051
  326   2HG2  VAL  44          3HG2      VAL  44  -7.405  12.198   2.060
  327   3HG2  VAL  44          2HG2      VAL  44  -8.479  13.104   0.995
  328    H    CYS  45           H        CYS  45  -8.070  11.959  -3.656
  329    HA   CYS  45           HA       CYS  45  -5.240  11.641  -4.548
  330   1HB   CYS  45          2HB       CYS  45  -7.876  11.054  -5.792
  331   2HB   CYS  45          1HB       CYS  45  -6.606  11.642  -6.867
  332    H    THR  46           H        THR  46  -4.258  13.258  -5.714
  333    HA   THR  46           HA       THR  46  -5.808  15.715  -6.326
  334    HB   THR  46           HB       THR  46  -4.785  16.056  -4.094
  335    HG1  THR  46           HG1      THR  46  -4.879  17.763  -5.686
  336   1HG2  THR  46          3HG2      THR  46  -2.214  15.451  -5.578
  337   2HG2  THR  46          2HG2      THR  46  -2.296  16.106  -3.942
  338   3HG2  THR  46          1HG2      THR  46  -2.926  14.494  -4.279
  339    H    GLY  47           H        GLY  47  -4.823  16.980  -8.014
  340   1HA   GLY  47          2HA       GLY  47  -3.455  17.343  -9.899
  341   2HA   GLY  47          1HA       GLY  47  -2.290  16.216  -9.201
  342    H    ASP  48           H        ASP  48  -5.660  15.961 -10.400
  343    HA   ASP  48           HA       ASP  48  -6.605  14.404 -11.885
  344   1HB   ASP  48          2HB       ASP  48  -3.714  14.077 -12.749
  345   2HB   ASP  48          1HB       ASP  48  -5.110  13.435 -13.612
  346    H    GLU  49           H        GLU  49  -5.073  13.745  -9.230
  347    HA   GLU  49           HA       GLU  49  -5.114  11.835  -7.883
  348   1HB   GLU  49          2HB       GLU  49  -5.743  10.207 -10.351
  349   2HB   GLU  49          1HB       GLU  49  -6.031   9.776  -8.667
  350   1HG   GLU  49          2HG       GLU  49  -8.003  10.861  -8.634
  351   2HG   GLU  49          1HG       GLU  49  -7.286  12.314  -9.332
  352    H    THR  50           H        THR  50  -2.831  12.891  -9.461
  353    HA   THR  50           HA       THR  50  -1.212  10.595 -10.224
  354    HB   THR  50           HB       THR  50   0.624  12.538  -9.781
  355    HG1  THR  50           HG1      THR  50  -1.282  13.807  -8.983
  356   1HG2  THR  50          3HG2      THR  50  -0.460  11.359 -11.949
  357   2HG2  THR  50          2HG2      THR  50  -1.078  12.995 -12.172
  358   3HG2  THR  50          1HG2      THR  50   0.660  12.717 -12.063
  359    H    GLN  51           H        GLN  51  -1.648  12.621  -7.372
  360    HA   GLN  51           HA       GLN  51   0.074  10.711  -5.833
  361   1HB   GLN  51          2HB       GLN  51  -0.653  13.528  -4.994
  362   2HB   GLN  51          1HB       GLN  51   0.611  12.492  -4.330
  363   1HG   GLN  51          2HG       GLN  51   1.977  13.659  -5.732
  364   2HG   GLN  51          1HG       GLN  51   1.334  12.571  -6.964
  365   1HE2  GLN  51          2HE2      GLN  51   0.836  16.229  -7.928
  366   2HE2  GLN  51          1HE2      GLN  51   2.200  15.399  -7.353
  367    H    CYS  52           H        CYS  52  -0.904   9.768  -3.969
  368    HA   CYS  52           HA       CYS  52  -3.562  10.787  -3.189
  369   1HB   CYS  52          2HB       CYS  52  -3.434   8.780  -5.063
  370   2HB   CYS  52          1HB       CYS  52  -3.585   7.869  -3.562
  371    H    TYR  53           H        TYR  53  -4.397   9.731  -1.213
  372    HA   TYR  53           HA       TYR  53  -2.412   8.196   0.341
  373   1HB   TYR  53          2HB       TYR  53  -1.731  10.093   1.403
  374   2HB   TYR  53          1HB       TYR  53  -3.100  11.020   0.805
  375    HD1  TYR  53           HD1      TYR  53  -2.314   8.302   3.290
  376    HD2  TYR  53           HD2      TYR  53  -4.735  11.715   2.317
  377    HE1  TYR  53           HE1      TYR  53  -3.381   8.176   5.525
  378    HE2  TYR  53           HE2      TYR  53  -5.801  11.593   4.551
  379    HH   TYR  53           HH       TYR  53  -6.114   9.402   6.323
  380    H    GLY  54           H        GLY  54  -3.391   7.143   2.213
  381   1HA   GLY  54          2HA       GLY  54  -5.796   7.127   3.356
  382   2HA   GLY  54          1HA       GLY  54  -6.262   6.573   1.745
  383    H    THR  55           H        THR  55  -6.673   4.398   2.032
  384    HA   THR  55           HA       THR  55  -4.675   2.820   3.591
  385    HB   THR  55           HB       THR  55  -6.445   0.966   3.278
  386    HG1  THR  55           HG1      THR  55  -8.258   3.055   2.912
  387   1HG2  THR  55          3HG2      THR  55  -6.069   2.833   5.217
  388   2HG2  THR  55          2HG2      THR  55  -7.748   3.154   4.782
  389   3HG2  THR  55          1HG2      THR  55  -7.266   1.544   5.316
  390    H    TRP  56           H        TRP  56  -3.217   1.729   2.498
  391    HA   TRP  56           HA       TRP  56  -3.747   0.937  -0.331
  392   1HB   TRP  56          2HB       TRP  56  -1.124   1.616   0.992
  393   2HB   TRP  56          1HB       TRP  56  -1.384   1.280  -0.724
  394    HD1  TRP  56           HD1      TRP  56  -2.378   3.855   1.959
  395    HE1  TRP  56           HE1      TRP  56  -2.869   6.085   0.771
  396    HE3  TRP  56           HE3      TRP  56  -1.870   2.367  -2.879
  397    HZ2  TRP  56           HZ2      TRP  56  -3.026   7.103  -1.922
  398    HZ3  TRP  56           HZ3      TRP  56  -2.198   3.965  -4.742
  399    HH2  TRP  56           HH2      TRP  56  -2.774   6.334  -4.269
  400    H    VAL  57           H        VAL  57  -4.567  -1.127   0.847
  401    HA   VAL  57           HA       VAL  57  -3.137  -2.774   2.530
  402    HB   VAL  57           HB       VAL  57  -4.577  -3.687   0.012
  403   1HG1  VAL  57          1HG1      VAL  57  -3.010  -5.210   1.682
  404   2HG1  VAL  57          3HG1      VAL  57  -4.593  -5.362   2.446
  405   3HG1  VAL  57          2HG1      VAL  57  -4.379  -5.832   0.759
  406   1HG2  VAL  57          1HG2      VAL  57  -5.461  -2.511   2.535
  407   2HG2  VAL  57          3HG2      VAL  57  -6.388  -2.837   1.069
  408   3HG2  VAL  57          2HG2      VAL  57  -6.169  -4.106   2.274
  409    HA   PRO  58           HA       PRO  58   0.642  -3.531   0.297
  410   1HB   PRO  58          2HB       PRO  58   1.782  -5.119   2.247
  411   2HB   PRO  58          1HB       PRO  58   1.748  -3.348   2.318
  412   1HG   PRO  58          2HG       PRO  58   0.149  -5.315   3.874
  413   2HG   PRO  58          1HG       PRO  58   0.564  -3.636   4.274
  414   1HD   PRO  58          2HD       PRO  58  -1.937  -4.569   3.267
  415   2HD   PRO  58          1HD       PRO  58  -1.434  -2.878   3.440
  416    H    ILE  59           H        ILE  59   1.208  -5.198  -1.138
  417    HA   ILE  59           HA       ILE  59   0.182  -7.927  -0.577
  418    HB   ILE  59           HB       ILE  59  -0.673  -8.042  -2.946
  419   1HG1  ILE  59          2HG1      ILE  59   0.677  -5.881  -3.517
  420   2HG1  ILE  59          1HG1      ILE  59  -0.899  -6.121  -4.264
  421   1HG2  ILE  59          2HG2      ILE  59  -2.153  -7.732  -0.956
  422   2HG2  ILE  59          1HG2      ILE  59  -2.030  -5.987  -1.176
  423   3HG2  ILE  59          3HG2      ILE  59  -2.801  -6.979  -2.413
  424   1HD1  ILE  59          2HD1      ILE  59  -1.862  -4.755  -2.318
  425   2HD1  ILE  59          1HD1      ILE  59  -0.200  -4.310  -1.946
  426   3HD1  ILE  59          3HD1      ILE  59  -0.902  -3.868  -3.497
  427    H    GLY  60           H        GLY  60   2.375  -5.829  -2.433
  428   1HA   GLY  60          2HA       GLY  60   3.921  -8.320  -3.002
  429   2HA   GLY  60          1HA       GLY  60   3.558  -7.214  -4.319
  430    H    LEU  61           H        LEU  61   5.832  -6.967  -4.649
  431    HA   LEU  61           HA       LEU  61   7.268  -5.473  -2.516
  432   1HB   LEU  61          2HB       LEU  61   8.531  -6.482  -5.056
  433   2HB   LEU  61          1HB       LEU  61   9.278  -6.208  -3.480
  434    HG   LEU  61           HG       LEU  61   7.166  -8.324  -3.985
  435   1HD1  LEU  61          3HD1      LEU  61   9.925  -8.297  -4.756
  436   2HD1  LEU  61          2HD1      LEU  61   9.730  -9.445  -3.432
  437   3HD1  LEU  61          1HD1      LEU  61   8.764  -9.616  -4.897
  438   1HD2  LEU  61          2HD2      LEU  61   8.171  -7.183  -1.629
  439   2HD2  LEU  61          1HD2      LEU  61   7.271  -8.694  -1.759
  440   3HD2  LEU  61          3HD2      LEU  61   9.034  -8.714  -1.785
  441    H    ALA  62           H        ALA  62   6.024  -5.173  -5.813
  442    HA   ALA  62           HA       ALA  62   5.888  -2.373  -5.737
  443   1HB   ALA  62          2HB       ALA  62   8.550  -3.415  -6.665
  444   2HB   ALA  62          1HB       ALA  62   7.915  -1.892  -7.289
  445   3HB   ALA  62          3HB       ALA  62   8.202  -2.084  -5.559
  446    H    ILE  63           H        ILE  63   4.208  -4.192  -6.898
  447    HA   ILE  63           HA       ILE  63   3.428  -3.173  -9.266
  448    HB   ILE  63           HB       ILE  63   5.928  -4.583  -9.743
  449   1HG1  ILE  63          2HG1      ILE  63   5.540  -2.307 -10.478
  450   2HG1  ILE  63          1HG1      ILE  63   5.679  -3.317 -11.914
  451   1HG2  ILE  63          1HG2      ILE  63   4.417  -6.421 -10.457
  452   2HG2  ILE  63          3HG2      ILE  63   3.583  -5.299 -11.532
  453   3HG2  ILE  63          2HG2      ILE  63   5.273  -5.709 -11.822
  454   1HD1  ILE  63          3HD1      ILE  63   2.939  -3.353 -11.157
  455   2HD1  ILE  63          2HD1      ILE  63   3.461  -1.668 -11.087
  456   3HD1  ILE  63          1HD1      ILE  63   3.649  -2.589 -12.580
  457    HA   PRO  64           HA       PRO  64   1.878  -7.695  -9.261
  458   1HB   PRO  64          2HB       PRO  64   2.406  -9.160  -6.979
  459   2HB   PRO  64          1HB       PRO  64   3.352  -9.248  -8.479
  460   1HG   PRO  64          2HG       PRO  64   4.034  -7.917  -5.907
  461   2HG   PRO  64          1HG       PRO  64   5.110  -8.556  -7.155
  462   1HD   PRO  64          2HD       PRO  64   4.505  -5.846  -6.754
  463   2HD   PRO  64          1HD       PRO  64   5.255  -6.523  -8.211
  464    H    GLU  65           H        GLU  65  -0.198  -8.159  -8.610
  465    HA   GLU  65           HA       GLU  65  -1.466  -6.273  -6.799
  466   1HB   GLU  65          2HB       GLU  65  -3.542  -7.307  -7.496
  467   2HB   GLU  65          1HB       GLU  65  -2.510  -7.162  -8.915
  468   1HG   GLU  65          2HG       GLU  65  -2.161  -9.428  -9.075
  469   2HG   GLU  65          1HG       GLU  65  -2.290  -9.682  -7.335
  470    H    ASN  66           H        ASN  66  -3.480  -8.310  -5.921
  471    HA   ASN  66           HA       ASN  66  -2.062  -9.138  -3.469
  472   1HB   ASN  66          2HB       ASN  66  -4.360  -7.966  -3.564
  473   2HB   ASN  66          1HB       ASN  66  -4.990  -9.530  -4.084
  474   1HD2  ASN  66          2HD2      ASN  66  -5.075  -9.271  -0.303
  475   2HD2  ASN  66          1HD2      ASN  66  -5.657  -8.257  -1.534
  476    H    ALA  67           H        ALA  67  -3.595 -10.551  -6.305
  477    HA   ALA  67           HA       ALA  67  -3.213 -13.277  -5.186
  478   1HB   ALA  67          1HB       ALA  67  -5.147 -12.128  -6.880
  479   2HB   ALA  67          3HB       ALA  67  -4.208 -13.213  -7.905
  480   3HB   ALA  67          2HB       ALA  67  -4.992 -13.832  -6.451
  481    H    ALA  68           H        ALA  68  -1.284 -11.116  -6.672
  482    HA   ALA  68           HA       ALA  68  -0.075 -13.035  -8.585
  483   1HB   ALA  68          1HB       ALA  68  -0.460 -10.596  -9.189
  484   2HB   ALA  68          3HB       ALA  68   0.790 -10.191  -8.013
  485   3HB   ALA  68          2HB       ALA  68   1.190 -11.173  -9.422
  486    H    ALA  69           H        ALA  69   2.592 -11.800  -8.238
  487    HA   ALA  69           HA       ALA  69   4.540 -12.178  -6.983
  488   1HB   ALA  69          1HB       ALA  69   3.096 -10.909  -5.266
  489   2HB   ALA  69          3HB       ALA  69   2.755 -12.491  -4.566
  490   3HB   ALA  69          2HB       ALA  69   4.414 -11.894  -4.630
  491    H    HIS  70           HN       HIS  70   5.199 -14.184  -7.727
  492    HA   HIS  70           HA       HIS  70   5.680 -16.478  -7.556
  493   1HB   HIS  70          2HB       HIS  70   4.861 -15.690  -4.900
  494   2HB   HIS  70          1HB       HIS  70   4.265 -17.312  -5.255
  495    HD1  HIS  70           HD1      HIS  70   5.950 -18.773  -4.074
  496    HD2  HIS  70           HD2      HIS  70   7.776 -15.853  -6.423
  497    HE1  HIS  70           HE1      HIS  70   8.430 -19.290  -4.061
   
  No H/Q in entry =         497
  Start of MODEL    5
    1   1H    GLU   1          3H        GLU   1  13.348  -8.751  -0.781
    2   2H    GLU   1          2H        GLU   1  12.378  -8.462  -2.145
    3   3H    GLU   1          1H        GLU   1  13.676  -7.425  -1.787
    4    HA   GLU   1           HA       GLU   1  12.600  -6.434  -0.017
    5   1HB   GLU   1          2HB       GLU   1  11.523  -5.658  -2.002
    6   2HB   GLU   1          1HB       GLU   1  10.604  -7.153  -2.175
    7   1HG   GLU   1          2HG       GLU   1   9.136  -5.429  -1.278
    8   2HG   GLU   1          1HG       GLU   1   9.438  -6.630  -0.024
    9    H    THR   2           H        THR   2  11.589  -9.681  -0.640
   10    HA   THR   2           HA       THR   2  10.524 -11.240   0.757
   11    HB   THR   2           HB       THR   2  10.841  -9.159   2.925
   12    HG1  THR   2           HG1      THR   2  12.659 -11.103   1.948
   13   1HG2  THR   2          3HG2      THR   2   9.567 -11.575   2.988
   14   2HG2  THR   2          2HG2      THR   2  11.201 -12.040   3.460
   15   3HG2  THR   2          1HG2      THR   2  10.328 -10.821   4.389
   16    H    VAL   3           H        VAL   3   8.427 -11.343   0.026
   17    HA   VAL   3           HA       VAL   3   6.548  -9.183   0.298
   18    HB   VAL   3           HB       VAL   3   5.685 -12.059   0.098
   19   1HG1  VAL   3          2HG1      VAL   3   4.599  -9.417  -0.421
   20   2HG1  VAL   3          1HG1      VAL   3   4.517 -10.428  -1.865
   21   3HG1  VAL   3          3HG1      VAL   3   3.766 -10.970  -0.364
   22   1HG2  VAL   3          3HG2      VAL   3   7.647 -10.770  -1.596
   23   2HG2  VAL   3          2HG2      VAL   3   7.019 -12.415  -1.686
   24   3HG2  VAL   3          1HG2      VAL   3   6.180 -11.104  -2.515
   25    H    GLU   4           H        GLU   4   7.656 -11.676   2.434
   26    HA   GLU   4           HA       GLU   4   5.414 -11.890   4.180
   27   1HB   GLU   4          2HB       GLU   4   8.020 -12.887   4.121
   28   2HB   GLU   4          1HB       GLU   4   7.975 -11.901   5.583
   29   1HG   GLU   4          2HG       GLU   4   5.617 -13.139   5.875
   30   2HG   GLU   4          1HG       GLU   4   6.438 -14.368   4.913
   31    H    SER   5           H        SER   5   8.205  -9.669   4.251
   32    HA   SER   5           HA       SER   5   7.064  -8.154   6.482
   33   1HB   SER   5          2HB       SER   5   9.502  -7.876   4.737
   34   2HB   SER   5          1HB       SER   5   8.985  -6.529   5.748
   35    HG   SER   5           HG       SER   5   9.975  -7.559   7.284
   36    H    CYS   6           H        CYS   6   7.392  -7.777   2.970
   37    HA   CYS   6           HA       CYS   6   6.397  -5.128   2.759
   38   1HB   CYS   6          2HB       CYS   6   6.894  -7.347   0.982
   39   2HB   CYS   6          1HB       CYS   6   5.345  -6.602   0.579
   40    H    LEU   7           H        LEU   7   4.813  -8.119   3.522
   41    HA   LEU   7           HA       LEU   7   2.152  -6.829   3.232
   42   1HB   LEU   7          2HB       LEU   7   2.858  -9.733   3.738
   43   2HB   LEU   7          1HB       LEU   7   1.238  -9.095   3.434
   44    HG   LEU   7           HG       LEU   7   3.580  -8.901   1.517
   45   1HD1  LEU   7          2HD1      LEU   7   1.266 -10.789   1.781
   46   2HD1  LEU   7          1HD1      LEU   7   1.828 -10.357   0.166
   47   3HD1  LEU   7          3HD1      LEU   7   2.933 -11.124   1.308
   48   1HD2  LEU   7          2HD2      LEU   7   0.674  -8.071   1.291
   49   2HD2  LEU   7          1HD2      LEU   7   2.071  -6.995   1.332
   50   3HD2  LEU   7          3HD2      LEU   7   1.822  -8.069  -0.047
   51    H    ALA   8           H        ALA   8   4.469  -7.942   5.536
   52    HA   ALA   8           HA       ALA   8   2.631  -7.968   7.810
   53   1HB   ALA   8          2HB       ALA   8   5.456  -8.546   7.338
   54   2HB   ALA   8          1HB       ALA   8   5.219  -7.590   8.800
   55   3HB   ALA   8          3HB       ALA   8   4.397  -9.139   8.617
   56    H    LYS   9           H        LYS   9   3.836  -5.644   5.826
   57    HA   LYS   9           HA       LYS   9   4.789  -3.467   7.203
   58   1HB   LYS   9          2HB       LYS   9   3.092  -3.982   4.842
   59   2HB   LYS   9          1HB       LYS   9   2.943  -2.357   5.484
   60   1HG   LYS   9          2HG       LYS   9   5.438  -2.149   5.412
   61   2HG   LYS   9          1HG       LYS   9   5.510  -3.751   4.677
   62   1HD   LYS   9          2HD       LYS   9   4.492  -3.035   2.694
   63   2HD   LYS   9          1HD       LYS   9   3.794  -1.608   3.455
   64   1HE   LYS   9          2HE       LYS   9   6.670  -2.084   2.669
   65   2HE   LYS   9          1HE       LYS   9   5.603  -0.775   2.162
   66   1HZ   LYS   9          3HZ       LYS   9   5.541  -0.321   4.719
   67   2HZ   LYS   9          2HZ       LYS   9   7.029  -1.140   4.697
   68   3HZ   LYS   9          1HZ       LYS   9   6.815   0.266   3.768
   69    HA   PRO  10           HA       PRO  10   1.553  -1.884   9.770
   70   1HB   PRO  10          2HB       PRO  10   1.225   0.740   8.975
   71   2HB   PRO  10          1HB       PRO  10   2.593   0.165   9.945
   72   1HG   PRO  10          2HG       PRO  10   2.515   0.890   7.053
   73   2HG   PRO  10          1HG       PRO  10   3.873   0.949   8.189
   74   1HD   PRO  10          2HD       PRO  10   3.456  -1.040   6.251
   75   2HD   PRO  10          1HD       PRO  10   4.558  -1.175   7.635
   76    H    HIS  11           H        HIS  11   1.099  -2.346   6.541
   77    HA   HIS  11           HA       HIS  11  -0.755  -2.881   5.301
   78   1HB   HIS  11          2HB       HIS  11  -1.897  -2.671   8.009
   79   2HB   HIS  11          1HB       HIS  11  -3.041  -2.432   6.683
   80    HD1  HIS  11           HD1      HIS  11  -4.180  -4.669   6.538
   81    HD2  HIS  11           HD2      HIS  11  -0.024  -5.050   6.672
   82    HE1  HIS  11           HE1      HIS  11  -3.669  -7.117   6.141
   83    H    THR  12           H        THR  12  -2.588  -1.993   4.324
   84    HA   THR  12           HA       THR  12  -2.586   0.076   2.862
   85    HB   THR  12           HB       THR  12  -4.549  -1.426   3.763
   86    HG1  THR  12           HG1      THR  12  -5.732  -0.538   2.248
   87   1HG2  THR  12          1HG2      THR  12  -5.146   1.306   4.895
   88   2HG2  THR  12          3HG2      THR  12  -6.349   0.030   4.707
   89   3HG2  THR  12          2HG2      THR  12  -4.983  -0.200   5.798
   90    H    GLU  13           H        GLU  13  -3.511   0.826   6.274
   91    HA   GLU  13           HA       GLU  13  -3.793   3.560   6.015
   92   1HB   GLU  13          2HB       GLU  13  -3.941   2.289   8.181
   93   2HB   GLU  13          1HB       GLU  13  -2.178   2.282   8.245
   94   1HG   GLU  13          2HG       GLU  13  -2.101   4.426   8.950
   95   2HG   GLU  13          1HG       GLU  13  -3.248   4.948   7.713
   96    H    ASN  14           H        ASN  14  -2.547   4.559   4.500
   97    HA   ASN  14           HA       ASN  14  -0.085   5.725   5.122
   98   1HB   ASN  14          2HB       ASN  14   0.180   2.949   4.272
   99   2HB   ASN  14          1HB       ASN  14   1.013   4.036   3.161
  100   1HD2  ASN  14          2HD2      ASN  14   3.328   5.198   5.675
  101   2HD2  ASN  14          1HD2      ASN  14   2.500   5.707   4.285
  102    H    SER  15           H        SER  15   1.090   5.651   2.443
  103    HA   SER  15           HA       SER  15  -0.944   6.008   0.464
  104   1HB   SER  15          2HB       SER  15  -0.694   8.549   0.327
  105   2HB   SER  15          1HB       SER  15  -1.642   7.938   1.678
  106    HG   SER  15           HG       SER  15   1.076   8.762   1.686
  107    H    PHE  16           H        PHE  16   0.149   7.883  -1.175
  108    HA   PHE  16           HA       PHE  16   2.971   7.902  -1.425
  109   1HB   PHE  16          2HB       PHE  16   2.994   5.551  -1.722
  110   2HB   PHE  16          1HB       PHE  16   1.527   5.579  -2.698
  111    HD1  PHE  16           HD1      PHE  16   5.011   6.979  -2.711
  112    HD2  PHE  16           HD2      PHE  16   1.727   5.443  -5.010
  113    HE1  PHE  16           HE1      PHE  16   6.382   7.131  -4.772
  114    HE2  PHE  16           HE2      PHE  16   3.094   5.596  -7.070
  115    HZ   PHE  16           HZ       PHE  16   5.425   6.435  -6.952
  116    H    THR  17           H        THR  17   3.547   9.139  -3.317
  117    HA   THR  17           HA       THR  17   1.178  10.155  -4.803
  118    HB   THR  17           HB       THR  17   2.070  12.163  -4.325
  119    HG1  THR  17           HG1      THR  17   4.424  11.989  -5.624
  120   1HG2  THR  17          1HG2      THR  17   4.675  10.744  -3.684
  121   2HG2  THR  17          3HG2      THR  17   4.315  12.434  -3.324
  122   3HG2  THR  17          2HG2      THR  17   3.409  11.150  -2.526
  123    H    ASN  18           H        ASN  18   1.829  10.870  -7.171
  124    HA   ASN  18           HA       ASN  18   2.470  10.114  -9.307
  125   1HB   ASN  18          2HB       ASN  18   4.617   8.520  -7.876
  126   2HB   ASN  18          1HB       ASN  18   4.632   9.088  -9.546
  127   1HD2  ASN  18          2HD2      ASN  18   4.759  12.594  -7.963
  128   2HD2  ASN  18          1HD2      ASN  18   3.450  11.759  -8.647
  129    H    VAL  19           H        VAL  19   0.869   8.536  -7.162
  130    HA   VAL  19           HA       VAL  19   1.023   5.809  -7.296
  131    HB   VAL  19           HB       VAL  19  -1.584   7.246  -7.806
  132   1HG1  VAL  19          3HG1      VAL  19  -0.753   4.705  -6.387
  133   2HG1  VAL  19          2HG1      VAL  19  -2.344   5.438  -6.171
  134   3HG1  VAL  19          1HG1      VAL  19  -1.844   4.872  -7.764
  135   1HG2  VAL  19          2HG2      VAL  19   0.309   7.567  -5.613
  136   2HG2  VAL  19          1HG2      VAL  19  -1.161   8.477  -5.962
  137   3HG2  VAL  19          3HG2      VAL  19  -1.251   6.972  -5.046
  138    H    TRP  20           H        TRP  20  -0.151   4.226  -8.645
  139    HA   TRP  20           HA       TRP  20  -0.646   5.062 -11.440
  140   1HB   TRP  20          2HB       TRP  20   1.036   3.835 -12.390
  141   2HB   TRP  20          1HB       TRP  20   1.800   3.992 -10.814
  142    HD1  TRP  20           HD1      TRP  20  -0.172   1.511 -12.967
  143    HE1  TRP  20           HE1      TRP  20   0.140  -0.860 -12.013
  144    HE3  TRP  20           HE3      TRP  20   2.412   2.620  -8.704
  145    HZ2  TRP  20           HZ2      TRP  20   1.358  -2.123  -9.755
  146    HZ3  TRP  20           HZ3      TRP  20   3.143   0.813  -7.175
  147    HH2  TRP  20           HH2      TRP  20   2.620  -1.556  -7.696
  148    H    LYS  21           H        LYS  21  -1.398   2.820 -12.604
  149    HA   LYS  21           HA       LYS  21  -2.984   1.183 -10.720
  150   1HB   LYS  21          2HB       LYS  21  -4.420   3.140 -11.435
  151   2HB   LYS  21          1HB       LYS  21  -4.295   2.537 -13.091
  152   1HG   LYS  21          2HG       LYS  21  -4.979   0.258 -11.751
  153   2HG   LYS  21          1HG       LYS  21  -5.852   1.476 -10.819
  154   1HD   LYS  21          2HD       LYS  21  -7.420   1.100 -12.468
  155   2HD   LYS  21          1HD       LYS  21  -6.473   2.354 -13.269
  156   1HE   LYS  21          2HE       LYS  21  -6.511   0.732 -14.931
  157   2HE   LYS  21          1HE       LYS  21  -5.028   0.290 -14.084
  158   1HZ   LYS  21          3HZ       LYS  21  -7.692  -0.871 -13.484
  159   2HZ   LYS  21          2HZ       LYS  21  -6.545  -1.600 -14.505
  160   3HZ   LYS  21          1HZ       LYS  21  -6.197  -1.369 -12.858
  161    H    ASP  22           H        ASP  22  -2.788  -0.914 -11.361
  162    HA   ASP  22           HA       ASP  22  -1.874  -1.401 -14.145
  163   1HB   ASP  22          2HB       ASP  22  -1.075  -2.408 -11.593
  164   2HB   ASP  22          1HB       ASP  22  -1.743  -3.746 -12.526
  165    H    ASP  23           H        ASP  23  -3.080  -2.625 -15.506
  166    HA   ASP  23           HA       ASP  23  -5.786  -3.421 -14.648
  167   1HB   ASP  23          2HB       ASP  23  -4.713  -2.529 -17.060
  168   2HB   ASP  23          1HB       ASP  23  -4.931  -4.259 -17.328
  169    H    LYS  24           H        LYS  24  -2.637  -4.713 -15.134
  170    HA   LYS  24           HA       LYS  24  -3.353  -7.504 -15.464
  171   1HB   LYS  24          2HB       LYS  24  -0.867  -5.951 -14.771
  172   2HB   LYS  24          1HB       LYS  24  -0.887  -7.703 -14.550
  173   1HG   LYS  24          2HG       LYS  24  -1.968  -7.494 -17.049
  174   2HG   LYS  24          1HG       LYS  24  -0.862  -6.119 -17.050
  175   1HD   LYS  24          2HD       LYS  24   0.420  -7.972 -17.836
  176   2HD   LYS  24          1HD       LYS  24   0.915  -7.730 -16.161
  177   1HE   LYS  24          2HE       LYS  24  -1.393  -9.484 -16.315
  178   2HE   LYS  24          1HE       LYS  24  -0.062 -10.106 -17.289
  179   1HZ   LYS  24          1HZ       LYS  24   1.401  -9.824 -15.367
  180   2HZ   LYS  24          3HZ       LYS  24   0.083  -9.302 -14.435
  181   3HZ   LYS  24          2HZ       LYS  24   0.121 -10.891 -15.033
  182    H    THR  25           H        THR  25  -2.098  -5.547 -12.773
  183    HA   THR  25           HA       THR  25  -2.573  -7.588 -10.773
  184    HB   THR  25           HB       THR  25  -2.188  -5.727  -9.157
  185    HG1  THR  25           HG1      THR  25  -1.617  -3.683 -10.239
  186   1HG2  THR  25          1HG2      THR  25  -0.387  -6.474 -11.343
  187   2HG2  THR  25          3HG2      THR  25   0.013  -4.914 -10.624
  188   3HG2  THR  25          2HG2      THR  25  -0.065  -6.357  -9.612
  189    H    LEU  26           H        LEU  26  -4.355  -4.910 -12.155
  190    HA   LEU  26           HA       LEU  26  -6.665  -4.473 -12.115
  191   1HB   LEU  26          2HB       LEU  26  -6.421  -7.228 -11.451
  192   2HB   LEU  26          1HB       LEU  26  -7.595  -6.522 -10.340
  193    HG   LEU  26           HG       LEU  26  -7.667  -6.165 -13.351
  194   1HD1  LEU  26          1HD1      LEU  26  -9.016  -8.111 -11.484
  195   2HD1  LEU  26          3HD1      LEU  26  -9.785  -7.634 -12.999
  196   3HD1  LEU  26          2HD1      LEU  26  -8.213  -8.433 -13.022
  197   1HD2  LEU  26          3HD2      LEU  26  -9.504  -5.379 -11.075
  198   2HD2  LEU  26          2HD2      LEU  26  -8.748  -4.322 -12.268
  199   3HD2  LEU  26          1HD2      LEU  26 -10.038  -5.421 -12.755
  200    H    ASP  27           H        ASP  27  -5.569  -2.737 -10.589
  201    HA   ASP  27           HA       ASP  27  -7.307  -2.147  -8.472
  202   1HB   ASP  27          2HB       ASP  27  -5.556  -4.318  -7.815
  203   2HB   ASP  27          1HB       ASP  27  -5.138  -2.935  -6.804
  204    H    ARG  28           H        ARG  28  -6.364  -0.483  -6.894
  205    HA   ARG  28           HA       ARG  28  -4.545   1.275  -8.377
  206   1HB   ARG  28          2HB       ARG  28  -6.553   1.874  -6.743
  207   2HB   ARG  28          1HB       ARG  28  -5.303   1.735  -5.508
  208   1HG   ARG  28          2HG       ARG  28  -5.269   4.023  -6.148
  209   2HG   ARG  28          1HG       ARG  28  -3.898   3.300  -6.989
  210   1HD   ARG  28          2HD       ARG  28  -5.239   4.754  -8.492
  211   2HD   ARG  28          1HD       ARG  28  -5.239   3.075  -9.030
  212    HE   ARG  28           HE       ARG  28  -7.522   2.872  -8.040
  213   1HH1  ARG  28          1HH2      ARG  28  -6.488   5.661  -9.600
  214   2HH1  ARG  28          2HH2      ARG  28  -7.849   6.632  -9.142
  215   1HH2  ARG  28          2HH1      ARG  28  -9.144   4.260  -6.967
  216   2HH2  ARG  28          1HH1      ARG  28  -9.354   5.838  -7.651
  217    H    TYR  29           H        TYR  29  -2.358   1.743  -7.704
  218    HA   TYR  29           HA       TYR  29  -1.350   0.150  -5.414
  219   1HB   TYR  29          2HB       TYR  29  -0.325  -0.075  -8.252
  220   2HB   TYR  29          1HB       TYR  29   0.526  -0.708  -6.844
  221    HD1  TYR  29           HD2      TYR  29  -0.577  -2.462  -5.410
  222    HD2  TYR  29           HD1      TYR  29  -2.209  -1.213  -9.181
  223    HE1  TYR  29           HE2      TYR  29  -1.989  -4.497  -5.472
  224    HE2  TYR  29           HE1      TYR  29  -3.621  -3.251  -9.243
  225    HH   TYR  29           HH       TYR  29  -3.307  -5.776  -6.781
  226    H    ALA  30           H        ALA  30   0.677   0.853  -4.613
  227    HA   ALA  30           HA       ALA  30   1.656   3.454  -5.710
  228   1HB   ALA  30          3HB       ALA  30   0.770   2.758  -2.944
  229   2HB   ALA  30          2HB       ALA  30   2.174   3.812  -3.108
  230   3HB   ALA  30          1HB       ALA  30   0.630   4.285  -3.816
  231    H    ASN  31           H        ASN  31   3.729   3.106  -6.350
  232    HA   ASN  31           HA       ASN  31   5.259   0.837  -5.352
  233   1HB   ASN  31          2HB       ASN  31   7.057   1.731  -6.825
  234   2HB   ASN  31          1HB       ASN  31   5.522   1.554  -7.675
  235   1HD2  ASN  31          2HD2      ASN  31   5.104   5.040  -8.200
  236   2HD2  ASN  31          1HD2      ASN  31   4.376   3.509  -8.291
  237    H    TYR  32           H        TYR  32   5.779   1.096  -3.177
  238    HA   TYR  32           HA       TYR  32   6.924   3.657  -2.264
  239   1HB   TYR  32          2HB       TYR  32   5.388   2.413  -0.773
  240   2HB   TYR  32          1HB       TYR  32   6.506   1.048  -0.770
  241    HD1  TYR  32           HD1      TYR  32   7.388   4.664  -0.733
  242    HD2  TYR  32           HD2      TYR  32   7.203   1.005   1.509
  243    HE1  TYR  32           HE1      TYR  32   8.679   5.722   1.100
  244    HE2  TYR  32           HE2      TYR  32   8.495   2.063   3.343
  245    HH   TYR  32           HH       TYR  32  10.034   5.144   2.964
  246    H    GLU  33           H        GLU  33   8.547   2.809  -4.180
  247    HA   GLU  33           HA       GLU  33  10.614   1.729  -4.720
  248   1HB   GLU  33          2HB       GLU  33  10.880   4.113  -3.642
  249   2HB   GLU  33          1HB       GLU  33  11.590   3.214  -2.301
  250   1HG   GLU  33          2HG       GLU  33  13.107   2.086  -3.988
  251   2HG   GLU  33          1HG       GLU  33  12.509   3.237  -5.184
  252    H    GLY  34           H        GLY  34  10.079  -0.486  -4.061
  253   1HA   GLY  34          2HA       GLY  34  11.586  -2.195  -2.951
  254   2HA   GLY  34          1HA       GLY  34  11.395  -1.235  -1.481
  255    H    CYS  35           H        CYS  35   8.586  -0.661  -1.815
  256    HA   CYS  35           HA       CYS  35   7.449  -3.420  -1.566
  257   1HB   CYS  35          2HB       CYS  35   7.810  -1.903   0.591
  258   2HB   CYS  35          1HB       CYS  35   6.299  -1.176   0.042
  259    H    LEU  36           H        LEU  36   4.945  -3.306  -1.711
  260    HA   LEU  36           HA       LEU  36   4.081  -1.156  -3.570
  261   1HB   LEU  36          2HB       LEU  36   4.825  -3.457  -4.652
  262   2HB   LEU  36          1HB       LEU  36   3.217  -3.959  -4.135
  263    HG   LEU  36           HG       LEU  36   3.247  -3.034  -6.455
  264   1HD1  LEU  36          3HD1      LEU  36   1.441  -2.551  -4.406
  265   2HD1  LEU  36          2HD1      LEU  36   1.700  -0.955  -5.109
  266   3HD1  LEU  36          1HD1      LEU  36   1.146  -2.286  -6.123
  267   1HD2  LEU  36          2HD2      LEU  36   4.902  -1.095  -5.252
  268   2HD2  LEU  36          1HD2      LEU  36   4.328  -1.110  -6.920
  269   3HD2  LEU  36          3HD2      LEU  36   3.414  -0.252  -5.678
  270    H    TRP  37           H        TRP  37   2.315  -0.263  -2.718
  271    HA   TRP  37           HA       TRP  37   0.594  -1.876  -0.918
  272   1HB   TRP  37          2HB       TRP  37   0.454   1.104  -1.492
  273   2HB   TRP  37          1HB       TRP  37  -0.328   0.228  -0.185
  274    HD1  TRP  37           HD1      TRP  37   3.301   0.728  -1.433
  275    HE1  TRP  37           HE1      TRP  37   4.820   0.944   0.640
  276    HE3  TRP  37           HE3      TRP  37  -0.163   0.103   2.275
  277    HZ2  TRP  37           HZ2      TRP  37   4.596   0.859   3.490
  278    HZ3  TRP  37           HZ3      TRP  37   0.517   0.169   4.650
  279    HH2  TRP  37           HH2      TRP  37   2.891   0.550   5.265
  280    H    ASN  38           H        ASN  38  -1.877  -1.186  -1.207
  281    HA   ASN  38           HA       ASN  38  -2.531  -0.923  -4.094
  282   1HB   ASN  38          2HB       ASN  38  -2.834  -3.183  -4.157
  283   2HB   ASN  38          1HB       ASN  38  -2.901  -3.318  -2.404
  284   1HD2  ASN  38          2HD2      ASN  38  -6.459  -2.203  -4.148
  285   2HD2  ASN  38          1HD2      ASN  38  -5.027  -1.424  -4.617
  286    H    ALA  39           H        ALA  39  -3.892   0.777  -4.201
  287    HA   ALA  39           HA       ALA  39  -5.570   1.479  -1.874
  288   1HB   ALA  39          2HB       ALA  39  -4.320   2.948  -3.934
  289   2HB   ALA  39          1HB       ALA  39  -6.054   3.096  -4.225
  290   3HB   ALA  39          3HB       ALA  39  -5.377   3.579  -2.670
  291    H    THR  40           H        THR  40  -7.803   1.347  -1.864
  292    HA   THR  40           HA       THR  40  -9.177   0.365  -4.309
  293    HB   THR  40           HB       THR  40  -8.846  -1.722  -3.318
  294    HG1  THR  40           HG1      THR  40 -10.837  -2.247  -2.854
  295   1HG2  THR  40          3HG2      THR  40  -7.735  -0.682  -1.287
  296   2HG2  THR  40          2HG2      THR  40  -9.342  -0.533  -0.578
  297   3HG2  THR  40          1HG2      THR  40  -8.689  -2.127  -0.955
  298    H    GLY  41           H        GLY  41  -9.619   1.297  -0.877
  299   1HA   GLY  41          2HA       GLY  41 -12.381   2.100  -1.298
  300   2HA   GLY  41          1HA       GLY  41 -11.425   2.412   0.150
  301    H    VAL  42           H        VAL  42 -12.600   4.570  -0.082
  302    HA   VAL  42           HA       VAL  42 -12.072   6.381  -2.201
  303    HB   VAL  42           HB       VAL  42 -12.488   6.964   0.746
  304   1HG1  VAL  42          3HG1      VAL  42 -11.505   8.813  -0.750
  305   2HG1  VAL  42          2HG1      VAL  42 -13.051   8.787  -1.599
  306   3HG1  VAL  42          1HG1      VAL  42 -12.994   9.203   0.114
  307   1HG2  VAL  42          2HG2      VAL  42 -14.397   6.726  -1.598
  308   2HG2  VAL  42          1HG2      VAL  42 -14.342   5.694  -0.170
  309   3HG2  VAL  42          3HG2      VAL  42 -14.848   7.377  -0.023
  310    H    VAL  43           H        VAL  43 -10.349   7.770  -2.608
  311    HA   VAL  43           HA       VAL  43  -8.115   7.803  -0.643
  312    HB   VAL  43           HB       VAL  43  -7.495   7.514  -3.563
  313   1HG1  VAL  43          1HG1      VAL  43  -5.723   8.070  -1.926
  314   2HG1  VAL  43          3HG1      VAL  43  -6.113   6.610  -1.017
  315   3HG1  VAL  43          2HG1      VAL  43  -5.455   6.484  -2.648
  316   1HG2  VAL  43          1HG2      VAL  43  -9.091   5.675  -2.963
  317   2HG2  VAL  43          3HG2      VAL  43  -7.478   5.084  -3.359
  318   3HG2  VAL  43          2HG2      VAL  43  -7.989   5.189  -1.675
  319    H    VAL  44           H        VAL  44  -7.463   9.879  -0.330
  320    HA   VAL  44           HA       VAL  44  -8.575  12.086  -1.769
  321    HB   VAL  44           HB       VAL  44  -6.099  11.895  -0.025
  322   1HG1  VAL  44          3HG1      VAL  44  -6.626  13.921  -1.806
  323   2HG1  VAL  44          2HG1      VAL  44  -7.439  14.502  -0.354
  324   3HG1  VAL  44          1HG1      VAL  44  -5.718  14.118  -0.307
  325   1HG2  VAL  44          2HG2      VAL  44  -8.630  11.528   0.764
  326   2HG2  VAL  44          1HG2      VAL  44  -7.472  12.411   1.759
  327   3HG2  VAL  44          3HG2      VAL  44  -8.622  13.292   0.755
  328    H    CYS  45           H        CYS  45  -8.196  11.936  -4.008
  329    HA   CYS  45           HA       CYS  45  -5.351  11.739  -4.873
  330   1HB   CYS  45          2HB       CYS  45  -7.962  11.027  -6.099
  331   2HB   CYS  45          1HB       CYS  45  -6.738  11.660  -7.199
  332    H    THR  46           H        THR  46  -4.335  13.532  -5.605
  333    HA   THR  46           HA       THR  46  -6.006  15.839  -6.493
  334    HB   THR  46           HB       THR  46  -5.118  16.180  -4.176
  335    HG1  THR  46           HG1      THR  46  -5.205  17.818  -6.067
  336   1HG2  THR  46          1HG2      THR  46  -3.052  14.832  -4.493
  337   2HG2  THR  46          3HG2      THR  46  -2.426  16.085  -5.566
  338   3HG2  THR  46          2HG2      THR  46  -2.711  16.444  -3.863
  339    H    GLY  47           H        GLY  47  -4.843  17.312  -7.950
  340   1HA   GLY  47          2HA       GLY  47  -3.487  17.734  -9.816
  341   2HA   GLY  47          1HA       GLY  47  -2.250  16.765  -9.011
  342    H    ASP  48           H        ASP  48  -5.391  16.239 -10.662
  343    HA   ASP  48           HA       ASP  48  -5.970  14.597 -12.250
  344   1HB   ASP  48          2HB       ASP  48  -3.037  13.955 -12.513
  345   2HB   ASP  48          1HB       ASP  48  -4.300  13.843 -13.739
  346    H    GLU  49           H        GLU  49  -4.994  14.134  -9.299
  347    HA   GLU  49           HA       GLU  49  -5.182  12.324  -7.849
  348   1HB   GLU  49          2HB       GLU  49  -5.600  10.608 -10.313
  349   2HB   GLU  49          1HB       GLU  49  -5.994  10.188  -8.649
  350   1HG   GLU  49          2HG       GLU  49  -7.382  12.490  -8.854
  351   2HG   GLU  49          1HG       GLU  49  -7.435  11.971 -10.538
  352    H    THR  50           H        THR  50  -2.822  12.791 -10.130
  353    HA   THR  50           HA       THR  50  -1.225  10.501 -10.124
  354    HB   THR  50           HB       THR  50   0.732  12.272  -9.877
  355    HG1  THR  50           HG1      THR  50  -0.001  14.187  -9.526
  356   1HG2  THR  50          1HG2      THR  50  -0.942  11.336 -12.000
  357   2HG2  THR  50          3HG2      THR  50  -0.519  13.017 -12.319
  358   3HG2  THR  50          2HG2      THR  50   0.752  11.820 -12.072
  359    H    GLN  51           H        GLN  51  -1.733  12.850  -7.518
  360    HA   GLN  51           HA       GLN  51  -0.027  11.136  -5.763
  361   1HB   GLN  51          2HB       GLN  51  -1.156  13.777  -4.890
  362   2HB   GLN  51          1HB       GLN  51   0.341  12.987  -4.394
  363   1HG   GLN  51          2HG       GLN  51   1.282  13.397  -6.658
  364   2HG   GLN  51          1HG       GLN  51  -0.198  14.252  -7.098
  365   1HE2  GLN  51          2HE2      GLN  51   2.575  16.496  -5.549
  366   2HE2  GLN  51          1HE2      GLN  51   2.762  15.160  -6.579
  367    H    CYS  52           H        CYS  52  -1.025  10.118  -3.963
  368    HA   CYS  52           HA       CYS  52  -3.790  10.892  -3.350
  369   1HB   CYS  52          2HB       CYS  52  -3.454   8.977  -5.282
  370   2HB   CYS  52          1HB       CYS  52  -3.630   7.998  -3.827
  371    H    TYR  53           H        TYR  53  -4.591   9.996  -1.376
  372    HA   TYR  53           HA       TYR  53  -2.666   8.379   0.201
  373   1HB   TYR  53          2HB       TYR  53  -2.040  10.351   1.213
  374   2HB   TYR  53          1HB       TYR  53  -3.530  11.172   0.760
  375    HD1  TYR  53           HD1      TYR  53  -1.985   8.851   3.221
  376    HD2  TYR  53           HD2      TYR  53  -5.460  11.165   2.205
  377    HE1  TYR  53           HE1      TYR  53  -2.900   8.472   5.495
  378    HE2  TYR  53           HE2      TYR  53  -6.369  10.794   4.481
  379    HH   TYR  53           HH       TYR  53  -6.130   9.172   6.311
  380    H    GLY  54           H        GLY  54  -3.715   7.320   2.063
  381   1HA   GLY  54          2HA       GLY  54  -6.182   7.290   3.078
  382   2HA   GLY  54          1HA       GLY  54  -6.553   6.715   1.451
  383    H    THR  55           H        THR  55  -6.779   4.528   1.474
  384    HA   THR  55           HA       THR  55  -4.930   2.979   3.244
  385    HB   THR  55           HB       THR  55  -6.697   1.121   2.874
  386    HG1  THR  55           HG1      THR  55  -7.823   2.111   1.202
  387   1HG2  THR  55          1HG2      THR  55  -6.575   3.363   4.670
  388   2HG2  THR  55          3HG2      THR  55  -8.257   2.911   4.400
  389   3HG2  THR  55          2HG2      THR  55  -7.107   1.714   4.990
  390    H    TRP  56           H        TRP  56  -3.516   1.691   2.291
  391    HA   TRP  56           HA       TRP  56  -3.867   0.905  -0.560
  392   1HB   TRP  56          2HB       TRP  56  -1.309   1.711   0.810
  393   2HB   TRP  56          1HB       TRP  56  -1.522   1.352  -0.906
  394    HD1  TRP  56           HD1      TRP  56  -2.718   3.894   1.730
  395    HE1  TRP  56           HE1      TRP  56  -3.245   6.106   0.527
  396    HE3  TRP  56           HE3      TRP  56  -1.927   2.446  -3.083
  397    HZ2  TRP  56           HZ2      TRP  56  -3.324   7.129  -2.167
  398    HZ3  TRP  56           HZ3      TRP  56  -2.235   4.036  -4.954
  399    HH2  TRP  56           HH2      TRP  56  -2.932   6.381  -4.504
  400    H    VAL  57           H        VAL  57  -4.646  -1.135   0.753
  401    HA   VAL  57           HA       VAL  57  -3.094  -2.626   2.495
  402    HB   VAL  57           HB       VAL  57  -4.779  -3.577   0.166
  403   1HG1  VAL  57          1HG1      VAL  57  -3.213  -5.122   2.220
  404   2HG1  VAL  57          3HG1      VAL  57  -4.742  -5.761   1.616
  405   3HG1  VAL  57          2HG1      VAL  57  -3.414  -5.451   0.499
  406   1HG2  VAL  57          3HG2      VAL  57  -5.162  -3.147   3.124
  407   2HG2  VAL  57          2HG2      VAL  57  -6.163  -2.581   1.788
  408   3HG2  VAL  57          1HG2      VAL  57  -6.188  -4.284   2.249
  409    HA   PRO  58           HA       PRO  58   0.626  -3.369   0.168
  410   1HB   PRO  58          2HB       PRO  58   1.798  -5.033   2.042
  411   2HB   PRO  58          1HB       PRO  58   1.811  -3.261   2.136
  412   1HG   PRO  58          2HG       PRO  58   0.176  -5.215   3.690
  413   2HG   PRO  58          1HG       PRO  58   0.715  -3.585   4.143
  414   1HD   PRO  58          2HD       PRO  58  -1.883  -4.254   3.275
  415   2HD   PRO  58          1HD       PRO  58  -1.200  -2.616   3.325
  416    H    ILE  59           H        ILE  59   1.162  -4.961  -1.323
  417    HA   ILE  59           HA       ILE  59   0.129  -7.713  -0.875
  418    HB   ILE  59           HB       ILE  59  -0.754  -7.722  -3.222
  419   1HG1  ILE  59          2HG1      ILE  59   0.662  -5.678  -3.854
  420   2HG1  ILE  59          1HG1      ILE  59  -0.999  -5.687  -4.440
  421   1HG2  ILE  59          2HG2      ILE  59  -2.260  -7.424  -1.285
  422   2HG2  ILE  59          1HG2      ILE  59  -1.991  -5.683  -1.344
  423   3HG2  ILE  59          3HG2      ILE  59  -2.824  -6.491  -2.672
  424   1HD1  ILE  59          1HD1      ILE  59  -1.242  -4.464  -1.969
  425   2HD1  ILE  59          3HD1      ILE  59   0.309  -3.869  -2.549
  426   3HD1  ILE  59          2HD1      ILE  59  -1.138  -3.628  -3.514
  427    H    GLY  60           H        GLY  60   2.191  -5.528  -2.791
  428   1HA   GLY  60          2HA       GLY  60   3.803  -7.961  -3.467
  429   2HA   GLY  60          1HA       GLY  60   3.462  -6.728  -4.675
  430    H    LEU  61           H        LEU  61   5.986  -7.081  -4.524
  431    HA   LEU  61           HA       LEU  61   7.216  -5.430  -2.415
  432   1HB   LEU  61          2HB       LEU  61   8.644  -6.590  -4.807
  433   2HB   LEU  61          1HB       LEU  61   9.293  -6.230  -3.208
  434    HG   LEU  61           HG       LEU  61   7.349  -8.438  -3.928
  435   1HD1  LEU  61          1HD1      LEU  61  10.029  -8.478  -4.150
  436   2HD1  LEU  61          3HD1      LEU  61   9.891  -8.868  -2.436
  437   3HD1  LEU  61          2HD1      LEU  61   9.106  -9.892  -3.640
  438   1HD2  LEU  61          3HD2      LEU  61   7.979  -7.096  -1.360
  439   2HD2  LEU  61          2HD2      LEU  61   6.543  -8.003  -1.832
  440   3HD2  LEU  61          1HD2      LEU  61   7.998  -8.860  -1.320
  441    H    ALA  62           H        ALA  62   6.058  -5.123  -5.673
  442    HA   ALA  62           HA       ALA  62   6.220  -2.323  -5.715
  443   1HB   ALA  62          3HB       ALA  62   8.729  -3.692  -6.590
  444   2HB   ALA  62          2HB       ALA  62   8.221  -2.232  -7.440
  445   3HB   ALA  62          1HB       ALA  62   8.525  -2.180  -5.703
  446    H    ILE  63           H        ILE  63   4.452  -4.363  -6.781
  447    HA   ILE  63           HA       ILE  63   3.552  -3.268  -9.100
  448    HB   ILE  63           HB       ILE  63   6.071  -4.579  -9.668
  449   1HG1  ILE  63          2HG1      ILE  63   5.555  -2.336 -10.409
  450   2HG1  ILE  63          1HG1      ILE  63   5.698  -3.352 -11.842
  451   1HG2  ILE  63          1HG2      ILE  63   3.637  -5.558 -11.177
  452   2HG2  ILE  63          3HG2      ILE  63   5.264  -5.601 -11.856
  453   3HG2  ILE  63          2HG2      ILE  63   4.892  -6.528 -10.404
  454   1HD1  ILE  63          2HD1      ILE  63   2.971  -3.379 -10.835
  455   2HD1  ILE  63          1HD1      ILE  63   3.505  -1.726 -11.145
  456   3HD1  ILE  63          3HD1      ILE  63   3.559  -2.929 -12.434
  457    HA   PRO  64           HA       PRO  64   2.093  -7.822  -9.172
  458   1HB   PRO  64          2HB       PRO  64   2.569  -9.281  -6.877
  459   2HB   PRO  64          1HB       PRO  64   3.559  -9.355  -8.347
  460   1HG   PRO  64          2HG       PRO  64   4.148  -8.018  -5.754
  461   2HG   PRO  64          1HG       PRO  64   5.267  -8.645  -6.972
  462   1HD   PRO  64          2HD       PRO  64   4.619  -5.944  -6.589
  463   2HD   PRO  64          1HD       PRO  64   5.419  -6.606  -8.024
  464    H    GLU  65           H        GLU  65   0.042  -8.454  -8.497
  465    HA   GLU  65           HA       GLU  65  -1.378  -6.530  -6.837
  466   1HB   GLU  65          2HB       GLU  65  -3.378  -7.723  -7.532
  467   2HB   GLU  65          1HB       GLU  65  -2.321  -7.553  -8.929
  468   1HG   GLU  65          2HG       GLU  65  -1.950 -10.000  -7.275
  469   2HG   GLU  65          1HG       GLU  65  -3.418  -9.910  -8.245
  470    H    ASN  66           H        ASN  66  -3.351  -8.300  -5.761
  471    HA   ASN  66           HA       ASN  66  -1.928  -9.158  -3.330
  472   1HB   ASN  66          2HB       ASN  66  -3.945  -7.961  -2.905
  473   2HB   ASN  66          1HB       ASN  66  -4.842  -8.898  -4.098
  474   1HD2  ASN  66          2HD2      ASN  66  -4.051 -10.606  -0.433
  475   2HD2  ASN  66          1HD2      ASN  66  -3.067  -9.337  -0.986
  476    H    ALA  67           H        ALA  67  -3.531 -10.565  -6.114
  477    HA   ALA  67           HA       ALA  67  -4.152 -13.139  -5.330
  478   1HB   ALA  67          3HB       ALA  67  -3.959 -11.963  -7.734
  479   2HB   ALA  67          2HB       ALA  67  -2.478 -12.919  -7.789
  480   3HB   ALA  67          1HB       ALA  67  -4.034 -13.716  -7.558
  481    H    ALA  68           H        ALA  68  -0.972 -11.704  -5.520
  482    HA   ALA  68           HA       ALA  68   1.093 -12.498  -4.736
  483   1HB   ALA  68          1HB       ALA  68  -0.385 -13.338  -2.837
  484   2HB   ALA  68          3HB       ALA  68  -0.433 -14.887  -3.678
  485   3HB   ALA  68          2HB       ALA  68   1.104 -14.246  -3.098
  486    H    ALA  69           H        ALA  69  -0.161 -13.332  -7.354
  487    HA   ALA  69           HA       ALA  69   1.361 -15.877  -7.761
  488   1HB   ALA  69          2HB       ALA  69  -1.238 -15.550  -8.300
  489   2HB   ALA  69          1HB       ALA  69  -0.588 -14.879  -9.796
  490   3HB   ALA  69          3HB       ALA  69  -0.202 -16.536  -9.332
  491    H    HIS  70           HN       HIS  70   2.981 -15.895  -9.317
  492    HA   HIS  70           HA       HIS  70   4.598 -14.989 -10.757
  493   1HB   HIS  70          2HB       HIS  70   1.988 -14.179 -11.739
  494   2HB   HIS  70          1HB       HIS  70   3.206 -12.960 -12.115
  495    HD1  HIS  70           HD1      HIS  70   1.942 -16.186 -13.230
  496    HD2  HIS  70           HD2      HIS  70   5.582 -14.168 -13.473
  497    HE1  HIS  70           HE1      HIS  70   3.280 -17.337 -15.048
   
  No H/Q in entry =         497
  Start of MODEL    6
    1   1H    GLU   1          3H        GLU   1  13.756  -7.131   1.269
    2   2H    GLU   1          2H        GLU   1  13.245  -7.490  -0.308
    3   3H    GLU   1          1H        GLU   1  13.825  -5.937   0.066
    4    HA   GLU   1           HA       GLU   1  11.950  -5.438   1.394
    5   1HB   GLU   1          2HB       GLU   1  10.138  -5.653  -0.251
    6   2HB   GLU   1          1HB       GLU   1  11.648  -5.231  -1.060
    7   1HG   GLU   1          2HG       GLU   1  11.052  -8.133  -0.739
    8   2HG   GLU   1          1HG       GLU   1  10.087  -7.241  -1.910
    9    H    THR   2           H        THR   2  12.309  -8.837   0.666
   10    HA   THR   2           HA       THR   2  11.197 -10.730   1.525
   11    HB   THR   2           HB       THR   2  10.748  -9.303   4.089
   12    HG1  THR   2           HG1      THR   2  13.053  -9.375   4.435
   13   1HG2  THR   2          3HG2      THR   2  10.569 -11.796   3.723
   14   2HG2  THR   2          2HG2      THR   2  12.306 -11.811   3.420
   15   3HG2  THR   2          1HG2      THR   2  11.691 -11.326   5.000
   16    H    VAL   3           H        VAL   3   9.198 -10.797   0.427
   17    HA   VAL   3           HA       VAL   3   6.997  -9.144   0.688
   18    HB   VAL   3           HB       VAL   3   6.935 -12.174   0.555
   19   1HG1  VAL   3          3HG1      VAL   3   4.757 -11.053   1.087
   20   2HG1  VAL   3          2HG1      VAL   3   4.914 -10.132  -0.408
   21   3HG1  VAL   3          1HG1      VAL   3   4.750 -11.886  -0.467
   22   1HG2  VAL   3          2HG2      VAL   3   8.247 -10.592  -1.181
   23   2HG2  VAL   3          1HG2      VAL   3   7.366 -12.027  -1.703
   24   3HG2  VAL   3          3HG2      VAL   3   6.622 -10.435  -1.847
   25    H    GLU   4           H        GLU   4   8.187 -11.480   3.031
   26    HA   GLU   4           HA       GLU   4   5.891 -11.716   4.681
   27   1HB   GLU   4          2HB       GLU   4   8.146 -12.939   4.887
   28   2HB   GLU   4          1HB       GLU   4   8.705 -11.516   5.767
   29   1HG   GLU   4          2HG       GLU   4   7.507 -12.048   7.618
   30   2HG   GLU   4          1HG       GLU   4   6.089 -12.504   6.673
   31    H    SER   5           H        SER   5   8.542  -9.313   4.869
   32    HA   SER   5           HA       SER   5   7.038  -7.805   6.895
   33   1HB   SER   5          2HB       SER   5   9.362  -7.736   7.290
   34   2HB   SER   5          1HB       SER   5   9.735  -7.499   5.584
   35    HG   SER   5           HG       SER   5   9.868  -5.590   6.975
   36    H    CYS   6           H        CYS   6   8.280  -7.143   3.588
   37    HA   CYS   6           HA       CYS   6   7.155  -4.627   3.190
   38   1HB   CYS   6          2HB       CYS   6   8.147  -6.690   1.506
   39   2HB   CYS   6          1HB       CYS   6   6.580  -6.201   0.855
   40    H    LEU   7           H        LEU   7   5.532  -7.713   3.458
   41    HA   LEU   7           HA       LEU   7   2.975  -6.490   2.635
   42   1HB   LEU   7          2HB       LEU   7   3.679  -9.328   3.414
   43   2HB   LEU   7          1HB       LEU   7   2.062  -8.800   2.947
   44    HG   LEU   7           HG       LEU   7   4.547  -9.001   1.255
   45   1HD1  LEU   7          3HD1      LEU   7   2.841 -10.826   1.335
   46   2HD1  LEU   7          2HD1      LEU   7   1.641  -9.682   0.734
   47   3HD1  LEU   7          1HD1      LEU   7   3.024 -10.119  -0.270
   48   1HD2  LEU   7          3HD2      LEU   7   2.122  -7.278   0.644
   49   2HD2  LEU   7          2HD2      LEU   7   3.750  -6.679   0.970
   50   3HD2  LEU   7          1HD2      LEU   7   3.436  -7.637  -0.477
   51    H    ALA   8           H        ALA   8   4.362  -8.075   5.523
   52    HA   ALA   8           HA       ALA   8   2.155  -7.688   7.239
   53   1HB   ALA   8          1HB       ALA   8   5.143  -7.625   7.729
   54   2HB   ALA   8          3HB       ALA   8   3.996  -7.351   9.040
   55   3HB   ALA   8          2HB       ALA   8   3.994  -8.887   8.174
   56    H    LYS   9           H        LYS   9   5.042  -5.627   7.188
   57    HA   LYS   9           HA       LYS   9   5.242  -3.298   7.588
   58   1HB   LYS   9          2HB       LYS   9   3.682  -4.006   5.235
   59   2HB   LYS   9          1HB       LYS   9   3.277  -2.391   5.795
   60   1HG   LYS   9          2HG       LYS   9   5.739  -1.875   5.880
   61   2HG   LYS   9          1HG       LYS   9   6.045  -3.461   5.174
   62   1HD   LYS   9          2HD       LYS   9   5.010  -2.885   3.131
   63   2HD   LYS   9          1HD       LYS   9   4.206  -1.480   3.836
   64   1HE   LYS   9          2HE       LYS   9   7.134  -1.826   3.184
   65   2HE   LYS   9          1HE       LYS   9   6.030  -0.573   2.614
   66   1HZ   LYS   9          3HZ       LYS   9   5.830  -0.114   5.168
   67   2HZ   LYS   9          2HZ       LYS   9   7.360  -0.851   5.211
   68   3HZ   LYS   9          1HZ       LYS   9   7.109   0.540   4.267
   69    HA   PRO  10           HA       PRO  10   1.995  -1.506  10.012
   70   1HB   PRO  10          2HB       PRO  10   1.600   1.028   8.998
   71   2HB   PRO  10          1HB       PRO  10   3.005   0.573   9.977
   72   1HG   PRO  10          2HG       PRO  10   2.840   1.052   7.040
   73   2HG   PRO  10          1HG       PRO  10   4.230   1.213   8.127
   74   1HD   PRO  10          2HD       PRO  10   3.752  -0.932   6.365
   75   2HD   PRO  10          1HD       PRO  10   4.935  -0.927   7.688
   76    H    HIS  11           H        HIS  11   1.535  -2.241   6.822
   77    HA   HIS  11           HA       HIS  11  -0.330  -2.890   5.624
   78   1HB   HIS  11          2HB       HIS  11  -1.371  -2.611   8.342
   79   2HB   HIS  11          1HB       HIS  11  -2.582  -2.294   7.092
   80    HD1  HIS  11           HD1      HIS  11   0.110  -4.637   6.081
   81    HD2  HIS  11           HD2      HIS  11  -3.684  -4.915   7.802
   82    HE1  HIS  11           HE1      HIS  11  -0.589  -7.061   5.895
   83    H    THR  12           H        THR  12  -2.211  -2.060   4.616
   84    HA   THR  12           HA       THR  12  -2.264  -0.023   3.084
   85    HB   THR  12           HB       THR  12  -4.195  -1.539   4.044
   86    HG1  THR  12           HG1      THR  12  -5.523  -0.572   2.635
   87   1HG2  THR  12          3HG2      THR  12  -4.796   1.196   5.167
   88   2HG2  THR  12          2HG2      THR  12  -5.984  -0.098   5.027
   89   3HG2  THR  12          1HG2      THR  12  -4.583  -0.297   6.080
   90    H    GLU  13           H        GLU  13  -3.111   0.738   6.510
   91    HA   GLU  13           HA       GLU  13  -3.447   3.476   6.224
   92   1HB   GLU  13          2HB       GLU  13  -3.578   2.242   8.408
   93   2HB   GLU  13          1HB       GLU  13  -1.813   2.218   8.452
   94   1HG   GLU  13          2HG       GLU  13  -1.742   4.337   9.202
   95   2HG   GLU  13          1HG       GLU  13  -2.760   4.887   7.870
   96    H    ASN  14           H        ASN  14  -2.220   4.478   4.713
   97    HA   ASN  14           HA       ASN  14   0.250   5.638   5.298
   98   1HB   ASN  14          2HB       ASN  14   0.524   2.857   4.580
   99   2HB   ASN  14          1HB       ASN  14   1.254   3.852   3.320
  100   1HD2  ASN  14          2HD2      ASN  14   4.104   3.828   5.462
  101   2HD2  ASN  14          1HD2      ASN  14   3.432   3.186   4.043
  102    H    SER  15           H        SER  15   1.367   5.424   2.557
  103    HA   SER  15           HA       SER  15  -0.664   5.793   0.611
  104   1HB   SER  15          2HB       SER  15  -0.568   8.296   0.448
  105   2HB   SER  15          1HB       SER  15  -1.347   7.712   1.913
  106    HG   SER  15           HG       SER  15   0.305   9.412   2.152
  107    H    PHE  16           H        PHE  16   0.394   7.699  -1.021
  108    HA   PHE  16           HA       PHE  16   3.225   7.723  -1.248
  109   1HB   PHE  16          2HB       PHE  16   3.237   5.386  -1.649
  110   2HB   PHE  16          1HB       PHE  16   1.767   5.462  -2.620
  111    HD1  PHE  16           HD1      PHE  16   5.283   6.780  -2.568
  112    HD2  PHE  16           HD2      PHE  16   1.938   5.510  -4.944
  113    HE1  PHE  16           HE1      PHE  16   6.642   7.041  -4.625
  114    HE2  PHE  16           HE2      PHE  16   3.296   5.775  -6.999
  115    HZ   PHE  16           HZ       PHE  16   5.652   6.534  -6.841
  116    H    THR  17           H        THR  17   3.764   9.153  -2.957
  117    HA   THR  17           HA       THR  17   1.418  10.173  -4.455
  118    HB   THR  17           HB       THR  17   2.313  12.159  -3.884
  119    HG1  THR  17           HG1      THR  17   4.628  11.949  -5.312
  120   1HG2  THR  17          2HG2      THR  17   3.732  11.064  -2.186
  121   2HG2  THR  17          1HG2      THR  17   4.963  10.758  -3.412
  122   3HG2  THR  17          3HG2      THR  17   4.576  12.414  -2.945
  123    H    ASN  18           H        ASN  18   1.749  10.682  -6.803
  124    HA   ASN  18           HA       ASN  18   2.514  10.074  -8.960
  125   1HB   ASN  18          2HB       ASN  18   4.800   9.743  -7.359
  126   2HB   ASN  18          1HB       ASN  18   4.608   8.202  -8.196
  127   1HD2  ASN  18          2HD2      ASN  18   5.512  11.571 -10.342
  128   2HD2  ASN  18          1HD2      ASN  18   5.011  11.705  -8.725
  129    H    VAL  19           H        VAL  19   1.185   8.270  -6.613
  130    HA   VAL  19           HA       VAL  19   1.293   5.587  -7.077
  131    HB   VAL  19           HB       VAL  19  -1.208   7.282  -6.834
  132   1HG1  VAL  19          1HG1      VAL  19  -0.804   4.309  -6.402
  133   2HG1  VAL  19          3HG1      VAL  19  -2.276   5.204  -6.028
  134   3HG1  VAL  19          2HG1      VAL  19  -1.742   5.049  -7.699
  135   1HG2  VAL  19          2HG2      VAL  19   0.834   7.011  -5.044
  136   2HG2  VAL  19          1HG2      VAL  19  -0.842   7.305  -4.585
  137   3HG2  VAL  19          3HG2      VAL  19  -0.201   5.662  -4.573
  138    H    TRP  20           H        TRP  20  -0.075   4.147  -8.427
  139    HA   TRP  20           HA       TRP  20  -0.920   5.327 -11.018
  140   1HB   TRP  20          2HB       TRP  20   0.548   4.117 -12.300
  141   2HB   TRP  20          1HB       TRP  20   1.520   4.119 -10.833
  142    HD1  TRP  20           HD1      TRP  20  -0.806   1.898 -12.899
  143    HE1  TRP  20           HE1      TRP  20  -0.497  -0.550 -12.172
  144    HE3  TRP  20           HE3      TRP  20   2.308   2.552  -8.903
  145    HZ2  TRP  20           HZ2      TRP  20   0.898  -2.038 -10.177
  146    HZ3  TRP  20           HZ3      TRP  20   3.116   0.597  -7.613
  147    HH2  TRP  20           HH2      TRP  20   2.417  -1.697  -8.247
  148    H    LYS  21           H        LYS  21  -1.928   3.273 -12.322
  149    HA   LYS  21           HA       LYS  21  -3.369   1.498 -10.444
  150   1HB   LYS  21          2HB       LYS  21  -4.773   3.586 -10.851
  151   2HB   LYS  21          1HB       LYS  21  -4.876   3.079 -12.539
  152   1HG   LYS  21          2HG       LYS  21  -5.493   0.750 -11.251
  153   2HG   LYS  21          1HG       LYS  21  -6.189   1.942 -10.151
  154   1HD   LYS  21          2HD       LYS  21  -7.904   1.423 -11.740
  155   2HD   LYS  21          1HD       LYS  21  -7.278   3.008 -12.195
  156   1HE   LYS  21          2HE       LYS  21  -5.817   0.769 -13.418
  157   2HE   LYS  21          1HE       LYS  21  -7.511   0.859 -13.904
  158   1HZ   LYS  21          1HZ       LYS  21  -6.806   3.420 -14.053
  159   2HZ   LYS  21          3HZ       LYS  21  -5.326   2.691 -14.443
  160   3HZ   LYS  21          2HZ       LYS  21  -6.711   2.344 -15.365
  161    H    ASP  22           H        ASP  22  -3.126  -0.519 -11.280
  162    HA   ASP  22           HA       ASP  22  -2.598  -0.766 -14.187
  163   1HB   ASP  22          2HB       ASP  22  -1.574  -2.039 -11.836
  164   2HB   ASP  22          1HB       ASP  22  -2.360  -3.261 -12.831
  165    H    ASP  23           H        ASP  23  -4.077  -1.670 -15.518
  166    HA   ASP  23           HA       ASP  23  -6.651  -2.565 -14.421
  167   1HB   ASP  23          2HB       ASP  23  -6.542  -1.254 -16.543
  168   2HB   ASP  23          1HB       ASP  23  -5.633  -2.571 -17.286
  169    H    LYS  24           H        LYS  24  -3.638  -3.858 -15.452
  170    HA   LYS  24           HA       LYS  24  -4.495  -6.576 -15.994
  171   1HB   LYS  24          2HB       LYS  24  -2.307  -5.475 -16.728
  172   2HB   LYS  24          1HB       LYS  24  -1.776  -5.620 -15.051
  173   1HG   LYS  24          2HG       LYS  24  -1.289  -7.804 -15.324
  174   2HG   LYS  24          1HG       LYS  24  -2.884  -8.130 -16.002
  175   1HD   LYS  24          2HD       LYS  24  -2.183  -7.706 -18.196
  176   2HD   LYS  24          1HD       LYS  24  -0.794  -6.753 -17.670
  177   1HE   LYS  24          2HE       LYS  24   0.451  -8.654 -17.085
  178   2HE   LYS  24          1HE       LYS  24  -0.983  -9.670 -16.956
  179   1HZ   LYS  24          2HZ       LYS  24  -1.271  -9.357 -19.393
  180   2HZ   LYS  24          1HZ       LYS  24   0.253  -8.608 -19.432
  181   3HZ   LYS  24          3HZ       LYS  24   0.121 -10.231 -18.961
  182    H    THR  25           H        THR  25  -2.804  -4.988 -13.305
  183    HA   THR  25           HA       THR  25  -3.103  -7.223 -11.499
  184    HB   THR  25           HB       THR  25  -2.180  -5.759  -9.835
  185    HG1  THR  25           HG1      THR  25  -2.059  -3.414 -10.657
  186   1HG2  THR  25          3HG2      THR  25  -1.099  -5.837 -12.500
  187   2HG2  THR  25          2HG2      THR  25  -0.693  -4.297 -11.744
  188   3HG2  THR  25          1HG2      THR  25  -0.240  -5.809 -10.961
  189    H    LEU  26           H        LEU  26  -5.035  -4.522 -12.474
  190    HA   LEU  26           HA       LEU  26  -7.275  -4.000 -12.042
  191   1HB   LEU  26          2HB       LEU  26  -6.987  -6.833 -11.292
  192   2HB   LEU  26          1HB       LEU  26  -8.336  -6.007 -10.510
  193    HG   LEU  26           HG       LEU  26  -7.805  -5.925 -13.492
  194   1HD1  LEU  26          2HD1      LEU  26  -8.450  -8.199 -12.395
  195   2HD1  LEU  26          1HD1      LEU  26 -10.029  -7.452 -12.152
  196   3HD1  LEU  26          3HD1      LEU  26  -9.385  -7.642 -13.782
  197   1HD2  LEU  26          3HD2      LEU  26  -9.145  -4.083 -12.200
  198   2HD2  LEU  26          2HD2      LEU  26  -9.843  -4.773 -13.666
  199   3HD2  LEU  26          1HD2      LEU  26 -10.397  -5.320 -12.083
  200    H    ASP  27           H        ASP  27  -6.039  -2.390 -10.507
  201    HA   ASP  27           HA       ASP  27  -7.517  -1.951  -8.188
  202   1HB   ASP  27          2HB       ASP  27  -5.699  -4.172  -7.880
  203   2HB   ASP  27          1HB       ASP  27  -5.298  -2.890  -6.739
  204    H    ARG  28           H        ARG  28  -6.497  -0.344  -6.677
  205    HA   ARG  28           HA       ARG  28  -4.654   1.396  -8.139
  206   1HB   ARG  28          2HB       ARG  28  -6.555   2.037  -6.423
  207   2HB   ARG  28          1HB       ARG  28  -5.303   1.734  -5.219
  208   1HG   ARG  28          2HG       ARG  28  -5.030   4.020  -5.677
  209   2HG   ARG  28          1HG       ARG  28  -3.821   3.268  -6.719
  210   1HD   ARG  28          2HD       ARG  28  -4.801   4.446  -8.390
  211   2HD   ARG  28          1HD       ARG  28  -6.065   3.219  -8.314
  212    HE   ARG  28           HE       ARG  28  -6.283   5.672  -6.631
  213   1HH1  ARG  28          2HH1      ARG  28  -8.641   4.236  -6.314
  214   2HH1  ARG  28          1HH1      ARG  28  -9.658   4.665  -7.648
  215   1HH2  ARG  28          1HH2      ARG  28  -7.062   5.940  -9.561
  216   2HH2  ARG  28          2HH2      ARG  28  -8.764   5.630  -9.487
  217    H    TYR  29           H        TYR  29  -2.417   1.600  -7.697
  218    HA   TYR  29           HA       TYR  29  -1.362  -0.025  -5.446
  219   1HB   TYR  29          2HB       TYR  29  -0.590  -0.339  -8.354
  220   2HB   TYR  29          1HB       TYR  29   0.352  -0.999  -7.018
  221    HD1  TYR  29           HD2      TYR  29  -0.801  -2.585  -5.384
  222    HD2  TYR  29           HD1      TYR  29  -2.508  -1.477  -9.163
  223    HE1  TYR  29           HE2      TYR  29  -2.296  -4.560  -5.283
  224    HE2  TYR  29           HE1      TYR  29  -4.009  -3.450  -9.061
  225    HH   TYR  29           HH       TYR  29  -4.455  -5.276  -6.227
  226    H    ALA  30           H        ALA  30   0.429   0.831  -4.508
  227    HA   ALA  30           HA       ALA  30   1.551   3.306  -5.750
  228   1HB   ALA  30          3HB       ALA  30   0.962   2.476  -2.964
  229   2HB   ALA  30          2HB       ALA  30   2.487   3.332  -3.193
  230   3HB   ALA  30          1HB       ALA  30   0.970   4.089  -3.678
  231    H    ASN  31           H        ASN  31   3.521   2.977  -6.676
  232    HA   ASN  31           HA       ASN  31   5.013   0.532  -6.183
  233   1HB   ASN  31          2HB       ASN  31   6.596   1.411  -7.815
  234   2HB   ASN  31          1HB       ASN  31   4.954   1.679  -8.398
  235   1HD2  ASN  31          2HD2      ASN  31   7.324   4.835  -8.115
  236   2HD2  ASN  31          1HD2      ASN  31   7.850   3.225  -8.246
  237    H    TYR  32           H        TYR  32   5.321   0.890  -3.800
  238    HA   TYR  32           HA       TYR  32   6.958   3.054  -2.833
  239   1HB   TYR  32          2HB       TYR  32   5.466   1.138  -1.619
  240   2HB   TYR  32          1HB       TYR  32   7.073   0.440  -1.423
  241    HD1  TYR  32           HD1      TYR  32   5.397   3.796  -1.154
  242    HD2  TYR  32           HD2      TYR  32   8.274   1.052   0.471
  243    HE1  TYR  32           HE1      TYR  32   5.861   5.378   0.698
  244    HE2  TYR  32           HE2      TYR  32   8.737   2.634   2.322
  245    HH   TYR  32           HH       TYR  32   6.789   5.498   2.821
  246    H    GLU  33           H        GLU  33   9.240   2.891  -2.197
  247    HA   GLU  33           HA       GLU  33  10.858   1.620  -4.202
  248   1HB   GLU  33          2HB       GLU  33  11.582   3.647  -2.974
  249   2HB   GLU  33          1HB       GLU  33  11.688   2.699  -1.490
  250   1HG   GLU  33          2HG       GLU  33  13.300   1.165  -2.729
  251   2HG   GLU  33          1HG       GLU  33  13.340   2.381  -4.007
  252    H    GLY  34           H        GLY  34  10.276  -0.626  -4.137
  253   1HA   GLY  34          2HA       GLY  34  11.156  -2.787  -3.534
  254   2HA   GLY  34          1HA       GLY  34  11.693  -2.111  -1.996
  255    H    CYS  35           H        CYS  35   8.544  -1.118  -2.740
  256    HA   CYS  35           HA       CYS  35   7.258  -3.460  -1.465
  257   1HB   CYS  35          2HB       CYS  35   8.052  -1.274   0.084
  258   2HB   CYS  35          1HB       CYS  35   6.337  -0.993  -0.216
  259    H    LEU  36           H        LEU  36   5.088  -3.657  -2.093
  260    HA   LEU  36           HA       LEU  36   4.047  -1.428  -3.794
  261   1HB   LEU  36          2HB       LEU  36   4.698  -3.508  -5.053
  262   2HB   LEU  36          1HB       LEU  36   3.464  -4.377  -4.162
  263    HG   LEU  36           HG       LEU  36   2.927  -3.332  -6.537
  264   1HD1  LEU  36          1HD1      LEU  36   1.448  -4.404  -4.633
  265   2HD1  LEU  36          3HD1      LEU  36   0.871  -2.752  -4.459
  266   3HD1  LEU  36          2HD1      LEU  36   0.701  -3.585  -6.001
  267   1HD2  LEU  36          2HD2      LEU  36   3.666  -1.022  -5.658
  268   2HD2  LEU  36          1HD2      LEU  36   2.123  -1.092  -6.504
  269   3HD2  LEU  36          3HD2      LEU  36   2.159  -1.021  -4.744
  270    H    TRP  37           H        TRP  37   2.309  -0.501  -2.884
  271    HA   TRP  37           HA       TRP  37   0.669  -2.068  -0.967
  272   1HB   TRP  37          2HB       TRP  37   0.499   0.904  -1.535
  273   2HB   TRP  37          1HB       TRP  37  -0.180   0.027  -0.171
  274    HD1  TRP  37           HD1      TRP  37   3.376   0.377  -1.675
  275    HE1  TRP  37           HE1      TRP  37   5.018   0.696   0.278
  276    HE3  TRP  37           HE3      TRP  37   0.103   0.182   2.249
  277    HZ2  TRP  37           HZ2      TRP  37   4.948   0.849   3.147
  278    HZ3  TRP  37           HZ3      TRP  37   0.912   0.407   4.570
  279    HH2  TRP  37           HH2      TRP  37   3.331   0.747   5.029
  280    H    ASN  38           H        ASN  38  -1.771  -1.493  -1.091
  281    HA   ASN  38           HA       ASN  38  -2.627  -1.142  -3.917
  282   1HB   ASN  38          2HB       ASN  38  -3.319  -3.281  -4.099
  283   2HB   ASN  38          1HB       ASN  38  -2.613  -3.618  -2.525
  284   1HD2  ASN  38          2HD2      ASN  38  -6.649  -2.804  -2.693
  285   2HD2  ASN  38          1HD2      ASN  38  -5.621  -2.106  -3.850
  286    H    ALA  39           H        ALA  39  -3.937   0.579  -3.897
  287    HA   ALA  39           HA       ALA  39  -5.562   1.125  -1.470
  288   1HB   ALA  39          2HB       ALA  39  -4.458   2.786  -3.691
  289   2HB   ALA  39          1HB       ALA  39  -5.979   3.307  -2.965
  290   3HB   ALA  39          3HB       ALA  39  -4.539   3.131  -1.963
  291    H    THR  40           H        THR  40  -7.807   1.513  -1.659
  292    HA   THR  40           HA       THR  40  -9.143  -0.096  -3.687
  293    HB   THR  40           HB       THR  40 -11.060   0.164  -2.368
  294    HG1  THR  40           HG1      THR  40 -11.262   2.013  -0.967
  295   1HG2  THR  40          2HG2      THR  40  -8.892  -0.631  -1.108
  296   2HG2  THR  40          1HG2      THR  40  -9.069   0.891  -0.235
  297   3HG2  THR  40          3HG2      THR  40 -10.362  -0.310  -0.191
  298    H    GLY  41           H        GLY  41 -11.507   1.599  -3.938
  299   1HA   GLY  41          2HA       GLY  41 -10.424   3.502  -5.958
  300   2HA   GLY  41          1HA       GLY  41 -12.064   2.852  -5.954
  301    H    VAL  42           H        VAL  42 -11.798   3.434  -2.849
  302    HA   VAL  42           HA       VAL  42 -12.785   6.237  -3.118
  303    HB   VAL  42           HB       VAL  42 -13.281   4.095  -1.035
  304   1HG1  VAL  42          3HG1      VAL  42 -13.686   7.058  -0.973
  305   2HG1  VAL  42          2HG1      VAL  42 -14.943   6.039  -0.274
  306   3HG1  VAL  42          1HG1      VAL  42 -13.294   5.952   0.344
  307   1HG2  VAL  42          1HG2      VAL  42 -14.939   5.504  -3.134
  308   2HG2  VAL  42          3HG2      VAL  42 -14.684   3.771  -2.927
  309   3HG2  VAL  42          2HG2      VAL  42 -15.684   4.659  -1.777
  310    H    VAL  43           H        VAL  43 -10.508   6.986  -3.139
  311    HA   VAL  43           HA       VAL  43  -9.488   7.273  -0.356
  312    HB   VAL  43           HB       VAL  43  -7.533   6.900  -2.602
  313   1HG1  VAL  43          2HG1      VAL  43  -7.522   7.121   0.283
  314   2HG1  VAL  43          1HG1      VAL  43  -6.767   5.607  -0.214
  315   3HG1  VAL  43          3HG1      VAL  43  -6.158   7.142  -0.834
  316   1HG2  VAL  43          3HG2      VAL  43  -9.087   4.980  -2.769
  317   2HG2  VAL  43          2HG2      VAL  43  -7.507   4.471  -2.171
  318   3HG2  VAL  43          1HG2      VAL  43  -8.858   4.651  -1.051
  319    H    VAL  44           H        VAL  44  -7.581   9.013  -0.492
  320    HA   VAL  44           HA       VAL  44  -8.768  11.351  -1.833
  321    HB   VAL  44           HB       VAL  44  -6.277  11.154  -0.111
  322   1HG1  VAL  44          2HG1      VAL  44  -6.752  13.174  -1.721
  323   2HG1  VAL  44          1HG1      VAL  44  -7.973  13.603  -0.524
  324   3HG1  VAL  44          3HG1      VAL  44  -6.277  13.492  -0.053
  325   1HG2  VAL  44          2HG2      VAL  44  -8.480  10.431   0.958
  326   2HG2  VAL  44          1HG2      VAL  44  -7.662  11.779   1.747
  327   3HG2  VAL  44          3HG2      VAL  44  -9.045  12.081   0.696
  328    H    CYS  45           H        CYS  45  -8.136  11.953  -3.853
  329    HA   CYS  45           HA       CYS  45  -5.335  11.348  -4.679
  330   1HB   CYS  45          2HB       CYS  45  -7.888  10.553  -6.022
  331   2HB   CYS  45          1HB       CYS  45  -6.507  10.969  -7.032
  332    H    THR  46           H        THR  46  -4.350  13.094  -5.580
  333    HA   THR  46           HA       THR  46  -6.058  15.254  -6.715
  334    HB   THR  46           HB       THR  46  -5.216  15.742  -4.349
  335    HG1  THR  46           HG1      THR  46  -4.032  17.671  -5.880
  336   1HG2  THR  46          1HG2      THR  46  -2.883  14.713  -5.168
  337   2HG2  THR  46          3HG2      THR  46  -2.578  16.404  -5.569
  338   3HG2  THR  46          2HG2      THR  46  -2.967  15.946  -3.910
  339    H    GLY  47           H        GLY  47  -4.812  16.708  -8.165
  340   1HA   GLY  47          2HA       GLY  47  -3.382  17.043  -9.991
  341   2HA   GLY  47          1HA       GLY  47  -2.178  16.120  -9.087
  342    H    ASP  48           H        ASP  48  -5.270  15.460 -10.791
  343    HA   ASP  48           HA       ASP  48  -5.757  13.756 -12.353
  344   1HB   ASP  48          2HB       ASP  48  -2.810  13.107 -12.393
  345   2HB   ASP  48          1HB       ASP  48  -3.997  12.871 -13.675
  346    H    GLU  49           H        GLU  49  -4.869  13.453  -9.322
  347    HA   GLU  49           HA       GLU  49  -5.085  11.730  -7.780
  348   1HB   GLU  49          2HB       GLU  49  -5.642   9.920 -10.151
  349   2HB   GLU  49          1HB       GLU  49  -6.029   9.604  -8.461
  350   1HG   GLU  49          2HG       GLU  49  -7.341  11.906  -8.687
  351   2HG   GLU  49          1HG       GLU  49  -7.363  11.457 -10.392
  352    H    THR  50           H        THR  50  -2.676  12.195  -9.827
  353    HA   THR  50           HA       THR  50  -1.214   9.739  -9.824
  354    HB   THR  50           HB       THR  50   0.807  11.475  -9.812
  355    HG1  THR  50           HG1      THR  50  -0.466  13.344 -10.999
  356   1HG2  THR  50          2HG2      THR  50  -0.814  10.230 -11.745
  357   2HG2  THR  50          1HG2      THR  50  -0.627  11.900 -12.285
  358   3HG2  THR  50          3HG2      THR  50   0.799  10.903 -11.984
  359    H    GLN  51           H        GLN  51  -1.625  12.303  -7.426
  360    HA   GLN  51           HA       GLN  51   0.099  10.691  -5.584
  361   1HB   GLN  51          2HB       GLN  51  -0.803  13.548  -5.159
  362   2HB   GLN  51          1HB       GLN  51   0.450  12.670  -4.282
  363   1HG   GLN  51          2HG       GLN  51   1.993  13.311  -5.789
  364   2HG   GLN  51          1HG       GLN  51   1.048  12.590  -7.094
  365   1HE2  GLN  51          2HE2      GLN  51   1.058  16.610  -6.615
  366   2HE2  GLN  51          1HE2      GLN  51   1.999  15.593  -5.635
  367    H    CYS  52           H        CYS  52  -0.899   9.819  -3.748
  368    HA   CYS  52           HA       CYS  52  -3.567  10.848  -3.025
  369   1HB   CYS  52          2HB       CYS  52  -3.201   7.943  -3.799
  370   2HB   CYS  52          1HB       CYS  52  -4.700   8.709  -3.280
  371    H    TYR  53           H        TYR  53  -4.420   9.865  -1.047
  372    HA   TYR  53           HA       TYR  53  -2.452   8.375   0.584
  373   1HB   TYR  53          2HB       TYR  53  -1.936  10.524   1.399
  374   2HB   TYR  53          1HB       TYR  53  -3.598  11.085   1.232
  375    HD1  TYR  53           HD1      TYR  53  -1.320   8.957   3.265
  376    HD2  TYR  53           HD2      TYR  53  -5.229  10.713   2.955
  377    HE1  TYR  53           HE1      TYR  53  -1.790   8.331   5.624
  378    HE2  TYR  53           HE2      TYR  53  -5.694  10.092   5.310
  379    HH   TYR  53           HH       TYR  53  -4.463   7.972   6.932
  380    H    GLY  54           H        GLY  54  -3.459   7.174   2.308
  381   1HA   GLY  54          2HA       GLY  54  -5.926   7.135   3.377
  382   2HA   GLY  54          1HA       GLY  54  -6.298   6.576   1.744
  383    H    THR  55           H        THR  55  -6.525   4.388   1.780
  384    HA   THR  55           HA       THR  55  -4.615   2.839   3.487
  385    HB   THR  55           HB       THR  55  -6.400   0.991   3.211
  386    HG1  THR  55           HG1      THR  55  -7.491   2.136   1.508
  387   1HG2  THR  55          3HG2      THR  55  -6.240   3.279   4.957
  388   2HG2  THR  55          2HG2      THR  55  -7.924   2.791   4.755
  389   3HG2  THR  55          1HG2      THR  55  -6.731   1.628   5.333
  390    H    TRP  56           H        TRP  56  -3.235   1.569   2.493
  391    HA   TRP  56           HA       TRP  56  -3.712   0.714  -0.323
  392   1HB   TRP  56          2HB       TRP  56  -1.083   1.521   0.901
  393   2HB   TRP  56          1HB       TRP  56  -1.403   1.166  -0.798
  394    HD1  TRP  56           HD1      TRP  56  -2.365   3.747   1.896
  395    HE1  TRP  56           HE1      TRP  56  -2.918   5.964   0.710
  396    HE3  TRP  56           HE3      TRP  56  -1.960   2.237  -2.946
  397    HZ2  TRP  56           HZ2      TRP  56  -3.153   6.965  -1.984
  398    HZ3  TRP  56           HZ3      TRP  56  -2.354   3.816  -4.806
  399    HH2  TRP  56           HH2      TRP  56  -2.950   6.182  -4.336
  400    H    VAL  57           H        VAL  57  -4.425  -1.291   1.104
  401    HA   VAL  57           HA       VAL  57  -2.718  -2.675   2.821
  402    HB   VAL  57           HB       VAL  57  -4.561  -3.813   0.692
  403   1HG1  VAL  57          3HG1      VAL  57  -3.059  -5.154   2.954
  404   2HG1  VAL  57          2HG1      VAL  57  -4.458  -5.881   2.162
  405   3HG1  VAL  57          1HG1      VAL  57  -2.993  -5.552   1.237
  406   1HG2  VAL  57          3HG2      VAL  57  -4.852  -3.406   3.686
  407   2HG2  VAL  57          2HG2      VAL  57  -5.652  -2.455   2.435
  408   3HG2  VAL  57          1HG2      VAL  57  -6.055  -4.159   2.640
  409    HA   PRO  58           HA       PRO  58   0.763  -3.438   0.192
  410   1HB   PRO  58          2HB       PRO  58   2.152  -4.967   2.010
  411   2HB   PRO  58          1HB       PRO  58   2.108  -3.197   2.037
  412   1HG   PRO  58          2HG       PRO  58   0.651  -5.143   3.781
  413   2HG   PRO  58          1HG       PRO  58   1.226  -3.508   4.161
  414   1HD   PRO  58          2HD       PRO  58  -1.429  -4.174   3.568
  415   2HD   PRO  58          1HD       PRO  58  -0.742  -2.539   3.451
  416    H    ILE  59           H        ILE  59   0.925  -4.979  -1.364
  417    HA   ILE  59           HA       ILE  59  -0.146  -7.695  -0.734
  418    HB   ILE  59           HB       ILE  59  -0.707  -7.807  -3.183
  419   1HG1  ILE  59          2HG1      ILE  59   0.974  -5.853  -3.622
  420   2HG1  ILE  59          1HG1      ILE  59  -0.507  -5.926  -4.574
  421   1HG2  ILE  59          2HG2      ILE  59  -2.383  -7.226  -1.423
  422   2HG2  ILE  59          1HG2      ILE  59  -2.021  -5.521  -1.688
  423   3HG2  ILE  59          3HG2      ILE  59  -2.738  -6.481  -2.982
  424   1HD1  ILE  59          2HD1      ILE  59  -0.953  -4.473  -2.099
  425   2HD1  ILE  59          1HD1      ILE  59   0.380  -3.768  -3.008
  426   3HD1  ILE  59          3HD1      ILE  59  -1.204  -3.942  -3.762
  427    H    GLY  60           H        GLY  60   2.475  -5.859  -2.277
  428   1HA   GLY  60          2HA       GLY  60   3.982  -8.400  -2.351
  429   2HA   GLY  60          1HA       GLY  60   3.727  -7.629  -3.906
  430    H    LEU  61           H        LEU  61   5.837  -7.080  -4.342
  431    HA   LEU  61           HA       LEU  61   7.245  -5.417  -2.317
  432   1HB   LEU  61          2HB       LEU  61   8.536  -6.655  -4.736
  433   2HB   LEU  61          1HB       LEU  61   9.274  -6.193  -3.201
  434    HG   LEU  61           HG       LEU  61   7.300  -8.461  -3.619
  435   1HD1  LEU  61          2HD1      LEU  61  10.025  -8.413  -4.100
  436   2HD1  LEU  61          1HD1      LEU  61   9.927  -9.030  -2.450
  437   3HD1  LEU  61          3HD1      LEU  61   9.075  -9.858  -3.753
  438   1HD2  LEU  61          2HD2      LEU  61   8.064  -6.946  -1.265
  439   2HD2  LEU  61          1HD2      LEU  61   6.852  -8.218  -1.424
  440   3HD2  LEU  61          3HD2      LEU  61   8.533  -8.639  -1.098
  441    H    ALA  62           H        ALA  62   6.098  -5.314  -5.705
  442    HA   ALA  62           HA       ALA  62   6.619  -2.424  -5.598
  443   1HB   ALA  62          3HB       ALA  62   8.750  -3.587  -6.394
  444   2HB   ALA  62          2HB       ALA  62   7.866  -3.938  -7.880
  445   3HB   ALA  62          1HB       ALA  62   8.139  -2.266  -7.389
  446    H    ILE  63           H        ILE  63   6.026  -4.706  -8.352
  447    HA   ILE  63           HA       ILE  63   3.615  -3.016  -8.867
  448    HB   ILE  63           HB       ILE  63   5.842  -3.294 -10.456
  449   1HG1  ILE  63          2HG1      ILE  63   4.009  -1.555 -10.466
  450   2HG1  ILE  63          1HG1      ILE  63   4.593  -2.017 -12.063
  451   1HG2  ILE  63          3HG2      ILE  63   4.808  -5.673 -10.935
  452   2HG2  ILE  63          2HG2      ILE  63   3.729  -4.769 -11.994
  453   3HG2  ILE  63          1HG2      ILE  63   5.472  -4.712 -12.256
  454   1HD1  ILE  63          1HD1      ILE  63   2.152  -3.243 -10.755
  455   2HD1  ILE  63          3HD1      ILE  63   2.082  -1.888 -11.886
  456   3HD1  ILE  63          2HD1      ILE  63   2.689  -3.456 -12.420
  457    HA   PRO  64           HA       PRO  64   2.459  -7.669  -9.174
  458   1HB   PRO  64          2HB       PRO  64   2.146  -8.520  -6.587
  459   2HB   PRO  64          1HB       PRO  64   3.641  -8.754  -7.511
  460   1HG   PRO  64          2HG       PRO  64   3.052  -6.772  -5.352
  461   2HG   PRO  64          1HG       PRO  64   4.592  -7.544  -5.774
  462   1HD   PRO  64          2HD       PRO  64   3.862  -4.929  -6.466
  463   2HD   PRO  64          1HD       PRO  64   5.140  -5.884  -7.247
  464    H    GLU  65           H        GLU  65   0.253  -8.361  -8.866
  465    HA   GLU  65           HA       GLU  65  -1.583  -6.188  -8.143
  466   1HB   GLU  65          2HB       GLU  65  -3.335  -7.640  -8.994
  467   2HB   GLU  65          1HB       GLU  65  -1.969  -7.722 -10.107
  468   1HG   GLU  65          2HG       GLU  65  -1.743  -9.691  -7.964
  469   2HG   GLU  65          1HG       GLU  65  -3.226  -9.898  -8.896
  470    H    ASN  66           H        ASN  66  -3.717  -7.813  -7.102
  471    HA   ASN  66           HA       ASN  66  -2.832  -7.955  -4.308
  472   1HB   ASN  66          2HB       ASN  66  -5.256  -8.576  -3.912
  473   2HB   ASN  66          1HB       ASN  66  -5.017  -7.015  -4.700
  474   1HD2  ASN  66          2HD2      ASN  66  -6.626  -7.985  -7.693
  475   2HD2  ASN  66          1HD2      ASN  66  -5.795  -6.761  -6.859
  476    H    ALA  67           H        ALA  67  -3.911 -10.207  -6.829
  477    HA   ALA  67           HA       ALA  67  -4.118 -12.559  -5.292
  478   1HB   ALA  67          1HB       ALA  67  -3.774 -11.882  -8.107
  479   2HB   ALA  67          3HB       ALA  67  -2.936 -13.376  -7.688
  480   3HB   ALA  67          2HB       ALA  67  -4.666 -13.220  -7.381
  481    H    ALA  68           H        ALA  68  -1.243 -10.933  -6.556
  482    HA   ALA  68           HA       ALA  68   1.041 -11.380  -6.219
  483   1HB   ALA  68          1HB       ALA  68   0.143 -10.826  -3.882
  484   2HB   ALA  68          3HB       ALA  68   0.141 -12.565  -3.586
  485   3HB   ALA  68          2HB       ALA  68   1.654 -11.733  -3.944
  486    H    ALA  69           H        ALA  69   0.650 -13.148  -7.924
  487    HA   ALA  69           HA       ALA  69   1.380 -15.783  -6.716
  488   1HB   ALA  69          2HB       ALA  69  -1.031 -15.540  -7.702
  489   2HB   ALA  69          1HB       ALA  69  -0.214 -15.595  -9.264
  490   3HB   ALA  69          3HB       ALA  69  -0.071 -16.950  -8.146
  491    H    HIS  70           HN       HIS  70   3.582 -14.816  -7.208
  492    HA   HIS  70           HA       HIS  70   4.316 -14.489 -10.011
  493   1HB   HIS  70          2HB       HIS  70   6.500 -14.003  -9.219
  494   2HB   HIS  70          1HB       HIS  70   5.425 -13.359  -7.980
  495    HD1  HIS  70           HD1      HIS  70   8.115 -15.819  -8.532
  496    HD2  HIS  70           HD2      HIS  70   5.235 -15.084  -5.610
  497    HE1  HIS  70           HE1      HIS  70   8.814 -17.142  -6.490
   
  No H/Q in entry =         497
  Start of MODEL    7
    1   1H    GLU   1          2H        GLU   1  13.053  -7.488  -0.841
    2   2H    GLU   1          1H        GLU   1  12.241  -6.524  -1.980
    3   3H    GLU   1          3H        GLU   1  13.580  -5.902  -1.148
    4    HA   GLU   1           HA       GLU   1  12.413  -5.425   0.703
    5   1HB   GLU   1          2HB       GLU   1  11.181  -4.268  -1.058
    6   2HB   GLU   1          1HB       GLU   1  10.227  -5.721  -1.374
    7   1HG   GLU   1          2HG       GLU   1   8.991  -4.104   0.052
    8   2HG   GLU   1          1HG       GLU   1   9.283  -5.630   0.886
    9    H    THR   2           H        THR   2  11.364  -8.367  -0.863
   10    HA   THR   2           HA       THR   2  10.551 -10.350   0.118
   11    HB   THR   2           HB       THR   2  10.448  -9.124   2.838
   12    HG1  THR   2           HG1      THR   2  12.424  -8.478   2.693
   13   1HG2  THR   2          2HG2      THR   2  10.128 -11.635   1.967
   14   2HG2  THR   2          1HG2      THR   2  11.883 -11.646   2.143
   15   3HG2  THR   2          3HG2      THR   2  10.859 -11.283   3.533
   16    H    VAL   3           H        VAL   3   8.414 -10.945   0.088
   17    HA   VAL   3           HA       VAL   3   6.408  -8.837   0.245
   18    HB   VAL   3           HB       VAL   3   6.481 -11.031  -1.240
   19   1HG1  VAL   3          1HG1      VAL   3   6.491 -12.507   0.822
   20   2HG1  VAL   3          3HG1      VAL   3   4.832 -11.986   1.114
   21   3HG1  VAL   3          2HG1      VAL   3   5.229 -12.882  -0.352
   22   1HG2  VAL   3          1HG2      VAL   3   4.162  -9.572  -0.028
   23   2HG2  VAL   3          3HG2      VAL   3   4.720  -9.596  -1.703
   24   3HG2  VAL   3          2HG2      VAL   3   3.836 -10.975  -1.046
   25    H    GLU   4           H        GLU   4   7.565 -11.427   2.319
   26    HA   GLU   4           HA       GLU   4   5.438 -11.465   4.216
   27   1HB   GLU   4          2HB       GLU   4   7.572 -12.980   3.989
   28   2HB   GLU   4          1HB       GLU   4   8.311 -11.775   5.046
   29   1HG   GLU   4          2HG       GLU   4   5.627 -12.759   5.859
   30   2HG   GLU   4          1HG       GLU   4   6.953 -13.914   5.991
   31    H    SER   5           H        SER   5   8.343  -9.425   3.987
   32    HA   SER   5           HA       SER   5   7.657  -7.970   6.431
   33   1HB   SER   5          2HB       SER   5   9.626  -6.677   6.011
   34   2HB   SER   5          1HB       SER   5  10.024  -8.320   5.520
   35    HG   SER   5           HG       SER   5   9.304  -6.109   3.901
   36    H    CYS   6           H        CYS   6   7.680  -7.212   2.931
   37    HA   CYS   6           HA       CYS   6   6.621  -4.602   3.095
   38   1HB   CYS   6          2HB       CYS   6   7.249  -5.295   0.929
   39   2HB   CYS   6          1HB       CYS   6   6.336  -6.796   1.044
   40    H    LEU   7           H        LEU   7   5.153  -7.670   3.757
   41    HA   LEU   7           HA       LEU   7   2.439  -6.481   3.809
   42   1HB   LEU   7          2HB       LEU   7   3.391  -9.313   4.323
   43   2HB   LEU   7          1HB       LEU   7   1.704  -8.797   4.327
   44    HG   LEU   7           HG       LEU   7   3.536  -8.372   1.955
   45   1HD1  LEU   7          3HD1      LEU   7   1.602 -10.648   2.504
   46   2HD1  LEU   7          2HD1      LEU   7   2.401 -10.348   0.960
   47   3HD1  LEU   7          1HD1      LEU   7   3.356 -10.784   2.377
   48   1HD2  LEU   7          1HD2      LEU   7   1.062  -7.313   2.604
   49   2HD2  LEU   7          3HD2      LEU   7   1.725  -7.435   0.974
   50   3HD2  LEU   7          2HD2      LEU   7   0.642  -8.688   1.581
   51    H    ALA   8           H        ALA   8   5.002  -7.588   5.906
   52    HA   ALA   8           HA       ALA   8   3.501  -7.558   8.374
   53   1HB   ALA   8          3HB       ALA   8   5.941  -8.471   7.798
   54   2HB   ALA   8          2HB       ALA   8   6.415  -6.855   8.321
   55   3HB   ALA   8          1HB       ALA   8   5.543  -7.919   9.425
   56    H    LYS   9           H        LYS   9   4.492  -5.197   6.209
   57    HA   LYS   9           HA       LYS   9   5.208  -2.908   7.579
   58   1HB   LYS   9          2HB       LYS   9   3.400  -3.465   5.218
   59   2HB   LYS   9          1HB       LYS   9   3.760  -1.820   5.696
   60   1HG   LYS   9          2HG       LYS   9   6.256  -3.006   5.731
   61   2HG   LYS   9          1HG       LYS   9   5.474  -3.767   4.349
   62   1HD   LYS   9          2HD       LYS   9   5.860  -1.913   3.142
   63   2HD   LYS   9          1HD       LYS   9   4.818  -1.014   4.243
   64   1HE   LYS   9          2HE       LYS   9   6.854  -0.838   5.788
   65   2HE   LYS   9          1HE       LYS   9   7.807  -1.399   4.415
   66   1HZ   LYS   9          1HZ       LYS   9   6.686   0.464   3.138
   67   2HZ   LYS   9          3HZ       LYS   9   6.206   1.076   4.646
   68   3HZ   LYS   9          2HZ       LYS   9   7.858   0.916   4.282
   69    HA   PRO  10           HA       PRO  10   1.687  -1.672   9.957
   70   1HB   PRO  10          2HB       PRO  10   1.143   0.926   9.214
   71   2HB   PRO  10          1HB       PRO  10   2.514   0.455  10.233
   72   1HG   PRO  10          2HG       PRO  10   2.502   1.287   7.376
   73   2HG   PRO  10          1HG       PRO  10   3.807   1.389   8.569
   74   1HD   PRO  10          2HD       PRO  10   3.557  -0.545   6.524
   75   2HD   PRO  10          1HD       PRO  10   4.690  -0.620   7.890
   76    H    HIS  11           H        HIS  11   1.374  -2.235   6.765
   77    HA   HIS  11           HA       HIS  11  -0.418  -2.880   5.466
   78   1HB   HIS  11          2HB       HIS  11  -1.576  -2.725   8.155
   79   2HB   HIS  11          1HB       HIS  11  -2.744  -2.451   6.856
   80    HD1  HIS  11           HD1      HIS  11  -3.883  -4.724   6.853
   81    HD2  HIS  11           HD2      HIS  11   0.269  -5.025   6.552
   82    HE1  HIS  11           HE1      HIS  11  -3.375  -7.147   6.318
   83    H    THR  12           H        THR  12  -2.363  -2.071   4.506
   84    HA   THR  12           HA       THR  12  -2.417   0.007   3.020
   85    HB   THR  12           HB       THR  12  -4.323  -1.576   3.926
   86    HG1  THR  12           HG1      THR  12  -5.587  -0.701   2.437
   87   1HG2  THR  12          3HG2      THR  12  -5.019   1.140   5.040
   88   2HG2  THR  12          2HG2      THR  12  -6.187  -0.165   4.837
   89   3HG2  THR  12          1HG2      THR  12  -4.830  -0.361   5.946
   90    H    GLU  13           H        GLU  13  -3.359   0.675   6.439
   91    HA   GLU  13           HA       GLU  13  -3.742   3.409   6.182
   92   1HB   GLU  13          2HB       GLU  13  -3.766   1.975   8.344
   93   2HB   GLU  13          1HB       GLU  13  -2.049   2.370   8.457
   94   1HG   GLU  13          2HG       GLU  13  -3.014   4.838   7.964
   95   2HG   GLU  13          1HG       GLU  13  -4.423   4.141   8.766
   96    H    ASN  14           H        ASN  14  -2.511   4.469   4.718
   97    HA   ASN  14           HA       ASN  14  -0.092   5.693   5.360
   98   1HB   ASN  14          2HB       ASN  14   0.332   2.943   4.759
   99   2HB   ASN  14          1HB       ASN  14   0.928   3.859   3.376
  100   1HD2  ASN  14          2HD2      ASN  14   3.636   5.312   5.167
  101   2HD2  ASN  14          1HD2      ASN  14   2.716   5.364   3.741
  102    H    SER  15           H        SER  15   1.092   5.437   2.623
  103    HA   SER  15           HA       SER  15  -0.875   5.778   0.623
  104   1HB   SER  15          2HB       SER  15  -0.760   8.319   0.473
  105   2HB   SER  15          1HB       SER  15  -1.705   7.672   1.809
  106    HG   SER  15           HG       SER  15   0.762   8.974   1.803
  107    H    PHE  16           H        PHE  16   0.151   7.653  -1.013
  108    HA   PHE  16           HA       PHE  16   3.005   7.766  -1.136
  109   1HB   PHE  16          2HB       PHE  16   2.600   5.294  -1.533
  110   2HB   PHE  16          1HB       PHE  16   1.748   5.741  -3.010
  111    HD1  PHE  16           HD2      PHE  16   2.939   6.881  -4.851
  112    HD2  PHE  16           HD1      PHE  16   5.006   5.418  -1.386
  113    HE1  PHE  16           HE2      PHE  16   5.092   7.067  -6.061
  114    HE2  PHE  16           HE1      PHE  16   7.164   5.598  -2.595
  115    HZ   PHE  16           HZ       PHE  16   7.208   6.423  -4.934
  116    H    THR  17           H        THR  17   3.664   8.809  -3.266
  117    HA   THR  17           HA       THR  17   1.278  10.092  -4.525
  118    HB   THR  17           HB       THR  17   2.249  12.050  -4.025
  119    HG1  THR  17           HG1      THR  17   4.333  12.418  -5.212
  120   1HG2  THR  17          3HG2      THR  17   3.574  10.685  -2.316
  121   2HG2  THR  17          2HG2      THR  17   4.902  10.709  -3.475
  122   3HG2  THR  17          1HG2      THR  17   4.289  12.221  -2.807
  123    H    ASN  18           H        ASN  18   1.545  10.682  -6.857
  124    HA   ASN  18           HA       ASN  18   2.149  10.115  -9.069
  125   1HB   ASN  18          2HB       ASN  18   4.531  10.136  -7.969
  126   2HB   ASN  18          1HB       ASN  18   4.371   8.379  -8.010
  127   1HD2  ASN  18          2HD2      ASN  18   5.875   9.645 -11.251
  128   2HD2  ASN  18          1HD2      ASN  18   6.287   9.895  -9.625
  129    H    VAL  19           H        VAL  19   0.765   8.370  -6.862
  130    HA   VAL  19           HA       VAL  19   0.910   5.670  -7.187
  131    HB   VAL  19           HB       VAL  19  -1.646   7.295  -7.270
  132   1HG1  VAL  19          2HG1      VAL  19  -1.052   4.421  -6.508
  133   2HG1  VAL  19          1HG1      VAL  19  -2.571   5.237  -6.136
  134   3HG1  VAL  19          3HG1      VAL  19  -2.095   4.981  -7.815
  135   1HG2  VAL  19          1HG2      VAL  19   0.337   7.307  -5.335
  136   2HG2  VAL  19          3HG2      VAL  19  -1.354   7.725  -5.061
  137   3HG2  VAL  19          2HG2      VAL  19  -0.786   6.088  -4.734
  138    H    TRP  20           H        TRP  20  -0.069   4.114  -8.584
  139    HA   TRP  20           HA       TRP  20  -0.912   5.126 -11.256
  140   1HB   TRP  20          2HB       TRP  20   0.700   3.970 -12.382
  141   2HB   TRP  20          1HB       TRP  20   1.549   3.926 -10.844
  142    HD1  TRP  20           HD1      TRP  20  -0.565   1.760 -13.181
  143    HE1  TRP  20           HE1      TRP  20  -0.353  -0.708 -12.465
  144    HE3  TRP  20           HE3      TRP  20   2.094   2.333  -8.864
  145    HZ2  TRP  20           HZ2      TRP  20   0.828  -2.233 -10.360
  146    HZ3  TRP  20           HZ3      TRP  20   2.764   0.360  -7.535
  147    HH2  TRP  20           HH2      TRP  20   2.130  -1.923  -8.276
  148    H    LYS  21           H        LYS  21  -1.798   2.914 -12.448
  149    HA   LYS  21           HA       LYS  21  -3.266   1.270 -10.479
  150   1HB   LYS  21          2HB       LYS  21  -4.745   3.224 -10.938
  151   2HB   LYS  21          1HB       LYS  21  -4.703   2.817 -12.657
  152   1HG   LYS  21          2HG       LYS  21  -5.342   0.402 -11.458
  153   2HG   LYS  21          1HG       LYS  21  -6.238   1.578 -10.492
  154   1HD   LYS  21          2HD       LYS  21  -7.718   1.928 -12.156
  155   2HD   LYS  21          1HD       LYS  21  -6.422   2.205 -13.321
  156   1HE   LYS  21          2HE       LYS  21  -6.380   0.004 -14.010
  157   2HE   LYS  21          1HE       LYS  21  -6.903  -0.606 -12.440
  158   1HZ   LYS  21          1HZ       LYS  21  -8.803   1.057 -13.886
  159   2HZ   LYS  21          3HZ       LYS  21  -8.501  -0.475 -14.546
  160   3HZ   LYS  21          2HZ       LYS  21  -9.068  -0.335 -12.950
  161    H    ASP  22           H        ASP  22  -2.742  -0.751 -11.173
  162    HA   ASP  22           HA       ASP  22  -2.257  -1.221 -14.033
  163   1HB   ASP  22          2HB       ASP  22  -1.376  -2.395 -11.582
  164   2HB   ASP  22          1HB       ASP  22  -2.226  -3.637 -12.501
  165    H    ASP  23           H        ASP  23  -3.746  -2.101 -15.370
  166    HA   ASP  23           HA       ASP  23  -6.420  -2.725 -14.355
  167   1HB   ASP  23          2HB       ASP  23  -5.833  -1.661 -16.649
  168   2HB   ASP  23          1HB       ASP  23  -5.408  -3.300 -17.148
  169    H    LYS  24           H        LYS  24  -3.466  -4.346 -14.989
  170    HA   LYS  24           HA       LYS  24  -4.574  -7.024 -15.323
  171   1HB   LYS  24          2HB       LYS  24  -2.011  -5.752 -15.502
  172   2HB   LYS  24          1HB       LYS  24  -1.888  -7.053 -14.320
  173   1HG   LYS  24          2HG       LYS  24  -2.745  -7.249 -17.214
  174   2HG   LYS  24          1HG       LYS  24  -1.404  -8.074 -16.420
  175   1HD   LYS  24          2HD       LYS  24  -3.549  -8.879 -14.896
  176   2HD   LYS  24          1HD       LYS  24  -4.256  -8.794 -16.509
  177   1HE   LYS  24          2HE       LYS  24  -3.199 -10.680 -17.127
  178   2HE   LYS  24          1HE       LYS  24  -1.641 -10.003 -16.654
  179   1HZ   LYS  24          1HZ       LYS  24  -2.556 -10.533 -14.274
  180   2HZ   LYS  24          3HZ       LYS  24  -3.490 -11.673 -15.115
  181   3HZ   LYS  24          2HZ       LYS  24  -1.794 -11.732 -15.204
  182    H    THR  25           H        THR  25  -2.657  -5.415 -12.791
  183    HA   THR  25           HA       THR  25  -3.174  -7.347 -10.749
  184    HB   THR  25           HB       THR  25  -2.466  -5.567  -9.181
  185    HG1  THR  25           HG1      THR  25  -2.005  -3.493 -10.187
  186   1HG2  THR  25          3HG2      THR  25  -0.999  -6.504 -11.434
  187   2HG2  THR  25          2HG2      THR  25  -0.555  -4.816 -11.177
  188   3HG2  THR  25          1HG2      THR  25  -0.369  -5.985  -9.870
  189    H    LEU  26           H        LEU  26  -4.945  -4.685 -12.087
  190    HA   LEU  26           HA       LEU  26  -7.180  -4.038 -11.825
  191   1HB   LEU  26          2HB       LEU  26  -7.056  -6.829 -10.962
  192   2HB   LEU  26          1HB       LEU  26  -8.347  -5.929 -10.162
  193    HG   LEU  26           HG       LEU  26  -7.885  -6.090 -13.156
  194   1HD1  LEU  26          3HD1      LEU  26  -9.988  -7.261 -11.315
  195   2HD1  LEU  26          2HD1      LEU  26 -10.149  -7.208 -13.070
  196   3HD1  LEU  26          1HD1      LEU  26  -8.849  -8.144 -12.333
  197   1HD2  LEU  26          3HD2      LEU  26  -9.803  -4.513 -11.437
  198   2HD2  LEU  26          2HD2      LEU  26  -8.789  -3.938 -12.761
  199   3HD2  LEU  26          1HD2      LEU  26 -10.204  -4.932 -13.102
  200    H    ASP  27           H        ASP  27  -5.813  -2.457 -10.305
  201    HA   ASP  27           HA       ASP  27  -7.422  -1.815  -8.080
  202   1HB   ASP  27          2HB       ASP  27  -5.876  -4.118  -7.563
  203   2HB   ASP  27          1HB       ASP  27  -5.101  -2.810  -6.669
  204    H    ARG  28           H        ARG  28  -6.402  -0.158  -6.631
  205    HA   ARG  28           HA       ARG  28  -4.513   1.477  -8.162
  206   1HB   ARG  28          2HB       ARG  28  -6.432   2.265  -6.540
  207   2HB   ARG  28          1HB       ARG  28  -5.233   1.981  -5.278
  208   1HG   ARG  28          2HG       ARG  28  -4.656   4.149  -5.749
  209   2HG   ARG  28          1HG       ARG  28  -3.715   3.377  -7.025
  210   1HD   ARG  28          2HD       ARG  28  -5.220   5.329  -7.746
  211   2HD   ARG  28          1HD       ARG  28  -5.376   3.835  -8.670
  212    HE   ARG  28           HE       ARG  28  -7.256   4.254  -6.414
  213   1HH1  ARG  28          1HH2      ARG  28  -6.746   5.050  -9.672
  214   2HH1  ARG  28          2HH2      ARG  28  -8.311   4.538 -10.209
  215   1HH2  ARG  28          2HH1      ARG  28  -9.215   3.192  -7.143
  216   2HH2  ARG  28          1HH1      ARG  28  -9.709   3.486  -8.776
  217    H    TYR  29           H        TYR  29  -2.277   1.755  -7.593
  218    HA   TYR  29           HA       TYR  29  -1.320   0.108  -5.311
  219   1HB   TYR  29          2HB       TYR  29  -0.405  -0.164  -8.182
  220   2HB   TYR  29          1HB       TYR  29   0.485  -0.823  -6.811
  221    HD1  TYR  29           HD2      TYR  29  -0.553  -2.569  -5.360
  222    HD2  TYR  29           HD1      TYR  29  -2.427  -1.188  -8.969
  223    HE1  TYR  29           HE2      TYR  29  -2.042  -4.553  -5.346
  224    HE2  TYR  29           HE1      TYR  29  -3.916  -3.171  -8.955
  225    HH   TYR  29           HH       TYR  29  -3.711  -5.606  -6.358
  226    H    ALA  30           H        ALA  30   0.726   0.716  -4.516
  227    HA   ALA  30           HA       ALA  30   1.864   3.230  -5.655
  228   1HB   ALA  30          1HB       ALA  30   1.266   2.588  -2.755
  229   2HB   ALA  30          3HB       ALA  30   2.327   3.905  -3.252
  230   3HB   ALA  30          2HB       ALA  30   0.623   3.924  -3.711
  231    H    ASN  31           H        ASN  31   3.709   2.314  -6.522
  232    HA   ASN  31           HA       ASN  31   5.169   0.147  -5.378
  233   1HB   ASN  31          2HB       ASN  31   7.032   0.957  -6.874
  234   2HB   ASN  31          1HB       ASN  31   5.492   0.735  -7.706
  235   1HD2  ASN  31          2HD2      ASN  31   5.158   4.149  -8.545
  236   2HD2  ASN  31          1HD2      ASN  31   4.492   2.590  -8.633
  237    H    TYR  32           H        TYR  32   5.904   0.314  -3.296
  238    HA   TYR  32           HA       TYR  32   7.058   2.859  -2.347
  239   1HB   TYR  32          2HB       TYR  32   5.576   1.362  -0.914
  240   2HB   TYR  32          1HB       TYR  32   6.928   0.229  -0.854
  241    HD1  TYR  32           HD1      TYR  32   6.562   3.963  -0.619
  242    HD2  TYR  32           HD2      TYR  32   8.144   0.370   1.123
  243    HE1  TYR  32           HE1      TYR  32   7.606   5.300   1.190
  244    HE2  TYR  32           HE2      TYR  32   9.187   1.708   2.932
  245    HH   TYR  32           HH       TYR  32   9.553   5.037   2.778
  246    H    GLU  33           H        GLU  33   8.562   1.970  -4.416
  247    HA   GLU  33           HA       GLU  33  10.662   1.093  -5.058
  248   1HB   GLU  33          2HB       GLU  33  10.852   3.144  -3.099
  249   2HB   GLU  33          1HB       GLU  33  12.106   1.959  -2.733
  250   1HG   GLU  33          2HG       GLU  33  11.696   2.852  -5.572
  251   2HG   GLU  33          1HG       GLU  33  12.608   3.874  -4.461
  252    H    GLY  34           H        GLY  34   9.084  -0.846  -3.517
  253   1HA   GLY  34          2HA       GLY  34  10.807  -2.946  -3.177
  254   2HA   GLY  34          1HA       GLY  34  10.957  -2.096  -1.640
  255    H    CYS  35           H        CYS  35   8.225  -1.207  -1.478
  256    HA   CYS  35           HA       CYS  35   6.850  -3.849  -1.133
  257   1HB   CYS  35          2HB       CYS  35   7.424  -2.922   1.047
  258   2HB   CYS  35          1HB       CYS  35   6.723  -1.366   0.605
  259    H    LEU  36           H        LEU  36   5.187  -3.986  -2.551
  260    HA   LEU  36           HA       LEU  36   4.028  -1.536  -3.681
  261   1HB   LEU  36          2HB       LEU  36   4.464  -3.533  -5.110
  262   2HB   LEU  36          1HB       LEU  36   3.244  -4.414  -4.189
  263    HG   LEU  36           HG       LEU  36   1.669  -2.461  -4.725
  264   1HD1  LEU  36          1HD1      LEU  36   3.784  -1.139  -5.538
  265   2HD1  LEU  36          3HD1      LEU  36   3.499  -1.984  -7.057
  266   3HD1  LEU  36          2HD1      LEU  36   2.253  -0.937  -6.381
  267   1HD2  LEU  36          3HD2      LEU  36   2.368  -4.803  -6.169
  268   2HD2  LEU  36          2HD2      LEU  36   0.829  -3.942  -6.200
  269   3HD2  LEU  36          1HD2      LEU  36   2.092  -3.535  -7.362
  270    H    TRP  37           H        TRP  37   2.332  -0.548  -2.760
  271    HA   TRP  37           HA       TRP  37   0.603  -2.079  -0.887
  272   1HB   TRP  37          2HB       TRP  37   0.561   0.901  -1.481
  273   2HB   TRP  37          1HB       TRP  37  -0.224   0.067  -0.153
  274    HD1  TRP  37           HD1      TRP  37   3.431   0.130  -1.441
  275    HE1  TRP  37           HE1      TRP  37   4.968   0.451   0.602
  276    HE3  TRP  37           HE3      TRP  37  -0.076   0.403   2.269
  277    HZ2  TRP  37           HZ2      TRP  37   4.738   0.778   3.435
  278    HZ3  TRP  37           HZ3      TRP  37   0.609   0.708   4.621
  279    HH2  TRP  37           HH2      TRP  37   3.012   0.902   5.214
  280    H    ASN  38           H        ASN  38  -1.840  -1.429  -1.111
  281    HA   ASN  38           HA       ASN  38  -2.586  -0.897  -3.923
  282   1HB   ASN  38          2HB       ASN  38  -3.796  -2.881  -4.266
  283   2HB   ASN  38          1HB       ASN  38  -2.334  -3.441  -3.464
  284   1HD2  ASN  38          2HD2      ASN  38  -5.899  -3.532  -1.428
  285   2HD2  ASN  38          1HD2      ASN  38  -5.743  -2.548  -2.804
  286    H    ALA  39           H        ALA  39  -4.186   0.577  -3.898
  287    HA   ALA  39           HA       ALA  39  -5.793   0.885  -1.422
  288   1HB   ALA  39          1HB       ALA  39  -4.524   2.814  -2.692
  289   2HB   ALA  39          3HB       ALA  39  -5.936   2.779  -3.747
  290   3HB   ALA  39          2HB       ALA  39  -6.129   3.112  -2.026
  291    H    THR  40           H        THR  40  -8.053   0.842  -1.484
  292    HA   THR  40           HA       THR  40  -9.284  -0.958  -3.307
  293    HB   THR  40           HB       THR  40 -11.333  -0.420  -2.193
  294    HG1  THR  40           HG1      THR  40 -10.008   2.004  -1.588
  295   1HG2  THR  40          1HG2      THR  40  -9.007  -1.026  -0.806
  296   2HG2  THR  40          3HG2      THR  40  -9.687   0.315   0.116
  297   3HG2  THR  40          2HG2      THR  40 -10.645  -1.140  -0.162
  298    H    GLY  41           H        GLY  41 -11.670   1.148  -3.540
  299   1HA   GLY  41          2HA       GLY  41 -10.681   2.200  -6.152
  300   2HA   GLY  41          1HA       GLY  41 -12.370   1.847  -5.792
  301    H    VAL  42           H        VAL  42 -11.541   3.187  -3.010
  302    HA   VAL  42           HA       VAL  42 -12.088   5.957  -4.002
  303    HB   VAL  42           HB       VAL  42 -12.927   4.542  -1.462
  304   1HG1  VAL  42          1HG1      VAL  42 -12.745   7.469  -2.117
  305   2HG1  VAL  42          3HG1      VAL  42 -14.061   6.889  -1.094
  306   3HG1  VAL  42          2HG1      VAL  42 -12.385   6.643  -0.600
  307   1HG2  VAL  42          2HG2      VAL  42 -14.265   5.631  -3.917
  308   2HG2  VAL  42          1HG2      VAL  42 -14.557   4.113  -3.069
  309   3HG2  VAL  42          3HG2      VAL  42 -15.155   5.629  -2.395
  310    H    VAL  43           H        VAL  43 -10.225   7.120  -3.910
  311    HA   VAL  43           HA       VAL  43  -8.690   7.086  -1.369
  312    HB   VAL  43           HB       VAL  43  -7.195   7.070  -3.973
  313   1HG1  VAL  43          3HG1      VAL  43  -6.378   7.475  -1.439
  314   2HG1  VAL  43          2HG1      VAL  43  -6.282   5.714  -1.484
  315   3HG1  VAL  43          1HG1      VAL  43  -5.361   6.677  -2.639
  316   1HG2  VAL  43          1HG2      VAL  43  -8.235   4.658  -2.459
  317   2HG2  VAL  43          3HG2      VAL  43  -8.561   5.078  -4.141
  318   3HG2  VAL  43          2HG2      VAL  43  -6.941   4.578  -3.654
  319    H    VAL  44           H        VAL  44  -7.759   9.110  -0.891
  320    HA   VAL  44           HA       VAL  44  -8.846  11.380  -2.374
  321    HB   VAL  44           HB       VAL  44  -6.913  11.221  -0.047
  322   1HG1  VAL  44          2HG1      VAL  44  -8.255  13.564  -1.417
  323   2HG1  VAL  44          1HG1      VAL  44  -7.577  13.664   0.209
  324   3HG1  VAL  44          3HG1      VAL  44  -6.527  13.308  -1.164
  325   1HG2  VAL  44          3HG2      VAL  44  -9.205  10.392   0.392
  326   2HG2  VAL  44          2HG2      VAL  44  -8.882  11.891   1.266
  327   3HG2  VAL  44          1HG2      VAL  44  -9.862  11.918  -0.200
  328    H    CYS  45           H        CYS  45  -7.816  11.228  -4.459
  329    HA   CYS  45           HA       CYS  45  -4.861  11.610  -4.417
  330   1HB   CYS  45          2HB       CYS  45  -6.458  11.098  -6.915
  331   2HB   CYS  45          1HB       CYS  45  -4.766  10.725  -6.591
  332    H    THR  46           H        THR  46  -3.983  13.505  -5.154
  333    HA   THR  46           HA       THR  46  -5.857  15.496  -6.358
  334    HB   THR  46           HB       THR  46  -5.338  16.047  -3.987
  335    HG1  THR  46           HG1      THR  46  -4.659  18.151  -4.433
  336   1HG2  THR  46          3HG2      THR  46  -2.631  15.440  -4.954
  337   2HG2  THR  46          2HG2      THR  46  -2.730  16.930  -4.016
  338   3HG2  THR  46          1HG2      THR  46  -3.273  15.408  -3.312
  339    H    GLY  47           H        GLY  47  -4.535  17.304  -7.469
  340   1HA   GLY  47          2HA       GLY  47  -3.024  17.893  -9.163
  341   2HA   GLY  47          1HA       GLY  47  -1.851  16.889  -8.310
  342    H    ASP  48           H        ASP  48  -4.638  16.616 -10.537
  343    HA   ASP  48           HA       ASP  48  -4.955  15.131 -12.338
  344   1HB   ASP  48          2HB       ASP  48  -2.061  14.322 -12.010
  345   2HB   ASP  48          1HB       ASP  48  -3.033  14.328 -13.482
  346    H    GLU  49           H        GLU  49  -4.792  14.380  -9.325
  347    HA   GLU  49           HA       GLU  49  -5.182  12.471  -8.052
  348   1HB   GLU  49          2HB       GLU  49  -6.018  11.653 -10.810
  349   2HB   GLU  49          1HB       GLU  49  -5.867  10.395  -9.578
  350   1HG   GLU  49          2HG       GLU  49  -8.003  10.995  -9.056
  351   2HG   GLU  49          1HG       GLU  49  -7.217  12.313  -8.185
  352    H    THR  50           H        THR  50  -2.536  12.981  -9.669
  353    HA   THR  50           HA       THR  50  -1.362  10.343  -9.940
  354    HB   THR  50           HB       THR  50  -0.557  12.445 -11.120
  355    HG1  THR  50           HG1      THR  50   1.078  11.167 -11.326
  356   1HG2  THR  50          1HG2      THR  50  -0.682  13.725  -8.848
  357   2HG2  THR  50          3HG2      THR  50   0.924  13.049  -8.573
  358   3HG2  THR  50          2HG2      THR  50   0.634  14.097  -9.963
  359    H    GLN  51           H        GLN  51  -1.472  12.811  -7.391
  360    HA   GLN  51           HA       GLN  51   0.130  11.014  -5.641
  361   1HB   GLN  51          2HB       GLN  51  -0.867  13.856  -5.231
  362   2HB   GLN  51          1HB       GLN  51   0.076  12.944  -4.051
  363   1HG   GLN  51          2HG       GLN  51   1.730  12.616  -6.081
  364   2HG   GLN  51          1HG       GLN  51   0.930  14.061  -6.699
  365   1HE2  GLN  51          2HE2      GLN  51   1.942  15.795  -3.493
  366   2HE2  GLN  51          1HE2      GLN  51   0.438  15.322  -4.123
  367    H    CYS  52           H        CYS  52  -0.872  10.180  -3.673
  368    HA   CYS  52           HA       CYS  52  -3.672  10.884  -3.214
  369   1HB   CYS  52          2HB       CYS  52  -3.443   9.099  -5.135
  370   2HB   CYS  52          1HB       CYS  52  -3.201   7.987  -3.790
  371    H    TYR  53           H        TYR  53  -4.554   9.949  -1.274
  372    HA   TYR  53           HA       TYR  53  -2.643   8.464   0.433
  373   1HB   TYR  53          2HB       TYR  53  -2.221  10.550   1.370
  374   2HB   TYR  53          1HB       TYR  53  -3.822  11.164   0.969
  375    HD1  TYR  53           HD1      TYR  53  -2.038   8.769   3.230
  376    HD2  TYR  53           HD2      TYR  53  -5.563  11.134   2.566
  377    HE1  TYR  53           HE1      TYR  53  -2.833   8.223   5.518
  378    HE2  TYR  53           HE2      TYR  53  -6.353  10.596   4.853
  379    HH   TYR  53           HH       TYR  53  -4.843   9.805   7.180
  380    H    GLY  54           H        GLY  54  -3.686   7.197   2.091
  381   1HA   GLY  54          2HA       GLY  54  -6.225   7.073   3.009
  382   2HA   GLY  54          1HA       GLY  54  -6.455   6.471   1.366
  383    H    THR  55           H        THR  55  -6.725   4.280   1.611
  384    HA   THR  55           HA       THR  55  -4.756   2.857   3.356
  385    HB   THR  55           HB       THR  55  -6.510   0.938   3.051
  386    HG1  THR  55           HG1      THR  55  -8.641   2.083   2.869
  387   1HG2  THR  55          2HG2      THR  55  -6.073   2.834   4.983
  388   2HG2  THR  55          1HG2      THR  55  -7.790   3.049   4.643
  389   3HG2  THR  55          3HG2      THR  55  -7.180   1.471   5.139
  390    H    TRP  56           H        TRP  56  -3.335   1.559   2.418
  391    HA   TRP  56           HA       TRP  56  -3.746   0.634  -0.388
  392   1HB   TRP  56          2HB       TRP  56  -1.149   1.517   0.843
  393   2HB   TRP  56          1HB       TRP  56  -1.461   1.164  -0.859
  394    HD1  TRP  56           HD1      TRP  56  -2.651   3.651   1.848
  395    HE1  TRP  56           HE1      TRP  56  -3.202   5.884   0.689
  396    HE3  TRP  56           HE3      TRP  56  -1.809   2.327  -2.998
  397    HZ2  TRP  56           HZ2      TRP  56  -3.279   6.966  -1.979
  398    HZ3  TRP  56           HZ3      TRP  56  -2.127   3.965  -4.832
  399    HH2  TRP  56           HH2      TRP  56  -2.859   6.275  -4.331
  400    H    VAL  57           H        VAL  57  -4.396  -1.390   1.023
  401    HA   VAL  57           HA       VAL  57  -2.686  -2.689   2.795
  402    HB   VAL  57           HB       VAL  57  -4.014  -4.324   0.643
  403   1HG1  VAL  57          2HG1      VAL  57  -2.780  -5.411   2.510
  404   2HG1  VAL  57          1HG1      VAL  57  -3.844  -4.599   3.658
  405   3HG1  VAL  57          3HG1      VAL  57  -4.502  -5.792   2.539
  406   1HG2  VAL  57          2HG2      VAL  57  -5.325  -2.564   2.708
  407   2HG2  VAL  57          1HG2      VAL  57  -5.752  -2.778   1.012
  408   3HG2  VAL  57          3HG2      VAL  57  -6.105  -4.054   2.178
  409    HA   PRO  58           HA       PRO  58   0.913  -3.468   0.324
  410   1HB   PRO  58          2HB       PRO  58   2.232  -4.984   2.232
  411   2HB   PRO  58          1HB       PRO  58   2.197  -3.211   2.219
  412   1HG   PRO  58          2HG       PRO  58   0.723  -5.107   3.983
  413   2HG   PRO  58          1HG       PRO  58   1.206  -3.424   4.293
  414   1HD   PRO  58          2HD       PRO  58  -1.398  -4.290   3.589
  415   2HD   PRO  58          1HD       PRO  58  -0.812  -2.615   3.543
  416    H    ILE  59           H        ILE  59   1.597  -5.233  -0.982
  417    HA   ILE  59           HA       ILE  59   0.524  -7.918  -0.368
  418    HB   ILE  59           HB       ILE  59  -0.440  -8.066  -2.688
  419   1HG1  ILE  59          2HG1      ILE  59   0.884  -5.950  -3.404
  420   2HG1  ILE  59          1HG1      ILE  59  -0.755  -6.154  -4.018
  421   1HG2  ILE  59          1HG2      ILE  59  -1.820  -7.694  -0.637
  422   2HG2  ILE  59          3HG2      ILE  59  -1.689  -5.955  -0.899
  423   3HG2  ILE  59          2HG2      ILE  59  -2.530  -6.964  -2.077
  424   1HD1  ILE  59          2HD1      ILE  59  -1.543  -4.715  -2.073
  425   2HD1  ILE  59          1HD1      ILE  59   0.151  -4.350  -1.761
  426   3HD1  ILE  59          3HD1      ILE  59  -0.578  -3.884  -3.290
  427    H    GLY  60           H        GLY  60   2.523  -5.873  -2.513
  428   1HA   GLY  60          2HA       GLY  60   4.089  -8.373  -3.050
  429   2HA   GLY  60          1HA       GLY  60   3.676  -7.280  -4.362
  430    H    LEU  61           H        LEU  61   5.869  -6.950  -4.842
  431    HA   LEU  61           HA       LEU  61   7.489  -5.545  -2.778
  432   1HB   LEU  61          2HB       LEU  61   8.461  -6.469  -5.486
  433   2HB   LEU  61          1HB       LEU  61   9.408  -6.146  -4.034
  434    HG   LEU  61           HG       LEU  61   7.288  -8.277  -3.982
  435   1HD1  LEU  61          2HD1      LEU  61   8.974  -8.504  -5.973
  436   2HD1  LEU  61          1HD1      LEU  61  10.137  -8.912  -4.713
  437   3HD1  LEU  61          3HD1      LEU  61   8.691  -9.897  -4.930
  438   1HD2  LEU  61          1HD2      LEU  61   9.494  -7.314  -2.315
  439   2HD2  LEU  61          3HD2      LEU  61   8.113  -8.319  -1.874
  440   3HD2  LEU  61          2HD2      LEU  61   9.555  -9.058  -2.571
  441    H    ALA  62           H        ALA  62   5.959  -5.093  -5.937
  442    HA   ALA  62           HA       ALA  62   5.753  -2.324  -5.753
  443   1HB   ALA  62          2HB       ALA  62   8.454  -3.218  -6.676
  444   2HB   ALA  62          1HB       ALA  62   7.749  -1.769  -7.397
  445   3HB   ALA  62          3HB       ALA  62   8.012  -1.849  -5.654
  446    H    ILE  63           H        ILE  63   4.085  -4.100  -6.957
  447    HA   ILE  63           HA       ILE  63   3.309  -2.992  -9.306
  448    HB   ILE  63           HB       ILE  63   5.771  -4.442  -9.798
  449   1HG1  ILE  63          2HG1      ILE  63   5.427  -2.182 -10.568
  450   2HG1  ILE  63          1HG1      ILE  63   5.508  -3.209 -11.998
  451   1HG2  ILE  63          3HG2      ILE  63   4.191  -6.265 -10.479
  452   2HG2  ILE  63          2HG2      ILE  63   3.457  -5.144 -11.626
  453   3HG2  ILE  63          1HG2      ILE  63   5.140  -5.628 -11.821
  454   1HD1  ILE  63          1HD1      ILE  63   2.813  -3.268 -11.362
  455   2HD1  ILE  63          3HD1      ILE  63   3.265  -1.607 -10.977
  456   3HD1  ILE  63          2HD1      ILE  63   3.544  -2.245 -12.598
  457    HA   PRO  64           HA       PRO  64   1.618  -7.476  -9.380
  458   1HB   PRO  64          2HB       PRO  64   2.148  -9.005  -7.142
  459   2HB   PRO  64          1HB       PRO  64   3.056  -9.091  -8.666
  460   1HG   PRO  64          2HG       PRO  64   3.830  -7.832  -6.082
  461   2HG   PRO  64          1HG       PRO  64   4.861  -8.485  -7.361
  462   1HD   PRO  64          2HD       PRO  64   4.370  -5.766  -6.905
  463   2HD   PRO  64          1HD       PRO  64   5.045  -6.441  -8.399
  464    H    GLU  65           H        GLU  65  -0.431  -7.981  -8.676
  465    HA   GLU  65           HA       GLU  65  -1.742  -6.109  -6.918
  466   1HB   GLU  65          2HB       GLU  65  -3.758  -7.231  -7.516
  467   2HB   GLU  65          1HB       GLU  65  -2.736  -7.352  -8.945
  468   1HG   GLU  65          2HG       GLU  65  -1.953  -9.590  -7.635
  469   2HG   GLU  65          1HG       GLU  65  -3.621  -9.478  -7.075
  470    H    ASN  66           H        ASN  66  -3.582  -8.144  -5.770
  471    HA   ASN  66           HA       ASN  66  -1.981  -8.742  -3.363
  472   1HB   ASN  66          2HB       ASN  66  -4.042  -8.922  -2.217
  473   2HB   ASN  66          1HB       ASN  66  -4.304  -7.616  -3.373
  474   1HD2  ASN  66          2HD2      ASN  66  -6.971 -10.428  -3.503
  475   2HD2  ASN  66          1HD2      ASN  66  -6.178  -9.788  -2.145
  476    H    ALA  67           H        ALA  67  -1.699 -10.325  -5.884
  477    HA   ALA  67           HA       ALA  67  -1.418 -12.908  -4.797
  478   1HB   ALA  67          1HB       ALA  67  -4.108 -12.364  -6.040
  479   2HB   ALA  67          3HB       ALA  67  -3.402 -13.979  -6.102
  480   3HB   ALA  67          2HB       ALA  67  -3.737 -13.222  -4.544
  481    H    ALA  68           H        ALA  68  -0.141 -11.103  -6.671
  482    HA   ALA  68           HA       ALA  68   0.145 -13.001  -8.938
  483   1HB   ALA  68          1HB       ALA  68  -1.032 -10.339  -9.099
  484   2HB   ALA  68          3HB       ALA  68   0.392 -10.485 -10.131
  485   3HB   ALA  68          2HB       ALA  68  -0.958 -11.604 -10.327
  486    H    ALA  69           H        ALA  69   1.705 -11.927  -6.493
  487    HA   ALA  69           HA       ALA  69   3.959 -10.483  -7.621
  488   1HB   ALA  69          1HB       ALA  69   3.423 -11.867  -4.997
  489   2HB   ALA  69          3HB       ALA  69   5.039 -11.276  -5.385
  490   3HB   ALA  69          2HB       ALA  69   3.685 -10.150  -5.304
  491    H    HIS  70           HN       HIS  70   6.114 -11.369  -7.915
  492    HA   HIS  70           HA       HIS  70   7.601 -12.983  -8.745
  493   1HB   HIS  70          2HB       HIS  70   5.904 -14.560  -6.819
  494   2HB   HIS  70          1HB       HIS  70   7.134 -15.365  -7.794
  495    HD1  HIS  70           HD1      HIS  70   8.236 -12.001  -7.140
  496    HD2  HIS  70           HD2      HIS  70   8.303 -15.575  -4.996
  497    HE1  HIS  70           HE1      HIS  70   9.973 -11.712  -5.319
   
  No H/Q in entry =         497
  Start of MODEL    8
    1   1H    GLU   1          2H        GLU   1  12.434  -8.981  -2.718
    2   2H    GLU   1          1H        GLU   1  13.152  -7.460  -2.961
    3   3H    GLU   1          3H        GLU   1  13.842  -8.557  -1.867
    4    HA   GLU   1           HA       GLU   1  12.733  -7.051  -0.502
    5   1HB   GLU   1          2HB       GLU   1  11.482  -5.893  -2.255
    6   2HB   GLU   1          1HB       GLU   1  10.445  -7.302  -2.477
    7   1HG   GLU   1          2HG       GLU   1   9.225  -5.785  -1.077
    8   2HG   GLU   1          1HG       GLU   1   9.801  -7.069  -0.025
    9    H    THR   2           H        THR   2  11.279  -7.650   1.239
   10    HA   THR   2           HA       THR   2  10.703 -10.557   1.248
   11    HB   THR   2           HB       THR   2  10.204  -9.045   3.714
   12    HG1  THR   2           HG1      THR   2  12.709  -9.098   3.843
   13   1HG2  THR   2          3HG2      THR   2  10.637 -11.632   3.076
   14   2HG2  THR   2          2HG2      THR   2  12.282 -11.155   3.495
   15   3HG2  THR   2          1HG2      THR   2  10.984 -10.970   4.674
   16    H    VAL   3           H        VAL   3   8.706 -10.681   0.139
   17    HA   VAL   3           HA       VAL   3   6.523  -8.924   0.369
   18    HB   VAL   3           HB       VAL   3   6.022 -11.890   0.380
   19   1HG1  VAL   3          2HG1      VAL   3   4.581  -9.509  -0.248
   20   2HG1  VAL   3          1HG1      VAL   3   4.794 -10.416  -1.746
   21   3HG1  VAL   3          3HG1      VAL   3   4.020 -11.177  -0.356
   22   1HG2  VAL   3          3HG2      VAL   3   7.789 -10.435  -1.457
   23   2HG2  VAL   3          2HG2      VAL   3   7.569 -12.172  -1.256
   24   3HG2  VAL   3          1HG2      VAL   3   6.467 -11.257  -2.284
   25    H    GLU   4           H        GLU   4   7.755 -11.283   2.628
   26    HA   GLU   4           HA       GLU   4   5.494 -11.479   4.359
   27   1HB   GLU   4          2HB       GLU   4   7.760 -12.805   4.326
   28   2HB   GLU   4          1HB       GLU   4   8.312 -11.524   5.406
   29   1HG   GLU   4          2HG       GLU   4   7.419 -12.834   7.039
   30   2HG   GLU   4          1HG       GLU   4   5.889 -12.130   6.514
   31    H    SER   5           H        SER   5   8.261  -9.220   4.357
   32    HA   SER   5           HA       SER   5   7.249  -7.788   6.685
   33   1HB   SER   5          2HB       SER   5   9.516  -7.358   4.752
   34   2HB   SER   5          1HB       SER   5   9.043  -6.078   5.865
   35    HG   SER   5           HG       SER   5  10.474  -7.229   7.010
   36    H    CYS   6           H        CYS   6   7.470  -7.065   3.181
   37    HA   CYS   6           HA       CYS   6   6.246  -4.524   3.250
   38   1HB   CYS   6          2HB       CYS   6   5.944  -6.702   1.157
   39   2HB   CYS   6          1HB       CYS   6   5.436  -5.027   0.935
   40    H    LEU   7           H        LEU   7   4.903  -7.650   3.873
   41    HA   LEU   7           HA       LEU   7   2.142  -6.556   3.745
   42   1HB   LEU   7          2HB       LEU   7   3.063  -9.386   4.292
   43   2HB   LEU   7          1HB       LEU   7   1.408  -8.860   3.983
   44    HG   LEU   7           HG       LEU   7   3.610  -8.334   1.988
   45   1HD1  LEU   7          3HD1      LEU   7   2.658 -10.898   2.784
   46   2HD1  LEU   7          2HD1      LEU   7   1.959 -10.546   1.204
   47   3HD1  LEU   7          1HD1      LEU   7   3.709 -10.510   1.423
   48   1HD2  LEU   7          3HD2      LEU   7   0.617  -8.256   2.071
   49   2HD2  LEU   7          2HD2      LEU   7   1.746  -7.123   1.327
   50   3HD2  LEU   7          1HD2      LEU   7   1.396  -8.663   0.542
   51    H    ALA   8           H        ALA   8   4.641  -7.584   5.931
   52    HA   ALA   8           HA       ALA   8   3.050  -7.863   8.319
   53   1HB   ALA   8          1HB       ALA   8   5.960  -7.136   7.871
   54   2HB   ALA   8          3HB       ALA   8   5.260  -7.317   9.479
   55   3HB   ALA   8          2HB       ALA   8   5.310  -8.695   8.379
   56    H    LYS   9           H        LYS   9   3.903  -5.263   6.351
   57    HA   LYS   9           HA       LYS   9   4.173  -3.014   7.946
   58   1HB   LYS   9          2HB       LYS   9   2.645  -3.502   5.364
   59   2HB   LYS   9          1HB       LYS   9   3.043  -1.898   5.959
   60   1HG   LYS   9          2HG       LYS   9   5.465  -3.177   6.142
   61   2HG   LYS   9          1HG       LYS   9   4.775  -3.891   4.689
   62   1HD   LYS   9          2HD       LYS   9   4.643  -1.837   3.579
   63   2HD   LYS   9          1HD       LYS   9   4.668  -0.917   5.084
   64   1HE   LYS   9          2HE       LYS   9   7.070  -2.144   5.270
   65   2HE   LYS   9          1HE       LYS   9   6.926  -2.038   3.515
   66   1HZ   LYS   9          3HZ       LYS   9   6.243   0.336   5.073
   67   2HZ   LYS   9          2HZ       LYS   9   7.888  -0.069   4.952
   68   3HZ   LYS   9          1HZ       LYS   9   6.974   0.215   3.548
   69    HA   PRO  10           HA       PRO  10   0.292  -2.376   9.954
   70   1HB   PRO  10          2HB       PRO  10  -0.549   0.157   9.259
   71   2HB   PRO  10          1HB       PRO  10   0.761  -0.173  10.406
   72   1HG   PRO  10          2HG       PRO  10   0.931   0.803   7.598
   73   2HG   PRO  10          1HG       PRO  10   2.076   1.019   8.933
   74   1HD   PRO  10          2HD       PRO  10   2.322  -0.813   6.805
   75   2HD   PRO  10          1HD       PRO  10   3.302  -0.811   8.285
   76    H    HIS  11           H        HIS  11   0.378  -2.616   6.660
   77    HA   HIS  11           HA       HIS  11  -1.174  -3.421   5.143
   78   1HB   HIS  11          2HB       HIS  11  -2.423  -3.906   7.722
   79   2HB   HIS  11          1HB       HIS  11  -3.609  -3.584   6.452
   80    HD1  HIS  11           HD1      HIS  11  -0.322  -5.553   6.545
   81    HD2  HIS  11           HD2      HIS  11  -4.269  -5.979   5.269
   82    HE1  HIS  11           HE1      HIS  11  -0.485  -7.840   5.471
   83    H    THR  12           H        THR  12  -1.054  -1.290   4.125
   84    HA   THR  12           HA       THR  12  -2.343   0.212   2.893
   85    HB   THR  12           HB       THR  12  -4.252  -1.337   4.036
   86    HG1  THR  12           HG1      THR  12  -5.451  -0.634   2.438
   87   1HG2  THR  12          3HG2      THR  12  -4.783   1.521   4.847
   88   2HG2  THR  12          2HG2      THR  12  -6.043   0.292   4.748
   89   3HG2  THR  12          1HG2      THR  12  -4.731   0.112   5.902
   90    H    GLU  13           H        GLU  13  -3.110   0.812   6.371
   91    HA   GLU  13           HA       GLU  13  -3.387   3.545   6.201
   92   1HB   GLU  13          2HB       GLU  13  -3.489   2.260   8.344
   93   2HB   GLU  13          1HB       GLU  13  -1.725   2.190   8.354
   94   1HG   GLU  13          2HG       GLU  13  -2.431   4.903   7.889
   95   2HG   GLU  13          1HG       GLU  13  -3.439   4.335   9.223
   96    H    ASN  14           H        ASN  14  -2.199   4.617   4.703
   97    HA   ASN  14           HA       ASN  14   0.272   5.774   5.270
   98   1HB   ASN  14          2HB       ASN  14   0.561   3.020   4.445
   99   2HB   ASN  14          1HB       ASN  14   1.276   4.075   3.227
  100   1HD2  ASN  14          2HD2      ASN  14   4.085   4.780   5.217
  101   2HD2  ASN  14          1HD2      ASN  14   3.374   4.768   3.676
  102    H    SER  15           H        SER  15   1.370   5.697   2.536
  103    HA   SER  15           HA       SER  15  -0.649   6.086   0.581
  104   1HB   SER  15          2HB       SER  15  -0.536   8.638   0.534
  105   2HB   SER  15          1HB       SER  15  -1.460   7.934   1.857
  106    HG   SER  15           HG       SER  15   0.587   8.076   3.065
  107    H    PHE  16           H        PHE  16   0.330   7.940  -1.078
  108    HA   PHE  16           HA       PHE  16   3.186   8.128  -1.200
  109   1HB   PHE  16          2HB       PHE  16   2.803   5.632  -1.562
  110   2HB   PHE  16          1HB       PHE  16   2.023   6.065  -3.084
  111    HD1  PHE  16           HD2      PHE  16   3.325   7.406  -4.791
  112    HD2  PHE  16           HD1      PHE  16   5.170   5.588  -1.369
  113    HE1  PHE  16           HE2      PHE  16   5.540   7.605  -5.882
  114    HE2  PHE  16           HE1      PHE  16   7.389   5.784  -2.458
  115    HZ   PHE  16           HZ       PHE  16   7.575   6.792  -4.718
  116    H    THR  17           H        THR  17   3.835   9.332  -3.120
  117    HA   THR  17           HA       THR  17   1.494  10.453  -4.594
  118    HB   THR  17           HB       THR  17   2.456  12.355  -3.764
  119    HG1  THR  17           HG1      THR  17   4.109  13.092  -5.304
  120   1HG2  THR  17          1HG2      THR  17   5.055  10.807  -3.777
  121   2HG2  THR  17          3HG2      THR  17   4.961  12.517  -3.357
  122   3HG2  THR  17          2HG2      THR  17   4.113  11.320  -2.378
  123    H    ASN  18           H        ASN  18   1.714  10.811  -6.896
  124    HA   ASN  18           HA       ASN  18   2.505  10.292  -9.065
  125   1HB   ASN  18          2HB       ASN  18   4.833  10.405  -7.665
  126   2HB   ASN  18          1HB       ASN  18   4.814   8.694  -8.096
  127   1HD2  ASN  18          2HD2      ASN  18   6.434  10.393 -10.953
  128   2HD2  ASN  18          1HD2      ASN  18   6.811  10.055  -9.331
  129    H    VAL  19           H        VAL  19   1.044   8.550  -7.003
  130    HA   VAL  19           HA       VAL  19   1.542   5.818  -7.324
  131    HB   VAL  19           HB       VAL  19  -1.113   7.266  -7.145
  132   1HG1  VAL  19          1HG1      VAL  19  -1.337   4.945  -7.992
  133   2HG1  VAL  19          3HG1      VAL  19  -0.443   4.362  -6.587
  134   3HG1  VAL  19          2HG1      VAL  19  -2.020   5.126  -6.376
  135   1HG2  VAL  19          2HG2      VAL  19   0.907   7.257  -5.327
  136   2HG2  VAL  19          1HG2      VAL  19  -0.798   7.337  -4.884
  137   3HG2  VAL  19          3HG2      VAL  19   0.050   5.791  -4.852
  138    H    TRP  20           H        TRP  20   0.515   4.230  -8.728
  139    HA   TRP  20           HA       TRP  20  -0.313   5.357 -11.364
  140   1HB   TRP  20          2HB       TRP  20   1.215   4.098 -12.485
  141   2HB   TRP  20          1HB       TRP  20   2.033   3.966 -10.935
  142    HD1  TRP  20           HD1      TRP  20  -0.171   2.017 -13.356
  143    HE1  TRP  20           HE1      TRP  20  -0.154  -0.474 -12.699
  144    HE3  TRP  20           HE3      TRP  20   2.374   2.291  -8.935
  145    HZ2  TRP  20           HZ2      TRP  20   0.840  -2.133 -10.596
  146    HZ3  TRP  20           HZ3      TRP  20   2.845   0.238  -7.631
  147    HH2  TRP  20           HH2      TRP  20   2.077  -1.972  -8.458
  148    H    LYS  21           H        LYS  21  -1.334   3.275 -12.629
  149    HA   LYS  21           HA       LYS  21  -3.050   1.744 -10.755
  150   1HB   LYS  21          2HB       LYS  21  -4.336   3.785 -11.342
  151   2HB   LYS  21          1HB       LYS  21  -4.144   3.400 -13.054
  152   1HG   LYS  21          2HG       LYS  21  -5.120   1.040 -12.163
  153   2HG   LYS  21          1HG       LYS  21  -5.896   2.137 -11.018
  154   1HD   LYS  21          2HD       LYS  21  -7.409   2.013 -12.842
  155   2HD   LYS  21          1HD       LYS  21  -6.554   3.539 -13.075
  156   1HE   LYS  21          2HE       LYS  21  -5.048   1.434 -14.319
  157   2HE   LYS  21          1HE       LYS  21  -6.718   1.350 -14.877
  158   1HZ   LYS  21          2HZ       LYS  21  -5.639   4.022 -14.733
  159   2HZ   LYS  21          1HZ       LYS  21  -4.866   3.020 -15.867
  160   3HZ   LYS  21          3HZ       LYS  21  -6.539   3.276 -15.966
  161    H    ASP  22           H        ASP  22  -2.783  -0.340 -11.396
  162    HA   ASP  22           HA       ASP  22  -2.048  -0.852 -14.217
  163   1HB   ASP  22          2HB       ASP  22  -1.185  -1.925 -11.776
  164   2HB   ASP  22          1HB       ASP  22  -2.159  -3.195 -12.513
  165    H    ASP  23           H        ASP  23  -3.450  -1.727 -15.616
  166    HA   ASP  23           HA       ASP  23  -6.170  -2.406 -14.746
  167   1HB   ASP  23          2HB       ASP  23  -5.176  -1.400 -17.087
  168   2HB   ASP  23          1HB       ASP  23  -5.292  -3.113 -17.494
  169    H    LYS  24           H        LYS  24  -3.149  -3.927 -15.171
  170    HA   LYS  24           HA       LYS  24  -4.147  -6.627 -15.676
  171   1HB   LYS  24          2HB       LYS  24  -1.484  -5.365 -15.055
  172   2HB   LYS  24          1HB       LYS  24  -1.676  -7.114 -14.902
  173   1HG   LYS  24          2HG       LYS  24  -2.404  -7.279 -17.228
  174   2HG   LYS  24          1HG       LYS  24  -2.344  -5.524 -17.397
  175   1HD   LYS  24          2HD       LYS  24  -0.288  -6.198 -18.309
  176   2HD   LYS  24          1HD       LYS  24   0.143  -5.777 -16.652
  177   1HE   LYS  24          2HE       LYS  24   0.008  -8.131 -15.989
  178   2HE   LYS  24          1HE       LYS  24  -0.506  -8.578 -17.614
  179   1HZ   LYS  24          2HZ       LYS  24   1.612  -7.614 -18.431
  180   2HZ   LYS  24          1HZ       LYS  24   2.107  -7.424 -16.818
  181   3HZ   LYS  24          3HZ       LYS  24   1.818  -8.976 -17.436
  182    H    THR  25           H        THR  25  -2.581  -4.940 -12.947
  183    HA   THR  25           HA       THR  25  -3.134  -7.042 -11.052
  184    HB   THR  25           HB       THR  25  -2.468  -5.387  -9.351
  185    HG1  THR  25           HG1      THR  25  -3.616  -3.657 -10.506
  186   1HG2  THR  25          1HG2      THR  25  -0.892  -6.330 -11.409
  187   2HG2  THR  25          3HG2      THR  25  -0.570  -4.595 -11.445
  188   3HG2  THR  25          2HG2      THR  25  -0.293  -5.513  -9.965
  189    H    LEU  26           H        LEU  26  -4.874  -4.290 -12.277
  190    HA   LEU  26           HA       LEU  26  -7.170  -3.798 -12.066
  191   1HB   LEU  26          2HB       LEU  26  -6.917  -6.533 -11.261
  192   2HB   LEU  26          1HB       LEU  26  -8.021  -5.732 -10.145
  193    HG   LEU  26           HG       LEU  26  -9.082  -6.724 -12.237
  194   1HD1  LEU  26          1HD1      LEU  26  -9.397  -4.001 -11.128
  195   2HD1  LEU  26          3HD1      LEU  26 -10.138  -4.242 -12.711
  196   3HD1  LEU  26          2HD1      LEU  26 -10.602  -5.270 -11.355
  197   1HD2  LEU  26          3HD2      LEU  26  -7.076  -5.710 -13.614
  198   2HD2  LEU  26          2HD2      LEU  26  -8.684  -5.788 -14.333
  199   3HD2  LEU  26          1HD2      LEU  26  -8.093  -4.271 -13.655
  200    H    ASP  27           H        ASP  27  -5.662  -2.149 -10.598
  201    HA   ASP  27           HA       ASP  27  -7.290  -1.311  -8.467
  202   1HB   ASP  27          2HB       ASP  27  -5.778  -3.663  -7.803
  203   2HB   ASP  27          1HB       ASP  27  -5.231  -2.317  -6.803
  204    H    ARG  28           H        ARG  28  -6.110   0.177  -6.877
  205    HA   ARG  28           HA       ARG  28  -4.123   1.737  -8.386
  206   1HB   ARG  28          2HB       ARG  28  -5.617   2.078  -5.792
  207   2HB   ARG  28          1HB       ARG  28  -4.192   3.068  -6.112
  208   1HG   ARG  28          2HG       ARG  28  -6.250   2.844  -8.268
  209   2HG   ARG  28          1HG       ARG  28  -6.617   3.861  -6.874
  210   1HD   ARG  28          2HD       ARG  28  -4.379   4.988  -7.225
  211   2HD   ARG  28          1HD       ARG  28  -4.249   4.102  -8.745
  212    HE   ARG  28           HE       ARG  28  -5.519   5.918  -9.564
  213   1HH1  ARG  28          1HH2      ARG  28  -6.164   5.805  -6.268
  214   2HH1  ARG  28          2HH2      ARG  28  -7.801   6.359  -6.393
  215   1HH2  ARG  28          2HH1      ARG  28  -7.874   6.197  -9.855
  216   2HH2  ARG  28          1HH1      ARG  28  -8.769   6.579  -8.423
  217    H    TYR  29           H        TYR  29  -1.905   1.986  -7.701
  218    HA   TYR  29           HA       TYR  29  -1.055   0.394  -5.363
  219   1HB   TYR  29          2HB       TYR  29  -0.112  -0.166  -8.185
  220   2HB   TYR  29          1HB       TYR  29   0.679  -0.790  -6.740
  221    HD1  TYR  29           HD2      TYR  29  -0.445  -2.433  -5.287
  222    HD2  TYR  29           HD1      TYR  29  -2.277  -1.005  -8.901
  223    HE1  TYR  29           HE2      TYR  29  -2.079  -4.296  -5.194
  224    HE2  TYR  29           HE1      TYR  29  -3.912  -2.871  -8.809
  225    HH   TYR  29           HH       TYR  29  -3.739  -5.336  -6.239
  226    H    ALA  30           H        ALA  30   0.714   1.243  -4.377
  227    HA   ALA  30           HA       ALA  30   2.096   3.497  -5.778
  228   1HB   ALA  30          2HB       ALA  30   1.478   3.050  -2.845
  229   2HB   ALA  30          1HB       ALA  30   2.621   4.270  -3.405
  230   3HB   ALA  30          3HB       ALA  30   0.924   4.372  -3.871
  231    H    ASN  31           H        ASN  31   4.252   3.201  -6.118
  232    HA   ASN  31           HA       ASN  31   5.490   0.714  -5.182
  233   1HB   ASN  31          2HB       ASN  31   7.391   1.410  -6.573
  234   2HB   ASN  31          1HB       ASN  31   5.883   1.570  -7.475
  235   1HD2  ASN  31          2HD2      ASN  31   7.865   4.747  -7.843
  236   2HD2  ASN  31          1HD2      ASN  31   8.190   3.115  -8.179
  237    H    TYR  32           H        TYR  32   6.012   0.797  -3.010
  238    HA   TYR  32           HA       TYR  32   7.252   3.235  -1.900
  239   1HB   TYR  32          2HB       TYR  32   5.587   1.851  -0.597
  240   2HB   TYR  32          1HB       TYR  32   6.794   0.567  -0.536
  241    HD1  TYR  32           HD1      TYR  32   6.348   4.208   0.232
  242    HD2  TYR  32           HD2      TYR  32   8.410   0.557   1.165
  243    HE1  TYR  32           HE1      TYR  32   7.439   5.317   2.163
  244    HE2  TYR  32           HE2      TYR  32   9.500   1.666   3.096
  245    HH   TYR  32           HH       TYR  32   9.400   3.503   4.458
  246    H    GLU  33           H        GLU  33   8.857   2.392  -3.854
  247    HA   GLU  33           HA       GLU  33  10.893   1.288  -4.416
  248   1HB   GLU  33          2HB       GLU  33  11.337   3.540  -3.284
  249   2HB   GLU  33          1HB       GLU  33  11.721   2.618  -1.830
  250   1HG   GLU  33          2HG       GLU  33  13.792   3.012  -3.002
  251   2HG   GLU  33          1HG       GLU  33  13.384   1.308  -3.207
  252    H    GLY  34           H        GLY  34  10.103  -0.936  -3.900
  253   1HA   GLY  34          2HA       GLY  34  11.486  -2.838  -2.945
  254   2HA   GLY  34          1HA       GLY  34  11.390  -1.977  -1.408
  255    H    CYS  35           H        CYS  35   8.698  -1.196  -1.414
  256    HA   CYS  35           HA       CYS  35   7.342  -3.868  -1.337
  257   1HB   CYS  35          2HB       CYS  35   6.890  -1.384   0.342
  258   2HB   CYS  35          1HB       CYS  35   5.838  -2.797   0.380
  259    H    LEU  36           H        LEU  36   4.835  -3.575  -1.552
  260    HA   LEU  36           HA       LEU  36   4.190  -1.378  -3.453
  261   1HB   LEU  36          2HB       LEU  36   4.679  -3.288  -4.881
  262   2HB   LEU  36          1HB       LEU  36   3.604  -4.313  -3.931
  263    HG   LEU  36           HG       LEU  36   1.745  -2.663  -4.478
  264   1HD1  LEU  36          1HD1      LEU  36   4.013  -1.559  -6.091
  265   2HD1  LEU  36          3HD1      LEU  36   2.380  -1.450  -6.739
  266   3HD1  LEU  36          2HD1      LEU  36   2.761  -0.705  -5.191
  267   1HD2  LEU  36          3HD2      LEU  36   2.770  -4.821  -5.940
  268   2HD2  LEU  36          2HD2      LEU  36   1.165  -4.109  -6.112
  269   3HD2  LEU  36          1HD2      LEU  36   2.486  -3.562  -7.144
  270    H    TRP  37           H        TRP  37   2.573  -0.329  -2.455
  271    HA   TRP  37           HA       TRP  37   0.589  -1.837  -0.844
  272   1HB   TRP  37          2HB       TRP  37   0.720   1.159  -1.305
  273   2HB   TRP  37          1HB       TRP  37  -0.130   0.301  -0.031
  274    HD1  TRP  37           HD1      TRP  37   3.538   0.682  -1.224
  275    HE1  TRP  37           HE1      TRP  37   5.033   0.745   0.877
  276    HE3  TRP  37           HE3      TRP  37   0.002  -0.007   2.391
  277    HZ2  TRP  37           HZ2      TRP  37   4.754   0.531   3.725
  278    HZ3  TRP  37           HZ3      TRP  37   0.630  -0.077   4.775
  279    HH2  TRP  37           HH2      TRP  37   3.006   0.196   5.449
  280    H    ASN  38           H        ASN  38  -1.791  -0.889  -1.246
  281    HA   ASN  38           HA       ASN  38  -2.239  -0.216  -4.075
  282   1HB   ASN  38          2HB       ASN  38  -3.457  -2.117  -4.684
  283   2HB   ASN  38          1HB       ASN  38  -2.133  -2.798  -3.744
  284   1HD2  ASN  38          2HD2      ASN  38  -5.947  -2.899  -2.242
  285   2HD2  ASN  38          1HD2      ASN  38  -5.584  -1.903  -3.568
  286    H    ALA  39           H        ALA  39  -3.847   1.240  -4.192
  287    HA   ALA  39           HA       ALA  39  -5.523   1.742  -1.826
  288   1HB   ALA  39          2HB       ALA  39  -4.617   3.257  -4.108
  289   2HB   ALA  39          1HB       ALA  39  -6.376   3.341  -4.005
  290   3HB   ALA  39          3HB       ALA  39  -5.387   3.841  -2.633
  291    H    THR  40           H        THR  40  -7.636   1.141  -1.648
  292    HA   THR  40           HA       THR  40  -9.045   0.121  -4.067
  293    HB   THR  40           HB       THR  40  -8.168  -1.875  -3.030
  294    HG1  THR  40           HG1      THR  40 -10.080  -2.889  -2.562
  295   1HG2  THR  40          3HG2      THR  40  -8.128  -0.399  -0.717
  296   2HG2  THR  40          2HG2      THR  40  -9.474  -1.497  -0.414
  297   3HG2  THR  40          1HG2      THR  40  -7.879  -2.143  -0.794
  298    H    GLY  41           H        GLY  41  -9.299   1.061  -0.633
  299   1HA   GLY  41          2HA       GLY  41 -12.194   1.569  -0.982
  300   2HA   GLY  41          1HA       GLY  41 -11.313   1.642   0.542
  301    H    VAL  42           H        VAL  42 -12.045   3.726   1.096
  302    HA   VAL  42           HA       VAL  42 -12.236   6.002  -0.497
  303    HB   VAL  42           HB       VAL  42 -12.862   5.906   1.912
  304   1HG1  VAL  42          2HG1      VAL  42 -10.623   4.756   2.505
  305   2HG1  VAL  42          1HG1      VAL  42  -9.943   6.383   2.519
  306   3HG1  VAL  42          3HG1      VAL  42 -11.242   5.960   3.635
  307   1HG2  VAL  42          3HG2      VAL  42 -12.326   8.069   0.563
  308   2HG2  VAL  42          2HG2      VAL  42 -12.446   8.191   2.318
  309   3HG2  VAL  42          1HG2      VAL  42 -10.862   8.133   1.544
  310    H    VAL  43           H        VAL  43 -10.798   7.429  -1.413
  311    HA   VAL  43           HA       VAL  43  -7.981   7.463  -0.611
  312    HB   VAL  43           HB       VAL  43  -8.868   6.318  -3.267
  313   1HG1  VAL  43          3HG1      VAL  43  -6.308   7.673  -2.468
  314   2HG1  VAL  43          2HG1      VAL  43  -6.263   6.334  -3.616
  315   3HG1  VAL  43          1HG1      VAL  43  -7.198   7.782  -3.988
  316   1HG2  VAL  43          1HG2      VAL  43  -7.076   5.375  -1.011
  317   2HG2  VAL  43          3HG2      VAL  43  -8.596   4.654  -1.542
  318   3HG2  VAL  43          2HG2      VAL  43  -7.170   4.567  -2.576
  319    H    VAL  44           H        VAL  44  -7.107   9.459  -1.086
  320    HA   VAL  44           HA       VAL  44  -8.781  11.265  -2.783
  321    HB   VAL  44           HB       VAL  44  -8.531  11.877  -0.349
  322   1HG1  VAL  44          2HG1      VAL  44  -6.031  11.027  -0.469
  323   2HG1  VAL  44          1HG1      VAL  44  -5.712  12.690  -0.963
  324   3HG1  VAL  44          3HG1      VAL  44  -6.466  12.363   0.598
  325   1HG2  VAL  44          3HG2      VAL  44  -8.826  13.513  -2.331
  326   2HG2  VAL  44          2HG2      VAL  44  -8.264  14.186  -0.801
  327   3HG2  VAL  44          1HG2      VAL  44  -7.116  13.884  -2.106
  328    H    CYS  45           H        CYS  45  -7.838  11.232  -4.801
  329    HA   CYS  45           HA       CYS  45  -4.876  11.593  -4.889
  330   1HB   CYS  45          2HB       CYS  45  -6.211   9.478  -5.947
  331   2HB   CYS  45          1HB       CYS  45  -6.228  10.580  -7.325
  332    H    THR  46           H        THR  46  -4.166  13.429  -5.829
  333    HA   THR  46           HA       THR  46  -6.125  15.068  -7.374
  334    HB   THR  46           HB       THR  46  -5.282  16.112  -5.280
  335    HG1  THR  46           HG1      THR  46  -3.979  17.490  -7.321
  336   1HG2  THR  46          3HG2      THR  46  -3.064  14.892  -5.388
  337   2HG2  THR  46          2HG2      THR  46  -2.573  16.051  -6.622
  338   3HG2  THR  46          1HG2      THR  46  -2.950  16.606  -4.991
  339    H    GLY  47           H        GLY  47  -5.092  16.404  -9.122
  340   1HA   GLY  47          2HA       GLY  47  -3.739  16.613 -11.034
  341   2HA   GLY  47          1HA       GLY  47  -2.499  15.688 -10.181
  342    H    ASP  48           H        ASP  48  -5.604  15.282 -11.905
  343    HA   ASP  48           HA       ASP  48  -6.399  13.436 -13.144
  344   1HB   ASP  48          2HB       ASP  48  -3.467  13.512 -13.553
  345   2HB   ASP  48          1HB       ASP  48  -4.241  11.966 -13.898
  346    H    GLU  49           H        GLU  49  -5.573  13.306 -10.194
  347    HA   GLU  49           HA       GLU  49  -5.605  11.712  -8.515
  348   1HB   GLU  49          2HB       GLU  49  -6.892  10.323 -10.822
  349   2HB   GLU  49          1HB       GLU  49  -6.378   9.326  -9.459
  350   1HG   GLU  49          2HG       GLU  49  -7.583  11.521  -8.244
  351   2HG   GLU  49          1HG       GLU  49  -8.614  11.197  -9.640
  352    H    THR  50           H        THR  50  -3.150  12.247  -9.489
  353    HA   THR  50           HA       THR  50  -1.832   9.661 -10.096
  354    HB   THR  50           HB       THR  50   0.212  11.342 -10.170
  355    HG1  THR  50           HG1      THR  50  -0.668  13.392 -10.933
  356   1HG2  THR  50          1HG2      THR  50  -1.939  10.693 -12.096
  357   2HG2  THR  50          3HG2      THR  50  -0.881  12.029 -12.549
  358   3HG2  THR  50          2HG2      THR  50  -0.198  10.435 -12.221
  359    H    GLN  51           H        GLN  51  -1.705  12.328  -7.702
  360    HA   GLN  51           HA       GLN  51  -0.110  10.502  -5.941
  361   1HB   GLN  51          2HB       GLN  51  -0.589  13.425  -5.384
  362   2HB   GLN  51          1HB       GLN  51   0.736  12.397  -4.837
  363   1HG   GLN  51          2HG       GLN  51   1.944  13.196  -6.567
  364   2HG   GLN  51          1HG       GLN  51   0.867  12.297  -7.635
  365   1HE2  GLN  51          2HE2      GLN  51   0.126  16.310  -7.075
  366   2HE2  GLN  51          1HE2      GLN  51   0.916  15.441  -5.849
  367    H    CYS  52           H        CYS  52  -1.051   9.855  -3.963
  368    HA   CYS  52           HA       CYS  52  -3.464  11.263  -3.056
  369   1HB   CYS  52          2HB       CYS  52  -4.308   8.558  -3.079
  370   2HB   CYS  52          1HB       CYS  52  -4.989   9.898  -3.990
  371    H    TYR  53           H        TYR  53  -4.473  10.056  -1.139
  372    HA   TYR  53           HA       TYR  53  -2.458   8.536   0.420
  373   1HB   TYR  53          2HB       TYR  53  -2.023  10.608   1.406
  374   2HB   TYR  53          1HB       TYR  53  -3.666  11.187   1.140
  375    HD1  TYR  53           HD1      TYR  53  -1.515   9.072   3.299
  376    HD2  TYR  53           HD2      TYR  53  -5.448  10.694   2.700
  377    HE1  TYR  53           HE1      TYR  53  -2.149   8.388   5.602
  378    HE2  TYR  53           HE2      TYR  53  -6.075  10.020   5.001
  379    HH   TYR  53           HH       TYR  53  -3.903   8.094   7.009
  380    H    GLY  54           H        GLY  54  -3.481   7.402   2.291
  381   1HA   GLY  54          2HA       GLY  54  -5.925   7.134   3.252
  382   2HA   GLY  54          1HA       GLY  54  -6.277   6.653   1.592
  383    H    THR  55           H        THR  55  -6.779   4.482   2.101
  384    HA   THR  55           HA       THR  55  -4.723   2.879   3.515
  385    HB   THR  55           HB       THR  55  -6.468   1.012   3.094
  386    HG1  THR  55           HG1      THR  55  -7.572   2.174   1.446
  387   1HG2  THR  55          3HG2      THR  55  -6.125   2.744   5.130
  388   2HG2  THR  55          2HG2      THR  55  -7.770   3.173   4.663
  389   3HG2  THR  55          1HG2      THR  55  -7.388   1.514   5.122
  390    H    TRP  56           H        TRP  56  -3.250   1.785   2.432
  391    HA   TRP  56           HA       TRP  56  -3.684   1.080  -0.435
  392   1HB   TRP  56          2HB       TRP  56  -1.110   1.771   0.979
  393   2HB   TRP  56          1HB       TRP  56  -1.304   1.462  -0.749
  394    HD1  TRP  56           HD1      TRP  56  -2.561   3.940   1.930
  395    HE1  TRP  56           HE1      TRP  56  -2.980   6.206   0.781
  396    HE3  TRP  56           HE3      TRP  56  -1.546   2.655  -2.893
  397    HZ2  TRP  56           HZ2      TRP  56  -2.895   7.328  -1.863
  398    HZ3  TRP  56           HZ3      TRP  56  -1.721   4.329  -4.711
  399    HH2  TRP  56           HH2      TRP  56  -2.391   6.661  -4.200
  400    H    VAL  57           H        VAL  57  -4.511  -1.017   0.683
  401    HA   VAL  57           HA       VAL  57  -3.064  -2.631   2.398
  402    HB   VAL  57           HB       VAL  57  -4.675  -3.432  -0.036
  403   1HG1  VAL  57          2HG1      VAL  57  -3.002  -5.199   0.532
  404   2HG1  VAL  57          1HG1      VAL  57  -3.639  -5.231   2.176
  405   3HG1  VAL  57          3HG1      VAL  57  -4.663  -5.716   0.824
  406   1HG2  VAL  57          1HG2      VAL  57  -5.163  -3.154   2.923
  407   2HG2  VAL  57          3HG2      VAL  57  -6.104  -2.500   1.583
  408   3HG2  VAL  57          2HG2      VAL  57  -6.170  -4.223   1.950
  409    HA   PRO  58           HA       PRO  58   0.714  -3.467   0.202
  410   1HB   PRO  58          2HB       PRO  58   1.774  -5.126   2.141
  411   2HB   PRO  58          1HB       PRO  58   1.767  -3.357   2.259
  412   1HG   PRO  58          2HG       PRO  58   0.106  -5.336   3.723
  413   2HG   PRO  58          1HG       PRO  58   0.522  -3.670   4.172
  414   1HD   PRO  58          2HD       PRO  58  -1.953  -4.571   3.067
  415   2HD   PRO  58          1HD       PRO  58  -1.454  -2.888   3.323
  416    H    ILE  59           H        ILE  59   1.250  -5.095  -1.281
  417    HA   ILE  59           HA       ILE  59   0.301  -7.858  -0.782
  418    HB   ILE  59           HB       ILE  59  -0.607  -7.890  -3.167
  419   1HG1  ILE  59          2HG1      ILE  59   0.534  -5.551  -3.536
  420   2HG1  ILE  59          1HG1      ILE  59  -1.016  -5.892  -4.300
  421   1HG2  ILE  59          1HG2      ILE  59  -1.914  -6.367  -0.906
  422   2HG2  ILE  59          3HG2      ILE  59  -2.768  -6.696  -2.413
  423   3HG2  ILE  59          2HG2      ILE  59  -2.199  -8.033  -1.412
  424   1HD1  ILE  59          2HD1      ILE  59  -1.084  -4.720  -1.559
  425   2HD1  ILE  59          1HD1      ILE  59  -0.601  -3.658  -2.881
  426   3HD1  ILE  59          3HD1      ILE  59  -2.167  -4.463  -2.922
  427    H    GLY  60           H        GLY  60   2.218  -5.618  -2.780
  428   1HA   GLY  60          2HA       GLY  60   3.796  -8.027  -3.609
  429   2HA   GLY  60          1HA       GLY  60   3.442  -6.719  -4.729
  430    H    LEU  61           H        LEU  61   5.916  -7.014  -4.772
  431    HA   LEU  61           HA       LEU  61   7.290  -5.606  -2.576
  432   1HB   LEU  61          2HB       LEU  61   8.517  -6.556  -5.172
  433   2HB   LEU  61          1HB       LEU  61   9.318  -6.285  -3.624
  434    HG   LEU  61           HG       LEU  61   7.180  -8.390  -4.071
  435   1HD1  LEU  61          1HD1      LEU  61  10.205  -8.610  -4.047
  436   2HD1  LEU  61          3HD1      LEU  61   9.110  -9.989  -3.960
  437   3HD1  LEU  61          2HD1      LEU  61   9.133  -8.970  -5.399
  438   1HD2  LEU  61          3HD2      LEU  61   8.282  -7.239  -1.739
  439   2HD2  LEU  61          2HD2      LEU  61   7.280  -8.685  -1.839
  440   3HD2  LEU  61          1HD2      LEU  61   9.038  -8.825  -1.897
  441    H    ALA  62           H        ALA  62   6.003  -4.987  -5.768
  442    HA   ALA  62           HA       ALA  62   6.060  -2.208  -5.546
  443   1HB   ALA  62          1HB       ALA  62   8.690  -3.320  -6.091
  444   2HB   ALA  62          3HB       ALA  62   8.191  -2.181  -7.343
  445   3HB   ALA  62          2HB       ALA  62   8.237  -1.673  -5.653
  446    H    ILE  63           H        ILE  63   4.396  -4.145  -6.828
  447    HA   ILE  63           HA       ILE  63   3.561  -2.867  -9.089
  448    HB   ILE  63           HB       ILE  63   6.077  -4.138  -9.664
  449   1HG1  ILE  63          2HG1      ILE  63   5.513  -1.875 -10.308
  450   2HG1  ILE  63          1HG1      ILE  63   5.730  -2.817 -11.783
  451   1HG2  ILE  63          1HG2      ILE  63   3.695  -5.088 -11.274
  452   2HG2  ILE  63          3HG2      ILE  63   5.344  -5.101 -11.898
  453   3HG2  ILE  63          2HG2      ILE  63   4.927  -6.077 -10.490
  454   1HD1  ILE  63          1HD1      ILE  63   2.991  -3.032 -10.919
  455   2HD1  ILE  63          3HD1      ILE  63   3.440  -1.327 -11.004
  456   3HD1  ILE  63          2HD1      ILE  63   3.618  -2.360 -12.423
  457    HA   PRO  64           HA       PRO  64   2.000  -7.369  -9.499
  458   1HB   PRO  64          2HB       PRO  64   2.362  -8.980  -7.285
  459   2HB   PRO  64          1HB       PRO  64   3.390  -8.996  -8.731
  460   1HG   PRO  64          2HG       PRO  64   3.948  -7.847  -6.045
  461   2HG   PRO  64          1HG       PRO  64   5.081  -8.417  -7.277
  462   1HD   PRO  64          2HD       PRO  64   4.482  -5.730  -6.720
  463   2HD   PRO  64          1HD       PRO  64   5.314  -6.312  -8.173
  464    H    GLU  65           H        GLU  65  -0.072  -8.037  -8.921
  465    HA   GLU  65           HA       GLU  65  -1.581  -6.184  -7.283
  466   1HB   GLU  65          2HB       GLU  65  -3.519  -7.516  -7.990
  467   2HB   GLU  65          1HB       GLU  65  -2.461  -7.219  -9.366
  468   1HG   GLU  65          2HG       GLU  65  -1.370  -9.517  -8.458
  469   2HG   GLU  65          1HG       GLU  65  -3.043  -9.762  -7.961
  470    H    ASN  66           H        ASN  66  -3.521  -7.805  -6.138
  471    HA   ASN  66           HA       ASN  66  -2.240  -8.570  -3.659
  472   1HB   ASN  66          2HB       ASN  66  -4.422  -8.892  -2.831
  473   2HB   ASN  66          1HB       ASN  66  -4.636  -7.639  -4.054
  474   1HD2  ASN  66          2HD2      ASN  66  -6.911  -9.593  -5.882
  475   2HD2  ASN  66          1HD2      ASN  66  -6.313  -8.052  -5.492
  476    H    ALA  67           H        ALA  67  -3.707 -10.361  -6.357
  477    HA   ALA  67           HA       ALA  67  -3.350 -12.964  -5.182
  478   1HB   ALA  67          3HB       ALA  67  -4.876 -12.433  -7.117
  479   2HB   ALA  67          2HB       ALA  67  -3.442 -12.271  -8.131
  480   3HB   ALA  67          1HB       ALA  67  -3.831 -13.825  -7.395
  481    H    ALA  68           H        ALA  68  -1.269 -10.824  -7.036
  482    HA   ALA  68           HA       ALA  68   1.013 -10.988  -7.557
  483   1HB   ALA  68          1HB       ALA  68   0.630 -12.324  -5.028
  484   2HB   ALA  68          3HB       ALA  68   1.878 -13.153  -5.956
  485   3HB   ALA  68          2HB       ALA  68   2.039 -11.433  -5.603
  486    H    ALA  69           H        ALA  69  -0.522 -12.227  -9.398
  487    HA   ALA  69           HA       ALA  69   0.532 -14.982  -9.747
  488   1HB   ALA  69          2HB       ALA  69  -1.913 -13.683 -10.423
  489   2HB   ALA  69          1HB       ALA  69  -1.126 -14.148 -11.930
  490   3HB   ALA  69          3HB       ALA  69  -1.469 -15.366 -10.701
  491    H    HIS  70           HN       HIS  70   1.392 -11.853 -10.553
  492    HA   HIS  70           HA       HIS  70   2.930 -12.846 -12.915
  493   1HB   HIS  70          2HB       HIS  70   0.938 -10.935 -13.025
  494   2HB   HIS  70          1HB       HIS  70   2.398  -9.957 -12.875
  495    HD1  HIS  70           HD1      HIS  70   0.416 -11.713 -15.335
  496    HD2  HIS  70           HD2      HIS  70   4.469 -10.842 -14.896
  497    HE1  HIS  70           HE1      HIS  70   1.468 -12.028 -17.618
   
  No H/Q in entry =         497
  Start of MODEL    9
    1   1H    GLU   1          1H        GLU   1  12.916  -7.835  -2.151
    2   2H    GLU   1          3H        GLU   1  11.718  -6.873  -2.866
    3   3H    GLU   1          2H        GLU   1  13.157  -6.162  -2.312
    4    HA   GLU   1           HA       GLU   1  12.585  -6.366  -0.094
    5   1HB   GLU   1          2HB       GLU   1  11.195  -4.688  -1.258
    6   2HB   GLU   1          1HB       GLU   1   9.993  -5.932  -1.610
    7   1HG   GLU   1          2HG       GLU   1   9.232  -4.752   0.344
    8   2HG   GLU   1          1HG       GLU   1   9.813  -6.326   0.885
    9    H    THR   2           H        THR   2  11.334  -7.435   1.594
   10    HA   THR   2           HA       THR   2  10.748 -10.233   0.925
   11    HB   THR   2           HB       THR   2  10.132  -9.179   3.631
   12    HG1  THR   2           HG1      THR   2  12.410  -9.139   4.077
   13   1HG2  THR   2          3HG2      THR   2  11.313 -11.600   2.350
   14   2HG2  THR   2          2HG2      THR   2  11.803 -11.230   4.003
   15   3HG2  THR   2          1HG2      THR   2  10.099 -11.482   3.624
   16    H    VAL   3           H        VAL   3   8.754 -10.485  -0.088
   17    HA   VAL   3           HA       VAL   3   6.511  -8.836   0.172
   18    HB   VAL   3           HB       VAL   3   6.268 -11.844  -0.010
   19   1HG1  VAL   3          1HG1      VAL   3   4.484  -9.633  -0.276
   20   2HG1  VAL   3          3HG1      VAL   3   4.701 -10.335  -1.880
   21   3HG1  VAL   3          2HG1      VAL   3   4.138 -11.342  -0.545
   22   1HG2  VAL   3          3HG2      VAL   3   7.813 -10.081  -1.695
   23   2HG2  VAL   3          2HG2      VAL   3   7.578 -11.823  -1.846
   24   3HG2  VAL   3          1HG2      VAL   3   6.439 -10.711  -2.604
   25    H    GLU   4           H        GLU   4   7.764 -11.206   2.423
   26    HA   GLU   4           HA       GLU   4   5.398 -11.460   4.051
   27   1HB   GLU   4          2HB       GLU   4   7.499 -12.948   4.060
   28   2HB   GLU   4          1HB       GLU   4   8.231 -11.697   5.069
   29   1HG   GLU   4          2HG       GLU   4   6.112 -11.916   6.537
   30   2HG   GLU   4          1HG       GLU   4   5.834 -13.429   5.677
   31    H    SER   5           H        SER   5   8.214  -9.279   4.206
   32    HA   SER   5           HA       SER   5   7.201  -7.963   6.604
   33   1HB   SER   5          2HB       SER   5   9.678  -8.158   5.734
   34   2HB   SER   5          1HB       SER   5   9.254  -6.739   4.782
   35    HG   SER   5           HG       SER   5   8.629  -5.728   6.741
   36    H    CYS   6           H        CYS   6   7.544  -6.993   3.170
   37    HA   CYS   6           HA       CYS   6   6.352  -4.473   3.337
   38   1HB   CYS   6          2HB       CYS   6   7.133  -5.069   1.194
   39   2HB   CYS   6          1HB       CYS   6   6.240  -6.589   1.190
   40    H    LEU   7           H        LEU   7   4.881  -7.657   3.554
   41    HA   LEU   7           HA       LEU   7   2.162  -6.528   3.577
   42   1HB   LEU   7          2HB       LEU   7   3.120  -9.363   4.067
   43   2HB   LEU   7          1HB       LEU   7   1.438  -8.862   3.861
   44    HG   LEU   7           HG       LEU   7   3.564  -8.319   1.781
   45   1HD1  LEU   7          1HD1      LEU   7   2.410 -10.836   2.501
   46   2HD1  LEU   7          3HD1      LEU   7   1.732 -10.344   0.949
   47   3HD1  LEU   7          2HD1      LEU   7   3.479 -10.473   1.147
   48   1HD2  LEU   7          2HD2      LEU   7   0.562  -8.134   1.944
   49   2HD2  LEU   7          1HD2      LEU   7   1.718  -6.909   1.418
   50   3HD2  LEU   7          3HD2      LEU   7   1.371  -8.296   0.385
   51    H    ALA   8           H        ALA   8   4.578  -7.700   5.806
   52    HA   ALA   8           HA       ALA   8   2.858  -7.778   8.137
   53   1HB   ALA   8          2HB       ALA   8   5.612  -8.324   7.550
   54   2HB   ALA   8          1HB       ALA   8   5.548  -7.184   8.894
   55   3HB   ALA   8          3HB       ALA   8   4.708  -8.730   9.010
   56    H    LYS   9           H        LYS   9   4.027  -5.345   6.188
   57    HA   LYS   9           HA       LYS   9   4.778  -3.161   7.694
   58   1HB   LYS   9          2HB       LYS   9   3.178  -3.639   5.211
   59   2HB   LYS   9          1HB       LYS   9   3.229  -2.001   5.826
   60   1HG   LYS   9          2HG       LYS   9   5.857  -2.694   6.032
   61   2HG   LYS   9          1HG       LYS   9   5.370  -3.636   4.625
   62   1HD   LYS   9          2HD       LYS   9   5.326  -1.802   3.330
   63   2HD   LYS   9          1HD       LYS   9   4.275  -0.966   4.475
   64   1HE   LYS   9          2HE       LYS   9   7.295  -1.168   4.630
   65   2HE   LYS   9          1HE       LYS   9   6.362   0.281   4.251
   66   1HZ   LYS   9          1HZ       LYS   9   5.531  -0.972   6.688
   67   2HZ   LYS   9          3HZ       LYS   9   7.159  -0.501   6.731
   68   3HZ   LYS   9          2HZ       LYS   9   5.952   0.646   6.392
   69    HA   PRO  10           HA       PRO  10   1.240  -1.844   9.999
   70   1HB   PRO  10          2HB       PRO  10   0.814   0.783   9.272
   71   2HB   PRO  10          1HB       PRO  10   2.128   0.255  10.337
   72   1HG   PRO  10          2HG       PRO  10   2.252   1.102   7.482
   73   2HG   PRO  10          1HG       PRO  10   3.505   1.177   8.732
   74   1HD   PRO  10          2HD       PRO  10   3.342  -0.745   6.682
   75   2HD   PRO  10          1HD       PRO  10   4.360  -0.871   8.130
   76    H    HIS  11           H        HIS  11   1.093  -2.230   6.739
   77    HA   HIS  11           HA       HIS  11  -0.620  -2.830   5.334
   78   1HB   HIS  11          2HB       HIS  11  -1.937  -2.809   7.954
   79   2HB   HIS  11          1HB       HIS  11  -3.024  -2.489   6.597
   80    HD1  HIS  11           HD1      HIS  11   0.037  -4.778   6.633
   81    HD2  HIS  11           HD2      HIS  11  -4.103  -5.011   6.157
   82    HE1  HIS  11           HE1      HIS  11  -0.479  -7.166   5.975
   83    H    THR  12           H        THR  12  -2.511  -2.012   4.324
   84    HA   THR  12           HA       THR  12  -2.553   0.052   2.867
   85    HB   THR  12           HB       THR  12  -4.490  -1.486   3.731
   86    HG1  THR  12           HG1      THR  12  -5.767  -0.517   2.293
   87   1HG2  THR  12          2HG2      THR  12  -5.174   1.216   4.892
   88   2HG2  THR  12          1HG2      THR  12  -6.324  -0.107   4.699
   89   3HG2  THR  12          3HG2      THR  12  -4.948  -0.288   5.788
   90    H    GLU  13           H        GLU  13  -3.533   0.803   6.259
   91    HA   GLU  13           HA       GLU  13  -3.846   3.535   5.968
   92   1HB   GLU  13          2HB       GLU  13  -3.826   2.035   8.142
   93   2HB   GLU  13          1HB       GLU  13  -2.157   2.595   8.273
   94   1HG   GLU  13          2HG       GLU  13  -3.484   4.928   7.677
   95   2HG   GLU  13          1HG       GLU  13  -4.670   4.081   8.674
   96    H    ASN  14           H        ASN  14  -2.584   4.537   4.477
   97    HA   ASN  14           HA       ASN  14  -0.145   5.734   5.142
   98   1HB   ASN  14          2HB       ASN  14   0.239   2.987   4.527
   99   2HB   ASN  14          1HB       ASN  14   0.823   3.897   3.133
  100   1HD2  ASN  14          2HD2      ASN  14   2.940   3.953   6.583
  101   2HD2  ASN  14          1HD2      ASN  14   1.533   3.018   6.417
  102    H    SER  15           H        SER  15   1.046   5.520   2.424
  103    HA   SER  15           HA       SER  15  -0.932   5.926   0.425
  104   1HB   SER  15          2HB       SER  15  -0.774   8.430   0.260
  105   2HB   SER  15          1HB       SER  15  -1.612   7.865   1.700
  106    HG   SER  15           HG       SER  15   1.003   8.893   1.433
  107    H    PHE  16           H        PHE  16   0.146   7.691  -1.254
  108    HA   PHE  16           HA       PHE  16   3.008   7.693  -1.403
  109   1HB   PHE  16          2HB       PHE  16   2.468   5.234  -1.775
  110   2HB   PHE  16          1HB       PHE  16   1.648   5.722  -3.258
  111    HD1  PHE  16           HD2      PHE  16   2.948   6.979  -5.023
  112    HD2  PHE  16           HD1      PHE  16   4.842   5.051  -1.687
  113    HE1  PHE  16           HE2      PHE  16   5.116   7.056  -6.214
  114    HE2  PHE  16           HE1      PHE  16   7.017   5.124  -2.881
  115    HZ   PHE  16           HZ       PHE  16   7.156   6.127  -5.146
  116    H    THR  17           H        THR  17   3.672   8.950  -3.291
  117    HA   THR  17           HA       THR  17   1.340  10.150  -4.698
  118    HB   THR  17           HB       THR  17   2.357  12.017  -3.892
  119    HG1  THR  17           HG1      THR  17   4.244  11.547  -5.943
  120   1HG2  THR  17          2HG2      THR  17   4.034  10.672  -2.620
  121   2HG2  THR  17          1HG2      THR  17   5.046  10.616  -4.063
  122   3HG2  THR  17          3HG2      THR  17   4.720  12.160  -3.276
  123    H    ASN  18           H        ASN  18   1.578  10.616  -7.021
  124    HA   ASN  18           HA       ASN  18   2.258  10.054  -9.209
  125   1HB   ASN  18          2HB       ASN  18   4.631   9.899  -7.767
  126   2HB   ASN  18          1HB       ASN  18   4.494   8.299  -8.500
  127   1HD2  ASN  18          2HD2      ASN  18   6.048  10.874 -10.880
  128   2HD2  ASN  18          1HD2      ASN  18   6.351  10.572  -9.238
  129    H    VAL  19           H        VAL  19   1.092   8.177  -6.862
  130    HA   VAL  19           HA       VAL  19   1.320   5.491  -7.375
  131    HB   VAL  19           HB       VAL  19  -1.243   7.061  -6.973
  132   1HG1  VAL  19          3HG1      VAL  19  -1.401   4.605  -7.780
  133   2HG1  VAL  19          2HG1      VAL  19  -0.776   4.188  -6.187
  134   3HG1  VAL  19          1HG1      VAL  19  -2.303   5.058  -6.340
  135   1HG2  VAL  19          2HG2      VAL  19   1.028   6.518  -5.287
  136   2HG2  VAL  19          1HG2      VAL  19  -0.427   7.443  -4.914
  137   3HG2  VAL  19          3HG2      VAL  19  -0.393   5.702  -4.635
  138    H    TRP  20           H        TRP  20   0.216   3.994  -8.777
  139    HA   TRP  20           HA       TRP  20  -0.924   5.222 -11.249
  140   1HB   TRP  20          2HB       TRP  20   0.491   4.067 -12.631
  141   2HB   TRP  20          1HB       TRP  20   1.536   4.032 -11.216
  142    HD1  TRP  20           HD1      TRP  20  -0.580   1.832 -13.436
  143    HE1  TRP  20           HE1      TRP  20  -0.320  -0.630 -12.716
  144    HE3  TRP  20           HE3      TRP  20   2.013   2.466  -9.089
  145    HZ2  TRP  20           HZ2      TRP  20   0.865  -2.131 -10.583
  146    HZ3  TRP  20           HZ3      TRP  20   2.699   0.511  -7.738
  147    HH2  TRP  20           HH2      TRP  20   2.126  -1.786  -8.476
  148    H    LYS  21           H        LYS  21  -1.803   2.984 -12.518
  149    HA   LYS  21           HA       LYS  21  -3.275   1.338 -10.545
  150   1HB   LYS  21          2HB       LYS  21  -4.775   3.253 -11.045
  151   2HB   LYS  21          1HB       LYS  21  -4.659   2.878 -12.767
  152   1HG   LYS  21          2HG       LYS  21  -5.338   0.436 -11.762
  153   2HG   LYS  21          1HG       LYS  21  -6.183   1.500 -10.638
  154   1HD   LYS  21          2HD       LYS  21  -7.731   1.142 -12.402
  155   2HD   LYS  21          1HD       LYS  21  -7.046   2.736 -12.726
  156   1HE   LYS  21          2HE       LYS  21  -5.432   0.625 -13.912
  157   2HE   LYS  21          1HE       LYS  21  -7.097   0.568 -14.492
  158   1HZ   LYS  21          2HZ       LYS  21  -6.886   3.022 -14.873
  159   2HZ   LYS  21          1HZ       LYS  21  -5.217   2.855 -14.595
  160   3HZ   LYS  21          3HZ       LYS  21  -5.944   2.045 -15.896
  161    H    ASP  22           H        ASP  22  -2.551  -0.636 -11.209
  162    HA   ASP  22           HA       ASP  22  -1.962  -1.142 -14.019
  163   1HB   ASP  22          2HB       ASP  22  -1.058  -2.183 -11.620
  164   2HB   ASP  22          1HB       ASP  22  -2.087  -3.470 -12.246
  165    H    ASP  23           H        ASP  23  -3.369  -1.939 -15.466
  166    HA   ASP  23           HA       ASP  23  -6.067  -2.717 -14.653
  167   1HB   ASP  23          2HB       ASP  23  -4.953  -1.735 -16.998
  168   2HB   ASP  23          1HB       ASP  23  -5.232  -3.436 -17.381
  169    H    LYS  24           H        LYS  24  -3.007  -4.182 -15.065
  170    HA   LYS  24           HA       LYS  24  -3.965  -6.900 -15.562
  171   1HB   LYS  24          2HB       LYS  24  -1.431  -5.499 -15.458
  172   2HB   LYS  24          1HB       LYS  24  -1.361  -6.949 -14.457
  173   1HG   LYS  24          2HG       LYS  24  -2.380  -6.931 -17.311
  174   2HG   LYS  24          1HG       LYS  24  -0.722  -7.337 -16.866
  175   1HD   LYS  24          2HD       LYS  24  -1.310  -9.401 -16.152
  176   2HD   LYS  24          1HD       LYS  24  -2.704  -8.782 -15.267
  177   1HE   LYS  24          2HE       LYS  24  -4.138  -9.102 -17.028
  178   2HE   LYS  24          1HE       LYS  24  -2.899  -8.757 -18.234
  179   1HZ   LYS  24          2HZ       LYS  24  -2.528 -11.156 -16.628
  180   2HZ   LYS  24          1HZ       LYS  24  -3.797 -11.194 -17.758
  181   3HZ   LYS  24          3HZ       LYS  24  -2.211 -10.890 -18.275
  182    H    THR  25           H        THR  25  -2.406  -5.192 -12.840
  183    HA   THR  25           HA       THR  25  -2.868  -7.272 -10.922
  184    HB   THR  25           HB       THR  25  -2.286  -5.623  -9.247
  185    HG1  THR  25           HG1      THR  25  -2.140  -3.378 -10.023
  186   1HG2  THR  25          2HG2      THR  25  -0.716  -6.136 -11.488
  187   2HG2  THR  25          1HG2      THR  25  -0.630  -4.386 -11.303
  188   3HG2  THR  25          3HG2      THR  25  -0.159  -5.435  -9.969
  189    H    LEU  26           H        LEU  26  -4.807  -4.725 -12.259
  190    HA   LEU  26           HA       LEU  26  -7.138  -4.399 -12.105
  191   1HB   LEU  26          2HB       LEU  26  -6.689  -7.087 -11.165
  192   2HB   LEU  26          1HB       LEU  26  -7.947  -6.325 -10.194
  193    HG   LEU  26           HG       LEU  26  -8.776  -7.498 -12.272
  194   1HD1  LEU  26          1HD1      LEU  26  -9.418  -4.897 -11.232
  195   2HD1  LEU  26          3HD1      LEU  26  -9.690  -4.899 -12.974
  196   3HD1  LEU  26          2HD1      LEU  26 -10.501  -6.087 -11.954
  197   1HD2  LEU  26          2HD2      LEU  26  -6.684  -6.473 -13.547
  198   2HD2  LEU  26          1HD2      LEU  26  -8.202  -6.765 -14.396
  199   3HD2  LEU  26          3HD2      LEU  26  -7.802  -5.141 -13.840
  200    H    ASP  27           H        ASP  27  -5.751  -2.640 -10.612
  201    HA   ASP  27           HA       ASP  27  -7.497  -1.843  -8.558
  202   1HB   ASP  27          2HB       ASP  27  -5.827  -4.081  -7.794
  203   2HB   ASP  27          1HB       ASP  27  -5.494  -2.680  -6.776
  204    H    ARG  28           H        ARG  28  -6.301  -0.380  -6.847
  205    HA   ARG  28           HA       ARG  28  -4.405   1.284  -8.379
  206   1HB   ARG  28          2HB       ARG  28  -6.381   1.933  -6.622
  207   2HB   ARG  28          1HB       ARG  28  -4.990   1.909  -5.537
  208   1HG   ARG  28          2HG       ARG  28  -4.845   4.090  -6.281
  209   2HG   ARG  28          1HG       ARG  28  -3.876   3.295  -7.524
  210   1HD   ARG  28          2HD       ARG  28  -5.457   4.738  -8.645
  211   2HD   ARG  28          1HD       ARG  28  -5.977   3.073  -8.903
  212    HE   ARG  28           HE       ARG  28  -7.207   4.355  -6.573
  213   1HH1  ARG  28          1HH2      ARG  28  -7.431   5.282  -9.724
  214   2HH1  ARG  28          2HH2      ARG  28  -9.088   4.832  -9.956
  215   1HH2  ARG  28          2HH1      ARG  28  -9.315   3.096  -6.963
  216   2HH2  ARG  28          1HH1      ARG  28 -10.153   3.596  -8.395
  217    H    TYR  29           H        TYR  29  -2.220   1.678  -7.619
  218    HA   TYR  29           HA       TYR  29  -1.299   0.082  -5.316
  219   1HB   TYR  29          2HB       TYR  29  -0.322  -0.419  -8.140
  220   2HB   TYR  29          1HB       TYR  29   0.463  -1.045  -6.691
  221    HD1  TYR  29           HD1      TYR  29  -2.552  -1.215  -8.809
  222    HD2  TYR  29           HD2      TYR  29  -0.552  -2.801  -5.355
  223    HE1  TYR  29           HE1      TYR  29  -4.151  -3.110  -8.754
  224    HE2  TYR  29           HE2      TYR  29  -2.150  -4.697  -5.300
  225    HH   TYR  29           HH       TYR  29  -4.616  -5.045  -6.158
  226    H    ALA  30           H        ALA  30   0.710   0.763  -4.514
  227    HA   ALA  30           HA       ALA  30   1.902   3.157  -5.857
  228   1HB   ALA  30          3HB       ALA  30   0.947   2.798  -3.046
  229   2HB   ALA  30          2HB       ALA  30   2.402   3.759  -3.303
  230   3HB   ALA  30          1HB       ALA  30   0.888   4.228  -4.075
  231    H    ASN  31           H        ASN  31   3.954   2.628  -6.410
  232    HA   ASN  31           HA       ASN  31   5.342   0.365  -5.258
  233   1HB   ASN  31          2HB       ASN  31   6.816   2.507  -6.743
  234   2HB   ASN  31          1HB       ASN  31   6.971   0.755  -6.861
  235   1HD2  ASN  31          2HD2      ASN  31   4.486   0.434  -9.367
  236   2HD2  ASN  31          1HD2      ASN  31   5.520  -0.380  -8.296
  237    H    TYR  32           H        TYR  32   5.941   0.521  -3.134
  238    HA   TYR  32           HA       TYR  32   6.970   3.076  -2.077
  239   1HB   TYR  32          2HB       TYR  32   5.486   1.183  -0.896
  240   2HB   TYR  32          1HB       TYR  32   7.082   0.562  -0.477
  241    HD1  TYR  32           HD2      TYR  32   8.797   2.544   0.257
  242    HD2  TYR  32           HD1      TYR  32   4.519   2.641   0.638
  243    HE1  TYR  32           HE2      TYR  32   8.994   4.252   2.044
  244    HE2  TYR  32           HE1      TYR  32   4.717   4.349   2.424
  245    HH   TYR  32           HH       TYR  32   7.537   5.005   4.037
  246    H    GLU  33           H        GLU  33   8.604   2.278  -4.072
  247    HA   GLU  33           HA       GLU  33  10.755   1.480  -4.628
  248   1HB   GLU  33          2HB       GLU  33  11.136   2.864  -1.960
  249   2HB   GLU  33          1HB       GLU  33  12.472   2.372  -2.999
  250   1HG   GLU  33          2HG       GLU  33  12.073   4.630  -3.594
  251   2HG   GLU  33          1HG       GLU  33  11.272   3.699  -4.859
  252    H    GLY  34           H        GLY  34   9.264  -0.651  -3.542
  253   1HA   GLY  34          2HA       GLY  34  10.886  -2.717  -3.123
  254   2HA   GLY  34          1HA       GLY  34  11.066  -1.926  -1.558
  255    H    CYS  35           H        CYS  35   8.236  -1.004  -1.537
  256    HA   CYS  35           HA       CYS  35   6.889  -3.658  -1.220
  257   1HB   CYS  35          2HB       CYS  35   7.445  -2.964   1.005
  258   2HB   CYS  35          1HB       CYS  35   6.936  -1.309   0.684
  259    H    LEU  36           H        LEU  36   5.372  -3.638  -2.808
  260    HA   LEU  36           HA       LEU  36   4.098  -1.166  -3.688
  261   1HB   LEU  36          2HB       LEU  36   4.517  -3.066  -5.238
  262   2HB   LEU  36          1HB       LEU  36   3.365  -4.036  -4.327
  263    HG   LEU  36           HG       LEU  36   1.684  -2.153  -4.744
  264   1HD1  LEU  36          2HD1      LEU  36   3.770  -0.709  -5.559
  265   2HD1  LEU  36          1HD1      LEU  36   3.357  -1.435  -7.113
  266   3HD1  LEU  36          3HD1      LEU  36   2.166  -0.466  -6.245
  267   1HD2  LEU  36          3HD2      LEU  36   2.202  -4.428  -6.100
  268   2HD2  LEU  36          2HD2      LEU  36   0.907  -3.322  -6.560
  269   3HD2  LEU  36          1HD2      LEU  36   2.461  -3.258  -7.392
  270    H    TRP  37           H        TRP  37   2.136  -0.390  -3.073
  271    HA   TRP  37           HA       TRP  37   0.628  -1.966  -1.040
  272   1HB   TRP  37          2HB       TRP  37   0.499   1.022  -1.601
  273   2HB   TRP  37          1HB       TRP  37  -0.329   0.157  -0.315
  274    HD1  TRP  37           HD1      TRP  37   3.374   0.157  -1.461
  275    HE1  TRP  37           HE1      TRP  37   4.835   0.454   0.647
  276    HE3  TRP  37           HE3      TRP  37  -0.265   0.567   2.100
  277    HZ2  TRP  37           HZ2      TRP  37   4.503   0.822   3.460
  278    HZ3  TRP  37           HZ3      TRP  37   0.328   0.878   4.476
  279    HH2  TRP  37           HH2      TRP  37   2.710   1.013   5.165
  280    H    ASN  38           H        ASN  38  -1.868  -1.340  -1.197
  281    HA   ASN  38           HA       ASN  38  -2.657  -1.110  -4.061
  282   1HB   ASN  38          2HB       ASN  38  -2.664  -3.474  -3.775
  283   2HB   ASN  38          1HB       ASN  38  -3.362  -3.356  -2.161
  284   1HD2  ASN  38          2HD2      ASN  38  -6.696  -2.784  -3.394
  285   2HD2  ASN  38          1HD2      ASN  38  -5.669  -2.455  -2.085
  286    H    ALA  39           H        ALA  39  -4.133   0.473  -4.195
  287    HA   ALA  39           HA       ALA  39  -5.720   1.187  -1.794
  288   1HB   ALA  39          2HB       ALA  39  -4.482   2.701  -3.831
  289   2HB   ALA  39          1HB       ALA  39  -6.218   2.865  -4.096
  290   3HB   ALA  39          3HB       ALA  39  -5.519   3.305  -2.538
  291    H    THR  40           H        THR  40  -7.951   1.067  -1.772
  292    HA   THR  40           HA       THR  40  -9.335   0.126  -4.229
  293    HB   THR  40           HB       THR  40  -8.904  -1.939  -3.111
  294    HG1  THR  40           HG1      THR  40 -11.348  -1.550  -1.923
  295   1HG2  THR  40          1HG2      THR  40  -8.348  -0.615  -0.916
  296   2HG2  THR  40          3HG2      THR  40 -10.043  -0.911  -0.526
  297   3HG2  THR  40          2HG2      THR  40  -8.950  -2.268  -0.796
  298    H    GLY  41           H        GLY  41  -9.635   1.279  -0.873
  299   1HA   GLY  41          2HA       GLY  41 -12.421   2.096  -1.295
  300   2HA   GLY  41          1HA       GLY  41 -11.471   2.367   0.167
  301    H    VAL  42           H        VAL  42 -12.862   4.501  -0.457
  302    HA   VAL  42           HA       VAL  42 -12.042   6.297  -2.435
  303    HB   VAL  42           HB       VAL  42 -12.940   6.754   0.416
  304   1HG1  VAL  42          2HG1      VAL  42 -11.690   8.646  -1.427
  305   2HG1  VAL  42          1HG1      VAL  42 -13.319   9.140  -0.971
  306   3HG1  VAL  42          3HG1      VAL  42 -12.106   8.851   0.274
  307   1HG2  VAL  42          1HG2      VAL  42 -14.388   5.898  -1.630
  308   2HG2  VAL  42          3HG2      VAL  42 -15.041   7.100  -0.518
  309   3HG2  VAL  42          2HG2      VAL  42 -14.379   7.604  -2.074
  310    H    VAL  43           H        VAL  43 -10.108   7.223  -2.880
  311    HA   VAL  43           HA       VAL  43  -8.154   7.530  -0.638
  312    HB   VAL  43           HB       VAL  43  -7.163   7.058  -3.421
  313   1HG1  VAL  43          3HG1      VAL  43  -6.262   6.348  -0.615
  314   2HG1  VAL  43          2HG1      VAL  43  -5.413   5.824  -2.069
  315   3HG1  VAL  43          1HG1      VAL  43  -5.542   7.542  -1.695
  316   1HG2  VAL  43          1HG2      VAL  43  -8.201   4.886  -1.570
  317   2HG2  VAL  43          3HG2      VAL  43  -8.846   5.293  -3.160
  318   3HG2  VAL  43          2HG2      VAL  43  -7.232   4.596  -3.014
  319    H    VAL  44           H        VAL  44  -7.822   9.670  -0.345
  320    HA   VAL  44           HA       VAL  44  -8.654  11.725  -2.100
  321    HB   VAL  44           HB       VAL  44  -6.555  11.682   0.077
  322   1HG1  VAL  44          1HG1      VAL  44  -7.577  13.960  -1.627
  323   2HG1  VAL  44          3HG1      VAL  44  -6.866  14.225  -0.035
  324   3HG1  VAL  44          2HG1      VAL  44  -5.902  13.498  -1.322
  325   1HG2  VAL  44          3HG2      VAL  44  -9.080  11.357   0.524
  326   2HG2  VAL  44          2HG2      VAL  44  -8.252  12.611   1.447
  327   3HG2  VAL  44          1HG2      VAL  44  -9.248  13.050   0.059
  328    H    CYS  45           H        CYS  45  -7.905  11.380  -4.250
  329    HA   CYS  45           HA       CYS  45  -4.950  11.352  -4.629
  330   1HB   CYS  45          2HB       CYS  45  -7.107  10.968  -6.724
  331   2HB   CYS  45          1HB       CYS  45  -5.383  10.641  -6.904
  332    H    THR  46           H        THR  46  -3.925  13.153  -5.385
  333    HA   THR  46           HA       THR  46  -5.618  15.328  -6.539
  334    HB   THR  46           HB       THR  46  -5.033  16.053  -4.324
  335    HG1  THR  46           HG1      THR  46  -4.701  17.720  -5.675
  336   1HG2  THR  46          2HG2      THR  46  -2.456  14.731  -5.006
  337   2HG2  THR  46          1HG2      THR  46  -2.371  16.149  -3.961
  338   3HG2  THR  46          3HG2      THR  46  -3.338  14.756  -3.480
  339    H    GLY  47           H        GLY  47  -4.303  16.853  -7.893
  340   1HA   GLY  47          2HA       GLY  47  -2.815  17.239  -9.659
  341   2HA   GLY  47          1HA       GLY  47  -1.674  16.209  -8.796
  342    H    ASP  48           H        ASP  48  -4.542  16.033 -10.924
  343    HA   ASP  48           HA       ASP  48  -5.064  14.455 -12.594
  344   1HB   ASP  48          2HB       ASP  48  -2.089  14.281 -12.346
  345   2HB   ASP  48          1HB       ASP  48  -2.918  13.002 -13.231
  346    H    GLU  49           H        GLU  49  -4.661  13.811  -9.531
  347    HA   GLU  49           HA       GLU  49  -5.164  11.983  -8.183
  348   1HB   GLU  49          2HB       GLU  49  -6.130  11.125 -10.868
  349   2HB   GLU  49          1HB       GLU  49  -5.896   9.857  -9.665
  350   1HG   GLU  49          2HG       GLU  49  -7.723  10.499  -8.509
  351   2HG   GLU  49          1HG       GLU  49  -7.222  12.190  -8.529
  352    H    THR  50           H        THR  50  -2.578  12.207 -10.156
  353    HA   THR  50           HA       THR  50  -1.500   9.545 -10.146
  354    HB   THR  50           HB       THR  50   0.734  11.079 -10.089
  355    HG1  THR  50           HG1      THR  50  -0.966  12.800 -11.438
  356   1HG2  THR  50          1HG2      THR  50  -0.474   9.610 -11.938
  357   2HG2  THR  50          3HG2      THR  50  -0.902  11.191 -12.591
  358   3HG2  THR  50          2HG2      THR  50   0.794  10.754 -12.379
  359    H    GLN  51           H        GLN  51  -1.510  12.199  -7.812
  360    HA   GLN  51           HA       GLN  51   0.069  10.505  -5.944
  361   1HB   GLN  51          2HB       GLN  51  -0.884  13.288  -5.306
  362   2HB   GLN  51          1HB       GLN  51   0.561  12.456  -4.734
  363   1HG   GLN  51          2HG       GLN  51   1.660  13.654  -6.314
  364   2HG   GLN  51          1HG       GLN  51   0.956  12.516  -7.463
  365   1HE2  GLN  51          2HE2      GLN  51  -1.083  16.065  -6.984
  366   2HE2  GLN  51          1HE2      GLN  51  -0.420  15.306  -5.618
  367    H    CYS  52           H        CYS  52  -0.920   9.957  -3.862
  368    HA   CYS  52           HA       CYS  52  -3.646  10.833  -3.404
  369   1HB   CYS  52          2HB       CYS  52  -3.651   8.978  -5.246
  370   2HB   CYS  52          1HB       CYS  52  -3.394   7.883  -3.890
  371    H    TYR  53           H        TYR  53  -4.625   9.764  -1.475
  372    HA   TYR  53           HA       TYR  53  -2.708   8.379   0.293
  373   1HB   TYR  53          2HB       TYR  53  -2.218  10.436   1.214
  374   2HB   TYR  53          1HB       TYR  53  -3.730  11.153   0.670
  375    HD1  TYR  53           HD1      TYR  53  -2.349   8.706   3.155
  376    HD2  TYR  53           HD2      TYR  53  -5.520  11.432   2.169
  377    HE1  TYR  53           HE1      TYR  53  -3.326   8.383   5.411
  378    HE2  TYR  53           HE2      TYR  53  -6.496  11.111   4.425
  379    HH   TYR  53           HH       TYR  53  -5.373   8.637   6.576
  380    H    GLY  54           H        GLY  54  -3.796   7.264   2.053
  381   1HA   GLY  54          2HA       GLY  54  -6.298   7.196   2.992
  382   2HA   GLY  54          1HA       GLY  54  -6.600   6.607   1.355
  383    H    THR  55           H        THR  55  -6.739   4.419   1.334
  384    HA   THR  55           HA       THR  55  -4.927   2.909   3.181
  385    HB   THR  55           HB       THR  55  -6.684   1.034   2.787
  386    HG1  THR  55           HG1      THR  55  -8.175   1.616   1.450
  387   1HG2  THR  55          2HG2      THR  55  -6.614   3.288   4.588
  388   2HG2  THR  55          1HG2      THR  55  -8.279   2.778   4.311
  389   3HG2  THR  55          3HG2      THR  55  -7.092   1.621   4.909
  390    H    TRP  56           H        TRP  56  -3.486   1.641   2.271
  391    HA   TRP  56           HA       TRP  56  -3.793   0.793  -0.563
  392   1HB   TRP  56          2HB       TRP  56  -1.254   1.670   0.785
  393   2HB   TRP  56          1HB       TRP  56  -1.482   1.301  -0.927
  394    HD1  TRP  56           HD1      TRP  56  -2.633   3.872   1.701
  395    HE1  TRP  56           HE1      TRP  56  -3.223   6.051   0.462
  396    HE3  TRP  56           HE3      TRP  56  -2.000   2.304  -3.091
  397    HZ2  TRP  56           HZ2      TRP  56  -3.399   7.000  -2.258
  398    HZ3  TRP  56           HZ3      TRP  56  -2.387   3.834  -4.990
  399    HH2  TRP  56           HH2      TRP  56  -3.083   6.186  -4.588
  400    H    VAL  57           H        VAL  57  -4.523  -1.226   0.863
  401    HA   VAL  57           HA       VAL  57  -2.864  -2.585   2.616
  402    HB   VAL  57           HB       VAL  57  -4.906  -3.640   2.316
  403   1HG1  VAL  57          1HG1      VAL  57  -4.431  -3.068  -0.585
  404   2HG1  VAL  57          3HG1      VAL  57  -5.596  -4.311  -0.128
  405   3HG1  VAL  57          2HG1      VAL  57  -5.813  -2.649   0.427
  406   1HG2  VAL  57          2HG2      VAL  57  -2.909  -5.266   2.078
  407   2HG2  VAL  57          1HG2      VAL  57  -4.496  -5.856   1.587
  408   3HG2  VAL  57          3HG2      VAL  57  -3.335  -5.331   0.368
  409    HA   PRO  58           HA       PRO  58   0.774  -3.323   0.189
  410   1HB   PRO  58          2HB       PRO  58   2.042  -4.922   2.069
  411   2HB   PRO  58          1HB       PRO  58   2.030  -3.149   2.102
  412   1HG   PRO  58          2HG       PRO  58   0.478  -5.071   3.774
  413   2HG   PRO  58          1HG       PRO  58   1.013  -3.419   4.161
  414   1HD   PRO  58          2HD       PRO  58  -1.606  -4.143   3.411
  415   2HD   PRO  58          1HD       PRO  58  -0.943  -2.496   3.366
  416    H    ILE  59           H        ILE  59   1.179  -4.860  -1.351
  417    HA   ILE  59           HA       ILE  59   0.184  -7.630  -0.866
  418    HB   ILE  59           HB       ILE  59  -0.638  -7.687  -3.210
  419   1HG1  ILE  59          2HG1      ILE  59   0.892  -5.783  -3.935
  420   2HG1  ILE  59          1HG1      ILE  59  -0.760  -5.707  -4.542
  421   1HG2  ILE  59          2HG2      ILE  59  -2.156  -7.151  -1.303
  422   2HG2  ILE  59          1HG2      ILE  59  -1.840  -5.437  -1.564
  423   3HG2  ILE  59          3HG2      ILE  59  -2.665  -6.380  -2.804
  424   1HD1  ILE  59          2HD1      ILE  59  -0.868  -4.355  -2.094
  425   2HD1  ILE  59          1HD1      ILE  59   0.655  -3.844  -2.814
  426   3HD1  ILE  59          3HD1      ILE  59  -0.848  -3.620  -3.696
  427    H    GLY  60           H        GLY  60   2.503  -5.516  -2.522
  428   1HA   GLY  60          2HA       GLY  60   4.108  -7.973  -3.021
  429   2HA   GLY  60          1HA       GLY  60   3.741  -6.938  -4.392
  430    H    LEU  61           H        LEU  61   5.937  -6.468  -4.753
  431    HA   LEU  61           HA       LEU  61   7.306  -4.940  -2.596
  432   1HB   LEU  61          2HB       LEU  61   8.618  -5.898  -5.133
  433   2HB   LEU  61          1HB       LEU  61   9.357  -5.561  -3.568
  434    HG   LEU  61           HG       LEU  61   7.442  -7.841  -4.156
  435   1HD1  LEU  61          3HD1      LEU  61  10.266  -7.570  -4.534
  436   2HD1  LEU  61          2HD1      LEU  61   9.992  -8.682  -3.193
  437   3HD1  LEU  61          1HD1      LEU  61   9.265  -9.003  -4.767
  438   1HD2  LEU  61          2HD2      LEU  61   7.828  -6.561  -1.759
  439   2HD2  LEU  61          1HD2      LEU  61   7.362  -8.255  -1.920
  440   3HD2  LEU  61          3HD2      LEU  61   9.057  -7.825  -1.686
  441    H    ALA  62           H        ALA  62   6.084  -4.679  -5.911
  442    HA   ALA  62           HA       ALA  62   5.865  -1.876  -5.809
  443   1HB   ALA  62          3HB       ALA  62   8.552  -2.868  -6.692
  444   2HB   ALA  62          2HB       ALA  62   7.885  -1.409  -7.427
  445   3HB   ALA  62          1HB       ALA  62   8.148  -1.477  -5.685
  446    H    ILE  63           H        ILE  63   4.216  -3.770  -6.982
  447    HA   ILE  63           HA       ILE  63   3.419  -2.771  -9.368
  448    HB   ILE  63           HB       ILE  63   5.975  -4.086  -9.809
  449   1HG1  ILE  63          2HG1      ILE  63   5.478  -1.826 -10.552
  450   2HG1  ILE  63          1HG1      ILE  63   5.720  -2.834 -11.977
  451   1HG2  ILE  63          2HG2      ILE  63   4.551  -5.990 -10.525
  452   2HG2  ILE  63          1HG2      ILE  63   3.687  -4.912 -11.621
  453   3HG2  ILE  63          3HG2      ILE  63   5.398  -5.253 -11.885
  454   1HD1  ILE  63          1HD1      ILE  63   2.956  -2.982 -11.229
  455   2HD1  ILE  63          3HD1      ILE  63   3.420  -1.280 -11.300
  456   3HD1  ILE  63          2HD1      ILE  63   3.652  -2.319 -12.707
  457    HA   PRO  64           HA       PRO  64   2.091  -7.378  -9.430
  458   1HB   PRO  64          2HB       PRO  64   2.627  -8.811  -7.127
  459   2HB   PRO  64          1HB       PRO  64   3.601  -8.866  -8.611
  460   1HG   PRO  64          2HG       PRO  64   4.177  -7.491  -6.036
  461   2HG   PRO  64          1HG       PRO  64   5.303  -8.094  -7.257
  462   1HD   PRO  64          2HD       PRO  64   4.598  -5.413  -6.889
  463   2HD   PRO  64          1HD       PRO  64   5.374  -6.069  -8.341
  464    H    GLU  65           H        GLU  65   0.091  -8.152  -8.715
  465    HA   GLU  65           HA       GLU  65  -1.410  -6.284  -7.049
  466   1HB   GLU  65          2HB       GLU  65  -3.347  -7.409  -7.849
  467   2HB   GLU  65          1HB       GLU  65  -2.215  -7.453  -9.198
  468   1HG   GLU  65          2HG       GLU  65  -1.566  -9.731  -7.746
  469   2HG   GLU  65          1HG       GLU  65  -3.325  -9.667  -7.650
  470    H    ASN  66           H        ASN  66  -3.302  -8.157  -6.001
  471    HA   ASN  66           HA       ASN  66  -1.793  -9.077  -3.621
  472   1HB   ASN  66          2HB       ASN  66  -3.919  -7.658  -3.484
  473   2HB   ASN  66          1HB       ASN  66  -4.791  -9.088  -4.037
  474   1HD2  ASN  66          2HD2      ASN  66  -4.956 -10.358  -0.766
  475   2HD2  ASN  66          1HD2      ASN  66  -5.688 -10.178  -2.286
  476    H    ALA  67           H        ALA  67  -1.530 -10.574  -6.096
  477    HA   ALA  67           HA       ALA  67  -2.250 -13.215  -5.073
  478   1HB   ALA  67          2HB       ALA  67  -4.090 -11.917  -6.776
  479   2HB   ALA  67          1HB       ALA  67  -3.259 -13.105  -7.781
  480   3HB   ALA  67          3HB       ALA  67  -4.088 -13.618  -6.311
  481    H    ALA  68           H        ALA  68  -1.489 -11.686  -8.232
  482    HA   ALA  68           HA       ALA  68   1.223 -12.473  -8.323
  483   1HB   ALA  68          3HB       ALA  68  -0.533 -14.685  -8.598
  484   2HB   ALA  68          2HB       ALA  68   0.142 -14.370 -10.195
  485   3HB   ALA  68          1HB       ALA  68   1.214 -14.666  -8.827
  486    H    ALA  69           H        ALA  69   2.180 -11.678 -10.201
  487    HA   ALA  69           HA       ALA  69   0.349 -10.266 -12.061
  488   1HB   ALA  69          2HB       ALA  69   2.451  -9.232 -10.892
  489   2HB   ALA  69          1HB       ALA  69   3.354 -10.090 -12.141
  490   3HB   ALA  69          3HB       ALA  69   2.162  -8.873 -12.595
  491    H    HIS  70           HN       HIS  70   2.573 -10.297 -14.118
  492    HA   HIS  70           HA       HIS  70   2.370 -13.143 -14.990
  493   1HB   HIS  70          2HB       HIS  70   2.017 -12.193 -17.349
  494   2HB   HIS  70          1HB       HIS  70   0.640 -12.099 -16.250
  495    HD1  HIS  70           HD1      HIS  70   2.417 -10.058 -18.551
  496    HD2  HIS  70           HD2      HIS  70   0.801  -9.387 -14.767
  497    HE1  HIS  70           HE1      HIS  70   2.165  -7.549 -18.314
   
  No H/Q in entry =         497
  Start of MODEL   10
    1   1H    GLU   1          2H        GLU   1  13.649  -7.011   0.870
    2   2H    GLU   1          1H        GLU   1  13.396  -6.875  -0.803
    3   3H    GLU   1          3H        GLU   1  13.922  -5.531   0.081
    4    HA   GLU   1           HA       GLU   1  11.895  -5.067   0.921
    5   1HB   GLU   1          2HB       GLU   1  10.360  -5.093  -0.833
    6   2HB   GLU   1          1HB       GLU   1  11.877  -5.330  -1.692
    7   1HG   GLU   1          2HG       GLU   1  10.160  -7.656  -0.779
    8   2HG   GLU   1          1HG       GLU   1   9.951  -6.885  -2.347
    9    H    THR   2           H        THR   2  12.123  -8.521   0.152
   10    HA   THR   2           HA       THR   2  11.081 -10.371   1.157
   11    HB   THR   2           HB       THR   2  10.633  -8.862   3.675
   12    HG1  THR   2           HG1      THR   2  12.584  -8.136   3.778
   13   1HG2  THR   2          1HG2      THR   2  10.420 -11.351   3.411
   14   2HG2  THR   2          3HG2      THR   2  12.148 -11.412   3.064
   15   3HG2  THR   2          2HG2      THR   2  11.583 -10.866   4.643
   16    H    VAL   3           H        VAL   3   9.112 -10.346  -0.048
   17    HA   VAL   3           HA       VAL   3   6.936  -8.637   0.305
   18    HB   VAL   3           HB       VAL   3   7.224 -10.592  -1.355
   19   1HG1  VAL   3          3HG1      VAL   3   7.439 -12.232   0.647
   20   2HG1  VAL   3          2HG1      VAL   3   5.680 -12.132   0.728
   21   3HG1  VAL   3          1HG1      VAL   3   6.464 -12.735  -0.733
   22   1HG2  VAL   3          1HG2      VAL   3   4.965  -9.215  -0.364
   23   2HG2  VAL   3          3HG2      VAL   3   5.121 -10.023  -1.923
   24   3HG2  VAL   3          2HG2      VAL   3   4.469 -10.899  -0.537
   25    H    GLU   4           H        GLU   4   8.140 -11.079   2.470
   26    HA   GLU   4           HA       GLU   4   5.764 -11.497   4.015
   27   1HB   GLU   4          2HB       GLU   4   7.750 -12.935   4.243
   28   2HB   GLU   4          1HB       GLU   4   8.669 -11.574   4.890
   29   1HG   GLU   4          2HG       GLU   4   7.038 -11.399   6.763
   30   2HG   GLU   4          1HG       GLU   4   6.200 -12.819   6.137
   31    H    SER   5           H        SER   5   8.455  -9.177   4.401
   32    HA   SER   5           HA       SER   5   7.132  -7.844   6.639
   33   1HB   SER   5          2HB       SER   5   9.686  -7.580   5.161
   34   2HB   SER   5          1HB       SER   5   9.041  -6.080   5.821
   35    HG   SER   5           HG       SER   5   9.650  -6.754   7.704
   36    H    CYS   6           H        CYS   6   7.787  -7.031   3.216
   37    HA   CYS   6           HA       CYS   6   6.552  -4.496   3.166
   38   1HB   CYS   6          2HB       CYS   6   6.645  -6.675   1.058
   39   2HB   CYS   6          1HB       CYS   6   5.993  -5.067   0.745
   40    H    LEU   7           H        LEU   7   5.188  -7.671   3.479
   41    HA   LEU   7           HA       LEU   7   2.442  -6.621   3.055
   42   1HB   LEU   7          2HB       LEU   7   3.475  -9.448   3.428
   43   2HB   LEU   7          1HB       LEU   7   1.781  -9.023   3.168
   44    HG   LEU   7           HG       LEU   7   4.076  -8.431   1.278
   45   1HD1  LEU   7          1HD1      LEU   7   1.763 -10.379   1.201
   46   2HD1  LEU   7          3HD1      LEU   7   2.667  -9.917  -0.241
   47   3HD1  LEU   7          2HD1      LEU   7   3.487 -10.738   1.086
   48   1HD2  LEU   7          2HD2      LEU   7   1.149  -7.681   1.257
   49   2HD2  LEU   7          1HD2      LEU   7   2.549  -6.615   1.118
   50   3HD2  LEU   7          3HD2      LEU   7   2.128  -7.697  -0.210
   51    H    ALA   8           H        ALA   8   4.654  -7.623   5.503
   52    HA   ALA   8           HA       ALA   8   2.613  -7.832   7.611
   53   1HB   ALA   8          3HB       ALA   8   4.977  -9.026   7.475
   54   2HB   ALA   8          2HB       ALA   8   5.549  -7.512   8.175
   55   3HB   ALA   8          1HB       ALA   8   4.352  -8.483   9.031
   56    H    LYS   9           H        LYS   9   3.807  -5.428   5.827
   57    HA   LYS   9           HA       LYS   9   4.759  -3.317   7.311
   58   1HB   LYS   9          2HB       LYS   9   3.175  -3.779   4.885
   59   2HB   LYS   9          1HB       LYS   9   2.894  -2.195   5.581
   60   1HG   LYS   9          2HG       LYS   9   5.363  -1.819   5.635
   61   2HG   LYS   9          1HG       LYS   9   5.585  -3.394   4.872
   62   1HD   LYS   9          2HD       LYS   9   4.680  -2.698   2.846
   63   2HD   LYS   9          1HD       LYS   9   3.769  -1.386   3.590
   64   1HE   LYS   9          2HE       LYS   9   6.740  -1.510   3.052
   65   2HE   LYS   9          1HE       LYS   9   5.578  -0.333   2.442
   66   1HZ   LYS   9          2HZ       LYS   9   5.245  -0.046   5.063
   67   2HZ   LYS   9          1HZ       LYS   9   6.888  -0.480   5.030
   68   3HZ   LYS   9          3HZ       LYS   9   6.352   0.872   4.159
   69    HA   PRO  10           HA       PRO  10   1.439  -1.813   9.838
   70   1HB   PRO  10          2HB       PRO  10   1.041   0.809   9.081
   71   2HB   PRO  10          1HB       PRO  10   2.427   0.265  10.044
   72   1HG   PRO  10          2HG       PRO  10   2.325   1.027   7.162
   73   2HG   PRO  10          1HG       PRO  10   3.682   1.112   8.298
   74   1HD   PRO  10          2HD       PRO  10   3.311  -0.859   6.332
   75   2HD   PRO  10          1HD       PRO  10   4.433  -0.977   7.700
   76    H    HIS  11           H        HIS  11   1.025  -2.288   6.615
   77    HA   HIS  11           HA       HIS  11  -0.808  -2.821   5.335
   78   1HB   HIS  11          2HB       HIS  11  -1.991  -2.627   8.034
   79   2HB   HIS  11          1HB       HIS  11  -3.111  -2.434   6.680
   80    HD1  HIS  11           HD1      HIS  11  -4.195  -4.716   6.648
   81    HD2  HIS  11           HD2      HIS  11  -0.023  -4.967   6.660
   82    HE1  HIS  11           HE1      HIS  11  -3.619  -7.154   6.274
   83    H    THR  12           H        THR  12  -2.667  -1.918   4.365
   84    HA   THR  12           HA       THR  12  -2.674   0.181   2.945
   85    HB   THR  12           HB       THR  12  -4.647  -1.306   3.830
   86    HG1  THR  12           HG1      THR  12  -5.896  -0.296   2.407
   87   1HG2  THR  12          1HG2      THR  12  -5.201   1.406   5.037
   88   2HG2  THR  12          3HG2      THR  12  -6.417   0.145   4.837
   89   3HG2  THR  12          2HG2      THR  12  -5.040  -0.122   5.904
   90    H    GLU  13           H        GLU  13  -3.559   0.888   6.375
   91    HA   GLU  13           HA       GLU  13  -3.761   3.645   6.129
   92   1HB   GLU  13          2HB       GLU  13  -3.974   2.303   8.282
   93   2HB   GLU  13          1HB       GLU  13  -2.213   2.350   8.393
   94   1HG   GLU  13          2HG       GLU  13  -2.943   5.000   7.858
   95   2HG   GLU  13          1HG       GLU  13  -4.147   4.433   9.019
   96    H    ASN  14           H        ASN  14  -2.447   4.598   4.654
   97    HA   ASN  14           HA       ASN  14   0.061   5.640   5.346
   98   1HB   ASN  14          2HB       ASN  14   0.220   2.879   4.559
   99   2HB   ASN  14          1HB       ASN  14   0.978   3.859   3.306
  100   1HD2  ASN  14          2HD2      ASN  14   3.792   4.639   5.282
  101   2HD2  ASN  14          1HD2      ASN  14   3.026   4.760   3.771
  102    H    SER  15           H        SER  15   1.216   5.483   2.617
  103    HA   SER  15           HA       SER  15  -0.747   6.003   0.639
  104   1HB   SER  15          2HB       SER  15  -1.481   7.915   1.816
  105   2HB   SER  15          1HB       SER  15   0.156   8.377   2.268
  106    HG   SER  15           HG       SER  15   0.461   9.228   0.337
  107    H    PHE  16           H        PHE  16   0.243   7.411  -1.183
  108    HA   PHE  16           HA       PHE  16   3.141   7.604  -1.255
  109   1HB   PHE  16          2HB       PHE  16   2.673   5.129  -1.568
  110   2HB   PHE  16          1HB       PHE  16   1.835   5.557  -3.061
  111    HD1  PHE  16           HD1      PHE  16   5.115   5.433  -1.363
  112    HD2  PHE  16           HD2      PHE  16   3.023   6.389  -4.986
  113    HE1  PHE  16           HE1      PHE  16   7.274   5.548  -2.579
  114    HE2  PHE  16           HE2      PHE  16   5.173   6.512  -6.202
  115    HZ   PHE  16           HZ       PHE  16   7.305   6.086  -5.002
  116    H    THR  17           H        THR  17   3.804   8.396  -3.541
  117    HA   THR  17           HA       THR  17   1.457   9.755  -4.792
  118    HB   THR  17           HB       THR  17   2.554  11.617  -4.082
  119    HG1  THR  17           HG1      THR  17   4.369  11.034  -6.163
  120   1HG2  THR  17          3HG2      THR  17   4.992   9.841  -4.055
  121   2HG2  THR  17          2HG2      THR  17   5.145  11.589  -3.873
  122   3HG2  THR  17          1HG2      THR  17   4.209  10.659  -2.703
  123    H    ASN  18           H        ASN  18   1.938  10.409  -7.159
  124    HA   ASN  18           HA       ASN  18   2.513   9.721  -9.344
  125   1HB   ASN  18          2HB       ASN  18   4.817   9.220  -7.835
  126   2HB   ASN  18          1HB       ASN  18   4.480   7.682  -8.630
  127   1HD2  ASN  18          2HD2      ASN  18   5.806   8.855 -11.663
  128   2HD2  ASN  18          1HD2      ASN  18   5.563   7.556 -10.597
  129    H    VAL  19           H        VAL  19   0.872   8.203  -7.182
  130    HA   VAL  19           HA       VAL  19   0.773   5.487  -7.404
  131    HB   VAL  19           HB       VAL  19  -1.612   7.335  -7.646
  132   1HG1  VAL  19          2HG1      VAL  19  -2.041   4.911  -8.116
  133   2HG1  VAL  19          1HG1      VAL  19  -1.415   4.535  -6.510
  134   3HG1  VAL  19          3HG1      VAL  19  -2.876   5.504  -6.681
  135   1HG2  VAL  19          1HG2      VAL  19   0.287   7.314  -5.660
  136   2HG2  VAL  19          3HG2      VAL  19  -1.389   7.815  -5.439
  137   3HG2  VAL  19          2HG2      VAL  19  -0.900   6.169  -5.038
  138    H    TRP  20           H        TRP  20  -0.312   3.985  -8.769
  139    HA   TRP  20           HA       TRP  20  -1.101   4.926 -11.469
  140   1HB   TRP  20          2HB       TRP  20   0.507   3.768 -12.619
  141   2HB   TRP  20          1HB       TRP  20   1.411   3.878 -11.115
  142    HD1  TRP  20           HD1      TRP  20  -0.611   1.438 -13.241
  143    HE1  TRP  20           HE1      TRP  20  -0.231  -0.957 -12.371
  144    HE3  TRP  20           HE3      TRP  20   2.085   2.457  -9.028
  145    HZ2  TRP  20           HZ2      TRP  20   1.077  -2.268 -10.193
  146    HZ3  TRP  20           HZ3      TRP  20   2.893   0.619  -7.582
  147    HH2  TRP  20           HH2      TRP  20   2.392  -1.739  -8.160
  148    H    LYS  21           H        LYS  21  -1.880   2.622 -12.621
  149    HA   LYS  21           HA       LYS  21  -3.254   0.959 -10.607
  150   1HB   LYS  21          2HB       LYS  21  -4.794   2.886 -11.116
  151   2HB   LYS  21          1HB       LYS  21  -4.831   2.339 -12.794
  152   1HG   LYS  21          2HG       LYS  21  -5.347  -0.001 -11.542
  153   2HG   LYS  21          1HG       LYS  21  -6.062   1.121 -10.383
  154   1HD   LYS  21          2HD       LYS  21  -7.874   1.221 -11.721
  155   2HD   LYS  21          1HD       LYS  21  -6.872   2.064 -12.903
  156   1HE   LYS  21          2HE       LYS  21  -7.925   0.091 -13.927
  157   2HE   LYS  21          1HE       LYS  21  -6.176  -0.117 -13.851
  158   1HZ   LYS  21          2HZ       LYS  21  -7.500  -1.037 -11.487
  159   2HZ   LYS  21          1HZ       LYS  21  -8.034  -1.851 -12.880
  160   3HZ   LYS  21          3HZ       LYS  21  -6.384  -1.840 -12.485
  161    H    ASP  22           H        ASP  22  -2.779  -1.076 -11.264
  162    HA   ASP  22           HA       ASP  22  -2.331  -1.565 -14.146
  163   1HB   ASP  22          2HB       ASP  22  -1.213  -2.581 -11.716
  164   2HB   ASP  22          1HB       ASP  22  -1.966  -3.921 -12.581
  165    H    ASP  23           H        ASP  23  -3.804  -2.611 -15.365
  166    HA   ASP  23           HA       ASP  23  -6.316  -3.516 -14.141
  167   1HB   ASP  23          2HB       ASP  23  -7.123  -3.746 -16.382
  168   2HB   ASP  23          1HB       ASP  23  -6.114  -2.300 -16.397
  169    H    LYS  24           H        LYS  24  -3.271  -4.792 -14.900
  170    HA   LYS  24           HA       LYS  24  -4.105  -7.545 -15.403
  171   1HB   LYS  24          2HB       LYS  24  -1.523  -6.064 -15.018
  172   2HB   LYS  24          1HB       LYS  24  -1.530  -7.816 -14.798
  173   1HG   LYS  24          2HG       LYS  24  -2.918  -7.660 -17.110
  174   2HG   LYS  24          1HG       LYS  24  -1.910  -6.221 -17.275
  175   1HD   LYS  24          2HD       LYS  24  -0.165  -7.514 -17.851
  176   2HD   LYS  24          1HD       LYS  24  -0.253  -8.316 -16.282
  177   1HE   LYS  24          2HE       LYS  24  -1.103 -10.182 -17.211
  178   2HE   LYS  24          1HE       LYS  24  -2.370  -9.258 -18.020
  179   1HZ   LYS  24          3HZ       LYS  24   0.012  -8.692 -19.328
  180   2HZ   LYS  24          2HZ       LYS  24  -0.028 -10.378 -19.121
  181   3HZ   LYS  24          1HZ       LYS  24  -1.303  -9.586 -19.916
  182    H    THR  25           H        THR  25  -2.349  -5.875 -12.781
  183    HA   THR  25           HA       THR  25  -2.708  -8.059 -10.915
  184    HB   THR  25           HB       THR  25  -2.063  -6.236  -9.226
  185    HG1  THR  25           HG1      THR  25  -2.840  -4.653 -10.989
  186   1HG2  THR  25          1HG2      THR  25  -0.450  -7.138 -11.575
  187   2HG2  THR  25          3HG2      THR  25   0.252  -5.948 -10.480
  188   3HG2  THR  25          2HG2      THR  25  -0.250  -7.521  -9.866
  189    H    LEU  26           H        LEU  26  -4.485  -5.217 -11.872
  190    HA   LEU  26           HA       LEU  26  -6.767  -4.750 -11.569
  191   1HB   LEU  26          2HB       LEU  26  -6.508  -7.482 -10.934
  192   2HB   LEU  26          1HB       LEU  26  -7.466  -6.765  -9.639
  193    HG   LEU  26           HG       LEU  26  -8.013  -6.488 -12.611
  194   1HD1  LEU  26          3HD1      LEU  26  -9.306  -8.087 -10.395
  195   2HD1  LEU  26          2HD1      LEU  26 -10.142  -7.718 -11.903
  196   3HD1  LEU  26          1HD1      LEU  26  -8.662  -8.679 -11.927
  197   1HD2  LEU  26          2HD2      LEU  26  -9.333  -5.333 -10.147
  198   2HD2  LEU  26          1HD2      LEU  26  -8.723  -4.469 -11.558
  199   3HD2  LEU  26          3HD2      LEU  26 -10.176  -5.459 -11.692
  200    H    ASP  27           H        ASP  27  -5.565  -2.951 -10.219
  201    HA   ASP  27           HA       ASP  27  -7.093  -2.380  -7.931
  202   1HB   ASP  27          2HB       ASP  27  -5.259  -4.462  -7.402
  203   2HB   ASP  27          1HB       ASP  27  -4.633  -3.031  -6.586
  204    H    ARG  28           H        ARG  28  -6.241  -0.540  -6.628
  205    HA   ARG  28           HA       ARG  28  -4.586   1.228  -8.269
  206   1HB   ARG  28          2HB       ARG  28  -6.456   1.999  -6.717
  207   2HB   ARG  28          1HB       ARG  28  -5.402   1.585  -5.365
  208   1HG   ARG  28          2HG       ARG  28  -5.002   3.890  -5.721
  209   2HG   ARG  28          1HG       ARG  28  -3.647   3.087  -6.518
  210   1HD   ARG  28          2HD       ARG  28  -4.480   4.752  -8.047
  211   2HD   ARG  28          1HD       ARG  28  -4.978   3.178  -8.668
  212    HE   ARG  28           HE       ARG  28  -7.210   3.718  -7.434
  213   1HH1  ARG  28          1HH2      ARG  28  -5.432   6.470  -7.283
  214   2HH1  ARG  28          2HH2      ARG  28  -6.480   7.454  -8.247
  215   1HH2  ARG  28          1HH1      ARG  28  -8.169   6.505  -9.413
  216   2HH2  ARG  28          2HH1      ARG  28  -8.414   4.791  -9.342
  217    H    TYR  29           H        TYR  29  -2.361   1.895  -7.614
  218    HA   TYR  29           HA       TYR  29  -1.217   0.163  -5.486
  219   1HB   TYR  29          2HB       TYR  29  -0.088   0.368  -8.284
  220   2HB   TYR  29          1HB       TYR  29   0.636  -0.516  -6.945
  221    HD1  TYR  29           HD2      TYR  29  -1.244  -2.060  -5.659
  222    HD2  TYR  29           HD1      TYR  29  -1.240  -0.942  -9.805
  223    HE1  TYR  29           HE2      TYR  29  -2.657  -4.027  -6.191
  224    HE2  TYR  29           HE1      TYR  29  -2.655  -2.904 -10.338
  225    HH   TYR  29           HH       TYR  29  -3.998  -4.503  -9.418
  226    H    ALA  30           H        ALA  30   0.598   0.905  -4.489
  227    HA   ALA  30           HA       ALA  30   1.572   3.621  -5.273
  228   1HB   ALA  30          1HB       ALA  30   0.579   2.579  -2.670
  229   2HB   ALA  30          3HB       ALA  30   2.033   3.574  -2.600
  230   3HB   ALA  30          2HB       ALA  30   0.551   4.223  -3.303
  231    H    ASN  31           H        ASN  31   3.446   2.854  -6.287
  232    HA   ASN  31           HA       ASN  31   5.060   0.700  -5.380
  233   1HB   ASN  31          2HB       ASN  31   6.857   1.767  -6.778
  234   2HB   ASN  31          1HB       ASN  31   5.326   1.552  -7.627
  235   1HD2  ASN  31          2HD2      ASN  31   4.699   5.034  -7.947
  236   2HD2  ASN  31          1HD2      ASN  31   4.039   3.477  -8.085
  237    H    TYR  32           H        TYR  32   5.701   0.724  -3.242
  238    HA   TYR  32           HA       TYR  32   6.955   3.196  -2.172
  239   1HB   TYR  32          2HB       TYR  32   5.202   1.542  -0.982
  240   2HB   TYR  32          1HB       TYR  32   6.699   0.737  -0.511
  241    HD1  TYR  32           HD2      TYR  32   8.630   2.464   0.255
  242    HD2  TYR  32           HD1      TYR  32   4.402   3.196   0.445
  243    HE1  TYR  32           HE2      TYR  32   9.005   4.179   2.007
  244    HE2  TYR  32           HE1      TYR  32   4.778   4.912   2.196
  245    HH   TYR  32           HH       TYR  32   7.482   6.395   2.768
  246    H    GLU  33           H        GLU  33   8.540   2.183  -4.087
  247    HA   GLU  33           HA       GLU  33  10.536   0.972  -4.571
  248   1HB   GLU  33          2HB       GLU  33  10.880   2.968  -2.417
  249   2HB   GLU  33          1HB       GLU  33  12.212   1.827  -2.609
  250   1HG   GLU  33          2HG       GLU  33  11.027   3.181  -5.021
  251   2HG   GLU  33          1HG       GLU  33  12.227   4.018  -4.033
  252    H    GLY  34           H        GLY  34  10.229  -1.253  -4.234
  253   1HA   GLY  34          2HA       GLY  34  11.263  -3.166  -3.131
  254   2HA   GLY  34          1HA       GLY  34  11.256  -2.252  -1.621
  255    H    CYS  35           H        CYS  35   8.635  -1.355  -1.506
  256    HA   CYS  35           HA       CYS  35   7.127  -3.938  -1.397
  257   1HB   CYS  35          2HB       CYS  35   6.613  -1.486   0.307
  258   2HB   CYS  35          1HB       CYS  35   5.932  -3.098   0.518
  259    H    LEU  36           H        LEU  36   4.717  -3.641  -1.674
  260    HA   LEU  36           HA       LEU  36   4.069  -1.268  -3.360
  261   1HB   LEU  36          2HB       LEU  36   4.520  -3.196  -4.853
  262   2HB   LEU  36          1HB       LEU  36   3.275  -4.118  -4.013
  263    HG   LEU  36           HG       LEU  36   1.762  -2.052  -4.539
  264   1HD1  LEU  36          1HD1      LEU  36   3.781  -0.750  -5.373
  265   2HD1  LEU  36          3HD1      LEU  36   3.774  -1.807  -6.783
  266   3HD1  LEU  36          2HD1      LEU  36   2.391  -0.767  -6.453
  267   1HD2  LEU  36          2HD2      LEU  36   2.380  -4.480  -5.939
  268   2HD2  LEU  36          1HD2      LEU  36   0.845  -3.613  -5.879
  269   3HD2  LEU  36          3HD2      LEU  36   2.030  -3.226  -7.126
  270    H    TRP  37           H        TRP  37   2.209  -0.330  -2.742
  271    HA   TRP  37           HA       TRP  37   0.480  -1.829  -0.849
  272   1HB   TRP  37          2HB       TRP  37   0.407   1.123  -1.510
  273   2HB   TRP  37          1HB       TRP  37  -0.401   0.295  -0.188
  274    HD1  TRP  37           HD1      TRP  37   3.265   0.550  -1.403
  275    HE1  TRP  37           HE1      TRP  37   4.746   0.828   0.689
  276    HE3  TRP  37           HE3      TRP  37  -0.315   0.425   2.233
  277    HZ2  TRP  37           HZ2      TRP  37   4.446   0.977   3.528
  278    HZ3  TRP  37           HZ3      TRP  37   0.305   0.629   4.616
  279    HH2  TRP  37           HH2      TRP  37   2.683   0.909   5.272
  280    H    ASN  38           H        ASN  38  -1.948  -1.181  -1.115
  281    HA   ASN  38           HA       ASN  38  -2.665  -0.896  -3.979
  282   1HB   ASN  38          2HB       ASN  38  -2.970  -3.151  -4.078
  283   2HB   ASN  38          1HB       ASN  38  -2.969  -3.322  -2.328
  284   1HD2  ASN  38          2HD2      ASN  38  -6.598  -2.204  -3.912
  285   2HD2  ASN  38          1HD2      ASN  38  -5.191  -1.407  -4.427
  286    H    ALA  39           H        ALA  39  -4.053   0.757  -4.060
  287    HA   ALA  39           HA       ALA  39  -5.689   1.415  -1.684
  288   1HB   ALA  39          2HB       ALA  39  -4.808   2.855  -4.139
  289   2HB   ALA  39          1HB       ALA  39  -6.363   3.326  -3.453
  290   3HB   ALA  39          3HB       ALA  39  -4.900   3.426  -2.473
  291    H    THR  40           H        THR  40  -7.943   1.359  -1.708
  292    HA   THR  40           HA       THR  40  -9.253   0.278  -4.161
  293    HB   THR  40           HB       THR  40  -9.316  -1.707  -3.012
  294    HG1  THR  40           HG1      THR  40 -11.233  -1.844  -1.837
  295   1HG2  THR  40          1HG2      THR  40  -8.788   0.040  -0.642
  296   2HG2  THR  40          3HG2      THR  40  -9.495  -1.550  -0.352
  297   3HG2  THR  40          2HG2      THR  40  -7.942  -1.411  -1.177
  298    H    GLY  41           H        GLY  41 -10.270   1.150  -0.838
  299   1HA   GLY  41          2HA       GLY  41 -12.742   2.297  -1.607
  300   2HA   GLY  41          1HA       GLY  41 -11.891   2.679  -0.110
  301    H    VAL  42           H        VAL  42 -12.586   4.913  -0.388
  302    HA   VAL  42           HA       VAL  42 -11.735   6.435  -2.712
  303    HB   VAL  42           HB       VAL  42 -12.592   7.397   0.034
  304   1HG1  VAL  42          3HG1      VAL  42 -11.336   8.992  -1.546
  305   2HG1  VAL  42          2HG1      VAL  42 -12.745   8.872  -2.601
  306   3HG1  VAL  42          1HG1      VAL  42 -12.914   9.529  -0.973
  307   1HG2  VAL  42          1HG2      VAL  42 -14.058   6.022  -1.949
  308   2HG2  VAL  42          3HG2      VAL  42 -14.707   6.884  -0.554
  309   3HG2  VAL  42          2HG2      VAL  42 -14.523   7.716  -2.098
  310    H    VAL  43           H        VAL  43 -10.027   8.004  -2.759
  311    HA   VAL  43           HA       VAL  43  -8.097   7.960  -0.508
  312    HB   VAL  43           HB       VAL  43  -7.295   7.345  -3.367
  313   1HG1  VAL  43          3HG1      VAL  43  -5.738   8.567  -1.626
  314   2HG1  VAL  43          2HG1      VAL  43  -5.587   6.953  -0.932
  315   3HG1  VAL  43          1HG1      VAL  43  -5.098   7.244  -2.601
  316   1HG2  VAL  43          3HG2      VAL  43  -7.958   5.625  -1.012
  317   2HG2  VAL  43          2HG2      VAL  43  -8.229   5.327  -2.729
  318   3HG2  VAL  43          1HG2      VAL  43  -6.615   5.130  -2.043
  319    H    VAL  44           H        VAL  44  -7.492  10.049  -0.131
  320    HA   VAL  44           HA       VAL  44  -8.337  12.255  -1.671
  321    HB   VAL  44           HB       VAL  44  -5.950  11.964   0.177
  322   1HG1  VAL  44          3HG1      VAL  44  -7.154  14.475  -1.032
  323   2HG1  VAL  44          2HG1      VAL  44  -5.899  14.438   0.207
  324   3HG1  VAL  44          1HG1      VAL  44  -5.563  13.813  -1.407
  325   1HG2  VAL  44          1HG2      VAL  44  -8.395  11.750   0.991
  326   2HG2  VAL  44          3HG2      VAL  44  -7.364  12.909   1.831
  327   3HG2  VAL  44          2HG2      VAL  44  -8.529  13.471   0.632
  328    H    CYS  45           H        CYS  45  -7.889  12.362  -3.839
  329    HA   CYS  45           HA       CYS  45  -5.069  11.846  -4.681
  330   1HB   CYS  45          2HB       CYS  45  -7.704  11.250  -5.874
  331   2HB   CYS  45          1HB       CYS  45  -6.502  11.865  -7.008
  332    H    THR  46           H        THR  46  -3.991  13.397  -5.889
  333    HA   THR  46           HA       THR  46  -5.455  15.890  -6.595
  334    HB   THR  46           HB       THR  46  -4.393  16.242  -4.372
  335    HG1  THR  46           HG1      THR  46  -4.499  18.021  -5.682
  336   1HG2  THR  46          2HG2      THR  46  -2.235  14.840  -5.677
  337   2HG2  THR  46          1HG2      THR  46  -1.668  16.404  -5.090
  338   3HG2  THR  46          3HG2      THR  46  -2.412  15.258  -3.973
  339    H    GLY  47           H        GLY  47  -4.412  17.076  -8.312
  340   1HA   GLY  47          2HA       GLY  47  -3.060  17.311 -10.228
  341   2HA   GLY  47          1HA       GLY  47  -1.912  16.201  -9.473
  342    H    ASP  48           H        ASP  48  -5.250  16.016 -10.775
  343    HA   ASP  48           HA       ASP  48  -6.220  14.391 -12.169
  344   1HB   ASP  48          2HB       ASP  48  -3.308  14.186 -12.931
  345   2HB   ASP  48          1HB       ASP  48  -4.515  13.111 -13.633
  346    H    GLU  49           H        GLU  49  -4.854  13.841  -9.424
  347    HA   GLU  49           HA       GLU  49  -5.008  12.027  -7.968
  348   1HB   GLU  49          2HB       GLU  49  -5.624  10.276 -10.359
  349   2HB   GLU  49          1HB       GLU  49  -5.968   9.943  -8.663
  350   1HG   GLU  49          2HG       GLU  49  -7.333  12.203  -8.818
  351   2HG   GLU  49          1HG       GLU  49  -7.361  11.820 -10.539
  352    H    THR  50           H        THR  50  -2.587  12.876  -9.440
  353    HA   THR  50           HA       THR  50  -1.085  10.441  -9.993
  354    HB   THR  50           HB       THR  50   0.829  12.338  -9.594
  355    HG1  THR  50           HG1      THR  50   0.025  14.281  -9.791
  356   1HG2  THR  50          3HG2      THR  50   0.250  10.928 -11.621
  357   2HG2  THR  50          2HG2      THR  50  -0.886  12.200 -12.076
  358   3HG2  THR  50          1HG2      THR  50   0.840  12.552 -11.980
  359    H    GLN  51           H        GLN  51  -1.246  12.812  -7.335
  360    HA   GLN  51           HA       GLN  51   0.300  10.897  -5.649
  361   1HB   GLN  51          2HB       GLN  51  -0.524  13.691  -4.845
  362   2HB   GLN  51          1HB       GLN  51   0.769  12.697  -4.175
  363   1HG   GLN  51          2HG       GLN  51   2.238  13.260  -5.831
  364   2HG   GLN  51          1HG       GLN  51   0.987  13.262  -7.074
  365   1HE2  GLN  51          2HE2      GLN  51   1.493  16.801  -6.984
  366   2HE2  GLN  51          1HE2      GLN  51   1.872  15.380  -7.832
  367    H    CYS  52           H        CYS  52  -0.769   9.904  -3.906
  368    HA   CYS  52           HA       CYS  52  -3.441  10.931  -3.205
  369   1HB   CYS  52          2HB       CYS  52  -3.262   9.018  -5.157
  370   2HB   CYS  52          1HB       CYS  52  -3.479   8.031  -3.714
  371    H    TYR  53           H        TYR  53  -4.230  10.174  -1.184
  372    HA   TYR  53           HA       TYR  53  -2.434   8.357   0.333
  373   1HB   TYR  53          2HB       TYR  53  -1.648  10.286   1.333
  374   2HB   TYR  53          1HB       TYR  53  -3.113  11.193   0.971
  375    HD1  TYR  53           HD2      TYR  53  -5.075  11.065   2.431
  376    HD2  TYR  53           HD1      TYR  53  -1.482   8.899   3.361
  377    HE1  TYR  53           HE2      TYR  53  -5.906  10.669   4.733
  378    HE2  TYR  53           HE1      TYR  53  -2.318   8.498   5.663
  379    HH   TYR  53           HH       TYR  53  -4.017   8.745   7.066
  380    H    GLY  54           H        GLY  54  -3.518   7.349   2.186
  381   1HA   GLY  54          2HA       GLY  54  -5.973   7.497   3.244
  382   2HA   GLY  54          1HA       GLY  54  -6.396   6.927   1.627
  383    H    THR  55           H        THR  55  -6.587   4.741   1.507
  384    HA   THR  55           HA       THR  55  -4.868   3.118   3.344
  385    HB   THR  55           HB       THR  55  -6.725   1.349   3.020
  386    HG1  THR  55           HG1      THR  55  -8.106   3.708   2.251
  387   1HG2  THR  55          3HG2      THR  55  -6.260   3.012   5.000
  388   2HG2  THR  55          2HG2      THR  55  -7.759   3.765   4.456
  389   3HG2  THR  55          1HG2      THR  55  -7.751   2.076   4.963
  390    H    TRP  56           H        TRP  56  -3.497   1.799   2.373
  391    HA   TRP  56           HA       TRP  56  -3.951   0.977  -0.457
  392   1HB   TRP  56          2HB       TRP  56  -1.320   1.698   0.813
  393   2HB   TRP  56          1HB       TRP  56  -1.623   1.359  -0.892
  394    HD1  TRP  56           HD1      TRP  56  -2.613   3.936   1.800
  395    HE1  TRP  56           HE1      TRP  56  -3.033   6.182   0.618
  396    HE3  TRP  56           HE3      TRP  56  -2.006   2.460  -3.025
  397    HZ2  TRP  56           HZ2      TRP  56  -3.099   7.211  -2.083
  398    HZ3  TRP  56           HZ3      TRP  56  -2.251   4.059  -4.890
  399    HH2  TRP  56           HH2      TRP  56  -2.796   6.444  -4.428
  400    H    VAL  57           H        VAL  57  -4.737  -1.013   0.953
  401    HA   VAL  57           HA       VAL  57  -3.145  -2.511   2.654
  402    HB   VAL  57           HB       VAL  57  -4.817  -3.613   0.367
  403   1HG1  VAL  57          3HG1      VAL  57  -3.097  -5.100   1.725
  404   2HG1  VAL  57          2HG1      VAL  57  -4.340  -5.019   2.973
  405   3HG1  VAL  57          1HG1      VAL  57  -4.722  -5.699   1.392
  406   1HG2  VAL  57          1HG2      VAL  57  -5.473  -2.901   3.244
  407   2HG2  VAL  57          3HG2      VAL  57  -6.128  -2.143   1.792
  408   3HG2  VAL  57          2HG2      VAL  57  -6.548  -3.812   2.182
  409    HA   PRO  58           HA       PRO  58   0.452  -3.300   0.171
  410   1HB   PRO  58          2HB       PRO  58   1.695  -4.983   1.981
  411   2HB   PRO  58          1HB       PRO  58   1.738  -3.211   2.072
  412   1HG   PRO  58          2HG       PRO  58   0.142  -5.141   3.700
  413   2HG   PRO  58          1HG       PRO  58   0.739  -3.524   4.134
  414   1HD   PRO  58          2HD       PRO  58  -1.912  -4.125   3.398
  415   2HD   PRO  58          1HD       PRO  58  -1.189  -2.502   3.393
  416    H    ILE  59           H        ILE  59   0.848  -4.838  -1.374
  417    HA   ILE  59           HA       ILE  59  -0.322  -7.548  -0.991
  418    HB   ILE  59           HB       ILE  59  -1.123  -7.445  -3.363
  419   1HG1  ILE  59          2HG1      ILE  59   0.454  -5.546  -3.973
  420   2HG1  ILE  59          1HG1      ILE  59  -1.204  -5.354  -4.537
  421   1HG2  ILE  59          3HG2      ILE  59  -2.179  -5.626  -1.215
  422   2HG2  ILE  59          2HG2      ILE  59  -2.960  -5.652  -2.796
  423   3HG2  ILE  59          1HG2      ILE  59  -2.861  -7.128  -1.838
  424   1HD1  ILE  59          2HD1      ILE  59  -1.213  -4.193  -1.996
  425   2HD1  ILE  59          1HD1      ILE  59   0.316  -3.687  -2.709
  426   3HD1  ILE  59          3HD1      ILE  59  -1.192  -3.343  -3.541
  427    H    GLY  60           H        GLY  60   2.146  -5.521  -2.548
  428   1HA   GLY  60          2HA       GLY  60   3.572  -8.066  -3.152
  429   2HA   GLY  60          1HA       GLY  60   3.288  -6.959  -4.490
  430    H    LEU  61           H        LEU  61   5.560  -6.750  -4.771
  431    HA   LEU  61           HA       LEU  61   7.031  -5.360  -2.593
  432   1HB   LEU  61          2HB       LEU  61   8.167  -6.406  -5.195
  433   2HB   LEU  61          1HB       LEU  61   9.040  -6.009  -3.715
  434    HG   LEU  61           HG       LEU  61   7.109  -8.301  -4.145
  435   1HD1  LEU  61          2HD1      LEU  61   9.867  -8.083  -4.511
  436   2HD1  LEU  61          1HD1      LEU  61   9.705  -8.833  -2.924
  437   3HD1  LEU  61          3HD1      LEU  61   8.958  -9.584  -4.333
  438   1HD2  LEU  61          3HD2      LEU  61   8.022  -6.915  -1.681
  439   2HD2  LEU  61          2HD2      LEU  61   6.558  -7.856  -1.965
  440   3HD2  LEU  61          1HD2      LEU  61   8.085  -8.676  -1.643
  441    H    ALA  62           H        ALA  62   5.833  -4.949  -5.885
  442    HA   ALA  62           HA       ALA  62   5.750  -2.139  -5.750
  443   1HB   ALA  62          2HB       ALA  62   8.389  -3.259  -6.576
  444   2HB   ALA  62          1HB       ALA  62   7.794  -1.838  -7.435
  445   3HB   ALA  62          3HB       ALA  62   8.024  -1.780  -5.687
  446    H    ILE  63           H        ILE  63   4.025  -3.981  -6.872
  447    HA   ILE  63           HA       ILE  63   3.272  -2.923  -9.280
  448    HB   ILE  63           HB       ILE  63   5.698  -4.454  -9.658
  449   1HG1  ILE  63          2HG1      ILE  63   5.360  -2.240 -10.574
  450   2HG1  ILE  63          1HG1      ILE  63   5.494  -3.368 -11.922
  451   1HG2  ILE  63          3HG2      ILE  63   4.084  -6.292 -10.221
  452   2HG2  ILE  63          2HG2      ILE  63   3.388  -5.244 -11.455
  453   3HG2  ILE  63          1HG2      ILE  63   5.064  -5.776 -11.592
  454   1HD1  ILE  63          1HD1      ILE  63   2.756  -3.318 -11.207
  455   2HD1  ILE  63          3HD1      ILE  63   3.289  -1.637 -11.230
  456   3HD1  ILE  63          2HD1      ILE  63   3.494  -2.646 -12.662
  457    HA   PRO  64           HA       PRO  64   1.471  -7.364  -9.182
  458   1HB   PRO  64          2HB       PRO  64   2.219  -8.961  -7.069
  459   2HB   PRO  64          1HB       PRO  64   2.999  -8.976  -8.663
  460   1HG   PRO  64          2HG       PRO  64   3.970  -7.789  -6.101
  461   2HG   PRO  64          1HG       PRO  64   4.901  -8.404  -7.477
  462   1HD   PRO  64          2HD       PRO  64   4.433  -5.698  -6.915
  463   2HD   PRO  64          1HD       PRO  64   4.987  -6.336  -8.475
  464    H    GLU  65           H        GLU  65  -0.356  -8.266  -8.011
  465    HA   GLU  65           HA       GLU  65  -1.050  -6.899  -5.463
  466   1HB   GLU  65          2HB       GLU  65  -2.124  -5.651  -7.346
  467   2HB   GLU  65          1HB       GLU  65  -2.950  -7.133  -7.831
  468   1HG   GLU  65          2HG       GLU  65  -3.170  -6.132  -4.999
  469   2HG   GLU  65          1HG       GLU  65  -4.196  -5.457  -6.262
  470    H    ASN  66           H        ASN  66  -3.012  -8.943  -7.607
  471    HA   ASN  66           HA       ASN  66  -3.201 -10.904  -5.369
  472   1HB   ASN  66          2HB       ASN  66  -5.344  -9.974  -6.122
  473   2HB   ASN  66          1HB       ASN  66  -4.994 -10.465  -7.778
  474   1HD2  ASN  66          2HD2      ASN  66  -5.621 -13.524  -5.086
  475   2HD2  ASN  66          1HD2      ASN  66  -4.746 -12.158  -4.588
  476    H    ALA  67           H        ALA  67  -0.993 -10.687  -7.400
  477    HA   ALA  67           HA       ALA  67  -0.668 -13.488  -7.922
  478   1HB   ALA  67          2HB       ALA  67  -1.836 -11.791 -10.093
  479   2HB   ALA  67          1HB       ALA  67  -0.638 -13.006 -10.543
  480   3HB   ALA  67          3HB       ALA  67  -2.123 -13.491  -9.724
  481    H    ALA  68           H        ALA  68   1.373 -13.886  -9.150
  482    HA   ALA  68           HA       ALA  68   3.317 -11.755  -8.568
  483   1HB   ALA  68          2HB       ALA  68   3.481 -14.639  -9.403
  484   2HB   ALA  68          1HB       ALA  68   4.890 -13.595  -9.594
  485   3HB   ALA  68          3HB       ALA  68   4.190 -13.848  -7.995
  486    H    ALA  69           H        ALA  69   1.234 -11.996 -10.968
  487    HA   ALA  69           HA       ALA  69   1.212 -11.380 -13.235
  488   1HB   ALA  69          2HB       ALA  69   3.183  -9.672 -11.853
  489   2HB   ALA  69          1HB       ALA  69   3.387  -9.753 -13.602
  490   3HB   ALA  69          3HB       ALA  69   1.852  -9.219 -12.917
  491    H    HIS  70           HN       HIS  70   1.717 -13.472 -14.093
  492    HA   HIS  70           HA       HIS  70   3.068 -15.107 -15.126
  493   1HB   HIS  70          2HB       HIS  70   3.062 -12.935 -16.631
  494   2HB   HIS  70          1HB       HIS  70   4.760 -12.856 -16.162
  495    HD1  HIS  70           HD1      HIS  70   4.514 -16.239 -16.016
  496    HD2  HIS  70           HD2      HIS  70   4.194 -13.664 -19.282
  497    HE1  HIS  70           HE1      HIS  70   5.010 -17.628 -18.076
   
  No H/Q in entry =         497
  Start of MODEL   11
    1   1H    GLU   1          1H        GLU   1  12.972  -7.703  -1.981
    2   2H    GLU   1          3H        GLU   1  12.085  -6.398  -2.606
    3   3H    GLU   1          2H        GLU   1  13.562  -6.118  -1.814
    4    HA   GLU   1           HA       GLU   1  12.682  -6.293   0.242
    5   1HB   GLU   1          2HB       GLU   1  11.348  -4.541  -0.789
    6   2HB   GLU   1          1HB       GLU   1  10.265  -5.736  -1.506
    7   1HG   GLU   1          2HG       GLU   1   9.137  -4.936   0.440
    8   2HG   GLU   1          1HG       GLU   1   9.774  -6.520   0.876
    9    H    THR   2           H        THR   2  11.558  -7.575   1.769
   10    HA   THR   2           HA       THR   2  10.802 -10.244   0.795
   11    HB   THR   2           HB       THR   2  10.488  -9.308   3.640
   12    HG1  THR   2           HG1      THR   2  12.862  -9.853   2.214
   13   1HG2  THR   2          2HG2      THR   2   9.869 -11.645   2.640
   14   2HG2  THR   2          1HG2      THR   2  11.612 -11.920   2.664
   15   3HG2  THR   2          3HG2      THR   2  10.754 -11.574   4.165
   16    H    VAL   3           H        VAL   3   8.678 -10.916   0.536
   17    HA   VAL   3           HA       VAL   3   6.607  -8.896   0.624
   18    HB   VAL   3           HB       VAL   3   5.886 -11.799   0.545
   19   1HG1  VAL   3          2HG1      VAL   3   4.822  -9.239  -0.295
   20   2HG1  VAL   3          1HG1      VAL   3   4.900 -10.353  -1.659
   21   3HG1  VAL   3          3HG1      VAL   3   4.010 -10.802  -0.204
   22   1HG2  VAL   3          2HG2      VAL   3   7.801 -10.447  -1.288
   23   2HG2  VAL   3          1HG2      VAL   3   7.640 -12.159  -0.897
   24   3HG2  VAL   3          3HG2      VAL   3   6.535 -11.410  -2.049
   25    H    GLU   4           H        GLU   4   7.781 -11.315   2.846
   26    HA   GLU   4           HA       GLU   4   5.470 -11.467   4.548
   27   1HB   GLU   4          2HB       GLU   4   7.847 -12.782   4.464
   28   2HB   GLU   4          1HB       GLU   4   8.139 -11.692   5.819
   29   1HG   GLU   4          2HG       GLU   4   5.493 -12.746   6.078
   30   2HG   GLU   4          1HG       GLU   4   6.598 -14.093   5.798
   31    H    SER   5           H        SER   5   8.412  -9.433   4.714
   32    HA   SER   5           HA       SER   5   7.409  -7.966   7.023
   33   1HB   SER   5          2HB       SER   5   9.679  -7.405   5.092
   34   2HB   SER   5          1HB       SER   5   9.325  -6.411   6.502
   35    HG   SER   5           HG       SER   5   9.843  -8.081   7.812
   36    H    CYS   6           H        CYS   6   7.609  -7.369   3.526
   37    HA   CYS   6           HA       CYS   6   6.604  -4.725   3.507
   38   1HB   CYS   6          2HB       CYS   6   7.430  -6.158   1.516
   39   2HB   CYS   6          1HB       CYS   6   5.784  -6.789   1.460
   40    H    LEU   7           H        LEU   7   5.057  -7.788   4.089
   41    HA   LEU   7           HA       LEU   7   2.368  -6.561   4.016
   42   1HB   LEU   7          2HB       LEU   7   3.237  -9.390   4.659
   43   2HB   LEU   7          1HB       LEU   7   1.569  -8.843   4.489
   44    HG   LEU   7           HG       LEU   7   3.508  -8.338   2.259
   45   1HD1  LEU   7          1HD1      LEU   7   3.203 -10.887   3.249
   46   2HD1  LEU   7          3HD1      LEU   7   1.932 -10.815   2.027
   47   3HD1  LEU   7          2HD1      LEU   7   3.608 -10.500   1.578
   48   1HD2  LEU   7          2HD2      LEU   7   0.788  -7.867   2.720
   49   2HD2  LEU   7          1HD2      LEU   7   1.616  -7.758   1.167
   50   3HD2  LEU   7          3HD2      LEU   7   0.812  -9.256   1.634
   51    H    ALA   8           H        ALA   8   4.867  -7.522   6.208
   52    HA   ALA   8           HA       ALA   8   3.300  -7.593   8.632
   53   1HB   ALA   8          2HB       ALA   8   5.656  -8.482   8.410
   54   2HB   ALA   8          1HB       ALA   8   6.219  -6.814   8.331
   55   3HB   ALA   8          3HB       ALA   8   5.431  -7.409   9.792
   56    H    LYS   9           H        LYS   9   4.227  -5.182   6.479
   57    HA   LYS   9           HA       LYS   9   4.673  -2.843   7.890
   58   1HB   LYS   9          2HB       LYS   9   3.031  -3.435   5.400
   59   2HB   LYS   9          1HB       LYS   9   3.559  -1.818   5.850
   60   1HG   LYS   9          2HG       LYS   9   5.926  -2.751   5.976
   61   2HG   LYS   9          1HG       LYS   9   5.292  -4.185   5.176
   62   1HD   LYS   9          2HD       LYS   9   5.366  -3.159   3.179
   63   2HD   LYS   9          1HD       LYS   9   4.391  -1.826   3.793
   64   1HE   LYS   9          2HE       LYS   9   7.399  -2.121   3.917
   65   2HE   LYS   9          1HE       LYS   9   6.475  -0.863   3.098
   66   1HZ   LYS   9          2HZ       LYS   9   5.559  -0.574   5.558
   67   2HZ   LYS   9          1HZ       LYS   9   7.109  -1.164   5.923
   68   3HZ   LYS   9          3HZ       LYS   9   6.938   0.243   4.993
   69    HA   PRO  10           HA       PRO  10   0.923  -1.809   9.961
   70   1HB   PRO  10          2HB       PRO  10   0.097   0.647   9.016
   71   2HB   PRO  10          1HB       PRO  10   1.463   0.419  10.121
   72   1HG   PRO  10          2HG       PRO  10   1.491   1.031   7.204
   73   2HG   PRO  10          1HG       PRO  10   2.700   1.412   8.443
   74   1HD   PRO  10          2HD       PRO  10   2.854  -0.672   6.568
   75   2HD   PRO  10          1HD       PRO  10   3.874  -0.518   8.012
   76    H    HIS  11           H        HIS  11   0.836  -2.389   6.692
   77    HA   HIS  11           HA       HIS  11  -0.817  -3.313   5.351
   78   1HB   HIS  11          2HB       HIS  11  -1.852  -3.587   8.039
   79   2HB   HIS  11          1HB       HIS  11  -3.147  -3.312   6.868
   80    HD1  HIS  11           HD1      HIS  11  -3.734  -5.212   5.315
   81    HD2  HIS  11           HD2      HIS  11  -0.162  -5.902   7.356
   82    HE1  HIS  11           HE1      HIS  11  -3.051  -7.591   4.783
   83    H    THR  12           H        THR  12  -0.751  -1.237   4.180
   84    HA   THR  12           HA       THR  12  -2.099   0.218   2.954
   85    HB   THR  12           HB       THR  12  -3.943  -1.301   4.265
   86    HG1  THR  12           HG1      THR  12  -5.322  -0.551   2.756
   87   1HG2  THR  12          3HG2      THR  12  -4.460   1.599   4.942
   88   2HG2  THR  12          2HG2      THR  12  -5.717   0.364   4.966
   89   3HG2  THR  12          1HG2      THR  12  -4.356   0.251   6.068
   90    H    GLU  13           H        GLU  13  -2.683   0.879   6.448
   91    HA   GLU  13           HA       GLU  13  -3.006   3.609   6.228
   92   1HB   GLU  13          2HB       GLU  13  -2.946   2.229   8.386
   93   2HB   GLU  13          1HB       GLU  13  -1.195   2.456   8.362
   94   1HG   GLU  13          2HG       GLU  13  -2.059   5.015   7.907
   95   2HG   GLU  13          1HG       GLU  13  -3.337   4.403   8.962
   96    H    ASN  14           H        ASN  14  -1.869   4.658   4.690
   97    HA   ASN  14           HA       ASN  14   0.577   5.876   5.134
   98   1HB   ASN  14          2HB       ASN  14   0.965   3.097   4.508
   99   2HB   ASN  14          1HB       ASN  14   1.565   4.061   3.157
  100   1HD2  ASN  14          2HD2      ASN  14   4.381   5.219   4.923
  101   2HD2  ASN  14          1HD2      ASN  14   3.545   5.147   3.448
  102    H    SER  15           H        SER  15   1.623   5.641   2.372
  103    HA   SER  15           HA       SER  15  -0.437   5.860   0.448
  104   1HB   SER  15          2HB       SER  15  -0.502   8.379   0.265
  105   2HB   SER  15          1HB       SER  15  -1.284   7.726   1.699
  106    HG   SER  15           HG       SER  15   0.752   9.439   1.533
  107    H    PHE  16           H        PHE  16   0.461   7.838  -1.213
  108    HA   PHE  16           HA       PHE  16   3.279   8.085  -1.434
  109   1HB   PHE  16          2HB       PHE  16   3.488   5.749  -1.787
  110   2HB   PHE  16          1HB       PHE  16   2.036   5.686  -2.786
  111    HD1  PHE  16           HD1      PHE  16   5.494   7.105  -2.675
  112    HD2  PHE  16           HD2      PHE  16   2.177   5.905  -5.122
  113    HE1  PHE  16           HE1      PHE  16   6.870   7.449  -4.710
  114    HE2  PHE  16           HE2      PHE  16   3.549   6.252  -7.155
  115    HZ   PHE  16           HZ       PHE  16   5.899   7.021  -6.952
  116    H    THR  17           H        THR  17   3.699   9.557  -3.126
  117    HA   THR  17           HA       THR  17   1.305  10.378  -4.675
  118    HB   THR  17           HB       THR  17   2.070  12.443  -4.231
  119    HG1  THR  17           HG1      THR  17   3.740  13.168  -5.538
  120   1HG2  THR  17          2HG2      THR  17   4.700  11.153  -3.447
  121   2HG2  THR  17          1HG2      THR  17   4.286  12.846  -3.176
  122   3HG2  THR  17          3HG2      THR  17   3.379  11.575  -2.357
  123    H    ASN  18           H        ASN  18   1.593  10.855  -7.019
  124    HA   ASN  18           HA       ASN  18   2.400  10.293  -9.173
  125   1HB   ASN  18          2HB       ASN  18   4.608   8.685  -7.890
  126   2HB   ASN  18          1HB       ASN  18   4.600   9.488  -9.461
  127   1HD2  ASN  18          2HD2      ASN  18   5.273  12.743  -8.070
  128   2HD2  ASN  18          1HD2      ASN  18   4.486  11.972  -9.360
  129    H    VAL  19           H        VAL  19   0.987   8.539  -6.946
  130    HA   VAL  19           HA       VAL  19   1.276   5.817  -7.376
  131    HB   VAL  19           HB       VAL  19  -1.296   7.397  -7.079
  132   1HG1  VAL  19          2HG1      VAL  19  -0.697   4.454  -6.647
  133   2HG1  VAL  19          1HG1      VAL  19  -2.187   5.258  -6.155
  134   3HG1  VAL  19          3HG1      VAL  19  -1.777   5.136  -7.863
  135   1HG2  VAL  19          2HG2      VAL  19   0.830   7.231  -5.346
  136   2HG2  VAL  19          1HG2      VAL  19  -0.838   7.517  -4.853
  137   3HG2  VAL  19          3HG2      VAL  19  -0.173   5.884  -4.810
  138    H    TRP  20           H        TRP  20  -0.200   4.364  -8.680
  139    HA   TRP  20           HA       TRP  20  -1.048   5.536 -11.271
  140   1HB   TRP  20          2HB       TRP  20   0.466   4.392 -12.555
  141   2HB   TRP  20          1HB       TRP  20   1.415   4.330 -11.073
  142    HD1  TRP  20           HD1      TRP  20  -0.810   2.207 -13.315
  143    HE1  TRP  20           HE1      TRP  20  -0.577  -0.267 -12.649
  144    HE3  TRP  20           HE3      TRP  20   2.026   2.697  -9.094
  145    HZ2  TRP  20           HZ2      TRP  20   0.667  -1.838 -10.605
  146    HZ3  TRP  20           HZ3      TRP  20   2.723   0.693  -7.811
  147    HH2  TRP  20           HH2      TRP  20   2.048  -1.572  -8.561
  148    H    LYS  21           H        LYS  21  -2.039   3.495 -12.585
  149    HA   LYS  21           HA       LYS  21  -3.536   1.775 -10.660
  150   1HB   LYS  21          2HB       LYS  21  -5.003   3.661 -11.396
  151   2HB   LYS  21          1HB       LYS  21  -4.770   3.144 -13.070
  152   1HG   LYS  21          2HG       LYS  21  -5.500   0.900 -11.380
  153   2HG   LYS  21          1HG       LYS  21  -6.711   2.182 -11.285
  154   1HD   LYS  21          2HD       LYS  21  -7.027   2.170 -13.666
  155   2HD   LYS  21          1HD       LYS  21  -5.619   1.136 -13.909
  156   1HE   LYS  21          2HE       LYS  21  -7.709  -0.168 -14.069
  157   2HE   LYS  21          1HE       LYS  21  -6.743  -0.688 -12.688
  158   1HZ   LYS  21          2HZ       LYS  21  -8.101   0.856 -11.314
  159   2HZ   LYS  21          1HZ       LYS  21  -9.115   1.091 -12.656
  160   3HZ   LYS  21          3HZ       LYS  21  -8.973  -0.450 -11.961
  161    H    ASP  22           H        ASP  22  -3.303  -0.348 -11.253
  162    HA   ASP  22           HA       ASP  22  -2.408  -0.876 -14.039
  163   1HB   ASP  22          2HB       ASP  22  -1.368  -1.724 -11.601
  164   2HB   ASP  22          1HB       ASP  22  -2.262  -3.127 -12.188
  165    H    ASP  23           H        ASP  23  -3.776  -1.876 -15.383
  166    HA   ASP  23           HA       ASP  23  -6.351  -2.885 -14.390
  167   1HB   ASP  23          2HB       ASP  23  -5.576  -1.733 -16.767
  168   2HB   ASP  23          1HB       ASP  23  -5.594  -3.443 -17.194
  169    H    LYS  24           H        LYS  24  -3.195  -4.000 -15.077
  170    HA   LYS  24           HA       LYS  24  -3.802  -6.777 -15.644
  171   1HB   LYS  24          2HB       LYS  24  -1.333  -5.285 -14.715
  172   2HB   LYS  24          1HB       LYS  24  -1.340  -7.032 -14.980
  173   1HG   LYS  24          2HG       LYS  24  -2.481  -5.415 -17.183
  174   2HG   LYS  24          1HG       LYS  24  -0.747  -5.220 -16.924
  175   1HD   LYS  24          2HD       LYS  24  -0.437  -7.655 -17.055
  176   2HD   LYS  24          1HD       LYS  24  -2.174  -7.872 -17.279
  177   1HE   LYS  24          2HE       LYS  24  -1.221  -5.932 -19.173
  178   2HE   LYS  24          1HE       LYS  24  -0.221  -7.381 -19.280
  179   1HZ   LYS  24          1HZ       LYS  24  -2.952  -8.073 -19.000
  180   2HZ   LYS  24          3HZ       LYS  24  -2.753  -7.022 -20.317
  181   3HZ   LYS  24          2HZ       LYS  24  -1.869  -8.470 -20.247
  182    H    THR  25           H        THR  25  -2.547  -5.019 -12.817
  183    HA   THR  25           HA       THR  25  -2.971  -7.284 -11.033
  184    HB   THR  25           HB       THR  25  -2.090  -5.883  -9.331
  185    HG1  THR  25           HG1      THR  25  -1.975  -3.507 -10.001
  186   1HG2  THR  25          1HG2      THR  25  -0.793  -6.101 -11.755
  187   2HG2  THR  25          3HG2      THR  25  -0.715  -4.369 -11.430
  188   3HG2  THR  25          2HG2      THR  25  -0.065  -5.517 -10.260
  189    H    LEU  26           H        LEU  26  -4.799  -4.631 -12.247
  190    HA   LEU  26           HA       LEU  26  -7.052  -4.063 -11.986
  191   1HB   LEU  26          2HB       LEU  26  -6.909  -6.849 -10.914
  192   2HB   LEU  26          1HB       LEU  26  -8.384  -5.921 -10.641
  193    HG   LEU  26           HG       LEU  26  -7.081  -6.458 -13.327
  194   1HD1  LEU  26          1HD1      LEU  26  -8.669  -8.128 -11.847
  195   2HD1  LEU  26          3HD1      LEU  26  -9.874  -7.251 -12.788
  196   3HD1  LEU  26          2HD1      LEU  26  -8.589  -8.139 -13.609
  197   1HD2  LEU  26          2HD2      LEU  26  -9.299  -4.648 -12.426
  198   2HD2  LEU  26          1HD2      LEU  26  -8.061  -4.369 -13.649
  199   3HD2  LEU  26          3HD2      LEU  26  -9.429  -5.426 -14.003
  200    H    ASP  27           H        ASP  27  -6.030  -2.382 -10.475
  201    HA   ASP  27           HA       ASP  27  -7.631  -1.834  -8.283
  202   1HB   ASP  27          2HB       ASP  27  -5.851  -4.024  -7.695
  203   2HB   ASP  27          1HB       ASP  27  -5.460  -2.653  -6.660
  204    H    ARG  28           H        ARG  28  -6.497  -0.271  -6.646
  205    HA   ARG  28           HA       ARG  28  -4.747   1.489  -8.224
  206   1HB   ARG  28          2HB       ARG  28  -6.581   2.265  -6.590
  207   2HB   ARG  28          1HB       ARG  28  -5.471   1.803  -5.299
  208   1HG   ARG  28          2HG       ARG  28  -4.585   3.873  -5.512
  209   2HG   ARG  28          1HG       ARG  28  -3.869   3.289  -7.015
  210   1HD   ARG  28          2HD       ARG  28  -5.181   5.414  -7.298
  211   2HD   ARG  28          1HD       ARG  28  -5.775   4.086  -8.295
  212    HE   ARG  28           HE       ARG  28  -7.245   3.972  -5.902
  213   1HH1  ARG  28          2HH1      ARG  28  -7.433   6.774  -5.613
  214   2HH1  ARG  28          1HH1      ARG  28  -8.630   7.280  -6.758
  215   1HH2  ARG  28          1HH2      ARG  28  -8.460   4.365  -8.627
  216   2HH2  ARG  28          2HH2      ARG  28  -9.211   5.917  -8.464
  217    H    TYR  29           H        TYR  29  -2.490   1.825  -7.733
  218    HA   TYR  29           HA       TYR  29  -1.392   0.216  -5.503
  219   1HB   TYR  29          2HB       TYR  29  -0.696  -0.222  -8.411
  220   2HB   TYR  29          1HB       TYR  29   0.295  -0.812  -7.076
  221    HD1  TYR  29           HD2      TYR  29  -0.582  -2.505  -5.502
  222    HD2  TYR  29           HD1      TYR  29  -2.836  -1.203  -8.914
  223    HE1  TYR  29           HE2      TYR  29  -2.094  -4.455  -5.246
  224    HE2  TYR  29           HE1      TYR  29  -4.349  -3.149  -8.660
  225    HH   TYR  29           HH       TYR  29  -3.699  -5.680  -6.282
  226    H    ALA  30           H        ALA  30   0.489   0.989  -4.696
  227    HA   ALA  30           HA       ALA  30   1.705   3.347  -6.073
  228   1HB   ALA  30          3HB       ALA  30   0.998   2.846  -3.206
  229   2HB   ALA  30          2HB       ALA  30   2.454   3.782  -3.546
  230   3HB   ALA  30          1HB       ALA  30   0.890   4.339  -4.139
  231    H    ASN  31           H        ASN  31   3.574   2.583  -6.953
  232    HA   ASN  31           HA       ASN  31   4.949   0.253  -5.954
  233   1HB   ASN  31          2HB       ASN  31   5.032   1.058  -8.335
  234   2HB   ASN  31          1HB       ASN  31   6.042   2.400  -7.793
  235   1HD2  ASN  31          2HD2      ASN  31   8.114  -0.658  -8.829
  236   2HD2  ASN  31          1HD2      ASN  31   6.793   0.085  -9.591
  237    H    TYR  32           H        TYR  32   5.283   0.845  -3.697
  238    HA   TYR  32           HA       TYR  32   6.822   3.142  -2.919
  239   1HB   TYR  32          2HB       TYR  32   5.357   1.487  -1.486
  240   2HB   TYR  32          1HB       TYR  32   6.860   0.573  -1.356
  241    HD1  TYR  32           HD1      TYR  32   5.947   4.223  -1.310
  242    HD2  TYR  32           HD2      TYR  32   7.998   0.981   0.621
  243    HE1  TYR  32           HE1      TYR  32   6.750   5.779   0.447
  244    HE2  TYR  32           HE2      TYR  32   8.801   2.536   2.377
  245    HH   TYR  32           HH       TYR  32   8.271   6.011   2.140
  246    H    GLU  33           H        GLU  33   9.097   3.047  -2.116
  247    HA   GLU  33           HA       GLU  33  10.799   1.708  -4.030
  248   1HB   GLU  33          2HB       GLU  33  11.417   3.177  -1.450
  249   2HB   GLU  33          1HB       GLU  33  12.656   2.560  -2.542
  250   1HG   GLU  33          2HG       GLU  33  12.453   4.396  -3.820
  251   2HG   GLU  33          1HG       GLU  33  10.756   4.008  -4.106
  252    H    GLY  34           H        GLY  34  10.215  -0.534  -3.739
  253   1HA   GLY  34          2HA       GLY  34  11.237  -2.587  -2.942
  254   2HA   GLY  34          1HA       GLY  34  11.647  -1.760  -1.440
  255    H    CYS  35           H        CYS  35   8.454  -1.266  -2.708
  256    HA   CYS  35           HA       CYS  35   7.218  -3.495  -1.325
  257   1HB   CYS  35          2HB       CYS  35   7.750  -1.029   0.149
  258   2HB   CYS  35          1HB       CYS  35   6.031  -1.422   0.115
  259    H    LEU  36           H        LEU  36   5.189  -3.798  -2.169
  260    HA   LEU  36           HA       LEU  36   4.101  -1.579  -3.846
  261   1HB   LEU  36          2HB       LEU  36   4.685  -3.705  -5.005
  262   2HB   LEU  36          1HB       LEU  36   3.517  -4.543  -4.008
  263    HG   LEU  36           HG       LEU  36   2.909  -3.565  -6.446
  264   1HD1  LEU  36          3HD1      LEU  36   1.541  -4.919  -4.751
  265   2HD1  LEU  36          2HD1      LEU  36   0.908  -3.369  -4.196
  266   3HD1  LEU  36          1HD1      LEU  36   0.641  -3.886  -5.861
  267   1HD2  LEU  36          3HD2      LEU  36   3.393  -1.203  -5.502
  268   2HD2  LEU  36          2HD2      LEU  36   1.891  -1.431  -6.390
  269   3HD2  LEU  36          1HD2      LEU  36   1.872  -1.387  -4.629
  270    H    TRP  37           H        TRP  37   2.436  -0.543  -2.888
  271    HA   TRP  37           HA       TRP  37   0.654  -2.082  -1.049
  272   1HB   TRP  37          2HB       TRP  37   0.677   0.918  -1.489
  273   2HB   TRP  37          1HB       TRP  37  -0.051   0.029  -0.163
  274    HD1  TRP  37           HD1      TRP  37   3.501   0.426  -1.645
  275    HE1  TRP  37           HE1      TRP  37   5.160   0.562   0.323
  276    HE3  TRP  37           HE3      TRP  37   0.273  -0.159   2.279
  277    HZ2  TRP  37           HZ2      TRP  37   5.117   0.444   3.186
  278    HZ3  TRP  37           HZ3      TRP  37   1.101  -0.147   4.600
  279    HH2  TRP  37           HH2      TRP  37   3.523   0.157   5.061
  280    H    ASN  38           H        ASN  38  -1.768  -1.228  -1.268
  281    HA   ASN  38           HA       ASN  38  -2.453  -0.534  -4.059
  282   1HB   ASN  38          2HB       ASN  38  -3.716  -2.450  -4.547
  283   2HB   ASN  38          1HB       ASN  38  -2.282  -3.108  -3.770
  284   1HD2  ASN  38          2HD2      ASN  38  -5.923  -3.482  -1.987
  285   2HD2  ASN  38          1HD2      ASN  38  -5.738  -2.621  -3.439
  286    H    ALA  39           H        ALA  39  -4.264   0.709  -4.139
  287    HA   ALA  39           HA       ALA  39  -5.712   1.159  -1.586
  288   1HB   ALA  39          1HB       ALA  39  -4.695   2.973  -3.327
  289   2HB   ALA  39          3HB       ALA  39  -6.332   2.820  -3.966
  290   3HB   ALA  39          2HB       ALA  39  -6.081   3.305  -2.288
  291    H    THR  40           H        THR  40  -7.826   0.634  -1.362
  292    HA   THR  40           HA       THR  40  -9.060  -1.216  -3.164
  293    HB   THR  40           HB       THR  40  -9.968  -1.472  -1.059
  294    HG1  THR  40           HG1      THR  40 -11.610  -0.791  -2.719
  295   1HG2  THR  40          3HG2      THR  40  -9.555   1.483  -0.858
  296   2HG2  THR  40          2HG2      THR  40 -10.754   0.736   0.198
  297   3HG2  THR  40          1HG2      THR  40  -9.071   0.206   0.260
  298    H    GLY  41           H        GLY  41 -10.831   1.711  -2.246
  299   1HA   GLY  41          2HA       GLY  41 -10.942   2.556  -5.085
  300   2HA   GLY  41          1HA       GLY  41 -12.468   2.113  -4.320
  301    H    VAL  42           H        VAL  42 -12.329   3.189  -1.838
  302    HA   VAL  42           HA       VAL  42 -12.632   6.024  -2.379
  303    HB   VAL  42           HB       VAL  42 -12.609   4.537   0.264
  304   1HG1  VAL  42          3HG1      VAL  42 -13.614   7.292  -0.519
  305   2HG1  VAL  42          2HG1      VAL  42 -13.891   6.530   1.047
  306   3HG1  VAL  42          1HG1      VAL  42 -12.251   6.944   0.545
  307   1HG2  VAL  42          3HG2      VAL  42 -14.383   4.234  -1.820
  308   2HG2  VAL  42          2HG2      VAL  42 -14.773   3.955  -0.123
  309   3HG2  VAL  42          1HG2      VAL  42 -15.150   5.506  -0.871
  310    H    VAL  43           H        VAL  43 -10.753   7.137  -2.781
  311    HA   VAL  43           HA       VAL  43  -8.728   7.158  -0.611
  312    HB   VAL  43           HB       VAL  43  -7.827   7.051  -3.484
  313   1HG1  VAL  43          3HG1      VAL  43  -6.613   6.722  -0.752
  314   2HG1  VAL  43          2HG1      VAL  43  -5.847   5.957  -2.144
  315   3HG1  VAL  43          1HG1      VAL  43  -6.056   7.708  -2.104
  316   1HG2  VAL  43          2HG2      VAL  43  -9.206   5.023  -3.020
  317   2HG2  VAL  43          1HG2      VAL  43  -7.501   4.634  -3.245
  318   3HG2  VAL  43          3HG2      VAL  43  -8.187   4.680  -1.621
  319    H    VAL  44           H        VAL  44  -7.127   9.039  -1.049
  320    HA   VAL  44           HA       VAL  44  -8.710  11.332  -2.123
  321    HB   VAL  44           HB       VAL  44  -7.901  11.169   0.342
  322   1HG1  VAL  44          2HG1      VAL  44  -5.548  10.573  -0.360
  323   2HG1  VAL  44          1HG1      VAL  44  -5.364  12.249  -0.875
  324   3HG1  VAL  44          3HG1      VAL  44  -5.679  11.876   0.820
  325   1HG2  VAL  44          3HG2      VAL  44  -8.789  13.198  -0.998
  326   2HG2  VAL  44          2HG2      VAL  44  -7.886  13.526   0.482
  327   3HG2  VAL  44          1HG2      VAL  44  -7.100  13.697  -1.088
  328    H    CYS  45           H        CYS  45  -8.066  11.654  -4.226
  329    HA   CYS  45           HA       CYS  45  -5.132  11.517  -4.779
  330   1HB   CYS  45          2HB       CYS  45  -7.539  10.713  -6.308
  331   2HB   CYS  45          1HB       CYS  45  -6.261  11.472  -7.249
  332    H    THR  46           H        THR  46  -4.120  13.242  -5.772
  333    HA   THR  46           HA       THR  46  -5.766  15.591  -6.546
  334    HB   THR  46           HB       THR  46  -4.955  15.857  -4.173
  335    HG1  THR  46           HG1      THR  46  -4.054  17.928  -4.589
  336   1HG2  THR  46          2HG2      THR  46  -2.270  15.728  -5.566
  337   2HG2  THR  46          1HG2      THR  46  -2.500  16.325  -3.921
  338   3HG2  THR  46          3HG2      THR  46  -2.867  14.643  -4.308
  339    H    GLY  47           H        GLY  47  -4.386  17.201  -7.781
  340   1HA   GLY  47          2HA       GLY  47  -2.982  17.642  -9.610
  341   2HA   GLY  47          1HA       GLY  47  -1.806  16.606  -8.799
  342    H    ASP  48           H        ASP  48  -4.721  16.451 -10.855
  343    HA   ASP  48           HA       ASP  48  -5.289  14.912 -12.541
  344   1HB   ASP  48          2HB       ASP  48  -2.312  14.684 -12.376
  345   2HB   ASP  48          1HB       ASP  48  -3.194  13.440 -13.261
  346    H    GLU  49           H        GLU  49  -4.812  14.248  -9.504
  347    HA   GLU  49           HA       GLU  49  -5.263  12.448  -8.136
  348   1HB   GLU  49          2HB       GLU  49  -6.233  11.297 -10.761
  349   2HB   GLU  49          1HB       GLU  49  -6.395  10.448  -9.222
  350   1HG   GLU  49          2HG       GLU  49  -8.455  11.627  -9.551
  351   2HG   GLU  49          1HG       GLU  49  -7.556  12.536  -8.337
  352    H    THR  50           H        THR  50  -2.742  12.639 -10.029
  353    HA   THR  50           HA       THR  50  -1.797   9.913 -10.212
  354    HB   THR  50           HB       THR  50   0.495  11.350 -10.190
  355    HG1  THR  50           HG1      THR  50  -0.776  13.242  -9.657
  356   1HG2  THR  50          3HG2      THR  50  -1.536  11.217 -12.435
  357   2HG2  THR  50          2HG2      THR  50   0.170  11.613 -12.645
  358   3HG2  THR  50          1HG2      THR  50  -0.299  10.014 -12.069
  359    H    GLN  51           H        GLN  51  -1.835  12.354  -7.703
  360    HA   GLN  51           HA       GLN  51  -0.085  10.614  -6.013
  361   1HB   GLN  51          2HB       GLN  51  -1.032  13.439  -5.446
  362   2HB   GLN  51          1HB       GLN  51   0.240  12.552  -4.604
  363   1HG   GLN  51          2HG       GLN  51   1.773  13.184  -6.127
  364   2HG   GLN  51          1HG       GLN  51   0.764  12.603  -7.452
  365   1HE2  GLN  51          2HE2      GLN  51   0.543  16.560  -6.363
  366   2HE2  GLN  51          1HE2      GLN  51   1.183  15.432  -5.270
  367    H    CYS  52           H        CYS  52  -0.960   9.758  -4.049
  368    HA   CYS  52           HA       CYS  52  -3.684  10.618  -3.344
  369   1HB   CYS  52          2HB       CYS  52  -3.252   8.288  -4.902
  370   2HB   CYS  52          1HB       CYS  52  -3.695   7.752  -3.285
  371    H    TYR  53           H        TYR  53  -4.461   9.475  -1.333
  372    HA   TYR  53           HA       TYR  53  -2.385   8.271   0.341
  373   1HB   TYR  53          2HB       TYR  53  -1.814  10.385   1.108
  374   2HB   TYR  53          1HB       TYR  53  -3.412  11.046   0.777
  375    HD1  TYR  53           HD1      TYR  53  -1.518   8.820   3.116
  376    HD2  TYR  53           HD2      TYR  53  -5.084  11.126   2.461
  377    HE1  TYR  53           HE1      TYR  53  -2.176   8.468   5.486
  378    HE2  TYR  53           HE2      TYR  53  -5.734  10.786   4.828
  379    HH   TYR  53           HH       TYR  53  -5.196   9.871   6.770
  380    H    GLY  54           H        GLY  54  -3.296   7.226   2.231
  381   1HA   GLY  54          2HA       GLY  54  -5.685   7.182   3.414
  382   2HA   GLY  54          1HA       GLY  54  -6.162   6.579   1.825
  383    H    THR  55           H        THR  55  -6.362   4.402   1.887
  384    HA   THR  55           HA       THR  55  -4.399   2.869   3.555
  385    HB   THR  55           HB       THR  55  -6.187   1.015   3.320
  386    HG1  THR  55           HG1      THR  55  -7.226   2.612   1.672
  387   1HG2  THR  55          3HG2      THR  55  -5.750   2.879   5.224
  388   2HG2  THR  55          2HG2      THR  55  -7.415   3.273   4.801
  389   3HG2  THR  55          1HG2      THR  55  -7.005   1.648   5.351
  390    H    TRP  56           H        TRP  56  -2.976   1.744   2.448
  391    HA   TRP  56           HA       TRP  56  -3.569   0.878  -0.345
  392   1HB   TRP  56          2HB       TRP  56  -0.908   1.567   0.880
  393   2HB   TRP  56          1HB       TRP  56  -1.234   1.240  -0.825
  394    HD1  TRP  56           HD1      TRP  56  -2.321   3.755   1.899
  395    HE1  TRP  56           HE1      TRP  56  -2.751   6.024   0.755
  396    HE3  TRP  56           HE3      TRP  56  -1.511   2.447  -2.962
  397    HZ2  TRP  56           HZ2      TRP  56  -2.745   7.128  -1.873
  398    HZ3  TRP  56           HZ3      TRP  56  -1.730   4.124  -4.770
  399    HH2  TRP  56           HH2      TRP  56  -2.348   6.467  -4.234
  400    H    VAL  57           H        VAL  57  -4.343  -1.162   0.956
  401    HA   VAL  57           HA       VAL  57  -2.826  -2.703   2.659
  402    HB   VAL  57           HB       VAL  57  -4.505  -3.597   0.307
  403   1HG1  VAL  57          3HG1      VAL  57  -2.806  -5.338   0.800
  404   2HG1  VAL  57          2HG1      VAL  57  -3.302  -5.325   2.492
  405   3HG1  VAL  57          1HG1      VAL  57  -4.429  -5.867   1.249
  406   1HG2  VAL  57          2HG2      VAL  57  -4.914  -2.925   3.145
  407   2HG2  VAL  57          1HG2      VAL  57  -6.075  -2.948   1.818
  408   3HG2  VAL  57          3HG2      VAL  57  -5.663  -4.444   2.657
  409    HA   PRO  58           HA       PRO  58   0.906  -3.521   0.418
  410   1HB   PRO  58          2HB       PRO  58   2.023  -5.163   2.339
  411   2HB   PRO  58          1HB       PRO  58   2.004  -3.394   2.443
  412   1HG   PRO  58          2HG       PRO  58   0.385  -5.377   3.955
  413   2HG   PRO  58          1HG       PRO  58   0.807  -3.706   4.384
  414   1HD   PRO  58          2HD       PRO  58  -1.693  -4.610   3.353
  415   2HD   PRO  58          1HD       PRO  58  -1.181  -2.923   3.561
  416    H    ILE  59           H        ILE  59   1.061  -4.970  -1.238
  417    HA   ILE  59           HA       ILE  59   0.005  -7.724  -0.803
  418    HB   ILE  59           HB       ILE  59   0.172  -7.487  -3.523
  419   1HG1  ILE  59          2HG1      ILE  59   0.766  -5.003  -3.063
  420   2HG1  ILE  59          1HG1      ILE  59  -0.503  -5.332  -4.244
  421   1HG2  ILE  59          3HG2      ILE  59  -2.036  -6.988  -1.543
  422   2HG2  ILE  59          2HG2      ILE  59  -2.349  -6.851  -3.273
  423   3HG2  ILE  59          1HG2      ILE  59  -1.784  -8.378  -2.598
  424   1HD1  ILE  59          1HD1      ILE  59  -1.246  -4.965  -1.358
  425   2HD1  ILE  59          3HD1      ILE  59  -0.923  -3.549  -2.359
  426   3HD1  ILE  59          2HD1      ILE  59  -2.204  -4.675  -2.806
  427    H    GLY  60           H        GLY  60   2.680  -5.880  -2.378
  428   1HA   GLY  60          2HA       GLY  60   4.333  -8.303  -1.960
  429   2HA   GLY  60          1HA       GLY  60   4.114  -7.815  -3.630
  430    H    LEU  61           H        LEU  61   6.070  -7.004  -4.231
  431    HA   LEU  61           HA       LEU  61   7.465  -5.196  -2.327
  432   1HB   LEU  61          2HB       LEU  61   8.661  -6.340  -4.842
  433   2HB   LEU  61          1HB       LEU  61   9.485  -5.771  -3.390
  434    HG   LEU  61           HG       LEU  61   7.757  -8.253  -3.634
  435   1HD1  LEU  61          1HD1      LEU  61  10.067  -8.416  -4.543
  436   2HD1  LEU  61          3HD1      LEU  61  10.697  -7.888  -2.982
  437   3HD1  LEU  61          2HD1      LEU  61   9.843  -9.427  -3.113
  438   1HD2  LEU  61          1HD2      LEU  61   7.533  -6.964  -1.452
  439   2HD2  LEU  61          3HD2      LEU  61   8.140  -8.612  -1.288
  440   3HD2  LEU  61          2HD2      LEU  61   9.254  -7.251  -1.199
  441    H    ALA  62           H        ALA  62   6.346  -5.271  -5.753
  442    HA   ALA  62           HA       ALA  62   6.564  -2.308  -5.650
  443   1HB   ALA  62          1HB       ALA  62   7.993  -4.101  -7.583
  444   2HB   ALA  62          3HB       ALA  62   7.558  -2.453  -8.038
  445   3HB   ALA  62          2HB       ALA  62   8.614  -2.736  -6.652
  446    H    ILE  63           H        ILE  63   5.706  -4.819  -8.151
  447    HA   ILE  63           HA       ILE  63   3.136  -3.310  -8.387
  448    HB   ILE  63           HB       ILE  63   4.759  -2.748 -10.220
  449   1HG1  ILE  63          2HG1      ILE  63   2.581  -4.127 -11.648
  450   2HG1  ILE  63          1HG1      ILE  63   2.035  -3.151 -10.284
  451   1HG2  ILE  63          3HG2      ILE  63   4.347  -5.694 -10.782
  452   2HG2  ILE  63          2HG2      ILE  63   4.880  -4.561 -12.026
  453   3HG2  ILE  63          1HG2      ILE  63   5.872  -4.828 -10.592
  454   1HD1  ILE  63          2HD1      ILE  63   3.489  -1.271 -11.214
  455   2HD1  ILE  63          1HD1      ILE  63   3.652  -2.248 -12.673
  456   3HD1  ILE  63          3HD1      ILE  63   2.062  -1.679 -12.168
  457    HA   PRO  64           HA       PRO  64   2.486  -8.026  -8.848
  458   1HB   PRO  64          2HB       PRO  64   2.373  -8.952  -6.268
  459   2HB   PRO  64          1HB       PRO  64   3.848  -9.004  -7.250
  460   1HG   PRO  64          2HG       PRO  64   3.133  -7.143  -5.024
  461   2HG   PRO  64          1HG       PRO  64   4.729  -7.722  -5.532
  462   1HD   PRO  64          2HD       PRO  64   3.665  -5.202  -6.128
  463   2HD   PRO  64          1HD       PRO  64   5.019  -5.974  -6.970
  464    H    GLU  65           H        GLU  65   0.307  -8.603  -8.876
  465    HA   GLU  65           HA       GLU  65  -1.623  -6.741  -7.758
  466   1HB   GLU  65          2HB       GLU  65  -3.257  -7.964  -8.941
  467   2HB   GLU  65          1HB       GLU  65  -1.808  -8.178  -9.924
  468   1HG   GLU  65          2HG       GLU  65  -1.467 -10.287  -8.333
  469   2HG   GLU  65          1HG       GLU  65  -3.218 -10.152  -8.176
  470    H    ASN  66           H        ASN  66  -3.682  -8.319  -6.807
  471    HA   ASN  66           HA       ASN  66  -2.525  -9.255  -4.232
  472   1HB   ASN  66          2HB       ASN  66  -4.622  -7.602  -4.668
  473   2HB   ASN  66          1HB       ASN  66  -5.472  -9.148  -4.621
  474   1HD2  ASN  66          2HD2      ASN  66  -4.550  -9.787  -1.172
  475   2HD2  ASN  66          1HD2      ASN  66  -4.801 -10.594  -2.646
  476    H    ALA  67           H        ALA  67  -2.297 -10.893  -6.625
  477    HA   ALA  67           HA       ALA  67  -3.379 -13.374  -5.544
  478   1HB   ALA  67          1HB       ALA  67  -4.549 -12.127  -8.032
  479   2HB   ALA  67          3HB       ALA  67  -4.576 -13.873  -7.782
  480   3HB   ALA  67          2HB       ALA  67  -5.398 -12.806  -6.643
  481    H    ALA  68           H        ALA  68  -2.419 -15.221  -6.579
  482    HA   ALA  68           HA       ALA  68  -0.610 -16.312  -7.607
  483   1HB   ALA  68          2HB       ALA  68  -1.692 -14.399  -9.614
  484   2HB   ALA  68          1HB       ALA  68  -0.107 -15.092  -9.959
  485   3HB   ALA  68          3HB       ALA  68  -1.499 -16.148  -9.718
  486    H    ALA  69           H        ALA  69   0.285 -13.289  -9.156
  487    HA   ALA  69           HA       ALA  69   2.977 -13.405  -8.224
  488   1HB   ALA  69          2HB       ALA  69   1.293 -11.214  -9.433
  489   2HB   ALA  69          1HB       ALA  69   2.943 -10.894  -8.900
  490   3HB   ALA  69          3HB       ALA  69   2.640 -12.094 -10.156
  491    H    HIS  70           HN       HIS  70   2.888 -13.680  -5.923
  492    HA   HIS  70           HA       HIS  70   1.633 -11.560  -4.304
  493   1HB   HIS  70          2HB       HIS  70   2.315 -14.271  -3.880
  494   2HB   HIS  70          1HB       HIS  70   3.333 -13.332  -2.787
  495    HD1  HIS  70           HD1      HIS  70   1.681 -14.474  -0.924
  496    HD2  HIS  70           HD2      HIS  70  -0.009 -11.559  -3.378
  497    HE1  HIS  70           HE1      HIS  70  -0.441 -13.709   0.228
   
  No H/Q in entry =         497
  Start of MODEL   12
    1   1H    GLU   1          2H        GLU   1  12.924  -7.799  -0.608
    2   2H    GLU   1          1H        GLU   1  12.529  -6.513  -1.645
    3   3H    GLU   1          3H        GLU   1  13.687  -6.293  -0.425
    4    HA   GLU   1           HA       GLU   1  12.148  -5.722   1.044
    5   1HB   GLU   1          2HB       GLU   1  11.119  -4.741  -1.033
    6   2HB   GLU   1          1HB       GLU   1  10.145  -6.207  -1.180
    7   1HG   GLU   1          2HG       GLU   1   8.675  -4.908   0.035
    8   2HG   GLU   1          1HG       GLU   1   9.575  -5.639   1.365
    9    H    THR   2           H        THR   2  11.128  -8.566  -0.823
   10    HA   THR   2           HA       THR   2  10.343 -10.637  -0.007
   11    HB   THR   2           HB       THR   2  10.399  -9.537   2.795
   12    HG1  THR   2           HG1      THR   2  12.559  -9.847   2.876
   13   1HG2  THR   2          2HG2      THR   2  10.735 -12.232   1.479
   14   2HG2  THR   2          1HG2      THR   2  11.223 -11.947   3.151
   15   3HG2  THR   2          3HG2      THR   2   9.537 -11.741   2.677
   16    H    VAL   3           H        VAL   3   8.200 -11.320   0.176
   17    HA   VAL   3           HA       VAL   3   6.192  -9.209   0.324
   18    HB   VAL   3           HB       VAL   3   5.459 -12.115   0.433
   19   1HG1  VAL   3          3HG1      VAL   3   3.850 -10.110   0.278
   20   2HG1  VAL   3          2HG1      VAL   3   4.437  -9.920  -1.374
   21   3HG1  VAL   3          1HG1      VAL   3   3.622 -11.408  -0.895
   22   1HG2  VAL   3          3HG2      VAL   3   6.865 -10.701  -1.834
   23   2HG2  VAL   3          2HG2      VAL   3   7.208 -12.292  -1.154
   24   3HG2  VAL   3          1HG2      VAL   3   5.766 -12.045  -2.139
   25    H    GLU   4           H        GLU   4   7.417 -11.735   2.446
   26    HA   GLU   4           HA       GLU   4   5.360 -11.720   4.402
   27   1HB   GLU   4          2HB       GLU   4   7.232 -13.354   4.366
   28   2HB   GLU   4          1HB       GLU   4   8.342 -12.068   4.841
   29   1HG   GLU   4          2HG       GLU   4   7.199 -11.760   6.944
   30   2HG   GLU   4          1HG       GLU   4   5.904 -12.855   6.456
   31    H    SER   5           H        SER   5   8.265  -9.666   4.096
   32    HA   SER   5           HA       SER   5   7.534  -8.113   6.466
   33   1HB   SER   5          2HB       SER   5   9.835  -8.362   4.730
   34   2HB   SER   5          1HB       SER   5   9.409  -6.665   4.931
   35    HG   SER   5           HG       SER   5  10.820  -7.549   6.580
   36    H    CYS   6           H        CYS   6   7.544  -7.557   2.934
   37    HA   CYS   6           HA       CYS   6   6.588  -4.903   2.948
   38   1HB   CYS   6          2HB       CYS   6   7.192  -6.463   0.937
   39   2HB   CYS   6          1HB       CYS   6   5.490  -6.920   0.997
   40    H    LEU   7           H        LEU   7   4.971  -7.890   3.729
   41    HA   LEU   7           HA       LEU   7   2.337  -6.543   3.827
   42   1HB   LEU   7          2HB       LEU   7   3.068  -9.403   4.505
   43   2HB   LEU   7          1HB       LEU   7   1.438  -8.756   4.311
   44    HG   LEU   7           HG       LEU   7   3.463  -8.542   2.090
   45   1HD1  LEU   7          3HD1      LEU   7   1.720 -10.886   2.852
   46   2HD1  LEU   7          2HD1      LEU   7   2.208 -10.612   1.179
   47   3HD1  LEU   7          1HD1      LEU   7   3.430 -10.885   2.420
   48   1HD2  LEU   7          2HD2      LEU   7   0.549  -8.118   2.494
   49   2HD2  LEU   7          1HD2      LEU   7   1.671  -7.279   1.422
   50   3HD2  LEU   7          3HD2      LEU   7   1.020  -8.853   0.960
   51    H    ALA   8           H        ALA   8   4.921  -7.654   5.861
   52    HA   ALA   8           HA       ALA   8   3.545  -7.596   8.387
   53   1HB   ALA   8          1HB       ALA   8   5.996  -8.417   7.709
   54   2HB   ALA   8          3HB       ALA   8   6.421  -6.773   8.188
   55   3HB   ALA   8          2HB       ALA   8   5.648  -7.856   9.345
   56    H    LYS   9           H        LYS   9   4.433  -5.236   6.140
   57    HA   LYS   9           HA       LYS   9   5.083  -2.910   7.479
   58   1HB   LYS   9          2HB       LYS   9   3.233  -3.493   5.151
   59   2HB   LYS   9          1HB       LYS   9   3.636  -1.851   5.609
   60   1HG   LYS   9          2HG       LYS   9   6.099  -2.601   5.493
   61   2HG   LYS   9          1HG       LYS   9   5.486  -4.014   4.633
   62   1HD   LYS   9          2HD       LYS   9   5.082  -2.831   2.744
   63   2HD   LYS   9          1HD       LYS   9   4.390  -1.479   3.640
   64   1HE   LYS   9          2HE       LYS   9   7.337  -2.058   3.239
   65   2HE   LYS   9          1HE       LYS   9   6.424  -0.722   2.541
   66   1HZ   LYS   9          3HZ       LYS   9   5.911  -0.473   5.173
   67   2HZ   LYS   9          2HZ       LYS   9   7.520  -1.020   5.186
   68   3HZ   LYS   9          1HZ       LYS   9   7.107   0.390   4.334
   69    HA   PRO  10           HA       PRO  10   1.565  -1.761   9.894
   70   1HB   PRO  10          2HB       PRO  10   1.076   0.867   9.223
   71   2HB   PRO  10          1HB       PRO  10   2.438   0.342  10.229
   72   1HG   PRO  10          2HG       PRO  10   2.445   1.262   7.401
   73   2HG   PRO  10          1HG       PRO  10   3.756   1.285   8.592
   74   1HD   PRO  10          2HD       PRO  10   3.425  -0.577   6.484
   75   2HD   PRO  10          1HD       PRO  10   4.588  -0.711   7.819
   76    H    HIS  11           H        HIS  11   1.260  -2.235   6.695
   77    HA   HIS  11           HA       HIS  11  -0.518  -2.807   5.354
   78   1HB   HIS  11          2HB       HIS  11  -1.793  -2.628   8.016
   79   2HB   HIS  11          1HB       HIS  11  -2.872  -2.478   6.625
   80    HD1  HIS  11           HD1      HIS  11  -3.891  -4.800   6.616
   81    HD2  HIS  11           HD2      HIS  11   0.282  -4.909   6.698
   82    HE1  HIS  11           HE1      HIS  11  -3.228  -7.215   6.243
   83    H    THR  12           H        THR  12  -2.410  -1.964   4.370
   84    HA   THR  12           HA       THR  12  -2.433   0.127   2.924
   85    HB   THR  12           HB       THR  12  -4.363  -1.449   3.780
   86    HG1  THR  12           HG1      THR  12  -5.679  -0.451   2.355
   87   1HG2  THR  12          3HG2      THR  12  -5.049   1.253   4.929
   88   2HG2  THR  12          2HG2      THR  12  -6.223  -0.042   4.700
   89   3HG2  THR  12          1HG2      THR  12  -4.874  -0.260   5.814
   90    H    GLU  13           H        GLU  13  -3.422   0.779   6.331
   91    HA   GLU  13           HA       GLU  13  -3.803   3.503   6.136
   92   1HB   GLU  13          2HB       GLU  13  -3.946   2.271   8.285
   93   2HB   GLU  13          1HB       GLU  13  -2.186   2.158   8.329
   94   1HG   GLU  13          2HG       GLU  13  -2.770   4.880   7.854
   95   2HG   GLU  13          1HG       GLU  13  -3.877   4.360   9.128
   96    H    ASN  14           H        ASN  14  -2.609   4.614   4.677
   97    HA   ASN  14           HA       ASN  14  -0.240   5.905   5.272
   98   1HB   ASN  14          2HB       ASN  14   0.244   3.119   4.621
   99   2HB   ASN  14          1HB       ASN  14   1.013   4.165   3.428
  100   1HD2  ASN  14          1HD2      ASN  14   2.337   6.055   4.448
  101   2HD2  ASN  14          2HD2      ASN  14   3.195   5.705   5.871
  102    H    SER  15           H        SER  15   1.046   5.751   2.647
  103    HA   SER  15           HA       SER  15  -0.899   5.891   0.560
  104   1HB   SER  15          2HB       SER  15  -0.945   8.364   0.274
  105   2HB   SER  15          1HB       SER  15  -1.711   7.844   1.769
  106    HG   SER  15           HG       SER  15   0.685   8.147   2.509
  107    H    PHE  16           H        PHE  16   0.161   7.772  -1.083
  108    HA   PHE  16           HA       PHE  16   2.987   7.940  -1.200
  109   1HB   PHE  16          2HB       PHE  16   2.747   5.442  -1.415
  110   2HB   PHE  16          1HB       PHE  16   1.823   5.713  -2.892
  111    HD1  PHE  16           HD1      PHE  16   5.156   5.982  -1.322
  112    HD2  PHE  16           HD2      PHE  16   2.866   6.508  -4.910
  113    HE1  PHE  16           HE1      PHE  16   7.254   6.205  -2.627
  114    HE2  PHE  16           HE2      PHE  16   4.951   6.738  -6.215
  115    HZ   PHE  16           HZ       PHE  16   7.155   6.583  -5.078
  116    H    THR  17           H        THR  17   3.620   8.938  -3.323
  117    HA   THR  17           HA       THR  17   1.195   9.971  -4.708
  118    HB   THR  17           HB       THR  17   2.142  11.933  -4.060
  119    HG1  THR  17           HG1      THR  17   4.126  11.652  -5.983
  120   1HG2  THR  17          2HG2      THR  17   4.703  10.345  -3.958
  121   2HG2  THR  17          1HG2      THR  17   4.727  12.104  -3.841
  122   3HG2  THR  17          3HG2      THR  17   3.852  11.152  -2.641
  123    H    ASN  18           H        ASN  18   1.895  10.769  -7.088
  124    HA   ASN  18           HA       ASN  18   2.413   9.981  -9.245
  125   1HB   ASN  18          2HB       ASN  18   4.642   8.637  -7.681
  126   2HB   ASN  18          1HB       ASN  18   4.549   8.681  -9.442
  127   1HD2  ASN  18          2HD2      ASN  18   6.656  11.568  -8.529
  128   2HD2  ASN  18          1HD2      ASN  18   6.784   9.876  -8.517
  129    H    VAL  19           H        VAL  19   0.836   8.400  -7.097
  130    HA   VAL  19           HA       VAL  19   1.054   5.654  -7.294
  131    HB   VAL  19           HB       VAL  19  -1.488   7.297  -7.442
  132   1HG1  VAL  19          1HG1      VAL  19  -1.793   4.898  -8.037
  133   2HG1  VAL  19          3HG1      VAL  19  -1.044   4.443  -6.506
  134   3HG1  VAL  19          2HG1      VAL  19  -2.578   5.310  -6.513
  135   1HG2  VAL  19          1HG2      VAL  19   0.343   7.500  -5.509
  136   2HG2  VAL  19          3HG2      VAL  19  -1.381   7.503  -5.139
  137   3HG2  VAL  19          2HG2      VAL  19  -0.440   6.024  -4.944
  138    H    TRP  20           H        TRP  20   0.009   4.070  -8.676
  139    HA   TRP  20           HA       TRP  20  -0.702   5.058 -11.392
  140   1HB   TRP  20          2HB       TRP  20   0.926   3.864 -12.459
  141   2HB   TRP  20          1HB       TRP  20   1.745   3.909 -10.903
  142    HD1  TRP  20           HD1      TRP  20  -0.209   1.600 -13.215
  143    HE1  TRP  20           HE1      TRP  20   0.012  -0.834 -12.386
  144    HE3  TRP  20           HE3      TRP  20   2.203   2.406  -8.785
  145    HZ2  TRP  20           HZ2      TRP  20   1.111  -2.246 -10.154
  146    HZ3  TRP  20           HZ3      TRP  20   2.833   0.498  -7.334
  147    HH2  TRP  20           HH2      TRP  20   2.291  -1.824  -8.012
  148    H    LYS  21           H        LYS  21  -1.472   2.816 -12.616
  149    HA   LYS  21           HA       LYS  21  -3.186   1.301 -10.713
  150   1HB   LYS  21          2HB       LYS  21  -4.669   3.005 -11.625
  151   2HB   LYS  21          1HB       LYS  21  -4.136   2.636 -13.268
  152   1HG   LYS  21          2HG       LYS  21  -5.040   0.261 -11.812
  153   2HG   LYS  21          1HG       LYS  21  -6.309   1.474 -11.990
  154   1HD   LYS  21          2HD       LYS  21  -4.818   1.217 -14.456
  155   2HD   LYS  21          1HD       LYS  21  -5.423  -0.358 -13.942
  156   1HE   LYS  21          2HE       LYS  21  -7.283   0.402 -15.077
  157   2HE   LYS  21          1HE       LYS  21  -7.638   1.056 -13.478
  158   1HZ   LYS  21          1HZ       LYS  21  -6.290   3.065 -14.309
  159   2HZ   LYS  21          3HZ       LYS  21  -6.594   2.443 -15.858
  160   3HZ   LYS  21          2HZ       LYS  21  -7.891   2.877 -14.847
  161    H    ASP  22           H        ASP  22  -3.446  -0.876 -11.345
  162    HA   ASP  22           HA       ASP  22  -1.951  -1.596 -13.811
  163   1HB   ASP  22          2HB       ASP  22  -2.317  -3.814 -11.978
  164   2HB   ASP  22          1HB       ASP  22  -0.827  -3.165 -12.650
  165    H    ASP  23           H        ASP  23  -3.227  -2.357 -15.387
  166    HA   ASP  23           HA       ASP  23  -5.971  -3.225 -14.827
  167   1HB   ASP  23          2HB       ASP  23  -5.293  -1.997 -16.942
  168   2HB   ASP  23          1HB       ASP  23  -4.407  -3.444 -17.424
  169    H    LYS  24           H        LYS  24  -2.870  -4.535 -14.791
  170    HA   LYS  24           HA       LYS  24  -3.619  -7.296 -15.464
  171   1HB   LYS  24          2HB       LYS  24  -1.095  -5.899 -14.545
  172   2HB   LYS  24          1HB       LYS  24  -1.188  -7.658 -14.701
  173   1HG   LYS  24          2HG       LYS  24  -2.150  -7.093 -17.096
  174   2HG   LYS  24          1HG       LYS  24  -1.320  -5.557 -16.843
  175   1HD   LYS  24          2HD       LYS  24   0.573  -6.572 -17.525
  176   2HD   LYS  24          1HD       LYS  24   0.523  -7.507 -16.030
  177   1HE   LYS  24          2HE       LYS  24  -0.833  -8.286 -18.629
  178   2HE   LYS  24          1HE       LYS  24   0.662  -8.987 -18.009
  179   1HZ   LYS  24          3HZ       LYS  24  -0.763  -9.425 -15.917
  180   2HZ   LYS  24          2HZ       LYS  24  -2.080  -9.248 -16.975
  181   3HZ   LYS  24          1HZ       LYS  24  -0.918 -10.455 -17.255
  182    H    THR  25           H        THR  25  -2.149  -5.662 -12.641
  183    HA   THR  25           HA       THR  25  -2.713  -7.765 -10.781
  184    HB   THR  25           HB       THR  25  -2.099  -6.247  -9.081
  185    HG1  THR  25           HG1      THR  25  -3.684  -4.721  -9.456
  186   1HG2  THR  25          1HG2      THR  25  -0.316  -6.513 -10.831
  187   2HG2  THR  25          3HG2      THR  25  -0.866  -5.001 -11.550
  188   3HG2  THR  25          2HG2      THR  25  -0.208  -5.009  -9.919
  189    H    LEU  26           H        LEU  26  -4.485  -5.000 -11.970
  190    HA   LEU  26           HA       LEU  26  -6.827  -4.697 -12.063
  191   1HB   LEU  26          2HB       LEU  26  -6.562  -7.412 -11.288
  192   2HB   LEU  26          1HB       LEU  26  -7.731  -6.683 -10.186
  193    HG   LEU  26           HG       LEU  26  -7.825  -6.527 -13.214
  194   1HD1  LEU  26          3HD1      LEU  26  -9.093  -8.310 -11.176
  195   2HD1  LEU  26          2HD1      LEU  26 -10.069  -7.815 -12.559
  196   3HD1  LEU  26          1HD1      LEU  26  -8.555  -8.683 -12.814
  197   1HD2  LEU  26          2HD2      LEU  26  -9.635  -5.463 -11.029
  198   2HD2  LEU  26          1HD2      LEU  26  -8.805  -4.538 -12.281
  199   3HD2  LEU  26          3HD2      LEU  26 -10.140  -5.607 -12.713
  200    H    ASP  27           H        ASP  27  -5.719  -2.889 -10.605
  201    HA   ASP  27           HA       ASP  27  -7.510  -2.097  -8.614
  202   1HB   ASP  27          2HB       ASP  27  -5.926  -4.285  -7.720
  203   2HB   ASP  27          1HB       ASP  27  -5.404  -2.858  -6.826
  204    H    ARG  28           H        ARG  28  -6.410  -0.468  -6.970
  205    HA   ARG  28           HA       ARG  28  -4.521   1.145  -8.574
  206   1HB   ARG  28          2HB       ARG  28  -6.533   2.040  -7.168
  207   2HB   ARG  28          1HB       ARG  28  -5.453   1.833  -5.787
  208   1HG   ARG  28          2HG       ARG  28  -4.433   3.772  -6.295
  209   2HG   ARG  28          1HG       ARG  28  -3.970   3.111  -7.864
  210   1HD   ARG  28          2HD       ARG  28  -5.323   5.216  -8.034
  211   2HD   ARG  28          1HD       ARG  28  -6.063   3.842  -8.852
  212    HE   ARG  28           HE       ARG  28  -7.166   3.782  -6.307
  213   1HH1  ARG  28          1HH2      ARG  28  -6.434   6.712  -7.718
  214   2HH1  ARG  28          2HH2      ARG  28  -8.066   7.281  -7.828
  215   1HH2  ARG  28          2HH1      ARG  28  -9.464   4.238  -6.926
  216   2HH2  ARG  28          1HH1      ARG  28  -9.783   5.879  -7.379
  217    H    TYR  29           H        TYR  29  -2.387   1.746  -7.720
  218    HA   TYR  29           HA       TYR  29  -1.483   0.309  -5.313
  219   1HB   TYR  29          2HB       TYR  29  -0.362  -0.290  -8.061
  220   2HB   TYR  29          1HB       TYR  29   0.357  -0.830  -6.544
  221    HD1  TYR  29           HD1      TYR  29  -2.535  -1.152  -8.807
  222    HD2  TYR  29           HD2      TYR  29  -0.693  -2.553  -5.191
  223    HE1  TYR  29           HE1      TYR  29  -4.114  -3.061  -8.737
  224    HE2  TYR  29           HE2      TYR  29  -2.269  -4.457  -5.123
  225    HH   TYR  29           HH       TYR  29  -4.760  -4.793  -6.132
  226    H    ALA  30           H        ALA  30   0.524   1.048  -4.522
  227    HA   ALA  30           HA       ALA  30   1.610   3.477  -5.883
  228   1HB   ALA  30          3HB       ALA  30   0.650   3.066  -3.116
  229   2HB   ALA  30          2HB       ALA  30   2.208   3.884  -3.245
  230   3HB   ALA  30          1HB       ALA  30   0.788   4.556  -4.047
  231    H    ASN  31           H        ASN  31   3.608   2.907  -6.608
  232    HA   ASN  31           HA       ASN  31   5.098   0.686  -5.538
  233   1HB   ASN  31          2HB       ASN  31   5.210   1.854  -7.895
  234   2HB   ASN  31          1HB       ASN  31   6.420   2.871  -7.111
  235   1HD2  ASN  31          2HD2      ASN  31   7.800  -0.469  -8.525
  236   2HD2  ASN  31          1HD2      ASN  31   6.597   0.536  -9.179
  237    H    TYR  32           H        TYR  32   5.774   0.849  -3.432
  238    HA   TYR  32           HA       TYR  32   6.968   3.391  -2.496
  239   1HB   TYR  32          2HB       TYR  32   5.370   1.622  -1.201
  240   2HB   TYR  32          1HB       TYR  32   6.955   1.007  -0.727
  241    HD1  TYR  32           HD2      TYR  32   8.596   3.421  -0.640
  242    HD2  TYR  32           HD1      TYR  32   4.551   2.811   0.663
  243    HE1  TYR  32           HE2      TYR  32   8.842   5.278   0.984
  244    HE2  TYR  32           HE1      TYR  32   4.795   4.668   2.290
  245    HH   TYR  32           HH       TYR  32   7.271   6.902   2.168
  246    H    GLU  33           H        GLU  33   8.499   2.351  -4.469
  247    HA   GLU  33           HA       GLU  33  10.543   1.261  -4.999
  248   1HB   GLU  33          2HB       GLU  33  11.101   3.532  -4.124
  249   2HB   GLU  33          1HB       GLU  33  11.308   2.826  -2.520
  250   1HG   GLU  33          2HG       GLU  33  13.257   1.738  -3.095
  251   2HG   GLU  33          1HG       GLU  33  12.782   1.560  -4.786
  252    H    GLY  34           H        GLY  34  10.270  -0.966  -4.587
  253   1HA   GLY  34          2HA       GLY  34  11.383  -2.842  -3.503
  254   2HA   GLY  34          1HA       GLY  34  11.483  -1.882  -2.025
  255    H    CYS  35           H        CYS  35   8.731  -0.951  -2.116
  256    HA   CYS  35           HA       CYS  35   7.337  -3.536  -1.527
  257   1HB   CYS  35          2HB       CYS  35   7.724  -1.153   0.085
  258   2HB   CYS  35          1HB       CYS  35   6.007  -1.475  -0.152
  259    H    LEU  36           H        LEU  36   4.893  -3.322  -1.752
  260    HA   LEU  36           HA       LEU  36   4.069  -1.246  -3.697
  261   1HB   LEU  36          2HB       LEU  36   4.802  -3.491  -4.809
  262   2HB   LEU  36          1HB       LEU  36   3.278  -4.106  -4.178
  263    HG   LEU  36           HG       LEU  36   3.072  -3.210  -6.496
  264   1HD1  LEU  36          1HD1      LEU  36   1.356  -2.935  -4.397
  265   2HD1  LEU  36          3HD1      LEU  36   1.504  -1.262  -4.939
  266   3HD1  LEU  36          2HD1      LEU  36   0.961  -2.509  -6.062
  267   1HD2  LEU  36          3HD2      LEU  36   4.686  -1.164  -5.493
  268   2HD2  LEU  36          2HD2      LEU  36   3.892  -1.183  -7.067
  269   3HD2  LEU  36          1HD2      LEU  36   3.104  -0.412  -5.691
  270    H    TRP  37           H        TRP  37   2.310  -0.333  -2.832
  271    HA   TRP  37           HA       TRP  37   0.581  -1.952  -1.032
  272   1HB   TRP  37          2HB       TRP  37   0.515   1.046  -1.500
  273   2HB   TRP  37          1HB       TRP  37  -0.245   0.144  -0.201
  274    HD1  TRP  37           HD1      TRP  37   3.394   0.309  -1.529
  275    HE1  TRP  37           HE1      TRP  37   4.959   0.559   0.496
  276    HE3  TRP  37           HE3      TRP  37  -0.049   0.381   2.253
  277    HZ2  TRP  37           HZ2      TRP  37   4.782   0.763   3.343
  278    HZ3  TRP  37           HZ3      TRP  37   0.675   0.595   4.602
  279    HH2  TRP  37           HH2      TRP  37   3.089   0.791   5.158
  280    H    ASN  38           H        ASN  38  -1.876  -1.345  -1.275
  281    HA   ASN  38           HA       ASN  38  -2.548  -0.796  -4.121
  282   1HB   ASN  38          2HB       ASN  38  -3.863  -2.746  -4.391
  283   2HB   ASN  38          1HB       ASN  38  -2.380  -3.316  -3.634
  284   1HD2  ASN  38          2HD2      ASN  38  -5.874  -3.344  -1.479
  285   2HD2  ASN  38          1HD2      ASN  38  -5.764  -2.404  -2.888
  286    H    ALA  39           H        ALA  39  -4.192   0.586  -4.272
  287    HA   ALA  39           HA       ALA  39  -5.827   1.153  -1.860
  288   1HB   ALA  39          2HB       ALA  39  -4.778   2.726  -4.065
  289   2HB   ALA  39          1HB       ALA  39  -6.523   2.936  -3.921
  290   3HB   ALA  39          3HB       ALA  39  -5.478   3.278  -2.544
  291    H    THR  40           H        THR  40  -8.071   0.934  -1.904
  292    HA   THR  40           HA       THR  40  -9.139  -0.886  -3.939
  293    HB   THR  40           HB       THR  40 -10.880  -1.264  -2.463
  294    HG1  THR  40           HG1      THR  40 -10.809   0.998  -0.953
  295   1HG2  THR  40          2HG2      THR  40  -8.568  -1.434  -1.312
  296   2HG2  THR  40          1HG2      THR  40  -9.031   0.046  -0.470
  297   3HG2  THR  40          3HG2      THR  40  -9.996  -1.417  -0.278
  298    H    GLY  41           H        GLY  41 -10.013   2.377  -2.740
  299   1HA   GLY  41          2HA       GLY  41 -10.445   3.448  -5.352
  300   2HA   GLY  41          1HA       GLY  41 -11.994   2.915  -4.698
  301    H    VAL  42           H        VAL  42 -12.180   3.638  -2.218
  302    HA   VAL  42           HA       VAL  42 -12.394   6.473  -2.211
  303    HB   VAL  42           HB       VAL  42 -13.700   4.959  -0.729
  304   1HG1  VAL  42          2HG1      VAL  42 -11.102   4.022  -0.053
  305   2HG1  VAL  42          1HG1      VAL  42 -11.787   4.737   1.406
  306   3HG1  VAL  42          3HG1      VAL  42 -12.649   3.449   0.567
  307   1HG2  VAL  42          2HG2      VAL  42 -12.014   7.070   0.653
  308   2HG2  VAL  42          1HG2      VAL  42 -13.561   7.326  -0.153
  309   3HG2  VAL  42          3HG2      VAL  42 -13.486   6.373   1.328
  310    H    VAL  43           H        VAL  43 -10.304   7.294  -2.839
  311    HA   VAL  43           HA       VAL  43  -8.420   7.456  -0.552
  312    HB   VAL  43           HB       VAL  43  -7.329   7.051  -3.325
  313   1HG1  VAL  43          2HG1      VAL  43  -6.344   6.662  -0.491
  314   2HG1  VAL  43          1HG1      VAL  43  -5.465   6.051  -1.893
  315   3HG1  VAL  43          3HG1      VAL  43  -5.728   7.784  -1.704
  316   1HG2  VAL  43          2HG2      VAL  43  -8.908   5.155  -2.755
  317   2HG2  VAL  43          1HG2      VAL  43  -7.230   4.659  -2.980
  318   3HG2  VAL  43          3HG2      VAL  43  -7.893   4.817  -1.354
  319    H    VAL  44           H        VAL  44  -7.946   9.573  -0.219
  320    HA   VAL  44           HA       VAL  44  -8.931  11.671  -1.852
  321    HB   VAL  44           HB       VAL  44  -6.727  11.613   0.220
  322   1HG1  VAL  44          3HG1      VAL  44  -7.644  13.770  -1.596
  323   2HG1  VAL  44          2HG1      VAL  44  -7.510  14.212   0.106
  324   3HG1  VAL  44          1HG1      VAL  44  -6.104  13.583  -0.755
  325   1HG2  VAL  44          3HG2      VAL  44  -9.290  11.216   0.682
  326   2HG2  VAL  44          2HG2      VAL  44  -8.375  12.303   1.728
  327   3HG2  VAL  44          1HG2      VAL  44  -9.403  12.963   0.456
  328    H    CYS  45           H        CYS  45  -8.286  12.088  -3.908
  329    HA   CYS  45           HA       CYS  45  -5.387  11.744  -4.564
  330   1HB   CYS  45          2HB       CYS  45  -7.883  11.122  -6.026
  331   2HB   CYS  45          1HB       CYS  45  -6.624  11.885  -6.995
  332    H    THR  46           H        THR  46  -4.301  13.493  -5.449
  333    HA   THR  46           HA       THR  46  -5.871  15.901  -6.183
  334    HB   THR  46           HB       THR  46  -5.190  16.182  -3.820
  335    HG1  THR  46           HG1      THR  46  -5.178  17.971  -5.287
  336   1HG2  THR  46          2HG2      THR  46  -2.497  15.522  -4.990
  337   2HG2  THR  46          1HG2      THR  46  -2.624  16.493  -3.523
  338   3HG2  THR  46          3HG2      THR  46  -3.272  14.854  -3.554
  339    H    GLY  47           H        GLY  47  -4.550  17.450  -7.448
  340   1HA   GLY  47          2HA       GLY  47  -3.035  17.935  -9.174
  341   2HA   GLY  47          1HA       GLY  47  -1.919  16.820  -8.383
  342    H    ASP  48           H        ASP  48  -5.036  16.556 -10.139
  343    HA   ASP  48           HA       ASP  48  -5.618  15.105 -11.907
  344   1HB   ASP  48          2HB       ASP  48  -2.751  15.481 -12.165
  345   2HB   ASP  48          1HB       ASP  48  -3.210  13.835 -12.598
  346    H    GLU  49           H        GLU  49  -4.635  14.341  -8.957
  347    HA   GLU  49           HA       GLU  49  -5.049  12.437  -7.681
  348   1HB   GLU  49          2HB       GLU  49  -5.420  10.870 -10.238
  349   2HB   GLU  49          1HB       GLU  49  -6.056  10.504  -8.635
  350   1HG   GLU  49          2HG       GLU  49  -7.918  11.671  -9.106
  351   2HG   GLU  49          1HG       GLU  49  -6.945  13.124  -9.340
  352    H    THR  50           H        THR  50  -2.576  12.916  -9.876
  353    HA   THR  50           HA       THR  50  -1.140  10.492  -9.892
  354    HB   THR  50           HB       THR  50   0.850  12.354  -9.420
  355    HG1  THR  50           HG1      THR  50   0.153  14.270  -9.915
  356   1HG2  THR  50          1HG2      THR  50  -0.598  11.445 -11.893
  357   2HG2  THR  50          3HG2      THR  50   0.740  12.589 -12.007
  358   3HG2  THR  50          2HG2      THR  50   1.006  10.987 -11.317
  359    H    GLN  51           H        GLN  51  -1.628  12.839  -7.299
  360    HA   GLN  51           HA       GLN  51   0.012  11.095  -5.517
  361   1HB   GLN  51          2HB       GLN  51  -1.107  13.782  -4.740
  362   2HB   GLN  51          1HB       GLN  51   0.286  12.933  -4.071
  363   1HG   GLN  51          2HG       GLN  51   1.680  13.839  -5.600
  364   2HG   GLN  51          1HG       GLN  51   0.596  13.431  -6.931
  365   1HE2  GLN  51          2HE2      GLN  51   0.357  17.145  -5.206
  366   2HE2  GLN  51          1HE2      GLN  51   1.197  15.901  -4.412
  367    H    CYS  52           H        CYS  52  -1.037  10.015  -3.824
  368    HA   CYS  52           HA       CYS  52  -3.801  10.825  -3.202
  369   1HB   CYS  52          2HB       CYS  52  -3.419   8.923  -5.159
  370   2HB   CYS  52          1HB       CYS  52  -3.675   7.941  -3.716
  371    H    TYR  53           H        TYR  53  -4.656   9.808  -1.276
  372    HA   TYR  53           HA       TYR  53  -2.810   8.099   0.262
  373   1HB   TYR  53          2HB       TYR  53  -2.006  10.076   1.202
  374   2HB   TYR  53          1HB       TYR  53  -3.542  10.916   0.997
  375    HD1  TYR  53           HD2      TYR  53  -5.494  10.300   2.486
  376    HD2  TYR  53           HD1      TYR  53  -1.498   8.910   3.238
  377    HE1  TYR  53           HE2      TYR  53  -6.126   9.731   4.814
  378    HE2  TYR  53           HE1      TYR  53  -2.134   8.333   5.564
  379    HH   TYR  53           HH       TYR  53  -5.294   9.206   6.867
  380    H    GLY  54           H        GLY  54  -3.878   7.183   2.185
  381   1HA   GLY  54          2HA       GLY  54  -6.350   7.328   3.210
  382   2HA   GLY  54          1HA       GLY  54  -6.733   6.662   1.619
  383    H    THR  55           H        THR  55  -6.265   4.504   1.202
  384    HA   THR  55           HA       THR  55  -4.727   3.012   3.270
  385    HB   THR  55           HB       THR  55  -6.541   1.143   2.887
  386    HG1  THR  55           HG1      THR  55  -7.542   2.960   1.399
  387   1HG2  THR  55          2HG2      THR  55  -6.003   2.884   4.896
  388   2HG2  THR  55          1HG2      THR  55  -7.682   3.304   4.549
  389   3HG2  THR  55          3HG2      THR  55  -7.256   1.647   4.978
  390    H    TRP  56           H        TRP  56  -3.303   1.703   2.315
  391    HA   TRP  56           HA       TRP  56  -3.758   0.774  -0.480
  392   1HB   TRP  56          2HB       TRP  56  -1.134   1.616   0.712
  393   2HB   TRP  56          1HB       TRP  56  -1.473   1.263  -0.986
  394    HD1  TRP  56           HD1      TRP  56  -2.681   3.730   1.729
  395    HE1  TRP  56           HE1      TRP  56  -3.196   5.982   0.599
  396    HE3  TRP  56           HE3      TRP  56  -1.730   2.483  -3.119
  397    HZ2  TRP  56           HZ2      TRP  56  -3.197   7.108  -2.052
  398    HZ3  TRP  56           HZ3      TRP  56  -1.998   4.150  -4.929
  399    HH2  TRP  56           HH2      TRP  56  -2.731   6.462  -4.403
  400    H    VAL  57           H        VAL  57  -4.427  -1.250   0.847
  401    HA   VAL  57           HA       VAL  57  -2.785  -2.572   2.669
  402    HB   VAL  57           HB       VAL  57  -4.443  -3.777   0.433
  403   1HG1  VAL  57          2HG1      VAL  57  -2.516  -5.060   2.040
  404   2HG1  VAL  57          1HG1      VAL  57  -4.076  -5.459   2.761
  405   3HG1  VAL  57          3HG1      VAL  57  -3.768  -5.831   1.064
  406   1HG2  VAL  57          1HG2      VAL  57  -5.448  -2.316   2.347
  407   2HG2  VAL  57          3HG2      VAL  57  -6.188  -3.881   2.012
  408   3HG2  VAL  57          2HG2      VAL  57  -5.086  -3.701   3.378
  409    HA   PRO  58           HA       PRO  58   0.904  -3.365   0.328
  410   1HB   PRO  58          2HB       PRO  58   2.110  -4.970   2.244
  411   2HB   PRO  58          1HB       PRO  58   2.113  -3.197   2.283
  412   1HG   PRO  58          2HG       PRO  58   0.505  -5.112   3.910
  413   2HG   PRO  58          1HG       PRO  58   1.042  -3.465   4.312
  414   1HD   PRO  58          2HD       PRO  58  -1.564  -4.169   3.495
  415   2HD   PRO  58          1HD       PRO  58  -0.888  -2.527   3.481
  416    H    ILE  59           H        ILE  59   1.538  -5.069  -1.057
  417    HA   ILE  59           HA       ILE  59   0.510  -7.788  -0.527
  418    HB   ILE  59           HB       ILE  59  -0.615  -7.863  -2.755
  419   1HG1  ILE  59          2HG1      ILE  59   0.739  -5.768  -3.524
  420   2HG1  ILE  59          1HG1      ILE  59  -0.923  -5.942  -4.073
  421   1HG2  ILE  59          3HG2      ILE  59  -1.853  -7.442  -0.616
  422   2HG2  ILE  59          2HG2      ILE  59  -1.704  -5.711  -0.915
  423   3HG2  ILE  59          1HG2      ILE  59  -2.635  -6.720  -2.022
  424   1HD1  ILE  59          1HD1      ILE  59  -1.639  -4.483  -2.154
  425   2HD1  ILE  59          3HD1      ILE  59   0.061  -4.199  -1.795
  426   3HD1  ILE  59          2HD1      ILE  59  -0.611  -3.664  -3.326
  427    H    GLY  60           H        GLY  60   2.370  -5.610  -2.634
  428   1HA   GLY  60          2HA       GLY  60   3.933  -8.031  -3.431
  429   2HA   GLY  60          1HA       GLY  60   3.451  -6.832  -4.626
  430    H    LEU  61           H        LEU  61   6.034  -7.274  -4.569
  431    HA   LEU  61           HA       LEU  61   7.443  -5.552  -2.677
  432   1HB   LEU  61          2HB       LEU  61   8.490  -6.712  -5.275
  433   2HB   LEU  61          1HB       LEU  61   9.430  -6.194  -3.875
  434    HG   LEU  61           HG       LEU  61   7.409  -8.453  -3.836
  435   1HD1  LEU  61          1HD1      LEU  61  10.174  -8.347  -4.729
  436   2HD1  LEU  61          3HD1      LEU  61   9.987  -9.446  -3.363
  437   3HD1  LEU  61          2HD1      LEU  61   9.024  -9.681  -4.820
  438   1HD2  LEU  61          3HD2      LEU  61   8.018  -7.087  -1.704
  439   2HD2  LEU  61          2HD2      LEU  61   8.117  -8.845  -1.618
  440   3HD2  LEU  61          1HD2      LEU  61   9.584  -7.889  -1.823
  441    H    ALA  62           H        ALA  62   6.062  -5.283  -5.902
  442    HA   ALA  62           HA       ALA  62   5.939  -2.478  -5.858
  443   1HB   ALA  62          3HB       ALA  62   8.588  -3.280  -6.132
  444   2HB   ALA  62          2HB       ALA  62   8.095  -2.865  -7.774
  445   3HB   ALA  62          1HB       ALA  62   7.942  -1.676  -6.480
  446    H    ILE  63           H        ILE  63   4.253  -4.510  -6.905
  447    HA   ILE  63           HA       ILE  63   3.324  -3.433  -9.232
  448    HB   ILE  63           HB       ILE  63   5.827  -4.744  -9.788
  449   1HG1  ILE  63          2HG1      ILE  63   5.306  -2.553 -10.629
  450   2HG1  ILE  63          1HG1      ILE  63   5.379  -3.625 -12.025
  451   1HG2  ILE  63          1HG2      ILE  63   3.410  -5.799 -11.275
  452   2HG2  ILE  63          3HG2      ILE  63   5.057  -5.900 -11.897
  453   3HG2  ILE  63          2HG2      ILE  63   4.624  -6.738 -10.406
  454   1HD1  ILE  63          3HD1      ILE  63   2.701  -3.683 -11.011
  455   2HD1  ILE  63          2HD1      ILE  63   3.187  -1.994 -11.170
  456   3HD1  ILE  63          1HD1      ILE  63   3.263  -3.068 -12.566
  457    HA   PRO  64           HA       PRO  64   1.711  -7.913  -9.193
  458   1HB   PRO  64          2HB       PRO  64   2.137  -9.366  -6.887
  459   2HB   PRO  64          1HB       PRO  64   3.133  -9.478  -8.351
  460   1HG   PRO  64          2HG       PRO  64   3.765  -8.191  -5.756
  461   2HG   PRO  64          1HG       PRO  64   4.864  -8.784  -7.007
  462   1HD   PRO  64          2HD       PRO  64   4.161  -6.082  -6.526
  463   2HD   PRO  64          1HD       PRO  64   5.069  -6.692  -7.922
  464    H    GLU  65           H        GLU  65  -0.390  -8.427  -8.552
  465    HA   GLU  65           HA       GLU  65  -1.795  -6.477  -6.974
  466   1HB   GLU  65          2HB       GLU  65  -2.652  -8.012  -8.933
  467   2HB   GLU  65          1HB       GLU  65  -2.972  -9.168  -7.641
  468   1HG   GLU  65          2HG       GLU  65  -4.064  -7.001  -6.511
  469   2HG   GLU  65          1HG       GLU  65  -4.263  -6.545  -8.202
  470    H    ASN  66           H        ASN  66  -3.584  -8.650  -5.748
  471    HA   ASN  66           HA       ASN  66  -1.966  -8.987  -3.277
  472   1HB   ASN  66          2HB       ASN  66  -4.346  -7.785  -3.501
  473   2HB   ASN  66          1HB       ASN  66  -4.916  -9.447  -3.327
  474   1HD2  ASN  66          2HD2      ASN  66  -4.531  -8.001   0.103
  475   2HD2  ASN  66          1HD2      ASN  66  -5.463  -7.610  -1.262
  476    H    ALA  67           H        ALA  67  -1.809 -10.787  -5.617
  477    HA   ALA  67           HA       ALA  67  -1.596 -13.278  -4.440
  478   1HB   ALA  67          1HB       ALA  67  -4.383 -12.532  -4.740
  479   2HB   ALA  67          3HB       ALA  67  -4.023 -13.974  -5.691
  480   3HB   ALA  67          2HB       ALA  67  -3.694 -13.956  -3.959
  481    H    ALA  68           H        ALA  68  -0.215 -12.109  -6.416
  482    HA   ALA  68           HA       ALA  68  -0.941 -13.724  -8.825
  483   1HB   ALA  68          1HB       ALA  68  -0.081 -10.850  -8.615
  484   2HB   ALA  68          3HB       ALA  68   0.312 -11.780 -10.062
  485   3HB   ALA  68          2HB       ALA  68  -1.372 -11.554  -9.588
  486    H    ALA  69           H        ALA  69   1.887 -11.669  -8.618
  487    HA   ALA  69           HA       ALA  69   3.640 -13.932  -9.086
  488   1HB   ALA  69          1HB       ALA  69   4.230 -11.039  -8.388
  489   2HB   ALA  69          3HB       ALA  69   5.457 -12.223  -8.839
  490   3HB   ALA  69          2HB       ALA  69   4.218 -11.750 -10.001
  491    H    HIS  70           HN       HIS  70   4.755 -15.121  -7.590
  492    HA   HIS  70           HA       HIS  70   4.129 -14.766  -4.768
  493   1HB   HIS  70          2HB       HIS  70   5.406 -16.774  -4.421
  494   2HB   HIS  70          1HB       HIS  70   4.504 -16.996  -5.920
  495    HD1  HIS  70           HD1      HIS  70   7.849 -17.235  -4.588
  496    HD2  HIS  70           HD2      HIS  70   6.226 -16.236  -8.297
  497    HE1  HIS  70           HE1      HIS  70   9.722 -17.473  -6.277
   
  No H/Q in entry =         497
  Start of MODEL   13
    1   1H    GLU   1          1H        GLU   1  12.555  -7.912  -2.252
    2   2H    GLU   1          3H        GLU   1  12.748  -6.253  -2.542
    3   3H    GLU   1          2H        GLU   1  13.848  -7.071  -1.538
    4    HA   GLU   1           HA       GLU   1  12.573  -6.127   0.064
    5   1HB   GLU   1          2HB       GLU   1  11.103  -5.034  -1.662
    6   2HB   GLU   1          1HB       GLU   1  10.145  -6.513  -1.712
    7   1HG   GLU   1          2HG       GLU   1   9.185  -4.787  -0.178
    8   2HG   GLU   1          1HG       GLU   1   9.593  -6.290   0.651
    9    H    THR   2           H        THR   2  10.979  -7.076   1.654
   10    HA   THR   2           HA       THR   2  10.848 -10.043   1.305
   11    HB   THR   2           HB       THR   2  10.656  -8.703   3.973
   12    HG1  THR   2           HG1      THR   2  12.498  -7.836   2.870
   13   1HG2  THR   2          1HG2      THR   2  10.327 -11.184   3.592
   14   2HG2  THR   2          3HG2      THR   2  12.022 -11.264   3.112
   15   3HG2  THR   2          2HG2      THR   2  11.592 -10.777   4.752
   16    H    VAL   3           H        VAL   3   8.736 -10.321   0.529
   17    HA   VAL   3           HA       VAL   3   6.482  -8.805   1.089
   18    HB   VAL   3           HB       VAL   3   6.314 -11.817   1.068
   19   1HG1  VAL   3          2HG1      VAL   3   4.482  -9.635   0.846
   20   2HG1  VAL   3          1HG1      VAL   3   4.540 -10.456  -0.714
   21   3HG1  VAL   3          3HG1      VAL   3   4.134 -11.361   0.745
   22   1HG2  VAL   3          3HG2      VAL   3   7.448 -10.003  -0.970
   23   2HG2  VAL   3          2HG2      VAL   3   7.625 -11.750  -0.796
   24   3HG2  VAL   3          1HG2      VAL   3   6.190 -11.082  -1.575
   25    H    GLU   4           H        GLU   4   8.202 -10.912   3.267
   26    HA   GLU   4           HA       GLU   4   6.165 -11.392   5.197
   27   1HB   GLU   4          2HB       GLU   4   9.014 -11.694   5.018
   28   2HB   GLU   4          1HB       GLU   4   8.625 -10.931   6.560
   29   1HG   GLU   4          2HG       GLU   4   8.575 -13.372   6.801
   30   2HG   GLU   4          1HG       GLU   4   6.951 -12.712   6.998
   31    H    SER   5           H        SER   5   8.630  -8.778   5.158
   32    HA   SER   5           HA       SER   5   7.228  -7.334   7.276
   33   1HB   SER   5          2HB       SER   5   9.317  -6.100   5.496
   34   2HB   SER   5          1HB       SER   5   9.006  -5.804   7.204
   35    HG   SER   5           HG       SER   5   9.576  -8.217   7.302
   36    H    CYS   6           H        CYS   6   7.709  -6.895   3.772
   37    HA   CYS   6           HA       CYS   6   6.375  -4.499   3.344
   38   1HB   CYS   6          2HB       CYS   6   7.340  -6.348   1.667
   39   2HB   CYS   6          1HB       CYS   6   5.636  -6.788   1.563
   40    H    LEU   7           H        LEU   7   5.008  -7.655   4.119
   41    HA   LEU   7           HA       LEU   7   2.266  -6.551   3.961
   42   1HB   LEU   7          2HB       LEU   7   3.201  -9.340   4.696
   43   2HB   LEU   7          1HB       LEU   7   1.538  -8.846   4.361
   44    HG   LEU   7           HG       LEU   7   3.835  -8.657   2.392
   45   1HD1  LEU   7          3HD1      LEU   7   1.615 -10.659   2.790
   46   2HD1  LEU   7          2HD1      LEU   7   2.358 -10.422   1.208
   47   3HD1  LEU   7          1HD1      LEU   7   3.339 -10.958   2.572
   48   1HD2  LEU   7          1HD2      LEU   7   0.894  -7.978   2.268
   49   2HD2  LEU   7          3HD2      LEU   7   2.271  -6.948   1.873
   50   3HD2  LEU   7          2HD2      LEU   7   1.838  -8.290   0.811
   51    H    ALA   8           H        ALA   8   4.725  -7.419   6.255
   52    HA   ALA   8           HA       ALA   8   3.079  -7.497   8.618
   53   1HB   ALA   8          1HB       ALA   8   5.633  -8.121   8.253
   54   2HB   ALA   8          3HB       ALA   8   5.887  -6.434   8.697
   55   3HB   ALA   8          2HB       ALA   8   5.079  -7.529   9.820
   56    H    LYS   9           H        LYS   9   3.944  -5.056   6.465
   57    HA   LYS   9           HA       LYS   9   4.278  -2.683   7.823
   58   1HB   LYS   9          2HB       LYS   9   2.819  -3.533   5.344
   59   2HB   LYS   9          1HB       LYS   9   2.688  -1.859   5.849
   60   1HG   LYS   9          2HG       LYS   9   5.158  -1.688   5.895
   61   2HG   LYS   9          1HG       LYS   9   5.269  -3.370   5.373
   62   1HD   LYS   9          2HD       LYS   9   4.485  -2.908   3.234
   63   2HD   LYS   9          1HD       LYS   9   3.645  -1.448   3.744
   64   1HE   LYS   9          2HE       LYS   9   6.587  -1.849   3.242
   65   2HE   LYS   9          1HE       LYS   9   5.517  -0.613   2.582
   66   1HZ   LYS   9          2HZ       LYS   9   5.274   0.011   5.089
   67   2HZ   LYS   9          1HZ       LYS   9   6.780  -0.766   5.223
   68   3HZ   LYS   9          3HZ       LYS   9   6.603   0.566   4.186
   69    HA   PRO  10           HA       PRO  10   0.585  -1.755  10.034
   70   1HB   PRO  10          2HB       PRO  10  -0.190   0.742   9.142
   71   2HB   PRO  10          1HB       PRO  10   1.154   0.457  10.262
   72   1HG   PRO  10          2HG       PRO  10   1.238   1.121   7.351
   73   2HG   PRO  10          1HG       PRO  10   2.419   1.486   8.620
   74   1HD   PRO  10          2HD       PRO  10   2.676  -0.558   6.733
   75   2HD   PRO  10          1HD       PRO  10   3.576  -0.473   8.258
   76    H    HIS  11           H        HIS  11   0.493  -2.184   6.724
   77    HA   HIS  11           HA       HIS  11  -1.151  -3.098   5.369
   78   1HB   HIS  11          2HB       HIS  11  -2.194  -3.446   8.032
   79   2HB   HIS  11          1HB       HIS  11  -3.495  -3.107   6.883
   80    HD1  HIS  11           HD1      HIS  11  -4.370  -5.175   5.835
   81    HD2  HIS  11           HD2      HIS  11  -0.304  -5.525   6.694
   82    HE1  HIS  11           HE1      HIS  11  -3.672  -7.485   5.067
   83    H    THR  12           H        THR  12  -1.086  -1.024   4.205
   84    HA   THR  12           HA       THR  12  -2.420   0.419   2.960
   85    HB   THR  12           HB       THR  12  -4.241  -1.183   4.211
   86    HG1  THR  12           HG1      THR  12  -5.543  -0.575   2.603
   87   1HG2  THR  12          1HG2      THR  12  -4.931   1.695   4.815
   88   2HG2  THR  12          3HG2      THR  12  -6.127   0.401   4.795
   89   3HG2  THR  12          2HG2      THR  12  -4.818   0.366   5.965
   90    H    GLU  13           H        GLU  13  -3.214   1.063   6.425
   91    HA   GLU  13           HA       GLU  13  -3.609   3.787   6.136
   92   1HB   GLU  13          2HB       GLU  13  -3.653   2.387   8.316
   93   2HB   GLU  13          1HB       GLU  13  -1.932   2.766   8.439
   94   1HG   GLU  13          2HG       GLU  13  -3.051   5.225   7.840
   95   2HG   GLU  13          1HG       GLU  13  -4.262   4.495   8.898
   96    H    ASN  14           H        ASN  14  -2.383   4.812   4.657
   97    HA   ASN  14           HA       ASN  14   0.014   6.086   5.289
   98   1HB   ASN  14          2HB       ASN  14   0.524   3.360   4.821
   99   2HB   ASN  14          1HB       ASN  14   0.988   4.167   3.323
  100   1HD2  ASN  14          2HD2      ASN  14   4.078   4.798   4.954
  101   2HD2  ASN  14          1HD2      ASN  14   3.290   3.923   3.730
  102    H    SER  15           H        SER  15   1.186   5.734   2.541
  103    HA   SER  15           HA       SER  15  -0.806   6.058   0.562
  104   1HB   SER  15          2HB       SER  15  -0.627   8.575   0.297
  105   2HB   SER  15          1HB       SER  15  -1.539   8.032   1.702
  106    HG   SER  15           HG       SER  15   1.224   8.447   1.930
  107    H    PHE  16           H        PHE  16   0.274   7.820  -1.167
  108    HA   PHE  16           HA       PHE  16   3.110   7.864  -1.341
  109   1HB   PHE  16          2HB       PHE  16   3.086   5.477  -1.502
  110   2HB   PHE  16          1HB       PHE  16   1.711   5.501  -2.608
  111    HD1  PHE  16           HD1      PHE  16   5.222   6.802  -2.328
  112    HD2  PHE  16           HD2      PHE  16   2.101   5.352  -4.896
  113    HE1  PHE  16           HE1      PHE  16   6.772   6.888  -4.262
  114    HE2  PHE  16           HE2      PHE  16   3.647   5.442  -6.828
  115    HZ   PHE  16           HZ       PHE  16   5.986   6.203  -6.513
  116    H    THR  17           H        THR  17   3.731   8.954  -3.327
  117    HA   THR  17           HA       THR  17   1.373   9.907  -4.870
  118    HB   THR  17           HB       THR  17   2.335  11.882  -4.249
  119    HG1  THR  17           HG1      THR  17   4.192  12.235  -5.912
  120   1HG2  THR  17          2HG2      THR  17   4.925  10.325  -4.130
  121   2HG2  THR  17          1HG2      THR  17   4.873  12.078  -3.947
  122   3HG2  THR  17          3HG2      THR  17   4.026  11.046  -2.794
  123    H    ASN  18           H        ASN  18   1.724  10.245  -7.234
  124    HA   ASN  18           HA       ASN  18   2.501   9.498  -9.341
  125   1HB   ASN  18          2HB       ASN  18   4.805   9.515  -8.077
  126   2HB   ASN  18          1HB       ASN  18   4.559   7.770  -7.977
  127   1HD2  ASN  18          2HD2      ASN  18   5.503   7.238 -11.320
  128   2HD2  ASN  18          1HD2      ASN  18   5.203   6.580  -9.783
  129    H    VAL  19           H        VAL  19   0.825   8.060  -7.139
  130    HA   VAL  19           HA       VAL  19   0.931   5.289  -7.314
  131    HB   VAL  19           HB       VAL  19  -1.531   7.052  -7.325
  132   1HG1  VAL  19          3HG1      VAL  19  -2.026   4.718  -7.959
  133   2HG1  VAL  19          2HG1      VAL  19  -1.168   4.145  -6.529
  134   3HG1  VAL  19          1HG1      VAL  19  -2.654   5.079  -6.352
  135   1HG2  VAL  19          2HG2      VAL  19   0.422   7.045  -5.461
  136   2HG2  VAL  19          1HG2      VAL  19  -1.279   7.259  -5.052
  137   3HG2  VAL  19          3HG2      VAL  19  -0.527   5.673  -4.885
  138    H    TRP  20           H        TRP  20  -0.057   3.738  -8.676
  139    HA   TRP  20           HA       TRP  20  -0.973   4.741 -11.329
  140   1HB   TRP  20          2HB       TRP  20   0.544   3.479 -12.494
  141   2HB   TRP  20          1HB       TRP  20   1.477   3.571 -11.006
  142    HD1  TRP  20           HD1      TRP  20  -0.815   1.208 -12.973
  143    HE1  TRP  20           HE1      TRP  20  -0.470  -1.197 -12.118
  144    HE3  TRP  20           HE3      TRP  20   2.298   2.125  -9.031
  145    HZ2  TRP  20           HZ2      TRP  20   0.975  -2.554 -10.055
  146    HZ3  TRP  20           HZ3      TRP  20   3.150   0.257  -7.645
  147    HH2  TRP  20           HH2      TRP  20   2.488  -2.079  -8.153
  148    H    LYS  21           H        LYS  21  -1.935   2.573 -12.494
  149    HA   LYS  21           HA       LYS  21  -3.304   0.832 -10.564
  150   1HB   LYS  21          2HB       LYS  21  -4.788   2.831 -10.655
  151   2HB   LYS  21          1HB       LYS  21  -4.921   2.626 -12.403
  152   1HG   LYS  21          2HG       LYS  21  -5.508   0.094 -11.478
  153   2HG   LYS  21          1HG       LYS  21  -6.232   1.120 -10.238
  154   1HD   LYS  21          2HD       LYS  21  -7.971   1.004 -11.777
  155   2HD   LYS  21          1HD       LYS  21  -7.145   2.466 -12.321
  156   1HE   LYS  21          2HE       LYS  21  -5.786   0.946 -13.869
  157   2HE   LYS  21          1HE       LYS  21  -6.956  -0.317 -13.486
  158   1HZ   LYS  21          1HZ       LYS  21  -8.666   1.493 -14.121
  159   2HZ   LYS  21          3HZ       LYS  21  -7.363   2.211 -14.936
  160   3HZ   LYS  21          2HZ       LYS  21  -7.861   0.641 -15.351
  161    H    ASP  22           H        ASP  22  -3.124  -1.138 -11.486
  162    HA   ASP  22           HA       ASP  22  -2.797  -1.314 -14.409
  163   1HB   ASP  22          2HB       ASP  22  -1.901  -2.809 -12.088
  164   2HB   ASP  22          1HB       ASP  22  -2.661  -3.873 -13.266
  165    H    ASP  23           H        ASP  23  -4.533  -1.794 -15.655
  166    HA   ASP  23           HA       ASP  23  -7.074  -2.593 -14.477
  167   1HB   ASP  23          2HB       ASP  23  -6.127  -1.644 -17.035
  168   2HB   ASP  23          1HB       ASP  23  -7.085  -3.105 -17.274
  169    H    LYS  24           H        LYS  24  -4.238  -4.151 -15.535
  170    HA   LYS  24           HA       LYS  24  -5.488  -6.748 -16.110
  171   1HB   LYS  24          2HB       LYS  24  -2.815  -5.501 -16.304
  172   2HB   LYS  24          1HB       LYS  24  -2.799  -7.207 -15.853
  173   1HG   LYS  24          2HG       LYS  24  -4.536  -7.446 -17.823
  174   2HG   LYS  24          1HG       LYS  24  -3.820  -5.930 -18.370
  175   1HD   LYS  24          2HD       LYS  24  -1.846  -7.948 -17.535
  176   2HD   LYS  24          1HD       LYS  24  -2.809  -8.422 -18.934
  177   1HE   LYS  24          2HE       LYS  24  -1.564  -7.072 -20.230
  178   2HE   LYS  24          1HE       LYS  24  -2.109  -5.687 -19.284
  179   1HZ   LYS  24          2HZ       LYS  24  -0.324  -6.470 -17.626
  180   2HZ   LYS  24          1HZ       LYS  24   0.320  -7.319 -18.949
  181   3HZ   LYS  24          3HZ       LYS  24   0.169  -5.632 -19.019
  182    H    THR  25           H        THR  25  -3.082  -5.526 -13.776
  183    HA   THR  25           HA       THR  25  -3.192  -7.776 -12.040
  184    HB   THR  25           HB       THR  25  -2.083  -6.400 -10.429
  185    HG1  THR  25           HG1      THR  25  -3.512  -4.612 -10.604
  186   1HG2  THR  25          3HG2      THR  25  -1.297  -5.520 -13.213
  187   2HG2  THR  25          2HG2      THR  25  -0.275  -5.402 -11.781
  188   3HG2  THR  25          1HG2      THR  25  -0.746  -6.986 -12.400
  189    H    LEU  26           H        LEU  26  -5.218  -5.006 -12.463
  190    HA   LEU  26           HA       LEU  26  -7.472  -4.798 -11.790
  191   1HB   LEU  26          2HB       LEU  26  -6.874  -7.449 -11.257
  192   2HB   LEU  26          1HB       LEU  26  -7.470  -6.841  -9.713
  193    HG   LEU  26           HG       LEU  26  -9.259  -7.742 -11.221
  194   1HD1  LEU  26          1HD1      LEU  26  -9.331  -5.586  -9.559
  195   2HD1  LEU  26          3HD1      LEU  26  -9.890  -4.852 -11.061
  196   3HD1  LEU  26          2HD1      LEU  26 -10.754  -6.230 -10.379
  197   1HD2  LEU  26          1HD2      LEU  26  -7.897  -6.089 -13.111
  198   2HD2  LEU  26          3HD2      LEU  26  -9.279  -7.149 -13.391
  199   3HD2  LEU  26          2HD2      LEU  26  -9.537  -5.467 -12.929
  200    H    ASP  27           H        ASP  27  -5.989  -2.892 -10.628
  201    HA   ASP  27           HA       ASP  27  -7.329  -2.094  -8.360
  202   1HB   ASP  27          2HB       ASP  27  -5.538  -4.300  -7.744
  203   2HB   ASP  27          1HB       ASP  27  -5.232  -2.888  -6.732
  204    H    ARG  28           H        ARG  28  -6.065  -0.555  -6.880
  205    HA   ARG  28           HA       ARG  28  -4.148   0.957  -8.568
  206   1HB   ARG  28          2HB       ARG  28  -6.159   1.933  -7.178
  207   2HB   ARG  28          1HB       ARG  28  -5.049   1.785  -5.817
  208   1HG   ARG  28          2HG       ARG  28  -4.217   3.787  -6.442
  209   2HG   ARG  28          1HG       ARG  28  -3.495   2.945  -7.812
  210   1HD   ARG  28          2HD       ARG  28  -4.759   4.744  -8.750
  211   2HD   ARG  28          1HD       ARG  28  -5.718   3.288  -9.022
  212    HE   ARG  28           HE       ARG  28  -6.285   4.995  -6.645
  213   1HH1  ARG  28          1HH2      ARG  28  -7.791   2.511  -7.876
  214   2HH1  ARG  28          2HH2      ARG  28  -9.195   3.315  -8.494
  215   1HH2  ARG  28          2HH1      ARG  28  -7.832   6.491  -8.205
  216   2HH2  ARG  28          1HH1      ARG  28  -9.219   5.567  -8.678
  217    H    TYR  29           H        TYR  29  -1.984   1.439  -7.746
  218    HA   TYR  29           HA       TYR  29  -1.209   0.071  -5.248
  219   1HB   TYR  29          2HB       TYR  29  -0.051  -0.655  -7.951
  220   2HB   TYR  29          1HB       TYR  29   0.633  -1.161  -6.404
  221    HD1  TYR  29           HD1      TYR  29  -2.309  -1.432  -8.635
  222    HD2  TYR  29           HD2      TYR  29  -0.415  -2.854  -5.052
  223    HE1  TYR  29           HE1      TYR  29  -3.937  -3.296  -8.513
  224    HE2  TYR  29           HE2      TYR  29  -2.045  -4.718  -4.931
  225    HH   TYR  29           HH       TYR  29  -4.035  -5.588  -7.505
  226    H    ALA  30           H        ALA  30   0.654   0.894  -4.323
  227    HA   ALA  30           HA       ALA  30   1.839   3.257  -5.729
  228   1HB   ALA  30          3HB       ALA  30   1.184   2.736  -2.838
  229   2HB   ALA  30          2HB       ALA  30   2.454   3.883  -3.264
  230   3HB   ALA  30          1HB       ALA  30   0.803   4.149  -3.823
  231    H    ASN  31           H        ASN  31   3.927   2.957  -6.307
  232    HA   ASN  31           HA       ASN  31   5.411   0.641  -5.321
  233   1HB   ASN  31          2HB       ASN  31   7.216   1.508  -6.820
  234   2HB   ASN  31          1HB       ASN  31   5.675   1.298  -7.651
  235   1HD2  ASN  31          2HD2      ASN  31   7.254   5.030  -7.232
  236   2HD2  ASN  31          1HD2      ASN  31   8.002   3.687  -6.511
  237    H    TYR  32           H        TYR  32   5.961   0.922  -3.160
  238    HA   TYR  32           HA       TYR  32   7.121   3.472  -2.256
  239   1HB   TYR  32          2HB       TYR  32   5.605   1.739  -0.924
  240   2HB   TYR  32          1HB       TYR  32   7.164   0.991  -0.580
  241    HD1  TYR  32           HD2      TYR  32   8.978   2.334   0.531
  242    HD2  TYR  32           HD1      TYR  32   4.965   3.805   0.097
  243    HE1  TYR  32           HE2      TYR  32   9.421   4.055   2.262
  244    HE2  TYR  32           HE1      TYR  32   5.408   5.524   1.828
  245    HH   TYR  32           HH       TYR  32   6.848   6.245   3.377
  246    H    GLU  33           H        GLU  33   8.689   2.526  -4.258
  247    HA   GLU  33           HA       GLU  33  10.775   1.543  -4.814
  248   1HB   GLU  33          2HB       GLU  33  10.949   3.813  -3.169
  249   2HB   GLU  33          1HB       GLU  33  12.135   2.681  -2.517
  250   1HG   GLU  33          2HG       GLU  33  13.519   3.179  -4.217
  251   2HG   GLU  33          1HG       GLU  33  12.323   2.553  -5.352
  252    H    GLY  34           H        GLY  34  10.237  -0.687  -4.280
  253   1HA   GLY  34          2HA       GLY  34  11.570  -2.534  -3.271
  254   2HA   GLY  34          1HA       GLY  34  11.602  -1.594  -1.778
  255    H    CYS  35           H        CYS  35   8.887  -0.765  -1.718
  256    HA   CYS  35           HA       CYS  35   7.554  -3.411  -1.297
  257   1HB   CYS  35          2HB       CYS  35   7.794  -1.023   0.365
  258   2HB   CYS  35          1HB       CYS  35   6.112  -1.503   0.136
  259    H    LEU  36           H        LEU  36   5.061  -3.166  -1.426
  260    HA   LEU  36           HA       LEU  36   4.228  -1.139  -3.422
  261   1HB   LEU  36          2HB       LEU  36   4.904  -3.120  -4.739
  262   2HB   LEU  36          1HB       LEU  36   3.779  -4.112  -3.807
  263    HG   LEU  36           HG       LEU  36   2.019  -2.309  -4.501
  264   1HD1  LEU  36          2HD1      LEU  36   4.004  -0.938  -5.501
  265   2HD1  LEU  36          1HD1      LEU  36   3.844  -2.029  -6.876
  266   3HD1  LEU  36          3HD1      LEU  36   2.486  -1.013  -6.395
  267   1HD2  LEU  36          3HD2      LEU  36   3.033  -4.711  -5.803
  268   2HD2  LEU  36          2HD2      LEU  36   1.365  -4.184  -5.581
  269   3HD2  LEU  36          1HD2      LEU  36   2.293  -3.611  -6.967
  270    H    TRP  37           H        TRP  37   2.450  -0.228  -2.564
  271    HA   TRP  37           HA       TRP  37   0.733  -1.824  -0.749
  272   1HB   TRP  37          2HB       TRP  37   0.545   1.137  -1.389
  273   2HB   TRP  37          1HB       TRP  37  -0.214   0.275  -0.059
  274    HD1  TRP  37           HD1      TRP  37   3.387   0.872  -1.341
  275    HE1  TRP  37           HE1      TRP  37   4.914   1.132   0.721
  276    HE3  TRP  37           HE3      TRP  37  -0.026   0.103   2.378
  277    HZ2  TRP  37           HZ2      TRP  37   4.696   1.029   3.580
  278    HZ3  TRP  37           HZ3      TRP  37   0.644   0.180   4.743
  279    HH2  TRP  37           HH2      TRP  37   3.007   0.649   5.360
  280    H    ASN  38           H        ASN  38  -1.742  -1.076  -1.051
  281    HA   ASN  38           HA       ASN  38  -2.420  -1.050  -3.949
  282   1HB   ASN  38          2HB       ASN  38  -2.605  -3.348  -3.617
  283   2HB   ASN  38          1HB       ASN  38  -3.032  -3.176  -1.925
  284   1HD2  ASN  38          2HD2      ASN  38  -6.166  -2.164  -4.336
  285   2HD2  ASN  38          1HD2      ASN  38  -4.682  -1.364  -4.500
  286    H    ALA  39           H        ALA  39  -3.732   0.664  -4.199
  287    HA   ALA  39           HA       ALA  39  -5.418   1.601  -1.967
  288   1HB   ALA  39          2HB       ALA  39  -4.194   2.816  -4.224
  289   2HB   ALA  39          1HB       ALA  39  -5.937   2.969  -4.448
  290   3HB   ALA  39          3HB       ALA  39  -5.177   3.597  -2.985
  291    H    THR  40           H        THR  40  -7.583   1.169  -1.826
  292    HA   THR  40           HA       THR  40  -8.949   0.027  -4.219
  293    HB   THR  40           HB       THR  40  -8.340  -1.886  -2.873
  294    HG1  THR  40           HG1      THR  40 -10.462  -1.888  -3.662
  295   1HG2  THR  40          3HG2      THR  40  -8.165  -0.263  -0.774
  296   2HG2  THR  40          2HG2      THR  40  -9.805  -0.841  -0.483
  297   3HG2  THR  40          1HG2      THR  40  -8.468  -1.987  -0.563
  298    H    GLY  41           H        GLY  41  -9.479   1.182  -0.867
  299   1HA   GLY  41          2HA       GLY  41 -12.236   1.932  -1.470
  300   2HA   GLY  41          1HA       GLY  41 -11.385   2.246   0.043
  301    H    VAL  42           H        VAL  42 -12.235   4.422   0.019
  302    HA   VAL  42           HA       VAL  42 -11.808   6.267  -2.126
  303    HB   VAL  42           HB       VAL  42 -12.092   6.789   0.848
  304   1HG1  VAL  42          3HG1      VAL  42 -11.487   8.531  -1.340
  305   2HG1  VAL  42          2HG1      VAL  42 -13.130   8.875  -0.799
  306   3HG1  VAL  42          1HG1      VAL  42 -11.789   8.959   0.343
  307   1HG2  VAL  42          1HG2      VAL  42 -14.124   6.728  -1.406
  308   2HG2  VAL  42          3HG2      VAL  42 -13.991   5.549  -0.102
  309   3HG2  VAL  42          2HG2      VAL  42 -14.467   7.208   0.255
  310    H    VAL  43           H        VAL  43 -10.104   7.731  -2.492
  311    HA   VAL  43           HA       VAL  43  -7.787   7.637  -0.638
  312    HB   VAL  43           HB       VAL  43  -7.298   7.358  -3.589
  313   1HG1  VAL  43          1HG1      VAL  43  -5.513   7.910  -1.844
  314   2HG1  VAL  43          3HG1      VAL  43  -5.761   6.280  -1.215
  315   3HG1  VAL  43          2HG1      VAL  43  -5.182   6.510  -2.866
  316   1HG2  VAL  43          2HG2      VAL  43  -8.855   5.530  -2.947
  317   2HG2  VAL  43          1HG2      VAL  43  -7.248   4.915  -3.333
  318   3HG2  VAL  43          3HG2      VAL  43  -7.753   5.067  -1.650
  319    H    VAL  44           H        VAL  44  -7.610   9.786  -0.157
  320    HA   VAL  44           HA       VAL  44  -8.503  11.977  -1.647
  321    HB   VAL  44           HB       VAL  44  -6.054  11.776   0.134
  322   1HG1  VAL  44          2HG1      VAL  44  -6.119  13.749  -1.483
  323   2HG1  VAL  44          1HG1      VAL  44  -7.574  14.275  -0.636
  324   3HG1  VAL  44          3HG1      VAL  44  -6.042  14.165   0.230
  325   1HG2  VAL  44          3HG2      VAL  44  -8.966  12.441   0.576
  326   2HG2  VAL  44          2HG2      VAL  44  -7.968  11.266   1.434
  327   3HG2  VAL  44          1HG2      VAL  44  -7.722  12.992   1.698
  328    H    CYS  45           H        CYS  45  -8.082  11.989  -3.855
  329    HA   CYS  45           HA       CYS  45  -5.241  11.674  -4.700
  330   1HB   CYS  45          2HB       CYS  45  -7.869  11.129  -5.975
  331   2HB   CYS  45          1HB       CYS  45  -6.588  11.710  -7.039
  332    H    THR  46           H        THR  46  -4.175  13.310  -5.732
  333    HA   THR  46           HA       THR  46  -5.668  15.764  -6.470
  334    HB   THR  46           HB       THR  46  -4.938  16.388  -4.300
  335    HG1  THR  46           HG1      THR  46  -4.261  17.816  -6.001
  336   1HG2  THR  46          3HG2      THR  46  -2.422  14.880  -5.021
  337   2HG2  THR  46          2HG2      THR  46  -2.493  15.986  -3.647
  338   3HG2  THR  46          1HG2      THR  46  -3.538  14.567  -3.692
  339    H    GLY  47           H        GLY  47  -4.398  17.150  -7.923
  340   1HA   GLY  47          2HA       GLY  47  -2.974  17.466  -9.763
  341   2HA   GLY  47          1HA       GLY  47  -1.834  16.393  -8.946
  342    H    ASP  48           H        ASP  48  -4.982  16.160 -10.647
  343    HA   ASP  48           HA       ASP  48  -5.713  14.559 -12.212
  344   1HB   ASP  48          2HB       ASP  48  -2.762  14.603 -12.521
  345   2HB   ASP  48          1HB       ASP  48  -3.576  13.158 -13.116
  346    H    GLU  49           H        GLU  49  -4.689  13.977  -9.257
  347    HA   GLU  49           HA       GLU  49  -5.055  12.165  -7.841
  348   1HB   GLU  49          2HB       GLU  49  -5.601  10.454 -10.268
  349   2HB   GLU  49          1HB       GLU  49  -6.181  10.223  -8.620
  350   1HG   GLU  49          2HG       GLU  49  -7.969  11.540  -8.985
  351   2HG   GLU  49          1HG       GLU  49  -6.954  12.832  -9.628
  352    H    THR  50           H        THR  50  -2.704  12.390 -10.227
  353    HA   THR  50           HA       THR  50  -1.362   9.922 -10.148
  354    HB   THR  50           HB       THR  50   0.738  11.685  -9.958
  355    HG1  THR  50           HG1      THR  50  -0.211  13.570  -9.939
  356   1HG2  THR  50          1HG2      THR  50  -0.812  10.354 -12.031
  357   2HG2  THR  50          3HG2      THR  50  -0.071  11.845 -12.616
  358   3HG2  THR  50          2HG2      THR  50   0.932  10.579 -11.907
  359    H    GLN  51           H        GLN  51  -1.537  12.474  -7.703
  360    HA   GLN  51           HA       GLN  51   0.103  10.752  -5.895
  361   1HB   GLN  51          2HB       GLN  51  -0.833  13.535  -5.216
  362   2HB   GLN  51          1HB       GLN  51   0.582  12.669  -4.617
  363   1HG   GLN  51          2HG       GLN  51   1.730  12.921  -6.708
  364   2HG   GLN  51          1HG       GLN  51   0.269  13.500  -7.510
  365   1HE2  GLN  51          2HE2      GLN  51   0.436  16.714  -5.722
  366   2HE2  GLN  51          1HE2      GLN  51  -0.719  15.513  -6.047
  367    H    CYS  52           H        CYS  52  -0.904   9.925  -3.988
  368    HA   CYS  52           HA       CYS  52  -3.617  10.883  -3.384
  369   1HB   CYS  52          2HB       CYS  52  -3.433   8.904  -5.242
  370   2HB   CYS  52          1HB       CYS  52  -3.567   7.955  -3.764
  371    H    TYR  53           H        TYR  53  -4.539   9.867  -1.442
  372    HA   TYR  53           HA       TYR  53  -2.607   8.391   0.250
  373   1HB   TYR  53          2HB       TYR  53  -2.121  10.487   1.142
  374   2HB   TYR  53          1HB       TYR  53  -3.723  11.124   0.783
  375    HD1  TYR  53           HD1      TYR  53  -1.727   9.111   3.161
  376    HD2  TYR  53           HD2      TYR  53  -5.601  10.752   2.288
  377    HE1  TYR  53           HE1      TYR  53  -2.463   8.604   5.476
  378    HE2  TYR  53           HE2      TYR  53  -6.332  10.252   4.603
  379    HH   TYR  53           HH       TYR  53  -4.809   9.931   6.986
  380    H    GLY  54           H        GLY  54  -3.673   7.297   2.057
  381   1HA   GLY  54          2HA       GLY  54  -6.165   7.189   3.006
  382   2HA   GLY  54          1HA       GLY  54  -6.467   6.582   1.376
  383    H    THR  55           H        THR  55  -6.831   4.400   1.727
  384    HA   THR  55           HA       THR  55  -4.847   2.946   3.425
  385    HB   THR  55           HB       THR  55  -6.543   1.026   3.126
  386    HG1  THR  55           HG1      THR  55  -8.225   3.191   2.410
  387   1HG2  THR  55          3HG2      THR  55  -6.294   2.945   5.014
  388   2HG2  THR  55          2HG2      THR  55  -7.954   3.242   4.500
  389   3HG2  THR  55          1HG2      THR  55  -7.486   1.651   5.101
  390    H    TRP  56           H        TRP  56  -3.306   1.906   2.399
  391    HA   TRP  56           HA       TRP  56  -3.736   0.983  -0.405
  392   1HB   TRP  56          2HB       TRP  56  -1.173   1.789   0.954
  393   2HB   TRP  56          1HB       TRP  56  -1.390   1.406  -0.758
  394    HD1  TRP  56           HD1      TRP  56  -2.541   4.008   1.838
  395    HE1  TRP  56           HE1      TRP  56  -3.078   6.189   0.582
  396    HE3  TRP  56           HE3      TRP  56  -1.856   2.418  -2.943
  397    HZ2  TRP  56           HZ2      TRP  56  -3.199   7.132  -2.137
  398    HZ3  TRP  56           HZ3      TRP  56  -2.187   3.950  -4.854
  399    HH2  TRP  56           HH2      TRP  56  -2.859   6.314  -4.460
  400    H    VAL  57           H        VAL  57  -4.518  -1.067   0.832
  401    HA   VAL  57           HA       VAL  57  -3.068  -2.610   2.591
  402    HB   VAL  57           HB       VAL  57  -4.388  -3.690   0.078
  403   1HG1  VAL  57          3HG1      VAL  57  -3.575  -4.905   2.723
  404   2HG1  VAL  57          2HG1      VAL  57  -4.848  -5.622   1.736
  405   3HG1  VAL  57          1HG1      VAL  57  -3.210  -5.479   1.097
  406   1HG2  VAL  57          3HG2      VAL  57  -5.475  -2.871   2.786
  407   2HG2  VAL  57          2HG2      VAL  57  -5.978  -2.290   1.198
  408   3HG2  VAL  57          1HG2      VAL  57  -6.355  -3.941   1.692
  409    HA   PRO  58           HA       PRO  58   0.791  -3.337   0.488
  410   1HB   PRO  58          2HB       PRO  58   1.866  -4.962   2.456
  411   2HB   PRO  58          1HB       PRO  58   1.834  -3.190   2.544
  412   1HG   PRO  58          2HG       PRO  58   0.173  -5.170   4.016
  413   2HG   PRO  58          1HG       PRO  58   0.582  -3.500   4.453
  414   1HD   PRO  58          2HD       PRO  58  -1.891  -4.395   3.366
  415   2HD   PRO  58          1HD       PRO  58  -1.371  -2.709   3.551
  416    H    ILE  59           H        ILE  59   1.345  -4.918  -1.012
  417    HA   ILE  59           HA       ILE  59   0.366  -7.691  -0.547
  418    HB   ILE  59           HB       ILE  59  -0.312  -7.694  -3.023
  419   1HG1  ILE  59          2HG1      ILE  59   0.870  -5.365  -3.263
  420   2HG1  ILE  59          1HG1      ILE  59  -0.619  -5.672  -4.149
  421   1HG2  ILE  59          1HG2      ILE  59  -1.812  -6.160  -0.886
  422   2HG2  ILE  59          3HG2      ILE  59  -2.530  -6.544  -2.452
  423   3HG2  ILE  59          2HG2      ILE  59  -2.029  -7.843  -1.369
  424   1HD1  ILE  59          2HD1      ILE  59  -1.872  -4.588  -2.233
  425   2HD1  ILE  59          1HD1      ILE  59  -0.313  -4.111  -1.567
  426   3HD1  ILE  59          3HD1      ILE  59  -0.823  -3.499  -3.135
  427    H    GLY  60           H        GLY  60   2.510  -5.521  -2.417
  428   1HA   GLY  60          2HA       GLY  60   4.234  -7.923  -2.815
  429   2HA   GLY  60          1HA       GLY  60   3.803  -6.942  -4.209
  430    H    LEU  61           H        LEU  61   6.221  -6.840  -4.316
  431    HA   LEU  61           HA       LEU  61   7.473  -5.008  -2.372
  432   1HB   LEU  61          2HB       LEU  61   8.812  -6.138  -4.823
  433   2HB   LEU  61          1HB       LEU  61   9.539  -5.672  -3.285
  434    HG   LEU  61           HG       LEU  61   7.794  -8.079  -3.851
  435   1HD1  LEU  61          1HD1      LEU  61  10.497  -7.785  -4.026
  436   2HD1  LEU  61          3HD1      LEU  61  10.331  -8.261  -2.336
  437   3HD1  LEU  61          2HD1      LEU  61   9.703  -9.303  -3.612
  438   1HD2  LEU  61          2HD2      LEU  61   8.304  -6.591  -1.330
  439   2HD2  LEU  61          1HD2      LEU  61   6.952  -7.636  -1.765
  440   3HD2  LEU  61          3HD2      LEU  61   8.479  -8.344  -1.239
  441    H    ALA  62           H        ALA  62   6.257  -4.946  -5.703
  442    HA   ALA  62           HA       ALA  62   6.078  -2.140  -5.793
  443   1HB   ALA  62          1HB       ALA  62   8.771  -3.208  -6.534
  444   2HB   ALA  62          3HB       ALA  62   8.139  -1.800  -7.389
  445   3HB   ALA  62          2HB       ALA  62   8.348  -1.748  -5.638
  446    H    ILE  63           H        ILE  63   4.419  -4.002  -6.874
  447    HA   ILE  63           HA       ILE  63   3.511  -3.200  -9.212
  448    HB   ILE  63           HB       ILE  63   6.132  -4.397  -9.830
  449   1HG1  ILE  63          2HG1      ILE  63   5.548  -2.031 -10.229
  450   2HG1  ILE  63          1HG1      ILE  63   5.862  -2.846 -11.759
  451   1HG2  ILE  63          1HG2      ILE  63   3.717  -4.983 -11.571
  452   2HG2  ILE  63          3HG2      ILE  63   5.398  -5.233 -12.042
  453   3HG2  ILE  63          2HG2      ILE  63   4.699  -6.184 -10.732
  454   1HD1  ILE  63          3HD1      ILE  63   3.076  -3.147 -11.062
  455   2HD1  ILE  63          2HD1      ILE  63   3.514  -1.439 -11.002
  456   3HD1  ILE  63          1HD1      ILE  63   3.778  -2.366 -12.478
  457    HA   PRO  64           HA       PRO  64   2.550  -7.882  -9.150
  458   1HB   PRO  64          2HB       PRO  64   3.075  -9.155  -6.751
  459   2HB   PRO  64          1HB       PRO  64   4.122  -9.228  -8.185
  460   1HG   PRO  64          2HG       PRO  64   4.498  -7.709  -5.660
  461   2HG   PRO  64          1HG       PRO  64   5.710  -8.269  -6.817
  462   1HD   PRO  64          2HD       PRO  64   4.762  -5.632  -6.575
  463   2HD   PRO  64          1HD       PRO  64   5.697  -6.266  -7.941
  464    H    GLU  65           H        GLU  65   0.494  -8.543  -8.602
  465    HA   GLU  65           HA       GLU  65  -0.821  -7.132  -6.312
  466   1HB   GLU  65          2HB       GLU  65  -1.820  -7.631  -9.130
  467   2HB   GLU  65          1HB       GLU  65  -2.896  -7.150  -7.817
  468   1HG   GLU  65          2HG       GLU  65  -2.298  -5.088  -8.762
  469   2HG   GLU  65          1HG       GLU  65  -1.164  -5.237  -7.425
  470    H    ASN  66           H        ASN  66  -3.258  -8.359  -6.336
  471    HA   ASN  66           HA       ASN  66  -2.794 -10.837  -5.055
  472   1HB   ASN  66          2HB       ASN  66  -4.986  -9.215  -5.455
  473   2HB   ASN  66          1HB       ASN  66  -5.401 -10.643  -6.402
  474   1HD2  ASN  66          2HD2      ASN  66  -6.608 -11.595  -3.107
  475   2HD2  ASN  66          1HD2      ASN  66  -7.085 -10.693  -4.464
  476    H    ALA  67           H        ALA  67  -3.887 -10.220  -8.410
  477    HA   ALA  67           HA       ALA  67  -4.171 -12.866  -9.279
  478   1HB   ALA  67          1HB       ALA  67  -4.241 -10.444 -10.524
  479   2HB   ALA  67          3HB       ALA  67  -2.729 -11.089 -11.163
  480   3HB   ALA  67          2HB       ALA  67  -4.233 -11.983 -11.386
  481    H    ALA  68           H        ALA  68  -1.210 -11.002 -10.022
  482    HA   ALA  68           HA       ALA  68   1.050 -11.656  -9.853
  483   1HB   ALA  68          1HB       ALA  68  -0.102 -12.946  -7.740
  484   2HB   ALA  68          3HB       ALA  68   0.477 -14.314  -8.692
  485   3HB   ALA  68          2HB       ALA  68   1.609 -13.072  -8.155
  486    H    ALA  69           H        ALA  69   1.658 -12.077 -11.940
  487    HA   ALA  69           HA       ALA  69   1.893 -13.236 -13.977
  488   1HB   ALA  69          2HB       ALA  69   2.169 -15.357 -11.847
  489   2HB   ALA  69          1HB       ALA  69   2.342 -15.752 -13.557
  490   3HB   ALA  69          3HB       ALA  69   3.437 -14.592 -12.805
  491    H    HIS  70           HN       HIS  70  -0.116 -12.991 -15.002
  492    HA   HIS  70           HA       HIS  70  -1.782 -15.401 -15.099
  493   1HB   HIS  70          2HB       HIS  70  -2.499 -13.606 -13.184
  494   2HB   HIS  70          1HB       HIS  70  -3.398 -12.977 -14.564
  495    HD1  HIS  70           HD1      HIS  70  -4.208 -14.896 -11.883
  496    HD2  HIS  70           HD2      HIS  70  -4.383 -15.761 -15.958
  497    HE1  HIS  70           HE1      HIS  70  -5.880 -16.779 -12.143
   
  No H/Q in entry =         497
  Start of MODEL   14
    1   1H    GLU   1          3H        GLU   1  14.473  -7.696  -1.439
    2   2H    GLU   1          2H        GLU   1  13.816  -7.015  -2.850
    3   3H    GLU   1          1H        GLU   1  14.816  -6.086  -1.840
    4    HA   GLU   1           HA       GLU   1  13.045  -5.368  -0.754
    5   1HB   GLU   1          2HB       GLU   1  10.873  -5.831  -1.559
    6   2HB   GLU   1          1HB       GLU   1  11.902  -6.067  -2.971
    7   1HG   GLU   1          2HG       GLU   1  10.859  -8.246  -1.133
    8   2HG   GLU   1          1HG       GLU   1  10.322  -7.928  -2.781
    9    H    THR   2           H        THR   2  10.946  -6.474   0.528
   10    HA   THR   2           HA       THR   2  11.875  -8.939   1.884
   11    HB   THR   2           HB       THR   2  10.955  -6.688   3.629
   12    HG1  THR   2           HG1      THR   2  12.575  -5.729   2.417
   13   1HG2  THR   2          3HG2      THR   2  11.737  -9.274   4.076
   14   2HG2  THR   2          2HG2      THR   2  13.244  -8.400   4.355
   15   3HG2  THR   2          1HG2      THR   2  11.802  -7.991   5.285
   16    H    VAL   3           H        VAL   3   9.923  -9.522   0.482
   17    HA   VAL   3           HA       VAL   3   7.342  -8.600   0.736
   18    HB   VAL   3           HB       VAL   3   8.261 -10.622  -0.585
   19   1HG1  VAL   3          2HG1      VAL   3   9.049 -11.826   1.459
   20   2HG1  VAL   3          1HG1      VAL   3   7.365 -12.051   1.933
   21   3HG1  VAL   3          3HG1      VAL   3   7.972 -12.797   0.455
   22   1HG2  VAL   3          3HG2      VAL   3   5.663  -9.878   0.251
   23   2HG2  VAL   3          2HG2      VAL   3   6.100 -10.822  -1.172
   24   3HG2  VAL   3          1HG2      VAL   3   5.731 -11.637   0.349
   25    H    GLU   4           H        GLU   4   9.203 -10.285   3.187
   26    HA   GLU   4           HA       GLU   4   7.071 -11.089   4.906
   27   1HB   GLU   4          2HB       GLU   4   9.904 -10.219   5.553
   28   2HB   GLU   4          1HB       GLU   4   8.806 -10.958   6.720
   29   1HG   GLU   4          2HG       GLU   4   9.292 -12.319   4.088
   30   2HG   GLU   4          1HG       GLU   4  10.484 -12.476   5.378
   31    H    SER   5           H        SER   5   8.963  -8.049   4.887
   32    HA   SER   5           HA       SER   5   7.183  -6.903   6.918
   33   1HB   SER   5          2HB       SER   5   9.492  -5.722   5.351
   34   2HB   SER   5          1HB       SER   5   8.603  -4.861   6.606
   35    HG   SER   5           HG       SER   5   9.150  -6.912   7.861
   36    H    CYS   6           H        CYS   6   7.906  -6.260   3.462
   37    HA   CYS   6           HA       CYS   6   6.111  -4.110   3.136
   38   1HB   CYS   6          2HB       CYS   6   6.634  -6.293   1.100
   39   2HB   CYS   6          1HB       CYS   6   6.054  -4.661   0.774
   40    H    LEU   7           H        LEU   7   5.423  -7.440   3.771
   41    HA   LEU   7           HA       LEU   7   2.579  -6.978   3.005
   42   1HB   LEU   7          2HB       LEU   7   4.003  -9.578   3.588
   43   2HB   LEU   7          1HB       LEU   7   2.335  -9.410   3.044
   44    HG   LEU   7           HG       LEU   7   4.869  -8.800   1.519
   45   1HD1  LEU   7          3HD1      LEU   7   2.460 -10.577   1.173
   46   2HD1  LEU   7          2HD1      LEU   7   3.451 -10.122  -0.213
   47   3HD1  LEU   7          1HD1      LEU   7   4.167 -11.013   1.130
   48   1HD2  LEU   7          2HD2      LEU   7   2.089  -7.702   1.135
   49   2HD2  LEU   7          1HD2      LEU   7   3.637  -6.863   1.018
   50   3HD2  LEU   7          3HD2      LEU   7   3.136  -7.974  -0.257
   51    H    ALA   8           H        ALA   8   4.743  -7.805   5.610
   52    HA   ALA   8           HA       ALA   8   2.517  -8.072   7.537
   53   1HB   ALA   8          3HB       ALA   8   4.750  -9.435   7.578
   54   2HB   ALA   8          2HB       ALA   8   5.445  -7.964   8.258
   55   3HB   ALA   8          1HB       ALA   8   4.135  -8.791   9.101
   56    H    LYS   9           H        LYS   9   3.695  -5.662   5.912
   57    HA   LYS   9           HA       LYS   9   4.734  -3.663   7.557
   58   1HB   LYS   9          2HB       LYS   9   3.500  -3.992   4.955
   59   2HB   LYS   9          1HB       LYS   9   2.982  -2.478   5.680
   60   1HG   LYS   9          2HG       LYS   9   5.489  -2.112   6.243
   61   2HG   LYS   9          1HG       LYS   9   5.798  -3.423   5.110
   62   1HD   LYS   9          2HD       LYS   9   4.642  -0.697   4.556
   63   2HD   LYS   9          1HD       LYS   9   6.006  -1.499   3.779
   64   1HE   LYS   9          2HE       LYS   9   4.247  -1.642   2.203
   65   2HE   LYS   9          1HE       LYS   9   4.315  -3.230   2.957
   66   1HZ   LYS   9          2HZ       LYS   9   2.627  -1.363   4.335
   67   2HZ   LYS   9          1HZ       LYS   9   2.106  -1.705   2.757
   68   3HZ   LYS   9          3HZ       LYS   9   2.321  -2.961   3.872
   69    HA   PRO  10           HA       PRO  10   1.298  -2.099   9.862
   70   1HB   PRO  10          2HB       PRO  10   0.960   0.535   9.120
   71   2HB   PRO  10          1HB       PRO  10   2.286  -0.036  10.148
   72   1HG   PRO  10          2HG       PRO  10   2.354   0.786   7.286
   73   2HG   PRO  10          1HG       PRO  10   3.652   0.808   8.493
   74   1HD   PRO  10          2HD       PRO  10   3.313  -1.109   6.455
   75   2HD   PRO  10          1HD       PRO  10   4.398  -1.266   7.851
   76    H    HIS  11           H        HIS  11   1.050  -2.490   6.606
   77    HA   HIS  11           HA       HIS  11  -0.712  -3.001   5.231
   78   1HB   HIS  11          2HB       HIS  11  -2.021  -2.912   7.881
   79   2HB   HIS  11          1HB       HIS  11  -3.084  -2.711   6.484
   80    HD1  HIS  11           HD1      HIS  11  -4.107  -5.031   6.384
   81    HD2  HIS  11           HD2      HIS  11   0.065  -5.152   6.504
   82    HE1  HIS  11           HE1      HIS  11  -3.444  -7.436   5.951
   83    H    THR  12           H        THR  12  -2.670  -2.120   4.331
   84    HA   THR  12           HA       THR  12  -2.647  -0.013   2.898
   85    HB   THR  12           HB       THR  12  -4.612  -1.542   3.721
   86    HG1  THR  12           HG1      THR  12  -5.827  -0.542   2.272
   87   1HG2  THR  12          1HG2      THR  12  -5.231   1.145   4.958
   88   2HG2  THR  12          3HG2      THR  12  -6.420  -0.135   4.719
   89   3HG2  THR  12          2HG2      THR  12  -5.058  -0.391   5.807
   90    H    GLU  13           H        GLU  13  -3.599   0.649   6.319
   91    HA   GLU  13           HA       GLU  13  -3.881   3.395   6.068
   92   1HB   GLU  13          2HB       GLU  13  -4.065   2.051   8.229
   93   2HB   GLU  13          1HB       GLU  13  -2.310   2.181   8.363
   94   1HG   GLU  13          2HG       GLU  13  -2.368   4.491   8.687
   95   2HG   GLU  13          1HG       GLU  13  -3.932   4.667   7.890
   96    H    ASN  14           H        ASN  14  -2.596   4.416   4.631
   97    HA   ASN  14           HA       ASN  14  -0.133   5.545   5.333
   98   1HB   ASN  14          2HB       ASN  14   0.257   2.838   4.772
   99   2HB   ASN  14          1HB       ASN  14   0.690   3.642   3.262
  100   1HD2  ASN  14          2HD2      ASN  14   2.923   4.408   6.634
  101   2HD2  ASN  14          1HD2      ASN  14   1.345   3.804   6.803
  102    H    SER  15           H        SER  15   1.003   5.233   2.546
  103    HA   SER  15           HA       SER  15  -0.950   5.779   0.589
  104   1HB   SER  15          2HB       SER  15  -0.691   8.292   0.474
  105   2HB   SER  15          1HB       SER  15  -1.599   7.709   1.863
  106    HG   SER  15           HG       SER  15  -0.168   8.697   3.025
  107    H    PHE  16           H        PHE  16   0.163   7.529  -1.070
  108    HA   PHE  16           HA       PHE  16   3.021   7.480  -1.205
  109   1HB   PHE  16          2HB       PHE  16   2.910   5.140  -1.641
  110   2HB   PHE  16          1HB       PHE  16   1.505   5.325  -2.690
  111    HD1  PHE  16           HD1      PHE  16   5.088   6.373  -2.386
  112    HD2  PHE  16           HD2      PHE  16   1.798   5.514  -5.009
  113    HE1  PHE  16           HE1      PHE  16   6.582   6.633  -4.347
  114    HE2  PHE  16           HE2      PHE  16   3.290   5.776  -6.969
  115    HZ   PHE  16           HZ       PHE  16   5.684   6.331  -6.640
  116    H    THR  17           H        THR  17   3.679   8.862  -2.938
  117    HA   THR  17           HA       THR  17   1.397  10.050  -4.422
  118    HB   THR  17           HB       THR  17   2.436  11.905  -3.602
  119    HG1  THR  17           HG1      THR  17   4.150  12.561  -5.132
  120   1HG2  THR  17          3HG2      THR  17   5.066  10.397  -3.711
  121   2HG2  THR  17          2HG2      THR  17   4.837  12.008  -3.031
  122   3HG2  THR  17          1HG2      THR  17   4.062  10.615  -2.278
  123    H    ASN  18           H        ASN  18   1.708  10.548  -6.741
  124    HA   ASN  18           HA       ASN  18   2.458   9.998  -8.918
  125   1HB   ASN  18          2HB       ASN  18   4.753   9.621  -7.388
  126   2HB   ASN  18          1HB       ASN  18   4.510   8.050  -8.155
  127   1HD2  ASN  18          2HD2      ASN  18   6.286  10.694 -10.387
  128   2HD2  ASN  18          1HD2      ASN  18   6.430  10.475  -8.710
  129    H    VAL  19           H        VAL  19   1.067   8.181  -6.642
  130    HA   VAL  19           HA       VAL  19   1.097   5.505  -7.162
  131    HB   VAL  19           HB       VAL  19  -1.347   7.276  -6.891
  132   1HG1  VAL  19          1HG1      VAL  19  -1.923   5.056  -7.823
  133   2HG1  VAL  19          3HG1      VAL  19  -1.068   4.282  -6.490
  134   3HG1  VAL  19          2HG1      VAL  19  -2.517   5.237  -6.175
  135   1HG2  VAL  19          2HG2      VAL  19   0.624   7.013  -5.102
  136   2HG2  VAL  19          1HG2      VAL  19  -1.067   7.111  -4.610
  137   3HG2  VAL  19          3HG2      VAL  19  -0.269   5.541  -4.713
  138    H    TRP  20           H        TRP  20  -0.238   4.119  -8.552
  139    HA   TRP  20           HA       TRP  20  -1.079   5.357 -11.117
  140   1HB   TRP  20          2HB       TRP  20   0.360   4.135 -12.431
  141   2HB   TRP  20          1HB       TRP  20   1.355   4.161 -10.980
  142    HD1  TRP  20           HD1      TRP  20  -0.849   1.883 -13.078
  143    HE1  TRP  20           HE1      TRP  20  -0.555  -0.552 -12.295
  144    HE3  TRP  20           HE3      TRP  20   2.012   2.642  -8.916
  145    HZ2  TRP  20           HZ2      TRP  20   0.747  -1.990 -10.195
  146    HZ3  TRP  20           HZ3      TRP  20   2.772   0.719  -7.549
  147    HH2  TRP  20           HH2      TRP  20   2.145  -1.594  -8.183
  148    H    LYS  21           H        LYS  21  -1.997   3.216 -12.451
  149    HA   LYS  21           HA       LYS  21  -3.496   1.478 -10.590
  150   1HB   LYS  21          2HB       LYS  21  -4.912   3.541 -11.022
  151   2HB   LYS  21          1HB       LYS  21  -4.956   3.061 -12.721
  152   1HG   LYS  21          2HG       LYS  21  -5.631   0.710 -11.610
  153   2HG   LYS  21          1HG       LYS  21  -6.252   1.790 -10.360
  154   1HD   LYS  21          2HD       LYS  21  -7.981   1.315 -12.061
  155   2HD   LYS  21          1HD       LYS  21  -7.546   3.025 -12.059
  156   1HE   LYS  21          2HE       LYS  21  -5.750   1.709 -13.827
  157   2HE   LYS  21          1HE       LYS  21  -7.374   1.144 -14.220
  158   1HZ   LYS  21          1HZ       LYS  21  -8.035   3.562 -14.150
  159   2HZ   LYS  21          3HZ       LYS  21  -6.380   3.931 -14.141
  160   3HZ   LYS  21          2HZ       LYS  21  -7.055   3.094 -15.457
  161    H    ASP  22           H        ASP  22  -3.068  -0.516 -11.399
  162    HA   ASP  22           HA       ASP  22  -2.486  -0.797 -14.274
  163   1HB   ASP  22          2HB       ASP  22  -1.584  -2.059 -11.897
  164   2HB   ASP  22          1HB       ASP  22  -2.422  -3.288 -12.843
  165    H    ASP  23           H        ASP  23  -3.959  -1.537 -15.683
  166    HA   ASP  23           HA       ASP  23  -6.594  -2.424 -14.756
  167   1HB   ASP  23          2HB       ASP  23  -5.891  -1.088 -16.965
  168   2HB   ASP  23          1HB       ASP  23  -5.709  -2.722 -17.605
  169    H    LYS  24           H        LYS  24  -3.550  -3.773 -15.532
  170    HA   LYS  24           HA       LYS  24  -4.470  -6.447 -16.248
  171   1HB   LYS  24          2HB       LYS  24  -2.237  -5.428 -16.909
  172   2HB   LYS  24          1HB       LYS  24  -1.754  -5.571 -15.217
  173   1HG   LYS  24          2HG       LYS  24  -2.885  -8.068 -16.150
  174   2HG   LYS  24          1HG       LYS  24  -1.567  -7.562 -17.208
  175   1HD   LYS  24          2HD       LYS  24  -0.783  -7.062 -14.501
  176   2HD   LYS  24          1HD       LYS  24  -1.380  -8.719 -14.608
  177   1HE   LYS  24          2HE       LYS  24   0.222  -9.329 -16.209
  178   2HE   LYS  24          1HE       LYS  24   0.514  -7.659 -16.692
  179   1HZ   LYS  24          3HZ       LYS  24   1.178  -7.608 -14.095
  180   2HZ   LYS  24          2HZ       LYS  24   1.660  -9.182 -14.521
  181   3HZ   LYS  24          1HZ       LYS  24   2.285  -7.841 -15.358
  182    H    THR  25           H        THR  25  -2.807  -5.005 -13.450
  183    HA   THR  25           HA       THR  25  -3.199  -7.292 -11.750
  184    HB   THR  25           HB       THR  25  -2.372  -5.864  -9.980
  185    HG1  THR  25           HG1      THR  25  -2.096  -3.542 -10.715
  186   1HG2  THR  25          2HG2      THR  25  -1.171  -5.589 -12.693
  187   2HG2  THR  25          1HG2      THR  25  -0.513  -4.589 -11.397
  188   3HG2  THR  25          3HG2      THR  25  -0.510  -6.346 -11.244
  189    H    LEU  26           H        LEU  26  -5.117  -4.530 -12.628
  190    HA   LEU  26           HA       LEU  26  -7.412  -4.153 -12.277
  191   1HB   LEU  26          2HB       LEU  26  -7.019  -6.930 -11.675
  192   2HB   LEU  26          1HB       LEU  26  -8.151  -6.248 -10.510
  193    HG   LEU  26           HG       LEU  26  -9.204  -7.144 -12.625
  194   1HD1  LEU  26          1HD1      LEU  26  -9.534  -4.403 -11.511
  195   2HD1  LEU  26          3HD1      LEU  26 -10.369  -4.744 -13.026
  196   3HD1  LEU  26          2HD1      LEU  26 -10.695  -5.729 -11.600
  197   1HD2  LEU  26          2HD2      LEU  26  -7.276  -6.181 -14.046
  198   2HD2  LEU  26          1HD2      LEU  26  -8.911  -6.013 -14.685
  199   3HD2  LEU  26          3HD2      LEU  26  -8.122  -4.639 -13.915
  200    H    ASP  27           H        ASP  27  -6.061  -2.492 -10.765
  201    HA   ASP  27           HA       ASP  27  -7.631  -1.899  -8.541
  202   1HB   ASP  27          2HB       ASP  27  -5.965  -4.188  -8.045
  203   2HB   ASP  27          1HB       ASP  27  -5.481  -2.871  -6.977
  204    H    ARG  28           H        ARG  28  -6.512  -0.388  -6.926
  205    HA   ARG  28           HA       ARG  28  -4.595   1.281  -8.415
  206   1HB   ARG  28          2HB       ARG  28  -6.580   2.054  -6.865
  207   2HB   ARG  28          1HB       ARG  28  -5.427   1.772  -5.561
  208   1HG   ARG  28          2HG       ARG  28  -4.491   3.772  -5.987
  209   2HG   ARG  28          1HG       ARG  28  -4.046   3.199  -7.595
  210   1HD   ARG  28          2HD       ARG  28  -5.439   5.277  -7.663
  211   2HD   ARG  28          1HD       ARG  28  -6.194   3.918  -8.497
  212    HE   ARG  28           HE       ARG  28  -6.987   4.262  -5.680
  213   1HH1  ARG  28          1HH2      ARG  28  -7.476   5.709  -8.716
  214   2HH1  ARG  28          2HH2      ARG  28  -9.205   5.658  -8.638
  215   1HH2  ARG  28          2HH1      ARG  28  -9.286   3.824  -5.696
  216   2HH2  ARG  28          1HH1      ARG  28 -10.229   4.591  -6.930
  217    H    TYR  29           H        TYR  29  -2.398   1.589  -7.736
  218    HA   TYR  29           HA       TYR  29  -1.488  -0.013  -5.412
  219   1HB   TYR  29          2HB       TYR  29  -0.464  -0.376  -8.237
  220   2HB   TYR  29          1HB       TYR  29   0.297  -1.067  -6.805
  221    HD1  TYR  29           HD2      TYR  29  -0.881  -2.786  -5.460
  222    HD2  TYR  29           HD1      TYR  29  -2.515  -1.287  -9.137
  223    HE1  TYR  29           HE2      TYR  29  -2.433  -4.715  -5.555
  224    HE2  TYR  29           HE1      TYR  29  -4.070  -3.217  -9.231
  225    HH   TYR  29           HH       TYR  29  -4.472  -5.295  -8.367
  226    H    ALA  30           H        ALA  30   0.631   0.570  -4.679
  227    HA   ALA  30           HA       ALA  30   1.780   3.035  -5.913
  228   1HB   ALA  30          1HB       ALA  30   0.734   2.652  -3.166
  229   2HB   ALA  30          3HB       ALA  30   2.317   3.424  -3.267
  230   3HB   ALA  30          2HB       ALA  30   0.934   4.136  -4.096
  231    H    ASN  31           H        ASN  31   3.729   2.277  -6.636
  232    HA   ASN  31           HA       ASN  31   5.107   0.054  -5.430
  233   1HB   ASN  31          2HB       ASN  31   6.998   0.759  -6.927
  234   2HB   ASN  31          1HB       ASN  31   5.464   0.553  -7.773
  235   1HD2  ASN  31          2HD2      ASN  31   5.117   4.010  -8.553
  236   2HD2  ASN  31          1HD2      ASN  31   4.309   2.520  -8.455
  237    H    TYR  32           H        TYR  32   5.493   0.507  -3.230
  238    HA   TYR  32           HA       TYR  32   6.921   2.965  -2.484
  239   1HB   TYR  32          2HB       TYR  32   5.141   1.772  -1.060
  240   2HB   TYR  32          1HB       TYR  32   6.397   0.589  -0.695
  241    HD1  TYR  32           HD1      TYR  32   6.612   4.292  -1.182
  242    HD2  TYR  32           HD2      TYR  32   7.073   0.985   1.520
  243    HE1  TYR  32           HE1      TYR  32   7.560   5.819   0.525
  244    HE2  TYR  32           HE2      TYR  32   8.018   2.513   3.228
  245    HH   TYR  32           HH       TYR  32   7.835   5.046   3.727
  246    H    GLU  33           H        GLU  33   8.557   1.819  -4.232
  247    HA   GLU  33           HA       GLU  33  10.556   0.565  -4.575
  248   1HB   GLU  33          2HB       GLU  33  10.795   2.883  -2.959
  249   2HB   GLU  33          1HB       GLU  33  11.904   1.680  -2.302
  250   1HG   GLU  33          2HG       GLU  33  12.619   1.281  -4.755
  251   2HG   GLU  33          1HG       GLU  33  11.815   2.814  -5.095
  252    H    GLY  34           H        GLY  34  10.296  -1.631  -4.103
  253   1HA   GLY  34          2HA       GLY  34  11.226  -3.487  -2.869
  254   2HA   GLY  34          1HA       GLY  34  11.314  -2.458  -1.441
  255    H    CYS  35           H        CYS  35   8.519  -1.479  -1.895
  256    HA   CYS  35           HA       CYS  35   7.047  -3.989  -1.184
  257   1HB   CYS  35          2HB       CYS  35   6.597  -1.293   0.122
  258   2HB   CYS  35          1HB       CYS  35   5.911  -2.843   0.604
  259    H    LEU  36           H        LEU  36   4.771  -3.942  -1.734
  260    HA   LEU  36           HA       LEU  36   4.009  -1.715  -3.576
  261   1HB   LEU  36          2HB       LEU  36   4.553  -3.856  -4.786
  262   2HB   LEU  36          1HB       LEU  36   3.240  -4.626  -3.920
  263    HG   LEU  36           HG       LEU  36   2.896  -3.540  -6.347
  264   1HD1  LEU  36          2HD1      LEU  36   1.301  -4.653  -4.549
  265   2HD1  LEU  36          1HD1      LEU  36   0.707  -3.004  -4.403
  266   3HD1  LEU  36          3HD1      LEU  36   0.650  -3.825  -5.960
  267   1HD2  LEU  36          3HD2      LEU  36   3.580  -1.256  -5.333
  268   2HD2  LEU  36          2HD2      LEU  36   2.113  -1.299  -6.311
  269   3HD2  LEU  36          1HD2      LEU  36   1.999  -1.278  -4.552
  270    H    TRP  37           H        TRP  37   2.298  -0.658  -2.735
  271    HA   TRP  37           HA       TRP  37   0.478  -2.082  -0.869
  272   1HB   TRP  37          2HB       TRP  37   0.505   0.873  -1.589
  273   2HB   TRP  37          1HB       TRP  37  -0.361   0.100  -0.271
  274    HD1  TRP  37           HD1      TRP  37   3.355   0.060  -1.374
  275    HE1  TRP  37           HE1      TRP  37   4.783   0.426   0.741
  276    HE3  TRP  37           HE3      TRP  37  -0.347   0.486   2.109
  277    HZ2  TRP  37           HZ2      TRP  37   4.388   0.844   3.554
  278    HZ3  TRP  37           HZ3      TRP  37   0.190   0.856   4.488
  279    HH2  TRP  37           HH2      TRP  37   2.557   1.047   5.222
  280    H    ASN  38           H        ASN  38  -1.933  -1.379  -1.163
  281    HA   ASN  38           HA       ASN  38  -2.629  -1.082  -4.034
  282   1HB   ASN  38          2HB       ASN  38  -2.993  -3.319  -4.159
  283   2HB   ASN  38          1HB       ASN  38  -2.913  -3.516  -2.413
  284   1HD2  ASN  38          2HD2      ASN  38  -6.607  -2.413  -3.856
  285   2HD2  ASN  38          1HD2      ASN  38  -5.224  -1.620  -4.437
  286    H    ALA  39           H        ALA  39  -4.004   0.579  -4.129
  287    HA   ALA  39           HA       ALA  39  -5.646   1.301  -1.784
  288   1HB   ALA  39          1HB       ALA  39  -4.553   2.688  -4.094
  289   2HB   ALA  39          3HB       ALA  39  -6.277   3.016  -3.915
  290   3HB   ALA  39          2HB       ALA  39  -5.172   3.358  -2.584
  291    H    THR  40           H        THR  40  -7.865   1.123  -1.736
  292    HA   THR  40           HA       THR  40  -9.286   0.196  -4.170
  293    HB   THR  40           HB       THR  40  -8.873  -1.916  -3.226
  294    HG1  THR  40           HG1      THR  40 -10.865  -2.512  -2.321
  295   1HG2  THR  40          1HG2      THR  40  -8.420  -0.422  -0.852
  296   2HG2  THR  40          3HG2      THR  40  -9.664  -1.613  -0.477
  297   3HG2  THR  40          2HG2      THR  40  -8.109  -2.136  -1.123
  298    H    GLY  41           H        GLY  41  -9.838   0.748  -0.663
  299   1HA   GLY  41          2HA       GLY  41 -12.532   1.607  -0.933
  300   2HA   GLY  41          1HA       GLY  41 -11.480   2.024   0.420
  301    H    VAL  42           H        VAL  42 -12.940   4.071   0.017
  302    HA   VAL  42           HA       VAL  42 -12.412   5.791  -2.196
  303    HB   VAL  42           HB       VAL  42 -14.251   6.006  -0.416
  304   1HG1  VAL  42          1HG1      VAL  42 -12.157   6.121   1.330
  305   2HG1  VAL  42          3HG1      VAL  42 -12.492   7.837   1.101
  306   3HG1  VAL  42          2HG1      VAL  42 -13.764   6.761   1.679
  307   1HG2  VAL  42          1HG2      VAL  42 -12.585   8.258  -1.510
  308   2HG2  VAL  42          3HG2      VAL  42 -14.208   7.749  -1.975
  309   3HG2  VAL  42          2HG2      VAL  42 -13.956   8.620  -0.463
  310    H    VAL  43           H        VAL  43 -10.776   7.265  -2.573
  311    HA   VAL  43           HA       VAL  43  -8.786   7.762  -0.424
  312    HB   VAL  43           HB       VAL  43  -7.857   7.046  -3.202
  313   1HG1  VAL  43          2HG1      VAL  43  -6.575   6.929  -0.455
  314   2HG1  VAL  43          1HG1      VAL  43  -5.781   6.511  -1.973
  315   3HG1  VAL  43          3HG1      VAL  43  -6.287   8.173  -1.672
  316   1HG2  VAL  43          1HG2      VAL  43  -8.640   5.218  -0.940
  317   2HG2  VAL  43          3HG2      VAL  43  -8.964   5.044  -2.665
  318   3HG2  VAL  43          2HG2      VAL  43  -7.340   4.760  -2.040
  319    H    VAL  44           H        VAL  44  -7.332   9.615  -1.022
  320    HA   VAL  44           HA       VAL  44  -8.820  11.524  -2.776
  321    HB   VAL  44           HB       VAL  44  -8.437  12.134  -0.349
  322   1HG1  VAL  44          3HG1      VAL  44  -6.187  11.120  -0.152
  323   2HG1  VAL  44          2HG1      VAL  44  -5.557  12.313  -1.289
  324   3HG1  VAL  44          1HG1      VAL  44  -6.162  12.827   0.287
  325   1HG2  VAL  44          3HG2      VAL  44  -8.606  13.743  -2.426
  326   2HG2  VAL  44          2HG2      VAL  44  -8.114  14.393  -0.862
  327   3HG2  VAL  44          1HG2      VAL  44  -6.900  14.042  -2.093
  328    H    CYS  45           H        CYS  45  -7.789  12.387  -4.565
  329    HA   CYS  45           HA       CYS  45  -4.879  11.804  -4.852
  330   1HB   CYS  45          2HB       CYS  45  -7.049  11.329  -6.911
  331   2HB   CYS  45          1HB       CYS  45  -5.327  11.342  -7.291
  332    H    THR  46           H        THR  46  -3.750  13.291  -6.255
  333    HA   THR  46           HA       THR  46  -5.248  15.671  -7.173
  334    HB   THR  46           HB       THR  46  -4.484  16.048  -4.768
  335    HG1  THR  46           HG1      THR  46  -4.810  17.894  -5.789
  336   1HG2  THR  46          3HG2      THR  46  -2.188  14.858  -5.547
  337   2HG2  THR  46          2HG2      THR  46  -1.741  16.547  -5.786
  338   3HG2  THR  46          1HG2      THR  46  -2.271  15.991  -4.198
  339    H    GLY  47           H        GLY  47  -3.902  17.028  -8.603
  340   1HA   GLY  47          2HA       GLY  47  -2.340  17.300 -10.336
  341   2HA   GLY  47          1HA       GLY  47  -1.251  16.272  -9.399
  342    H    ASP  48           H        ASP  48  -4.000  16.158 -11.665
  343    HA   ASP  48           HA       ASP  48  -4.575  14.493 -13.233
  344   1HB   ASP  48          2HB       ASP  48  -1.682  14.507 -13.034
  345   2HB   ASP  48          1HB       ASP  48  -2.277  12.876 -13.340
  346    H    GLU  49           H        GLU  49  -4.423  14.064 -10.143
  347    HA   GLU  49           HA       GLU  49  -5.012  12.360  -8.681
  348   1HB   GLU  49          2HB       GLU  49  -5.906  11.256 -11.335
  349   2HB   GLU  49          1HB       GLU  49  -5.994  10.247  -9.889
  350   1HG   GLU  49          2HG       GLU  49  -7.856  11.313  -9.214
  351   2HG   GLU  49          1HG       GLU  49  -7.025  12.867  -9.283
  352    H    THR  50           H        THR  50  -2.288  12.568  -9.472
  353    HA   THR  50           HA       THR  50  -1.409   9.758  -9.855
  354    HB   THR  50           HB       THR  50   0.912  11.016  -9.828
  355    HG1  THR  50           HG1      THR  50  -0.306  12.986  -9.185
  356   1HG2  THR  50          3HG2      THR  50  -1.185  10.940 -11.978
  357   2HG2  THR  50          2HG2      THR  50   0.381  11.684 -12.300
  358   3HG2  THR  50          1HG2      THR  50   0.291   9.985 -11.833
  359    H    GLN  51           H        GLN  51  -1.319  12.379  -7.464
  360    HA   GLN  51           HA       GLN  51   0.134  10.547  -5.622
  361   1HB   GLN  51          2HB       GLN  51  -0.602  13.366  -4.898
  362   2HB   GLN  51          1HB       GLN  51   0.788  12.409  -4.383
  363   1HG   GLN  51          2HG       GLN  51   1.852  12.648  -6.526
  364   2HG   GLN  51          1HG       GLN  51   0.396  13.347  -7.236
  365   1HE2  GLN  51          2HE2      GLN  51   2.751  15.682  -4.810
  366   2HE2  GLN  51          1HE2      GLN  51   2.895  13.993  -4.732
  367    H    CYS  52           H        CYS  52  -0.925   9.756  -3.772
  368    HA   CYS  52           HA       CYS  52  -3.563  10.897  -3.138
  369   1HB   CYS  52          2HB       CYS  52  -3.349   7.937  -3.703
  370   2HB   CYS  52          1HB       CYS  52  -4.811   8.880  -3.433
  371    H    TYR  53           H        TYR  53  -4.518   9.953  -1.173
  372    HA   TYR  53           HA       TYR  53  -2.628   8.484   0.568
  373   1HB   TYR  53          2HB       TYR  53  -2.145  10.576   1.463
  374   2HB   TYR  53          1HB       TYR  53  -3.721  11.234   1.036
  375    HD1  TYR  53           HD1      TYR  53  -2.144   8.684   3.305
  376    HD2  TYR  53           HD2      TYR  53  -5.369  11.453   2.688
  377    HE1  TYR  53           HE1      TYR  53  -2.973   8.224   5.598
  378    HE2  TYR  53           HE2      TYR  53  -6.192  10.999   4.982
  379    HH   TYR  53           HH       TYR  53  -4.609   9.897   7.319
  380    H    GLY  54           H        GLY  54  -3.711   7.227   2.186
  381   1HA   GLY  54          2HA       GLY  54  -6.228   7.207   3.161
  382   2HA   GLY  54          1HA       GLY  54  -6.530   6.659   1.511
  383    H    THR  55           H        THR  55  -6.642   4.480   1.376
  384    HA   THR  55           HA       THR  55  -4.908   2.881   3.228
  385    HB   THR  55           HB       THR  55  -6.697   1.074   2.870
  386    HG1  THR  55           HG1      THR  55  -7.543   2.610   1.078
  387   1HG2  THR  55          1HG2      THR  55  -6.488   3.119   4.707
  388   2HG2  THR  55          3HG2      THR  55  -8.163   3.246   4.170
  389   3HG2  THR  55          2HG2      THR  55  -7.564   1.729   4.841
  390    H    TRP  56           H        TRP  56  -3.530   1.546   2.307
  391    HA   TRP  56           HA       TRP  56  -3.844   0.754  -0.546
  392   1HB   TRP  56          2HB       TRP  56  -1.288   1.559   0.820
  393   2HB   TRP  56          1HB       TRP  56  -1.521   1.225  -0.901
  394    HD1  TRP  56           HD1      TRP  56  -2.695   3.744   1.777
  395    HE1  TRP  56           HE1      TRP  56  -3.244   5.959   0.590
  396    HE3  TRP  56           HE3      TRP  56  -1.936   2.319  -3.040
  397    HZ2  TRP  56           HZ2      TRP  56  -3.345   6.993  -2.103
  398    HZ3  TRP  56           HZ3      TRP  56  -2.263   3.907  -4.905
  399    HH2  TRP  56           HH2      TRP  56  -2.964   6.251  -4.446
  400    H    VAL  57           H        VAL  57  -4.638  -1.232   0.877
  401    HA   VAL  57           HA       VAL  57  -3.020  -2.650   2.628
  402    HB   VAL  57           HB       VAL  57  -4.934  -3.605   0.496
  403   1HG1  VAL  57          2HG1      VAL  57  -3.086  -5.243   2.209
  404   2HG1  VAL  57          1HG1      VAL  57  -4.709  -5.847   1.877
  405   3HG1  VAL  57          3HG1      VAL  57  -3.601  -5.519   0.544
  406   1HG2  VAL  57          3HG2      VAL  57  -4.903  -3.393   3.511
  407   2HG2  VAL  57          2HG2      VAL  57  -6.018  -2.635   2.375
  408   3HG2  VAL  57          1HG2      VAL  57  -6.100  -4.373   2.663
  409    HA   PRO  58           HA       PRO  58   0.569  -3.598   0.226
  410   1HB   PRO  58          2HB       PRO  58   1.741  -5.225   2.124
  411   2HB   PRO  58          1HB       PRO  58   1.791  -3.452   2.173
  412   1HG   PRO  58          2HG       PRO  58   0.143  -5.338   3.803
  413   2HG   PRO  58          1HG       PRO  58   0.725  -3.715   4.221
  414   1HD   PRO  58          2HD       PRO  58  -1.895  -4.341   3.404
  415   2HD   PRO  58          1HD       PRO  58  -1.177  -2.717   3.414
  416    H    ILE  59           H        ILE  59   0.717  -5.152  -1.339
  417    HA   ILE  59           HA       ILE  59  -0.405  -7.843  -0.709
  418    HB   ILE  59           HB       ILE  59  -1.070  -7.964  -3.117
  419   1HG1  ILE  59          2HG1      ILE  59   0.622  -6.098  -3.706
  420   2HG1  ILE  59          1HG1      ILE  59  -0.933  -6.077  -4.534
  421   1HG2  ILE  59          1HG2      ILE  59  -2.207  -6.017  -1.159
  422   2HG2  ILE  59          3HG2      ILE  59  -2.855  -6.003  -2.799
  423   3HG2  ILE  59          2HG2      ILE  59  -2.925  -7.479  -1.835
  424   1HD1  ILE  59          3HD1      ILE  59  -1.199  -4.611  -2.083
  425   2HD1  ILE  59          2HD1      ILE  59   0.221  -4.025  -2.939
  426   3HD1  ILE  59          1HD1      ILE  59  -1.346  -4.020  -3.737
  427    H    GLY  60           H        GLY  60   2.221  -6.019  -2.287
  428   1HA   GLY  60          2HA       GLY  60   3.666  -8.601  -2.398
  429   2HA   GLY  60          1HA       GLY  60   3.425  -7.803  -3.939
  430    H    LEU  61           H        LEU  61   5.690  -7.611  -4.195
  431    HA   LEU  61           HA       LEU  61   7.223  -6.046  -2.234
  432   1HB   LEU  61          2HB       LEU  61   8.194  -7.039  -4.914
  433   2HB   LEU  61          1HB       LEU  61   9.144  -6.676  -3.474
  434    HG   LEU  61           HG       LEU  61   7.047  -8.859  -3.585
  435   1HD1  LEU  61          1HD1      LEU  61   9.585  -8.827  -4.824
  436   2HD1  LEU  61          3HD1      LEU  61   9.770  -9.793  -3.360
  437   3HD1  LEU  61          2HD1      LEU  61   8.548 -10.228  -4.555
  438   1HD2  LEU  61          3HD2      LEU  61   8.371  -7.586  -1.453
  439   2HD2  LEU  61          2HD2      LEU  61   7.449  -9.087  -1.381
  440   3HD2  LEU  61          1HD2      LEU  61   9.190  -9.135  -1.653
  441    H    ALA  62           H        ALA  62   6.018  -5.559  -5.604
  442    HA   ALA  62           HA       ALA  62   6.363  -2.683  -5.139
  443   1HB   ALA  62          1HB       ALA  62   8.132  -4.206  -7.017
  444   2HB   ALA  62          3HB       ALA  62   7.749  -2.512  -7.328
  445   3HB   ALA  62          2HB       ALA  62   8.562  -2.974  -5.830
  446    H    ILE  63           H        ILE  63   5.958  -4.820  -8.056
  447    HA   ILE  63           HA       ILE  63   3.633  -3.043  -8.671
  448    HB   ILE  63           HB       ILE  63   5.965  -3.419 -10.134
  449   1HG1  ILE  63          2HG1      ILE  63   4.312  -1.509 -10.094
  450   2HG1  ILE  63          1HG1      ILE  63   4.928  -1.916 -11.694
  451   1HG2  ILE  63          2HG2      ILE  63   4.763  -5.646 -10.838
  452   2HG2  ILE  63          1HG2      ILE  63   3.779  -4.582 -11.840
  453   3HG2  ILE  63          3HG2      ILE  63   5.526  -4.642 -12.072
  454   1HD1  ILE  63          3HD1      ILE  63   2.304  -2.922 -10.561
  455   2HD1  ILE  63          2HD1      ILE  63   2.454  -1.563 -11.677
  456   3HD1  ILE  63          1HD1      ILE  63   2.908  -3.188 -12.195
  457    HA   PRO  64           HA       PRO  64   2.366  -7.641  -9.304
  458   1HB   PRO  64          2HB       PRO  64   1.955  -8.678  -6.800
  459   2HB   PRO  64          1HB       PRO  64   3.469  -8.889  -7.701
  460   1HG   PRO  64          2HG       PRO  64   2.870  -7.045  -5.422
  461   2HG   PRO  64          1HG       PRO  64   4.395  -7.848  -5.838
  462   1HD   PRO  64          2HD       PRO  64   3.807  -5.168  -6.364
  463   2HD   PRO  64          1HD       PRO  64   5.053  -6.121  -7.194
  464    H    GLU  65           H        GLU  65   0.155  -8.373  -8.995
  465    HA   GLU  65           HA       GLU  65  -1.686  -6.202  -8.359
  466   1HB   GLU  65          2HB       GLU  65  -3.413  -7.673  -9.160
  467   2HB   GLU  65          1HB       GLU  65  -2.017  -7.924 -10.209
  468   1HG   GLU  65          2HG       GLU  65  -1.541  -9.718  -8.172
  469   2HG   GLU  65          1HG       GLU  65  -3.297  -9.783  -8.328
  470    H    ASN  66           H        ASN  66  -3.763  -8.043  -7.306
  471    HA   ASN  66           HA       ASN  66  -3.323  -7.612  -4.510
  472   1HB   ASN  66          2HB       ASN  66  -5.343  -9.077  -6.159
  473   2HB   ASN  66          1HB       ASN  66  -5.282  -9.413  -4.428
  474   1HD2  ASN  66          2HD2      ASN  66  -6.981  -6.451  -3.620
  475   2HD2  ASN  66          1HD2      ASN  66  -6.525  -8.025  -3.176
  476    H    ALA  67           H        ALA  67  -2.954 -10.498  -6.557
  477    HA   ALA  67           HA       ALA  67  -2.006 -12.039  -4.210
  478   1HB   ALA  67          2HB       ALA  67  -3.286 -12.691  -6.681
  479   2HB   ALA  67          1HB       ALA  67  -1.721 -13.502  -6.647
  480   3HB   ALA  67          3HB       ALA  67  -2.881 -13.770  -5.346
  481    H    ALA  68           H        ALA  68  -0.054 -13.628  -5.154
  482    HA   ALA  68           HA       ALA  68   2.035 -11.744  -6.176
  483   1HB   ALA  68          1HB       ALA  68   1.945 -13.020  -3.665
  484   2HB   ALA  68          3HB       ALA  68   3.132 -13.922  -4.609
  485   3HB   ALA  68          2HB       ALA  68   3.325 -12.185  -4.378
  486    H    ALA  69           H        ALA  69   2.656 -12.417  -8.172
  487    HA   ALA  69           HA       ALA  69   2.146 -15.135  -9.089
  488   1HB   ALA  69          2HB       ALA  69   2.081 -13.071 -10.555
  489   2HB   ALA  69          1HB       ALA  69   3.840 -13.015 -10.435
  490   3HB   ALA  69          3HB       ALA  69   3.051 -14.397 -11.197
  491    H    HIS  70           HN       HIS  70   5.118 -13.232  -8.491
  492    HA   HIS  70           HA       HIS  70   6.807 -15.586  -8.842
  493   1HB   HIS  70          2HB       HIS  70   7.193 -12.701  -8.295
  494   2HB   HIS  70          1HB       HIS  70   8.413 -13.767  -7.601
  495    HD1  HIS  70           HD1      HIS  70  10.261 -13.165  -9.287
  496    HD2  HIS  70           HD2      HIS  70   6.787 -14.589 -11.098
  497    HE1  HIS  70           HE1      HIS  70  10.845 -13.603 -11.712
   
  No H/Q in entry =         497
  Start of MODEL   15
    1   1H    GLU   1          1H        GLU   1  13.594  -7.506  -0.153
    2   2H    GLU   1          3H        GLU   1  13.818  -6.052  -0.994
    3   3H    GLU   1          2H        GLU   1  14.221  -6.150   0.653
    4    HA   GLU   1           HA       GLU   1  12.221  -5.080   0.767
    5   1HB   GLU   1          2HB       GLU   1  10.414  -5.400  -0.743
    6   2HB   GLU   1          1HB       GLU   1  11.869  -5.373  -1.730
    7   1HG   GLU   1          2HG       GLU   1  10.521  -7.910  -0.754
    8   2HG   GLU   1          1HG       GLU   1  10.282  -7.210  -2.353
    9    H    THR   2           H        THR   2  12.211  -8.613   0.213
   10    HA   THR   2           HA       THR   2  11.424 -10.323   1.606
   11    HB   THR   2           HB       THR   2  10.861  -8.475   3.861
   12    HG1  THR   2           HG1      THR   2  13.491  -8.990   2.942
   13   1HG2  THR   2          1HG2      THR   2  11.734 -11.221   3.365
   14   2HG2  THR   2          3HG2      THR   2  12.705 -10.416   4.599
   15   3HG2  THR   2          2HG2      THR   2  10.955 -10.531   4.790
   16    H    VAL   3           H        VAL   3   9.466 -10.717   0.523
   17    HA   VAL   3           HA       VAL   3   7.166  -9.097   0.546
   18    HB   VAL   3           HB       VAL   3   7.006 -12.106   0.715
   19   1HG1  VAL   3          2HG1      VAL   3   5.272  -9.910  -0.066
   20   2HG1  VAL   3          1HG1      VAL   3   5.466 -11.064  -1.385
   21   3HG1  VAL   3          3HG1      VAL   3   4.872 -11.609   0.183
   22   1HG2  VAL   3          3HG2      VAL   3   8.164 -10.373  -1.457
   23   2HG2  VAL   3          2HG2      VAL   3   8.756 -11.913  -0.836
   24   3HG2  VAL   3          1HG2      VAL   3   7.333 -11.871  -1.875
   25    H    GLU   4           H        GLU   4   8.483 -11.174   3.032
   26    HA   GLU   4           HA       GLU   4   6.156 -11.438   4.670
   27   1HB   GLU   4          2HB       GLU   4   8.551 -12.531   4.851
   28   2HB   GLU   4          1HB       GLU   4   8.884 -11.134   5.878
   29   1HG   GLU   4          2HG       GLU   4   8.067 -12.595   7.475
   30   2HG   GLU   4          1HG       GLU   4   6.556 -11.835   6.972
   31    H    SER   5           H        SER   5   8.671  -8.931   4.530
   32    HA   SER   5           HA       SER   5   7.381  -7.422   6.698
   33   1HB   SER   5          2HB       SER   5   9.629  -7.007   6.874
   34   2HB   SER   5          1HB       SER   5   9.911  -7.243   5.151
   35    HG   SER   5           HG       SER   5   9.193  -4.965   6.567
   36    H    CYS   6           H        CYS   6   8.124  -6.766   3.237
   37    HA   CYS   6           HA       CYS   6   6.787  -4.322   3.008
   38   1HB   CYS   6          2HB       CYS   6   6.876  -6.626   1.045
   39   2HB   CYS   6          1HB       CYS   6   6.184  -5.058   0.647
   40    H    LEU   7           H        LEU   7   5.443  -7.506   3.489
   41    HA   LEU   7           HA       LEU   7   2.700  -6.522   2.978
   42   1HB   LEU   7          2HB       LEU   7   3.698  -9.275   3.753
   43   2HB   LEU   7          1HB       LEU   7   2.039  -8.874   3.303
   44    HG   LEU   7           HG       LEU   7   4.493  -8.588   1.543
   45   1HD1  LEU   7          1HD1      LEU   7   2.072 -10.414   1.433
   46   2HD1  LEU   7          3HD1      LEU   7   3.282 -10.280   0.156
   47   3HD1  LEU   7          2HD1      LEU   7   3.739 -10.899   1.742
   48   1HD2  LEU   7          3HD2      LEU   7   1.806  -7.400   1.446
   49   2HD2  LEU   7          2HD2      LEU   7   3.269  -6.944   0.574
   50   3HD2  LEU   7          1HD2      LEU   7   2.252  -8.253  -0.032
   51    H    ALA   8           H        ALA   8   4.745  -7.607   5.628
   52    HA   ALA   8           HA       ALA   8   2.683  -7.567   7.652
   53   1HB   ALA   8          2HB       ALA   8   5.025  -8.651   7.796
   54   2HB   ALA   8          1HB       ALA   8   5.616  -7.029   8.156
   55   3HB   ALA   8          3HB       ALA   8   4.449  -7.800   9.229
   56    H    LYS   9           H        LYS   9   4.161  -5.189   5.827
   57    HA   LYS   9           HA       LYS   9   4.621  -2.948   7.365
   58   1HB   LYS   9          2HB       LYS   9   3.495  -3.519   4.660
   59   2HB   LYS   9          1HB       LYS   9   3.336  -1.873   5.240
   60   1HG   LYS   9          2HG       LYS   9   5.885  -2.173   5.879
   61   2HG   LYS   9          1HG       LYS   9   5.820  -3.451   4.666
   62   1HD   LYS   9          2HD       LYS   9   4.895  -1.810   3.033
   63   2HD   LYS   9          1HD       LYS   9   5.093  -0.541   4.245
   64   1HE   LYS   9          2HE       LYS   9   7.535  -2.076   3.973
   65   2HE   LYS   9          1HE       LYS   9   7.030  -1.431   2.411
   66   1HZ   LYS   9          1HZ       LYS   9   6.641   0.554   4.336
   67   2HZ   LYS   9          3HZ       LYS   9   8.204  -0.068   4.560
   68   3HZ   LYS   9          2HZ       LYS   9   7.744   0.549   3.044
   69    HA   PRO  10           HA       PRO  10   0.756  -1.605   9.040
   70   1HB   PRO  10          2HB       PRO  10   0.500   1.010   8.180
   71   2HB   PRO  10          1HB       PRO  10   1.598   0.505   9.476
   72   1HG   PRO  10          2HG       PRO  10   2.235   1.243   6.652
   73   2HG   PRO  10          1HG       PRO  10   3.240   1.383   8.104
   74   1HD   PRO  10          2HD       PRO  10   3.483  -0.625   6.161
   75   2HD   PRO  10          1HD       PRO  10   4.161  -0.707   7.797
   76    H    HIS  11           H        HIS  11  -0.323  -3.110   7.668
   77    HA   HIS  11           HA       HIS  11  -1.095  -3.173   5.152
   78   1HB   HIS  11          2HB       HIS  11  -2.453  -3.917   7.603
   79   2HB   HIS  11          1HB       HIS  11  -3.573  -3.568   6.279
   80    HD1  HIS  11           HD1      HIS  11  -0.094  -5.086   5.925
   81    HD2  HIS  11           HD2      HIS  11  -4.090  -6.165   5.395
   82    HE1  HIS  11           HE1      HIS  11  -0.084  -7.348   4.791
   83    H    THR  12           H        THR  12  -1.146  -1.135   4.127
   84    HA   THR  12           HA       THR  12  -2.476   0.358   2.955
   85    HB   THR  12           HB       THR  12  -4.308  -1.276   4.137
   86    HG1  THR  12           HG1      THR  12  -5.687  -0.474   2.629
   87   1HG2  THR  12          2HG2      THR  12  -4.933   1.573   4.906
   88   2HG2  THR  12          1HG2      THR  12  -6.163   0.316   4.806
   89   3HG2  THR  12          3HG2      THR  12  -4.853   0.174   5.972
   90    H    GLU  13           H        GLU  13  -3.213   0.844   6.449
   91    HA   GLU  13           HA       GLU  13  -3.541   3.594   6.286
   92   1HB   GLU  13          2HB       GLU  13  -3.609   2.068   8.390
   93   2HB   GLU  13          1HB       GLU  13  -1.882   2.410   8.523
   94   1HG   GLU  13          2HG       GLU  13  -2.224   4.579   9.143
   95   2HG   GLU  13          1HG       GLU  13  -3.605   4.774   8.063
   96    H    ASN  14           H        ASN  14  -2.284   4.658   4.860
   97    HA   ASN  14           HA       ASN  14   0.151   5.831   5.497
   98   1HB   ASN  14          2HB       ASN  14   0.539   3.071   4.884
   99   2HB   ASN  14          1HB       ASN  14   1.158   3.996   3.514
  100   1HD2  ASN  14          2HD2      ASN  14   4.126   4.580   5.315
  101   2HD2  ASN  14          1HD2      ASN  14   3.399   4.067   3.870
  102    H    SER  15           H        SER  15   1.326   5.573   2.752
  103    HA   SER  15           HA       SER  15  -0.688   5.917   0.788
  104   1HB   SER  15          2HB       SER  15  -0.516   8.437   0.558
  105   2HB   SER  15          1HB       SER  15  -1.407   7.880   1.971
  106    HG   SER  15           HG       SER  15   0.153   8.580   3.238
  107    H    PHE  16           H        PHE  16   0.306   7.644  -0.943
  108    HA   PHE  16           HA       PHE  16   3.144   7.751  -1.174
  109   1HB   PHE  16          2HB       PHE  16   2.815   5.270  -1.376
  110   2HB   PHE  16          1HB       PHE  16   1.819   5.563  -2.803
  111    HD1  PHE  16           HD1      PHE  16   5.239   5.788  -1.406
  112    HD2  PHE  16           HD2      PHE  16   2.774   6.283  -4.880
  113    HE1  PHE  16           HE1      PHE  16   7.271   5.960  -2.821
  114    HE2  PHE  16           HE2      PHE  16   4.793   6.467  -6.295
  115    HZ   PHE  16           HZ       PHE  16   7.049   6.299  -5.268
  116    H    THR  17           H        THR  17   3.719   8.682  -3.364
  117    HA   THR  17           HA       THR  17   1.283   9.866  -4.616
  118    HB   THR  17           HB       THR  17   2.302  11.839  -4.311
  119    HG1  THR  17           HG1      THR  17   3.176  12.168  -6.175
  120   1HG2  THR  17          1HG2      THR  17   3.709  10.580  -2.582
  121   2HG2  THR  17          3HG2      THR  17   4.971  10.506  -3.812
  122   3HG2  THR  17          2HG2      THR  17   4.407  12.068  -3.220
  123    H    ASN  18           H        ASN  18   2.037  10.669  -7.034
  124    HA   ASN  18           HA       ASN  18   2.359   9.834  -9.211
  125   1HB   ASN  18          2HB       ASN  18   4.726   9.816  -8.546
  126   2HB   ASN  18          1HB       ASN  18   4.512   8.247  -7.770
  127   1HD2  ASN  18          2HD2      ASN  18   5.688   6.987 -10.896
  128   2HD2  ASN  18          1HD2      ASN  18   6.128   7.330  -9.292
  129    H    VAL  19           H        VAL  19   0.705   8.407  -7.042
  130    HA   VAL  19           HA       VAL  19   0.665   5.639  -7.269
  131    HB   VAL  19           HB       VAL  19  -1.735   7.495  -7.248
  132   1HG1  VAL  19          3HG1      VAL  19  -1.363   4.583  -6.494
  133   2HG1  VAL  19          2HG1      VAL  19  -2.770   5.533  -6.023
  134   3HG1  VAL  19          1HG1      VAL  19  -2.437   5.239  -7.729
  135   1HG2  VAL  19          1HG2      VAL  19   0.307   7.426  -5.420
  136   2HG2  VAL  19          3HG2      VAL  19  -1.357   7.866  -5.031
  137   3HG2  VAL  19          2HG2      VAL  19  -0.792   6.217  -4.754
  138    H    TRP  20           H        TRP  20  -0.766   4.234  -8.604
  139    HA   TRP  20           HA       TRP  20  -1.652   5.355 -11.183
  140   1HB   TRP  20          2HB       TRP  20  -0.038   4.456 -12.520
  141   2HB   TRP  20          1HB       TRP  20   0.927   4.364 -11.051
  142    HD1  TRP  20           HD1      TRP  20  -0.905   2.237 -13.572
  143    HE1  TRP  20           HE1      TRP  20  -0.555  -0.259 -13.025
  144    HE3  TRP  20           HE3      TRP  20   1.358   2.646  -9.014
  145    HZ2  TRP  20           HZ2      TRP  20   0.559  -1.866 -10.938
  146    HZ3  TRP  20           HZ3      TRP  20   2.055   0.619  -7.772
  147    HH2  TRP  20           HH2      TRP  20   1.655  -1.635  -8.731
  148    H    LYS  21           H        LYS  21  -2.330   3.174 -12.552
  149    HA   LYS  21           HA       LYS  21  -3.685   1.302 -10.676
  150   1HB   LYS  21          2HB       LYS  21  -5.404   2.928 -11.262
  151   2HB   LYS  21          1HB       LYS  21  -5.011   2.773 -12.976
  152   1HG   LYS  21          2HG       LYS  21  -5.557   0.200 -11.672
  153   2HG   LYS  21          1HG       LYS  21  -6.940   1.299 -11.659
  154   1HD   LYS  21          2HD       LYS  21  -5.682   1.422 -14.238
  155   2HD   LYS  21          1HD       LYS  21  -5.981  -0.268 -13.828
  156   1HE   LYS  21          2HE       LYS  21  -8.092   0.132 -14.565
  157   2HE   LYS  21          1HE       LYS  21  -8.314   0.931 -13.008
  158   1HZ   LYS  21          2HZ       LYS  21  -7.339   2.285 -15.463
  159   2HZ   LYS  21          1HZ       LYS  21  -8.948   2.321 -14.922
  160   3HZ   LYS  21          3HZ       LYS  21  -7.722   3.018 -13.980
  161    H    ASP  22           H        ASP  22  -3.116  -0.727 -11.296
  162    HA   ASP  22           HA       ASP  22  -2.170  -1.120 -14.079
  163   1HB   ASP  22          2HB       ASP  22  -1.157  -1.926 -11.621
  164   2HB   ASP  22          1HB       ASP  22  -1.921  -3.385 -12.252
  165    H    ASP  23           H        ASP  23  -3.455  -2.180 -15.494
  166    HA   ASP  23           HA       ASP  23  -5.960  -3.395 -14.578
  167   1HB   ASP  23          2HB       ASP  23  -5.855  -2.167 -16.736
  168   2HB   ASP  23          1HB       ASP  23  -4.684  -3.342 -17.337
  169    H    LYS  24           H        LYS  24  -2.715  -4.301 -15.108
  170    HA   LYS  24           HA       LYS  24  -3.164  -7.141 -15.627
  171   1HB   LYS  24          2HB       LYS  24  -0.858  -5.306 -15.215
  172   2HB   LYS  24          1HB       LYS  24  -0.607  -6.980 -14.718
  173   1HG   LYS  24          2HG       LYS  24  -0.322  -7.584 -16.865
  174   2HG   LYS  24          1HG       LYS  24  -1.946  -7.009 -17.243
  175   1HD   LYS  24          2HD       LYS  24  -0.498  -5.756 -18.658
  176   2HD   LYS  24          1HD       LYS  24  -0.924  -4.660 -17.343
  177   1HE   LYS  24          2HE       LYS  24   1.175  -4.853 -16.325
  178   2HE   LYS  24          1HE       LYS  24   1.525  -6.390 -17.116
  179   1HZ   LYS  24          3HZ       LYS  24   1.118  -4.492 -19.111
  180   2HZ   LYS  24          2HZ       LYS  24   2.168  -3.793 -17.973
  181   3HZ   LYS  24          1HZ       LYS  24   2.563  -5.276 -18.701
  182    H    THR  25           H        THR  25  -1.790  -5.265 -12.928
  183    HA   THR  25           HA       THR  25  -1.930  -7.420 -11.029
  184    HB   THR  25           HB       THR  25  -1.240  -5.821  -9.426
  185    HG1  THR  25           HG1      THR  25  -1.650  -3.479 -10.180
  186   1HG2  THR  25          1HG2      THR  25   0.253  -5.994 -11.490
  187   2HG2  THR  25          3HG2      THR  25  -0.428  -4.448 -11.992
  188   3HG2  THR  25          2HG2      THR  25   0.478  -4.563 -10.485
  189    H    LEU  26           H        LEU  26  -4.151  -5.041 -12.227
  190    HA   LEU  26           HA       LEU  26  -6.478  -4.946 -12.084
  191   1HB   LEU  26          2HB       LEU  26  -5.828  -7.610 -11.288
  192   2HB   LEU  26          1HB       LEU  26  -7.125  -7.017 -10.250
  193    HG   LEU  26           HG       LEU  26  -7.130  -6.887 -13.281
  194   1HD1  LEU  26          2HD1      LEU  26  -7.387  -9.174 -11.988
  195   2HD1  LEU  26          1HD1      LEU  26  -8.999  -8.557 -11.627
  196   3HD1  LEU  26          3HD1      LEU  26  -8.493  -8.777 -13.303
  197   1HD2  LEU  26          3HD2      LEU  26  -8.898  -5.846 -11.117
  198   2HD2  LEU  26          2HD2      LEU  26  -8.571  -5.180 -12.717
  199   3HD2  LEU  26          1HD2      LEU  26  -9.692  -6.530 -12.535
  200    H    ASP  27           H        ASP  27  -5.635  -3.000 -10.639
  201    HA   ASP  27           HA       ASP  27  -7.440  -2.443  -8.623
  202   1HB   ASP  27          2HB       ASP  27  -5.545  -4.435  -7.750
  203   2HB   ASP  27          1HB       ASP  27  -5.401  -2.986  -6.760
  204    H    ARG  28           H        ARG  28  -6.531  -0.746  -6.937
  205    HA   ARG  28           HA       ARG  28  -4.763   1.059  -8.457
  206   1HB   ARG  28          2HB       ARG  28  -6.818   1.756  -7.015
  207   2HB   ARG  28          1HB       ARG  28  -5.744   1.522  -5.635
  208   1HG   ARG  28          2HG       ARG  28  -5.112   3.669  -6.009
  209   2HG   ARG  28          1HG       ARG  28  -4.163   2.995  -7.333
  210   1HD   ARG  28          2HD       ARG  28  -5.596   4.890  -8.075
  211   2HD   ARG  28          1HD       ARG  28  -6.004   3.383  -8.896
  212    HE   ARG  28           HE       ARG  28  -7.576   4.139  -6.489
  213   1HH1  ARG  28          1HH2      ARG  28  -7.329   4.495  -9.867
  214   2HH1  ARG  28          2HH2      ARG  28  -8.996   4.147 -10.180
  215   1HH2  ARG  28          2HH1      ARG  28  -9.720   3.335  -6.889
  216   2HH2  ARG  28          1HH1      ARG  28 -10.349   3.489  -8.495
  217    H    TYR  29           H        TYR  29  -2.654   1.737  -7.592
  218    HA   TYR  29           HA       TYR  29  -1.673   0.191  -5.274
  219   1HB   TYR  29          2HB       TYR  29  -0.540  -0.103  -8.059
  220   2HB   TYR  29          1HB       TYR  29   0.271  -0.667  -6.602
  221    HD1  TYR  29           HD1      TYR  29  -2.645  -1.123  -8.816
  222    HD2  TYR  29           HD2      TYR  29  -0.529  -2.622  -5.395
  223    HE1  TYR  29           HE1      TYR  29  -3.970  -3.217  -8.913
  224    HE2  TYR  29           HE2      TYR  29  -1.856  -4.714  -5.495
  225    HH   TYR  29           HH       TYR  29  -3.109  -6.005  -7.263
  226    H    ALA  30           H        ALA  30   0.294   0.929  -4.434
  227    HA   ALA  30           HA       ALA  30   1.294   3.520  -5.545
  228   1HB   ALA  30          3HB       ALA  30   0.307   2.849  -2.849
  229   2HB   ALA  30          2HB       ALA  30   1.890   3.628  -2.853
  230   3HB   ALA  30          1HB       ALA  30   0.511   4.428  -3.607
  231    H    ASN  31           H        ASN  31   3.064   2.550  -6.573
  232    HA   ASN  31           HA       ASN  31   4.646   0.455  -5.535
  233   1HB   ASN  31          2HB       ASN  31   6.179   0.925  -7.261
  234   2HB   ASN  31          1HB       ASN  31   4.639   1.494  -7.902
  235   1HD2  ASN  31          2HD2      ASN  31   5.625   5.002  -7.090
  236   2HD2  ASN  31          1HD2      ASN  31   4.347   3.978  -6.648
  237    H    TYR  32           H        TYR  32   5.724   0.455  -3.644
  238    HA   TYR  32           HA       TYR  32   7.051   2.992  -2.790
  239   1HB   TYR  32          2HB       TYR  32   5.241   1.607  -1.355
  240   2HB   TYR  32          1HB       TYR  32   6.703   0.752  -0.862
  241    HD1  TYR  32           HD2      TYR  32   8.740   2.240  -0.160
  242    HD2  TYR  32           HD1      TYR  32   4.681   3.633  -0.325
  243    HE1  TYR  32           HE2      TYR  32   9.323   4.118   1.353
  244    HE2  TYR  32           HE1      TYR  32   5.262   5.510   1.187
  245    HH   TYR  32           HH       TYR  32   7.904   5.614   3.058
  246    H    GLU  33           H        GLU  33   8.444   1.723  -4.650
  247    HA   GLU  33           HA       GLU  33  10.280   0.277  -5.138
  248   1HB   GLU  33          2HB       GLU  33  11.306   1.969  -2.844
  249   2HB   GLU  33          1HB       GLU  33  12.277   1.236  -4.122
  250   1HG   GLU  33          2HG       GLU  33  11.268   2.619  -5.802
  251   2HG   GLU  33          1HG       GLU  33  10.038   3.195  -4.676
  252    H    GLY  34           H        GLY  34   9.876  -1.871  -4.553
  253   1HA   GLY  34          2HA       GLY  34  10.812  -3.746  -3.337
  254   2HA   GLY  34          1HA       GLY  34  11.065  -2.684  -1.954
  255    H    CYS  35           H        CYS  35   8.245  -1.590  -2.320
  256    HA   CYS  35           HA       CYS  35   6.667  -4.001  -1.585
  257   1HB   CYS  35          2HB       CYS  35   6.492  -1.574   0.182
  258   2HB   CYS  35          1HB       CYS  35   6.008  -3.229   0.531
  259    H    LEU  36           H        LEU  36   4.839  -3.886  -2.781
  260    HA   LEU  36           HA       LEU  36   3.918  -1.202  -3.661
  261   1HB   LEU  36          2HB       LEU  36   4.294  -3.046  -5.351
  262   2HB   LEU  36          1HB       LEU  36   2.924  -3.887  -4.631
  263    HG   LEU  36           HG       LEU  36   1.794  -1.479  -4.945
  264   1HD1  LEU  36          1HD1      LEU  36   4.269  -1.236  -6.307
  265   2HD1  LEU  36          3HD1      LEU  36   3.019  -1.330  -7.544
  266   3HD1  LEU  36          2HD1      LEU  36   2.930  -0.090  -6.297
  267   1HD2  LEU  36          2HD2      LEU  36   0.968  -3.626  -5.858
  268   2HD2  LEU  36          1HD2      LEU  36   0.846  -2.341  -7.060
  269   3HD2  LEU  36          3HD2      LEU  36   2.148  -3.515  -7.155
  270    H    TRP  37           H        TRP  37   2.129  -0.332  -2.838
  271    HA   TRP  37           HA       TRP  37   0.469  -1.944  -0.987
  272   1HB   TRP  37          2HB       TRP  37   0.295   1.037  -1.525
  273   2HB   TRP  37          1HB       TRP  37  -0.383   0.145  -0.174
  274    HD1  TRP  37           HD1      TRP  37   3.166   0.596  -1.661
  275    HE1  TRP  37           HE1      TRP  37   4.800   0.891   0.302
  276    HE3  TRP  37           HE3      TRP  37  -0.080   0.184   2.276
  277    HZ2  TRP  37           HZ2      TRP  37   4.742   0.955   3.160
  278    HZ3  TRP  37           HZ3      TRP  37   0.731   0.366   4.592
  279    HH2  TRP  37           HH2      TRP  37   3.142   0.762   5.043
  280    H    ASN  38           H        ASN  38  -2.027  -1.132  -1.196
  281    HA   ASN  38           HA       ASN  38  -2.703  -0.885  -4.073
  282   1HB   ASN  38          2HB       ASN  38  -3.424  -3.009  -4.289
  283   2HB   ASN  38          1HB       ASN  38  -2.772  -3.352  -2.693
  284   1HD2  ASN  38          2HD2      ASN  38  -6.792  -2.468  -2.940
  285   2HD2  ASN  38          1HD2      ASN  38  -5.718  -1.720  -4.023
  286    H    ALA  39           H        ALA  39  -4.222   0.609  -4.329
  287    HA   ALA  39           HA       ALA  39  -5.826   1.452  -1.983
  288   1HB   ALA  39          2HB       ALA  39  -4.743   2.773  -4.360
  289   2HB   ALA  39          1HB       ALA  39  -6.443   3.155  -4.090
  290   3HB   ALA  39          3HB       ALA  39  -5.255   3.474  -2.825
  291    H    THR  40           H        THR  40  -8.091   1.516  -2.081
  292    HA   THR  40           HA       THR  40  -9.280  -0.308  -4.108
  293    HB   THR  40           HB       THR  40 -10.069  -1.129  -2.110
  294    HG1  THR  40           HG1      THR  40 -12.056   0.329  -1.586
  295   1HG2  THR  40          2HG2      THR  40  -9.694   1.683  -1.092
  296   2HG2  THR  40          1HG2      THR  40 -10.610   0.499  -0.160
  297   3HG2  THR  40          3HG2      THR  40  -8.913   0.201  -0.541
  298    H    GLY  41           H        GLY  41  -9.896   2.854  -2.565
  299   1HA   GLY  41          2HA       GLY  41 -10.638   4.144  -4.985
  300   2HA   GLY  41          1HA       GLY  41 -12.114   3.578  -4.199
  301    H    VAL  42           H        VAL  42 -11.684   3.982  -1.563
  302    HA   VAL  42           HA       VAL  42 -11.973   6.823  -1.268
  303    HB   VAL  42           HB       VAL  42 -11.393   4.709   0.829
  304   1HG1  VAL  42          3HG1      VAL  42 -10.971   7.108   1.494
  305   2HG1  VAL  42          2HG1      VAL  42 -12.667   7.441   1.143
  306   3HG1  VAL  42          1HG1      VAL  42 -12.238   6.313   2.429
  307   1HG2  VAL  42          3HG2      VAL  42 -13.867   5.643  -0.574
  308   2HG2  VAL  42          2HG2      VAL  42 -13.429   4.021  -0.038
  309   3HG2  VAL  42          1HG2      VAL  42 -13.992   5.215   1.131
  310    H    VAL  43           H        VAL  43 -10.038   7.737  -2.178
  311    HA   VAL  43           HA       VAL  43  -7.766   7.722  -0.276
  312    HB   VAL  43           HB       VAL  43  -7.272   7.334  -3.232
  313   1HG1  VAL  43          2HG1      VAL  43  -5.536   8.259  -1.543
  314   2HG1  VAL  43          1HG1      VAL  43  -5.495   6.616  -0.903
  315   3HG1  VAL  43          3HG1      VAL  43  -5.042   6.921  -2.580
  316   1HG2  VAL  43          2HG2      VAL  43  -7.656   5.278  -1.046
  317   2HG2  VAL  43          1HG2      VAL  43  -8.430   5.339  -2.629
  318   3HG2  VAL  43          3HG2      VAL  43  -6.719   4.931  -2.500
  319    H    VAL  44           H        VAL  44  -7.449   9.854   0.137
  320    HA   VAL  44           HA       VAL  44  -8.490  12.008  -1.363
  321    HB   VAL  44           HB       VAL  44  -6.068  11.882   0.459
  322   1HG1  VAL  44          1HG1      VAL  44  -6.088  13.814  -1.211
  323   2HG1  VAL  44          3HG1      VAL  44  -7.562  14.363  -0.414
  324   3HG1  VAL  44          2HG1      VAL  44  -6.052  14.272   0.492
  325   1HG2  VAL  44          1HG2      VAL  44  -8.447  11.385   1.317
  326   2HG2  VAL  44          3HG2      VAL  44  -7.545  12.643   2.162
  327   3HG2  VAL  44          2HG2      VAL  44  -8.791  13.083   0.994
  328    H    CYS  45           H        CYS  45  -8.046  12.180  -3.542
  329    HA   CYS  45           HA       CYS  45  -5.200  11.868  -4.391
  330   1HB   CYS  45          2HB       CYS  45  -7.813  11.279  -5.669
  331   2HB   CYS  45          1HB       CYS  45  -6.560  11.920  -6.730
  332    H    THR  46           H        THR  46  -4.200  13.492  -5.564
  333    HA   THR  46           HA       THR  46  -5.747  15.944  -6.190
  334    HB   THR  46           HB       THR  46  -4.823  16.310  -3.932
  335    HG1  THR  46           HG1      THR  46  -3.540  17.680  -6.053
  336   1HG2  THR  46          3HG2      THR  46  -2.715  14.760  -4.856
  337   2HG2  THR  46          2HG2      THR  46  -2.021  16.379  -4.766
  338   3HG2  THR  46          1HG2      THR  46  -2.749  15.650  -3.334
  339    H    GLY  47           H        GLY  47  -4.702  17.252  -7.813
  340   1HA   GLY  47          2HA       GLY  47  -3.296  17.638  -9.661
  341   2HA   GLY  47          1HA       GLY  47  -2.121  16.554  -8.913
  342    H    ASP  48           H        ASP  48  -5.408  16.228 -10.320
  343    HA   ASP  48           HA       ASP  48  -6.197  14.678 -11.909
  344   1HB   ASP  48          2HB       ASP  48  -3.488  15.205 -12.638
  345   2HB   ASP  48          1HB       ASP  48  -3.756  13.467 -12.779
  346    H    GLU  49           H        GLU  49  -4.889  14.045  -9.082
  347    HA   GLU  49           HA       GLU  49  -5.086  12.171  -7.708
  348   1HB   GLU  49          2HB       GLU  49  -5.677  10.486 -10.139
  349   2HB   GLU  49          1HB       GLU  49  -6.169  10.209  -8.468
  350   1HG   GLU  49          2HG       GLU  49  -7.414  12.494  -8.721
  351   2HG   GLU  49          1HG       GLU  49  -7.264  12.187 -10.452
  352    H    THR  50           H        THR  50  -2.685  13.037  -9.305
  353    HA   THR  50           HA       THR  50  -1.227  10.567  -9.850
  354    HB   THR  50           HB       THR  50  -0.775  12.888 -10.901
  355    HG1  THR  50           HG1      THR  50   1.489  12.429 -10.905
  356   1HG2  THR  50          1HG2      THR  50  -0.574  13.722  -8.324
  357   2HG2  THR  50          3HG2      THR  50   1.122  13.411  -8.691
  358   3HG2  THR  50          2HG2      THR  50   0.200  14.546  -9.676
  359    H    GLN  51           H        GLN  51  -1.664  12.783  -7.163
  360    HA   GLN  51           HA       GLN  51   0.119  11.028  -5.512
  361   1HB   GLN  51          2HB       GLN  51  -0.820  13.833  -4.835
  362   2HB   GLN  51          1HB       GLN  51   0.402  12.882  -3.990
  363   1HG   GLN  51          2HG       GLN  51   2.021  13.452  -5.467
  364   2HG   GLN  51          1HG       GLN  51   0.961  13.197  -6.852
  365   1HE2  GLN  51          2HE2      GLN  51   1.786  16.883  -6.438
  366   2HE2  GLN  51          1HE2      GLN  51   2.767  15.499  -6.494
  367    H    CYS  52           H        CYS  52  -0.876  10.019  -3.717
  368    HA   CYS  52           HA       CYS  52  -3.567  10.937  -2.962
  369   1HB   CYS  52          2HB       CYS  52  -3.369   9.008  -4.922
  370   2HB   CYS  52          1HB       CYS  52  -3.580   8.047  -3.460
  371    H    TYR  53           H        TYR  53  -4.404   9.845  -1.047
  372    HA   TYR  53           HA       TYR  53  -2.468   8.210   0.471
  373   1HB   TYR  53          2HB       TYR  53  -1.754  10.055   1.601
  374   2HB   TYR  53          1HB       TYR  53  -3.096  11.035   1.023
  375    HD1  TYR  53           HD1      TYR  53  -2.127   8.476   3.560
  376    HD2  TYR  53           HD2      TYR  53  -5.006  11.441   2.392
  377    HE1  TYR  53           HE1      TYR  53  -3.230   8.273   5.770
  378    HE2  TYR  53           HE2      TYR  53  -6.111  11.237   4.602
  379    HH   TYR  53           HH       TYR  53  -5.065  10.361   7.107
  380    H    GLY  54           H        GLY  54  -3.517   7.211   2.387
  381   1HA   GLY  54          2HA       GLY  54  -5.962   7.226   3.433
  382   2HA   GLY  54          1HA       GLY  54  -6.378   6.672   1.809
  383    H    THR  55           H        THR  55  -6.639   4.491   1.792
  384    HA   THR  55           HA       THR  55  -4.811   2.875   3.537
  385    HB   THR  55           HB       THR  55  -6.637   1.064   3.139
  386    HG1  THR  55           HG1      THR  55  -7.617   2.515   1.489
  387   1HG2  THR  55          3HG2      THR  55  -6.217   2.887   5.131
  388   2HG2  THR  55          2HG2      THR  55  -7.894   3.225   4.706
  389   3HG2  THR  55          1HG2      THR  55  -7.420   1.600   5.198
  390    H    TRP  56           H        TRP  56  -3.302   1.869   2.430
  391    HA   TRP  56           HA       TRP  56  -3.844   0.950  -0.360
  392   1HB   TRP  56          2HB       TRP  56  -1.192   1.661   0.863
  393   2HB   TRP  56          1HB       TRP  56  -1.542   1.358  -0.841
  394    HD1  TRP  56           HD1      TRP  56  -2.425   3.889   1.926
  395    HE1  TRP  56           HE1      TRP  56  -2.903   6.152   0.798
  396    HE3  TRP  56           HE3      TRP  56  -2.048   2.493  -2.951
  397    HZ2  TRP  56           HZ2      TRP  56  -3.094   7.224  -1.873
  398    HZ3  TRP  56           HZ3      TRP  56  -2.380   4.126  -4.773
  399    HH2  TRP  56           HH2      TRP  56  -2.904   6.499  -4.244
  400    H    VAL  57           H        VAL  57  -4.572  -1.127   0.874
  401    HA   VAL  57           HA       VAL  57  -2.912  -2.571   2.606
  402    HB   VAL  57           HB       VAL  57  -4.719  -3.597   0.398
  403   1HG1  VAL  57          3HG1      VAL  57  -2.733  -5.031   1.859
  404   2HG1  VAL  57          2HG1      VAL  57  -4.309  -5.509   2.489
  405   3HG1  VAL  57          1HG1      VAL  57  -3.958  -5.680   0.769
  406   1HG2  VAL  57          3HG2      VAL  57  -4.977  -3.106   3.367
  407   2HG2  VAL  57          2HG2      VAL  57  -6.002  -2.502   2.064
  408   3HG2  VAL  57          1HG2      VAL  57  -6.068  -4.204   2.522
  409    HA   PRO  58           HA       PRO  58   0.644  -3.370   0.093
  410   1HB   PRO  58          2HB       PRO  58   1.929  -4.999   1.924
  411   2HB   PRO  58          1HB       PRO  58   1.926  -3.227   1.997
  412   1HG   PRO  58          2HG       PRO  58   0.442  -5.172   3.683
  413   2HG   PRO  58          1HG       PRO  58   0.911  -3.494   4.043
  414   1HD   PRO  58          2HD       PRO  58  -1.682  -4.393   3.263
  415   2HD   PRO  58          1HD       PRO  58  -1.137  -2.711   3.364
  416    H    ILE  59           H        ILE  59   0.559  -4.742  -1.574
  417    HA   ILE  59           HA       ILE  59  -0.598  -7.446  -1.160
  418    HB   ILE  59           HB       ILE  59  -0.715  -7.417  -3.716
  419   1HG1  ILE  59          2HG1      ILE  59   0.970  -5.385  -3.670
  420   2HG1  ILE  59          1HG1      ILE  59  -0.287  -5.458  -4.898
  421   1HG2  ILE  59          2HG2      ILE  59  -2.666  -7.031  -2.243
  422   2HG2  ILE  59          1HG2      ILE  59  -2.274  -5.313  -2.180
  423   3HG2  ILE  59          3HG2      ILE  59  -2.760  -6.052  -3.707
  424   1HD1  ILE  59          1HD1      ILE  59  -1.017  -4.128  -2.337
  425   2HD1  ILE  59          3HD1      ILE  59   0.130  -3.274  -3.367
  426   3HD1  ILE  59          2HD1      ILE  59  -1.462  -3.703  -3.987
  427    H    GLY  60           H        GLY  60   2.304  -5.783  -2.435
  428   1HA   GLY  60          2HA       GLY  60   3.745  -8.313  -2.084
  429   2HA   GLY  60          1HA       GLY  60   3.549  -7.855  -3.771
  430    H    LEU  61           H        LEU  61   5.682  -7.465  -4.192
  431    HA   LEU  61           HA       LEU  61   7.160  -5.535  -2.495
  432   1HB   LEU  61          2HB       LEU  61   8.186  -7.051  -4.895
  433   2HB   LEU  61          1HB       LEU  61   9.123  -6.348  -3.574
  434    HG   LEU  61           HG       LEU  61   7.166  -8.653  -3.323
  435   1HD1  LEU  61          1HD1      LEU  61  10.055  -8.467  -3.855
  436   2HD1  LEU  61          3HD1      LEU  61   9.646  -9.523  -2.502
  437   3HD1  LEU  61          2HD1      LEU  61   8.952  -9.821  -4.095
  438   1HD2  LEU  61          2HD2      LEU  61   8.422  -6.842  -1.390
  439   2HD2  LEU  61          1HD2      LEU  61   7.097  -7.983  -1.158
  440   3HD2  LEU  61          3HD2      LEU  61   8.768  -8.538  -1.057
  441    H    ALA  62           H        ALA  62   6.003  -5.943  -5.842
  442    HA   ALA  62           HA       ALA  62   5.827  -3.101  -6.233
  443   1HB   ALA  62          2HB       ALA  62   8.200  -4.514  -7.461
  444   2HB   ALA  62          1HB       ALA  62   7.627  -2.927  -7.977
  445   3HB   ALA  62          3HB       ALA  62   8.228  -3.154  -6.330
  446    H    ILE  63           H        ILE  63   3.952  -3.221  -7.311
  447    HA   ILE  63           HA       ILE  63   2.325  -3.823  -8.885
  448    HB   ILE  63           HB       ILE  63   4.735  -4.140 -10.668
  449   1HG1  ILE  63          2HG1      ILE  63   3.413  -1.793  -9.419
  450   2HG1  ILE  63          1HG1      ILE  63   5.047  -1.953 -10.044
  451   1HG2  ILE  63          1HG2      ILE  63   2.192  -4.869 -11.180
  452   2HG2  ILE  63          3HG2      ILE  63   2.071  -3.153 -11.578
  453   3HG2  ILE  63          2HG2      ILE  63   3.240  -4.170 -12.420
  454   1HD1  ILE  63          2HD1      ILE  63   2.578  -1.661 -11.788
  455   2HD1  ILE  63          1HD1      ILE  63   3.649  -0.330 -11.348
  456   3HD1  ILE  63          3HD1      ILE  63   4.258  -1.662 -12.330
  457    HA   PRO  64           HA       PRO  64   3.186  -8.357  -8.833
  458   1HB   PRO  64          2HB       PRO  64   1.686  -9.021  -6.638
  459   2HB   PRO  64          1HB       PRO  64   3.410  -8.623  -6.557
  460   1HG   PRO  64          2HG       PRO  64   1.090  -7.016  -5.650
  461   2HG   PRO  64          1HG       PRO  64   2.794  -6.894  -5.177
  462   1HD   PRO  64          2HD       PRO  64   1.384  -5.220  -7.044
  463   2HD   PRO  64          1HD       PRO  64   3.109  -5.160  -6.620
  464    H    GLU  65           H        GLU  65   0.137  -7.887  -7.176
  465    HA   GLU  65           HA       GLU  65  -1.829  -7.461  -8.974
  466   1HB   GLU  65          2HB       GLU  65  -2.390  -9.741  -9.936
  467   2HB   GLU  65          1HB       GLU  65  -0.972  -8.968 -10.640
  468   1HG   GLU  65          2HG       GLU  65   0.199 -10.300  -8.587
  469   2HG   GLU  65          1HG       GLU  65  -1.156 -11.380  -8.918
  470    H    ASN  66           H        ASN  66  -1.787  -7.379  -6.303
  471    HA   ASN  66           HA       ASN  66  -3.291  -7.858  -4.543
  472   1HB   ASN  66          2HB       ASN  66  -4.744  -8.745  -6.573
  473   2HB   ASN  66          1HB       ASN  66  -4.288 -10.322  -5.931
  474   1HD2  ASN  66          2HD2      ASN  66  -6.294 -10.020  -3.012
  475   2HD2  ASN  66          1HD2      ASN  66  -5.054 -10.897  -3.769
  476    H    ALA  67           H        ALA  67  -2.611 -11.121  -5.849
  477    HA   ALA  67           HA       ALA  67  -1.588 -11.921  -3.209
  478   1HB   ALA  67          1HB       ALA  67  -1.928 -13.445  -5.808
  479   2HB   ALA  67          3HB       ALA  67  -1.363 -14.166  -4.301
  480   3HB   ALA  67          2HB       ALA  67  -2.995 -13.505  -4.405
  481    H    ALA  68           H        ALA  68   0.420 -13.718  -3.885
  482    HA   ALA  68           HA       ALA  68   2.546 -11.850  -4.832
  483   1HB   ALA  68          2HB       ALA  68   2.699 -14.347  -3.118
  484   2HB   ALA  68          1HB       ALA  68   4.101 -13.422  -3.653
  485   3HB   ALA  68          3HB       ALA  68   2.916 -12.683  -2.575
  486    H    ALA  69           H        ALA  69   2.516 -12.209  -7.063
  487    HA   ALA  69           HA       ALA  69   3.260 -14.976  -7.907
  488   1HB   ALA  69          1HB       ALA  69   0.940 -13.404  -8.695
  489   2HB   ALA  69          3HB       ALA  69   1.937 -13.822 -10.088
  490   3HB   ALA  69          2HB       ALA  69   1.310 -15.093  -9.039
  491    H    HIS  70           HN       HIS  70   2.790 -12.080  -9.893
  492    HA   HIS  70           HA       HIS  70   4.306 -11.093 -11.409
  493   1HB   HIS  70          2HB       HIS  70   4.869 -10.140  -9.092
  494   2HB   HIS  70          1HB       HIS  70   6.231 -11.260  -9.084
  495    HD1  HIS  70           HD1      HIS  70   5.597 -10.226 -12.482
  496    HD2  HIS  70           HD2      HIS  70   7.652  -8.587  -9.247
  497    HE1  HIS  70           HE1      HIS  70   7.150  -8.470 -13.436
   
  No H/Q in entry =         497